data_r4uuxsf
# 
_audit.revision_id     1_0 
_audit.creation_date   ? 
_audit.update_record   'Initial release' 
# 
_cell.entry_id      4uux 
_cell.length_a      73.3900 
_cell.length_b      94.0300 
_cell.length_c      132.3800 
_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   0.90000 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.990 
_diffrn_reflns.pdbx_d_res_low    28.927 
_diffrn_reflns.limit_h_max       36 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       47 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       66 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            62924 
_diffrn_reflns.pdbx_number_obs   62877 
# 
_entry.id   4uux 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               4uux 
_symmetry.space_group_name_H-M   'P 21 21 21' 
_symmetry.Int_Tables_number      19 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 'X,  Y,  Z'           
2 'X+1/2,  -Y+1/2,  -Z' 
3 '-X,  Y+1/2,  -Z+1/2' 
4 '-X+1/2,  -Y,  Z+1/2' 
# 
#
loop_
_refln.crystal_id
_refln.wavelength_id
_refln.scale_group_code
_refln.index_h
_refln.index_k
_refln.index_l
_refln.status
_refln.F_meas_au
_refln.F_meas_sigma_au
_refln.intensity_meas
_refln.intensity_sigma
_refln.pdbx_I_plus
_refln.pdbx_I_plus_sigma
_refln.pdbx_I_minus
_refln.pdbx_I_minus_sigma
_refln.pdbx_F_plus
_refln.pdbx_F_plus_sigma
_refln.pdbx_F_minus
_refln.pdbx_F_minus_sigma
_refln.pdbx_anom_difference
_refln.pdbx_anom_difference_sigma
1 1 1    0    0    6 o  677.821   7.6036  351.773   7.8864  351.773   7.8864  351.773   7.8864  677.821   7.6036  677.821   7.6036 0.000000 0.000000 
1 1 1    0    0    8 o  788.189   8.4392  475.647   10.179  475.647   10.179  475.647   10.179  788.189   8.4392  788.189   8.4392 0.000000 0.000000 
1 1 1    0    0   10 o  613.026   10.599  287.901   9.9386  287.901   9.9386  287.901   9.9386  613.026   10.599  613.026   10.599 0.000000 0.000000 
1 1 1    0    0   12 o  1349.47   12.729  1394.32   26.286  1394.32   26.286  1394.32   26.286  1349.47   12.729  1349.47   12.729 0.000000 0.000000 
1 1 1    0    0   14 o   85.214   15.675   6.0909   1.8404   6.0909   1.8404   6.0909   1.8404   85.214   15.675   85.214   15.675 0.000000 0.000000 
1 1 1    0    0   16 o  1826.72   23.486  2557.13   65.644  2557.13   65.644  2557.13   65.644  1826.72   23.486  1826.72   23.486 0.000000 0.000000 
1 1 1    0    0   18 o  767.145   9.0186  450.650   10.586  450.650   10.586  450.650   10.586  767.145   9.0186  767.145   9.0186 0.000000 0.000000 
1 1 1    0    0   20 o  606.905   8.4391  282.101   7.8360  282.101   7.8360  282.101   7.8360  606.905   8.4391  606.905   8.4391 0.000000 0.000000 
1 1 1    0    0   22 o  1359.49   18.630  1416.44   38.750  1416.44   38.750  1416.44   38.750  1359.49   18.630  1359.49   18.630 0.000000 0.000000 
1 1 1    0    0   24 o  1402.91   13.621  1507.27   29.243  1507.27   29.243  1507.27   29.243  1402.91   13.621  1402.91   13.621 0.000000 0.000000 
1 1 1    0    0   26 o  258.194   11.038   51.308   4.3442   51.308   4.3442   51.308   4.3442  258.194   11.038  258.194   11.038 0.000000 0.000000 
1 1 1    0    0   28 o  430.951   13.489  142.586   8.8781  142.586   8.8781  142.586   8.8781  430.951   13.489  430.951   13.489 0.000000 0.000000 
1 1 1    0    0   30 o  221.874   14.979   38.198   5.0338   38.198   5.0338   38.198   5.0338  221.874   14.979  221.874   14.979 0.000000 0.000000 
1 1 1    0    0   32 f  1694.89   16.159  2199.93   41.912  2199.93   41.912  2199.93   41.912  1694.89   16.159  1694.89   16.159 0.000000 0.000000 
1 1 1    0    0   34 o  1001.66   11.782  768.360   18.059  768.360   18.059  768.360   18.059  1001.66   11.782  1001.66   11.782 0.000000 0.000000 
1 1 1    0    0   36 o  434.364   13.129  144.840   8.7108  144.840   8.7108  144.840   8.7108  434.364   13.129  434.364   13.129 0.000000 0.000000 
1 1 1    0    0   38 o  178.841   29.115   26.386   7.3359   26.386   7.3359   26.386   7.3359  178.841   29.115  178.841   29.115 0.000000 0.000000 
1 1 1    0    0   40 o  139.572   55.151   20.668   11.336   20.668   11.336   20.668   11.336  139.572   55.151  139.572   55.151 0.000000 0.000000 
1 1 1    0    0   42 o  748.561   12.131  429.453   13.892  429.453   13.892  429.453   13.892  748.561   12.131  748.561   12.131 0.000000 0.000000 
1 1 1    0    0   44 o  693.653   12.389  368.917   13.144  368.917   13.144  368.917   13.144  693.653   12.389  693.653   12.389 0.000000 0.000000 
1 1 1    0    0   46 o  232.431   22.594   42.660   7.8638   42.660   7.8638   42.660   7.8638  232.431   22.594  232.431   22.594 0.000000 0.000000 
1 1 1    0    0   48 o   54.373   35.303  -0.3740   7.0190  -0.3740   7.0190  -0.3740   7.0190   54.373   35.303   54.373   35.303 0.000000 0.000000 
1 1 1    0    0   50 o  863.293   12.836  571.888   16.952  571.888   16.952  571.888   16.952  863.293   12.836  863.293   12.836 0.000000 0.000000 
1 1 1    0    0   52 o  894.037   18.977  615.894   25.943  615.894   25.943  615.894   25.943  894.037   18.977  894.037   18.977 0.000000 0.000000 
1 1 1    0    0   54 f   86.264   44.148   8.6475   7.3804   8.6475   7.3804   8.6475   7.3804   86.264   44.148   86.264   44.148 0.000000 0.000000 
1 1 1    0    0   56 o  839.023   20.376  544.366   26.132  544.366   26.132  544.366   26.132  839.023   20.376  839.023   20.376 0.000000 0.000000 
1 1 1    0    0   58 o  167.147   47.998   26.945   10.648   26.945   10.648   26.945   10.648  167.147   47.998  167.147   47.998 0.000000 0.000000 
1 1 1    0    0   60 o   59.190   37.895   0.8845   7.7252   0.8845   7.7252   0.8845   7.7252   59.190   37.895   59.190   37.895 0.000000 0.000000 
1 1 1    0    0   62 o   55.943   38.322  -5.7147   10.461  -5.7147   10.461  -5.7147   10.461   55.943   38.322   55.943   38.322 0.000000 0.000000 
1 1 1    0    0   64 o  112.097   43.649   13.946   7.1425   13.946   7.1425   13.946   7.1425  112.097   43.649  112.097   43.649 0.000000 0.000000 
1 1 1    0    0   66 o   56.081   38.071  -3.4898   9.8387  -3.4898   9.8387  -3.4898   9.8387   56.081   38.071   56.081   38.071 0.000000 0.000000 
1 1 1    0    1    5 o  1158.08   7.7830  1026.69   13.795  1026.69   13.795  1026.69   13.795  1158.08   7.7830  1158.08   7.7830 0.000000 0.000000 
1 1 1    0    1    6 o  991.517   6.9244  752.577   10.508  752.577   10.508  752.577   10.508  991.517   6.9244  991.517   6.9244 0.000000 0.000000 
1 1 1    0    1    7 f  658.801   6.1847  332.277   6.2353  332.277   6.2353  332.277   6.2353  658.801   6.1847  658.801   6.1847 0.000000 0.000000 
1 1 1    0    1    8 o  1261.81   8.4154  1218.86   16.252  1218.86   16.252  1218.86   16.252  1261.81   8.4154  1261.81   8.4154 0.000000 0.000000 
1 1 1    0    1    9 o  347.262   4.5106   92.341   2.3966   92.341   2.3966   92.341   2.3966  347.262   4.5106  347.262   4.5106 0.000000 0.000000 
1 1 1    0    1   10 o  169.083   7.5811   22.014   1.9530   22.014   1.9530   22.014   1.9530  169.083   7.5811  169.083   7.5811 0.000000 0.000000 
1 1 1    0    1   11 o  1005.76   7.1667  774.359   11.031  774.359   11.031  774.359   11.031  1005.76   7.1667  1005.76   7.1667 0.000000 0.000000 
1 1 1    0    1   12 o  571.925   5.2971  250.413   4.6362  250.413   4.6362  250.413   4.6362  571.925   5.2971  571.925   5.2971 0.000000 0.000000 
1 1 1    0    1   13 o  1733.81   11.164  2301.59   29.626  2301.59   29.626  2301.59   29.626  1733.81   11.164  1733.81   11.164 0.000000 0.000000 
1 1 1    0    1   14 o  1592.34   10.387  1941.26   25.312  1941.26   25.312  1941.26   25.312  1592.34   10.387  1592.34   10.387 0.000000 0.000000 
1 1 1    0    1   15 o  548.620   6.2345  230.461   5.2338  230.461   5.2338  230.461   5.2338  548.620   6.2345  548.620   6.2345 0.000000 0.000000 
1 1 1    0    1   16 o  659.250   8.2146  332.835   8.2862  332.835   8.2862  332.835   8.2862  659.250   8.2146  659.250   8.2146 0.000000 0.000000 
1 1 1    0    1   17 o  524.512   5.4863  210.638   4.4035  210.638   4.4035  210.638   4.4035  524.512   5.4863  524.512   5.4863 0.000000 0.000000 
1 1 1    0    1   18 f  305.826   5.7215   71.663   2.6761   71.663   2.6761   71.663   2.6761  305.826   5.7215  305.826   5.7215 0.000000 0.000000 
1 1 1    0    1   19 o   97.851   12.495   7.6830   1.7881   7.6830   1.7881   7.6830   1.7881   97.851   12.495   97.851   12.495 0.000000 0.000000 
1 1 1    0    1   20 o  234.190   6.7768   42.088   2.4246   42.088   2.4246   42.088   2.4246  234.190   6.7768  234.190   6.7768 0.000000 0.000000 
1 1 1    0    1   21 o  300.864   6.2297   69.378   2.8661   69.378   2.8661   69.378   2.8661  300.864   6.2297  300.864   6.2297 0.000000 0.000000 
1 1 1    0    1   22 o   99.902   16.453   8.2416   2.3107   8.2416   2.3107   8.2416   2.3107   99.902   16.453   99.902   16.453 0.000000 0.000000 
1 1 1    0    1   23 o  480.730   6.9925  177.017   5.1427  177.017   5.1427  177.017   5.1427  480.730   6.9925  480.730   6.9925 0.000000 0.000000 
1 1 1    0    1   24 o  723.595   6.5884  400.884   7.2957  400.884   7.2957  400.884   7.2957  723.595   6.5884  723.595   6.5884 0.000000 0.000000 
1 1 1    0    1   25 o  127.881   12.692   12.889   2.4281   12.889   2.4281   12.889   2.4281  127.881   12.692  127.881   12.692 0.000000 0.000000 
1 1 1    0    1   26 o   44.753   24.347   2.1557   2.3565   2.1557   2.3565   2.1557   2.3565   44.753   24.347   44.753   24.347 0.000000 0.000000 
1 1 1    0    1   27 o  666.250   6.6335  339.859   6.7632  339.859   6.7632  339.859   6.7632  666.250   6.6335  666.250   6.6335 0.000000 0.000000 
1 1 1    0    1   28 o   35.485   23.969  -1.8280   3.8035  -1.8280   3.8035  -1.8280   3.8035   35.485   23.969   35.485   23.969 0.000000 0.000000 
1 1 1    0    1   29 o  787.568   7.1490  474.878   8.6163  474.878   8.6163  474.878   8.6163  787.568   7.1490  787.568   7.1490 0.000000 0.000000 
1 1 1    0    1   30 o  454.373   7.1760  158.143   4.9879  158.143   4.9879  158.143   4.9879  454.373   7.1760  454.373   7.1760 0.000000 0.000000 
1 1 1    0    1   31 o  1056.46   8.3420  854.501   13.488  854.501   13.488  854.501   13.488  1056.46   8.3420  1056.46   8.3420 0.000000 0.000000 
1 1 1    0    1   32 o  1240.59   9.2013  1178.36   17.470  1178.36   17.470  1178.36   17.470  1240.59   9.2013  1240.59   9.2013 0.000000 0.000000 
1 1 1    0    1   33 o  173.903   16.359   23.773   4.2658   23.773   4.2658   23.773   4.2658  173.903   16.359  173.903   16.359 0.000000 0.000000 
1 1 1    0    1   34 o  719.419   7.7815  396.321   8.5664  396.321   8.5664  396.321   8.5664  719.419   7.7815  719.419   7.7815 0.000000 0.000000 
1 1 1    0    1   36 o  682.360   8.1943  356.594   8.5556  356.594   8.5556  356.594   8.5556  682.360   8.1943  682.360   8.1943 0.000000 0.000000 
1 1 1    0    1   37 o   41.684   27.820  -1.6367   4.8498  -1.6367   4.8498  -1.6367   4.8498   41.684   27.820   41.684   27.820 0.000000 0.000000 
1 1 1    0    1   38 o   38.780   26.687  -3.8183   5.2082  -3.8183   5.2082  -3.8183   5.2082   38.780   26.687   38.780   26.687 0.000000 0.000000 
1 1 1    0    1   39 o  257.427   14.852   51.282   5.8074   51.282   5.8074   51.282   5.8074  257.427   14.852  257.427   14.852 0.000000 0.000000 
1 1 1    0    1   40 o  378.050   15.913  110.136   9.1712  110.136   9.1712  110.136   9.1712  378.050   15.913  378.050   15.913 0.000000 0.000000 
1 1 1    0    1   41 o  453.499   10.113  157.750   7.0122  157.750   7.0122  157.750   7.0122  453.499   10.113  453.499   10.113 0.000000 0.000000 
1 1 1    0    1   42 o  483.527   9.5538  179.282   7.0645  179.282   7.0645  179.282   7.0645  483.527   9.5538  483.527   9.5538 0.000000 0.000000 
1 1 1    0    1   43 o  140.998   26.627   16.835   5.1486   16.835   5.1486   16.835   5.1486  140.998   26.627  140.998   26.627 0.000000 0.000000 
1 1 1    0    1   44 o  221.981   15.875   38.396   5.3306   38.396   5.3306   38.396   5.3306  221.981   15.875  221.981   15.875 0.000000 0.000000 
1 1 1    0    1   45 o  384.611   10.543  113.634   6.1959  113.634   6.1959  113.634   6.1959  384.611   10.543  384.611   10.543 0.000000 0.000000 
1 1 1    0    1   46 o  395.466   11.654  120.249   7.0406  120.249   7.0406  120.249   7.0406  395.466   11.654  395.466   11.654 0.000000 0.000000 
1 1 1    0    1   47 o  217.292   20.430   37.332   6.6567   37.332   6.6567   37.332   6.6567  217.292   20.430  217.292   20.430 0.000000 0.000000 
1 1 1    0    1   48 o  117.288   32.160   12.793   4.9920   12.793   4.9920   12.793   4.9920  117.288   32.160  117.288   32.160 0.000000 0.000000 
1 1 1    0    1   49 o  209.315   16.787   34.372   5.2988   34.372   5.2988   34.372   5.2988  209.315   16.787  209.315   16.787 0.000000 0.000000 
1 1 1    0    1   50 o  292.148   13.016   65.975   5.7942   65.975   5.7942   65.975   5.7942  292.148   13.016  292.148   13.016 0.000000 0.000000 
1 1 1    0    1   51 o   42.361   28.498  -2.0489   5.2747  -2.0489   5.2747  -2.0489   5.2747   42.361   28.498   42.361   28.498 0.000000 0.000000 
1 1 1    0    1   52 o  431.030   16.094  143.897   10.585  143.897   10.585  143.897   10.585  431.030   16.094  431.030   16.094 0.000000 0.000000 
1 1 1    0    1   53 o  276.689   14.257   59.446   6.0014   59.446   6.0014   59.446   6.0014  276.689   14.257  276.689   14.257 0.000000 0.000000 
1 1 1    0    1   54 o   51.177   33.532  -0.5324   6.5427  -0.5324   6.5427  -0.5324   6.5427   51.177   33.532   51.177   33.532 0.000000 0.000000 
1 1 1    0    1   55 o   52.653   34.182   0.0577   6.5771   0.0577   6.5771   0.0577   6.5771   52.653   34.182   52.653   34.182 0.000000 0.000000 
1 1 1    0    1   56 o  391.935   12.203  118.633   7.3047  118.633   7.3047  118.633   7.3047  391.935   12.203  391.935   12.203 0.000000 0.000000 
1 1 1    0    1   57 o   79.218   41.596   7.6047   6.6692   7.6047   6.6692   7.6047   6.6692   79.218   41.596   79.218   41.596 0.000000 0.000000 
1 1 1    0    1   58 o  286.385   25.706   66.229   11.059   66.229   11.059   66.229   11.059  286.385   25.706  286.385   25.706 0.000000 0.000000 
1 1 1    0    1   59 o   53.015   33.612   1.2865   5.9019   1.2865   5.9019   1.2865   5.9019   53.015   33.612   53.015   33.612 0.000000 0.000000 
1 1 1    0    1   60 o  134.592   33.260   16.833   5.9314   16.833   5.9314   16.833   5.9314  134.592   33.260  134.592   33.260 0.000000 0.000000 
1 1 1    0    1   61 o   30.312   21.886  -9.2393   5.2107  -9.2393   5.2107  -9.2393   5.2107   30.312   21.886   30.312   21.886 0.000000 0.000000 
1 1 1    0    1   62 o  191.856   22.955   30.377   6.4857   30.377   6.4857   30.377   6.4857  191.856   22.955  191.856   22.955 0.000000 0.000000 
1 1 1    0    1   63 o  271.090   13.760   57.534   5.6762   57.534   5.6762   57.534   5.6762  271.090   13.760  271.090   13.760 0.000000 0.000000 
1 1 1    0    1   64 o  105.710   37.228   12.145   5.4679   12.145   5.4679   12.145   5.4679  105.710   37.228  105.710   37.228 0.000000 0.000000 
1 1 1    0    1   65 o  175.170   22.462   25.784   5.7512   25.784   5.7512   25.784   5.7512  175.170   22.462  175.170   22.462 0.000000 0.000000 
1 1 1    0    1   66 o   40.342   26.894  -0.6962   4.5100  -0.6962   4.5100  -0.6962   4.5100   40.342   26.894   40.342   26.894 0.000000 0.000000 
1 1 1    0    2    4 o   93.642   6.9970   6.8234   0.9900   6.8234   0.9900   6.8234   0.9900   93.642   6.9970   93.642   6.9970 0.000000 0.000000 
1 1 1    0    2    5 o  878.570   6.3225  590.881   8.5013  590.881   8.5013  590.881   8.5013  878.570   6.3225  878.570   6.3225 0.000000 0.000000 
1 1 1    0    2    6 o  1096.09   7.4830  919.701   12.553  919.701   12.553  919.701   12.553  1096.09   7.4830  1096.09   7.4830 0.000000 0.000000 
1 1 1    0    2    7 o   31.755   13.368   1.0911   0.6546   1.0911   0.6546   1.0911   0.6546   31.755   13.368   31.755   13.368 0.000000 0.000000 
1 1 1    0    2    8 f  299.264   5.1126   68.605   2.3403   68.605   2.3403   68.605   2.3403  299.264   5.1126  299.264   5.1126 0.000000 0.000000 
1 1 1    0    2    9 o   24.333   14.345   0.5092   0.9123   0.5092   0.9123   0.5092   0.9123   24.333   14.345   24.333   14.345 0.000000 0.000000 
1 1 1    0    2   10 o  326.936   5.3704   81.874   2.6858   81.874   2.6858   81.874   2.6858  326.936   5.3704  326.936   5.3704 0.000000 0.000000 
1 1 1    0    2   11 f  2083.51   13.136  3323.95   41.887  3323.95   41.887  3323.95   41.887  2083.51   13.136  2083.51   13.136 0.000000 0.000000 
1 1 1    0    2   12 o  254.538   5.0342   49.645   1.9596   49.645   1.9596   49.645   1.9596  254.538   5.0342  254.538   5.0342 0.000000 0.000000 
1 1 1    0    2   13 o  1070.53   7.5690  877.325   12.401  877.325   12.401  877.325   12.401  1070.53   7.5690  1070.53   7.5690 0.000000 0.000000 
1 1 1    0    2   14 o  939.253   6.9521  675.352   9.9934  675.352   9.9934  675.352   9.9934  939.253   6.9521  939.253   6.9521 0.000000 0.000000 
1 1 1    0    2   15 o  677.378   6.7464  351.306   6.9932  351.306   6.9932  351.306   6.9932  677.378   6.7464  677.378   6.7464 0.000000 0.000000 
1 1 1    0    2   16 o  593.909   6.5082  270.079   5.9147  270.079   5.9147  270.079   5.9147  593.909   6.5082  593.909   6.5082 0.000000 0.000000 
1 1 1    0    2   17 o  133.693   8.5038   13.848   1.7240   13.848   1.7240   13.848   1.7240  133.693   8.5038  133.693   8.5038 0.000000 0.000000 
1 1 1    0    2   18 o   21.610   14.797  -1.0327   1.5554  -1.0327   1.5554  -1.0327   1.5554   21.610   14.797   21.610   14.797 0.000000 0.000000 
1 1 1    0    2   19 o  278.459   6.0365   59.435   2.5701   59.435   2.5701   59.435   2.5701  278.459   6.0365  278.459   6.0365 0.000000 0.000000 
1 1 1    0    2   20 o  356.665   5.8335   97.449   3.1827   97.449   3.1827   97.449   3.1827  356.665   5.8335  356.665   5.8335 0.000000 0.000000 
1 1 1    0    2   21 o  650.634   6.1166  324.121   6.0902  324.121   6.0902  324.121   6.0902  650.634   6.1166  650.634   6.1166 0.000000 0.000000 
1 1 1    0    2   22 o  859.369   9.7561  565.671   12.829  565.671   12.829  565.671   12.829  859.369   9.7561  859.369   9.7561 0.000000 0.000000 
1 1 1    0    2   23 o  718.041   7.5001  394.812   8.2410  394.812   8.2410  394.812   8.2410  718.041   7.5001  718.041   7.5001 0.000000 0.000000 
1 1 1    0    2   24 o  894.868   7.1967  613.105   9.8560  613.105   9.8560  613.105   9.8560  894.868   7.1967  894.868   7.1967 0.000000 0.000000 
1 1 1    0    2   25 o  509.329   6.2463  198.652   4.8679  198.652   4.8679  198.652   4.8679  509.329   6.2463  509.329   6.2463 0.000000 0.000000 
1 1 1    0    2   26 o  1393.11   9.6295  1485.94   20.531  1485.94   20.531  1485.94   20.531  1393.11   9.6295  1393.11   9.6295 0.000000 0.000000 
1 1 1    0    2   27 o  801.761   7.0755  492.146   8.6815  492.146   8.6815  492.146   8.6815  801.761   7.0755  801.761   7.0755 0.000000 0.000000 
1 1 1    0    2   28 o   27.740   19.825  -5.8715   3.8237  -5.8715   3.8237  -5.8715   3.8237   27.740   19.825   27.740   19.825 0.000000 0.000000 
1 1 1    0    2   29 o  568.260   6.8339  247.273   5.9421  247.273   5.9421  247.273   5.9421  568.260   6.8339  568.260   6.8339 0.000000 0.000000 
1 1 1    0    2   30 f  736.152   8.3943  414.978   9.4557  414.978   9.4557  414.978   9.4557  736.152   8.3943  736.152   8.3943 0.000000 0.000000 
1 1 1    0    2   31 o  779.785   7.4325  465.559   8.8693  465.559   8.8693  465.559   8.8693  779.785   7.4325  779.785   7.4325 0.000000 0.000000 
1 1 1    0    2   32 o  521.350   7.5511  208.183   6.0229  208.183   6.0229  208.183   6.0229  521.350   7.5511  521.350   7.5511 0.000000 0.000000 
1 1 1    0    2   33 o  1953.93   12.869  2923.78   38.483  2923.78   38.483  2923.78   38.483  1953.93   12.869  1953.93   12.869 0.000000 0.000000 
1 1 1    0    2   34 o  1595.58   11.062  1949.52   27.013  1949.52   27.013  1949.52   27.013  1595.58   11.062  1595.58   11.062 0.000000 0.000000 
1 1 1    0    2   35 f  127.804   34.833   15.020   5.8907   15.020   5.8907   15.020   5.8907  127.804   34.833  127.804   34.833 0.000000 0.000000 
1 1 1    0    2   36 o  310.532   11.191   74.125   5.3037   74.125   5.3037   74.125   5.3037  310.532   11.191  310.532   11.191 0.000000 0.000000 
1 1 1    0    2   37 o  230.341   15.105   41.168   5.2729   41.168   5.2729   41.168   5.2729  230.341   15.105  230.341   15.105 0.000000 0.000000 
1 1 1    0    2   38 o  130.045   29.751   14.845   5.1587   14.845   5.1587   14.845   5.1587  130.045   29.751  130.045   29.751 0.000000 0.000000 
1 1 1    0    2   39 o  254.432   14.890   50.111   5.7532   50.111   5.7532   50.111   5.7532  254.432   14.890  254.432   14.890 0.000000 0.000000 
1 1 1    0    2   40 o  717.571   12.173  394.784   13.361  394.784   13.361  394.784   13.361  717.571   12.173  717.571   12.173 0.000000 0.000000 
1 1 1    0    2   41 o   34.641   24.458  -6.3139   5.2208  -6.3139   5.2208  -6.3139   5.2208   34.641   24.458   34.641   24.458 0.000000 0.000000 
1 1 1    0    2   42 o  187.465   20.027   27.895   5.5812   27.895   5.5812   27.895   5.5812  187.465   20.027  187.465   20.027 0.000000 0.000000 
1 1 1    0    2   43 o  240.348   15.628   44.877   5.6935   44.877   5.6935   44.877   5.6935  240.348   15.628  240.348   15.628 0.000000 0.000000 
1 1 1    0    2   44 o  114.868   33.635   12.478   5.1366   12.478   5.1366   12.478   5.1366  114.868   33.635  114.868   33.635 0.000000 0.000000 
1 1 1    0    2   45 o   93.411   36.407   9.2545   4.9671   9.2545   4.9671   9.2545   4.9671   93.411   36.407   93.411   36.407 0.000000 0.000000 
1 1 1    0    2   46 o  351.636   12.361   95.201   6.6342   95.201   6.6342   95.201   6.6342  351.636   12.361  351.636   12.361 0.000000 0.000000 
1 1 1    0    2   47 o   77.484   39.019   6.9298   5.7114   6.9298   5.7114   6.9298   5.7114   77.484   39.019   77.484   39.019 0.000000 0.000000 
1 1 1    0    2   48 o   88.878   36.540   8.6178   4.9160   8.6178   4.9160   8.6178   4.9160   88.878   36.540   88.878   36.540 0.000000 0.000000 
1 1 1    0    2   49 o  215.982   16.559   36.534   5.4001   36.534   5.4001   36.534   5.4001  215.982   16.559  215.982   16.559 0.000000 0.000000 
1 1 1    0    2   50 o  230.999   15.774   41.650   5.5175   41.650   5.5175   41.650   5.5175  230.999   15.774  230.999   15.774 0.000000 0.000000 
1 1 1    0    2   51 o  156.113   27.556   20.625   5.9722   20.625   5.9722   20.625   5.9722  156.113   27.556  156.113   27.556 0.000000 0.000000 
1 1 1    0    2   52 o  329.850   14.601   84.295   7.3389   84.295   7.3389   84.295   7.3389  329.850   14.601  329.850   14.601 0.000000 0.000000 
1 1 1    0    2   53 o  276.974   16.775   59.895   7.0517   59.895   7.0517   59.895   7.0517  276.974   16.775  276.974   16.775 0.000000 0.000000 
1 1 1    0    2   54 o  300.128   13.273   69.773   6.0703   69.773   6.0703   69.773   6.0703  300.128   13.273  300.128   13.273 0.000000 0.000000 
1 1 1    0    2   55 o   45.980   30.045  -0.3469   5.2004  -0.3469   5.2004  -0.3469   5.2004   45.980   30.045   45.980   30.045 0.000000 0.000000 
1 1 1    0    2   56 o  349.043   12.595   94.220   6.7091   94.220   6.7091   94.220   6.7091  349.043   12.595  349.043   12.595 0.000000 0.000000 
1 1 1    0    2   57 o  151.808   28.329   19.893   5.9104   19.893   5.9104   19.893   5.9104  151.808   28.329  151.808   28.329 0.000000 0.000000 
1 1 1    0    2   58 o   52.876   35.359  -1.8914   7.9015  -1.8914   7.9015  -1.8914   7.9015   52.876   35.359   52.876   35.359 0.000000 0.000000 
1 1 1    0    2   59 o   69.060   39.861   5.3037   6.8038   5.3037   6.8038   5.3037   6.8038   69.060   39.861   69.060   39.861 0.000000 0.000000 
1 1 1    0    2   60 o  168.524   25.844   23.956   6.2005   23.956   6.2005   23.956   6.2005  168.524   25.844  168.524   25.844 0.000000 0.000000 
1 1 1    0    2   61 o   55.651   33.668   2.8127   5.2779   2.8127   5.2779   2.8127   5.2779   55.651   33.668   55.651   33.668 0.000000 0.000000 
1 1 1    0    2   62 o   68.608   38.871   5.6580   6.3007   5.6580   6.3007   5.6580   6.3007   68.608   38.871   68.608   38.871 0.000000 0.000000 
1 1 1    0    2   63 f  212.414   19.865   36.500   6.3290   36.500   6.3290   36.500   6.3290  212.414   19.865  212.414   19.865 0.000000 0.000000 
1 1 1    0    2   64 o  243.120   14.992   46.695   5.5302   46.695   5.5302   46.695   5.5302  243.120   14.992  243.120   14.992 0.000000 0.000000 
1 1 1    0    2   65 o   91.104   35.927   9.5630   4.8143   9.5630   4.8143   9.5630   4.8143   91.104   35.927   91.104   35.927 0.000000 0.000000 
1 1 1    0    2   66 o   69.245   35.220   6.2414   4.6804   6.2414   4.6804   6.2414   4.6804   69.245   35.220   69.245   35.220 0.000000 0.000000 
1 1 1    0    3    2 o  686.279   7.5334  360.624   7.9112  360.624   7.9112  360.624   7.9112  686.279   7.5334  686.279   7.5334 0.000000 0.000000 
1 1 1    0    3    3 o  157.012   5.5887   18.940   1.3393   18.940   1.3393   18.940   1.3393  157.012   5.5887  157.012   5.5887 0.000000 0.000000 
1 1 1    0    3    4 o  252.495   5.6468   48.868   2.1799   48.868   2.1799   48.868   2.1799  252.495   5.6468  252.495   5.6468 0.000000 0.000000 
1 1 1    0    3    5 o  2057.57   18.268  3243.26   57.521  3243.26   57.521  3243.26   57.521  2057.57   18.268  2057.57   18.268 0.000000 0.000000 
1 1 1    0    3    6 o  167.765   5.2002   21.603   1.3324   21.603   1.3324   21.603   1.3324  167.765   5.2002  167.765   5.2002 0.000000 0.000000 
1 1 1    0    3    7 o   92.823   5.8635   6.6732   0.8255   6.6732   0.8255   6.6732   0.8255   92.823   5.8635   92.823   5.8635 0.000000 0.000000 
1 1 1    0    3    8 o  1409.90   10.688  1521.96   23.062  1521.96   23.062  1521.96   23.062  1409.90   10.688  1409.90   10.688 0.000000 0.000000 
1 1 1    0    3    9 o  1202.81   11.524  1107.85   21.213  1107.85   21.213  1107.85   21.213  1202.81   11.524  1202.81   11.524 0.000000 0.000000 
1 1 1    0    3   10 o  674.338   5.5920  348.109   5.7710  348.109   5.7710  348.109   5.7710  674.338   5.5920  674.338   5.5920 0.000000 0.000000 
1 1 1    0    3   11 o  163.333   5.6531   20.492   1.4094   20.492   1.4094   20.492   1.4094  163.333   5.6531  163.333   5.6531 0.000000 0.000000 
1 1 1    0    3   12 o  1091.16   7.6542  911.464   12.782  911.464   12.782  911.464   12.782  1091.16   7.6542  1091.16   7.6542 0.000000 0.000000 
1 1 1    0    3   13 o  1398.05   9.3109  1496.35   19.922  1496.35   19.922  1496.35   19.922  1398.05   9.3109  1398.05   9.3109 0.000000 0.000000 
1 1 1    0    3   14 f  899.574   6.7829  619.497   9.3383  619.497   9.3383  619.497   9.3383  899.574   6.7829  899.574   6.7829 0.000000 0.000000 
1 1 1    0    3   15 o  1423.83   13.408  1552.72   29.215  1552.72   29.215  1552.72   29.215  1423.83   13.408  1423.83   13.408 0.000000 0.000000 
1 1 1    0    3   16 o  897.985   7.9115  617.395   10.872  617.395   10.872  617.395   10.872  897.985   7.9115  897.985   7.9115 0.000000 0.000000 
1 1 1    0    3   17 o  418.548   5.3850  134.150   3.4486  134.150   3.4486  134.150   3.4486  418.548   5.3850  418.548   5.3850 0.000000 0.000000 
1 1 1    0    3   18 o  795.105   6.4907  484.002   7.8981  484.002   7.8981  484.002   7.8981  795.105   6.4907  795.105   6.4907 0.000000 0.000000 
1 1 1    0    3   19 o  288.211   5.9607   63.663   2.6270   63.663   2.6270   63.663   2.6270  288.211   5.9607  288.211   5.9607 0.000000 0.000000 
1 1 1    0    3   20 o  361.679   5.8152  100.206   3.2174  100.206   3.2174  100.206   3.2174  361.679   5.8152  361.679   5.8152 0.000000 0.000000 
1 1 1    0    3   21 o  932.952   7.2067  666.417   10.290  666.417   10.290  666.417   10.290  932.952   7.2067  932.952   7.2067 0.000000 0.000000 
1 1 1    0    3   22 o  768.776   9.3270  452.700   10.972  452.700   10.972  452.700   10.972  768.776   9.3270  768.776   9.3270 0.000000 0.000000 
1 1 1    0    3   23 o  1111.83   9.4404  946.632   16.063  946.632   16.063  946.632   16.063  1111.83   9.4404  1111.83   9.4404 0.000000 0.000000 
1 1 1    0    3   24 o  1124.54   8.2508  968.229   14.200  968.229   14.200  968.229   14.200  1124.54   8.2508  1124.54   8.2508 0.000000 0.000000 
1 1 1    0    3   25 o  126.250   13.333   12.609   2.5108   12.609   2.5108   12.609   2.5108  126.250   13.333  126.250   13.333 0.000000 0.000000 
1 1 1    0    3   26 o  1117.51   8.2937  956.111   14.185  956.111   14.185  956.111   14.185  1117.51   8.2937  1117.51   8.2937 0.000000 0.000000 
1 1 1    0    3   27 o  472.760   6.4964  171.166   4.6989  171.166   4.6989  171.166   4.6989  472.760   6.4964  472.760   6.4964 0.000000 0.000000 
1 1 1    0    3   28 o  797.077   10.036  486.589   12.240  486.589   12.240  486.589   12.240  797.077   10.036  797.077   10.036 0.000000 0.000000 
1 1 1    0    3   29 o  863.949   7.4370  571.446   9.8329  571.446   9.8329  571.446   9.8329  863.949   7.4370  863.949   7.4370 0.000000 0.000000 
1 1 1    0    3   30 o  1549.97   10.614  1839.42   25.179  1839.42   25.179  1839.42   25.179  1549.97   10.614  1549.97   10.614 0.000000 0.000000 
1 1 1    0    3   31 o  180.099   13.616   25.259   3.7042   25.259   3.7042   25.259   3.7042  180.099   13.616  180.099   13.616 0.000000 0.000000 
1 1 1    0    3   32 o  568.619   7.4625  247.617   6.4924  247.617   6.4924  247.617   6.4924  568.619   7.4625  568.619   7.4625 0.000000 0.000000 
1 1 1    0    3   33 o  553.724   7.6649  234.833   6.4936  234.833   6.4936  234.833   6.4936  553.724   7.6649  553.724   7.6649 0.000000 0.000000 
1 1 1    0    3   34 o  1075.15   9.9475  885.200   16.367  885.200   16.367  885.200   16.367  1075.15   9.9475  1075.15   9.9475 0.000000 0.000000 
1 1 1    0    3   35 o   39.874   27.091  -2.7653   5.0029  -2.7653   5.0029  -2.7653   5.0029   39.874   27.091   39.874   27.091 0.000000 0.000000 
1 1 1    0    3   36 o  432.506   9.2470  143.408   6.1153  143.408   6.1153  143.408   6.1153  432.506   9.2470  432.506   9.2470 0.000000 0.000000 
1 1 1    0    3   37 o  365.051   10.544  102.294   5.8804  102.294   5.8804  102.294   5.8804  365.051   10.544  365.051   10.544 0.000000 0.000000 
1 1 1    0    3   38 o  976.747   8.7080  730.591   13.017  730.591   13.017  730.591   13.017  976.747   8.7080  976.747   8.7080 0.000000 0.000000 
1 1 1    0    3   39 o   45.923   29.977  -0.5842   5.1570  -0.5842   5.1570  -0.5842   5.1570   45.923   29.977   45.923   29.977 0.000000 0.000000 
1 1 1    0    3   40 o  885.598   12.283  601.166   16.643  601.166   16.643  601.166   16.643  885.598   12.283  885.598   12.283 0.000000 0.000000 
1 1 1    0    3   41 o  514.926   9.2010  203.249   7.2466  203.249   7.2466  203.249   7.2466  514.926   9.2010  514.926   9.2010 0.000000 0.000000 
1 1 1    0    3   42 o  275.579   13.739   58.651   5.7622   58.651   5.7622   58.651   5.7622  275.579   13.739  275.579   13.739 0.000000 0.000000 
1 1 1    0    3   43 o   55.193   33.131   2.4116   5.0318   2.4116   5.0318   2.4116   5.0318   55.193   33.131   55.193   33.131 0.000000 0.000000 
1 1 1    0    3   44 o  601.947   8.8814  277.748   8.1789  277.748   8.1789  277.748   8.1789  601.947   8.8814  601.947   8.8814 0.000000 0.000000 
1 1 1    0    3   45 f  225.539   15.733   39.625   5.3707   39.625   5.3707   39.625   5.3707  225.539   15.733  225.539   15.733 0.000000 0.000000 
1 1 1    0    3   46 o  360.054   12.173   99.781   6.6910   99.781   6.6910   99.781   6.6910  360.054   12.173  360.054   12.173 0.000000 0.000000 
1 1 1    0    3   47 f  368.599   12.412  104.611   6.9847  104.611   6.9847  104.611   6.9847  368.599   12.412  368.599   12.412 0.000000 0.000000 
1 1 1    0    3   48 o   57.879   33.605   3.2420   4.8801   3.2420   4.8801   3.2420   4.8801   57.879   33.605   57.879   33.605 0.000000 0.000000 
1 1 1    0    3   49 o  314.251   15.210   76.488   7.2768   76.488   7.2768   76.488   7.2768  314.251   15.210  314.251   15.210 0.000000 0.000000 
1 1 1    0    3   50 o   94.200   37.030   9.5456   5.1210   9.5456   5.1210   9.5456   5.1210   94.200   37.030   94.200   37.030 0.000000 0.000000 
1 1 1    0    3   51 o  311.813   19.336   76.022   9.1472   76.022   9.1472   76.022   9.1472  311.813   19.336  311.813   19.336 0.000000 0.000000 
1 1 1    0    3   52 o  236.371   19.571   44.123   6.9692   44.123   6.9692   44.123   6.9692  236.371   19.571  236.371   19.571 0.000000 0.000000 
1 1 1    0    3   53 o  169.035   21.022   23.159   5.2122   23.159   5.2122   23.159   5.2122  169.035   21.022  169.035   21.022 0.000000 0.000000 
1 1 1    0    3   54 o   62.268   35.092   4.2241   5.0990   4.2241   5.0990   4.2241   5.0990   62.268   35.092   62.268   35.092 0.000000 0.000000 
1 1 1    0    3   55 o   69.949   36.344   5.7710   5.0511   5.7710   5.0511   5.7710   5.0511   69.949   36.344   69.949   36.344 0.000000 0.000000 
1 1 1    0    3   56 o   73.559   37.430   6.4508   5.2877   6.4508   5.2877   6.4508   5.2877   73.559   37.430   73.559   37.430 0.000000 0.000000 
1 1 1    0    3   57 f  177.408   23.941   25.940   6.1679   25.940   6.1679   25.940   6.1679  177.408   23.941  177.408   23.941 0.000000 0.000000 
1 1 1    0    3   58 o  137.576   34.523   17.587   6.2881   17.587   6.2881   17.587   6.2881  137.576   34.523  137.576   34.523 0.000000 0.000000 
1 1 1    0    3   59 o   53.983   33.938   1.6409   5.8770   1.6409   5.8770   1.6409   5.8770   53.983   33.938   53.983   33.938 0.000000 0.000000 
1 1 1    0    3   60 o   51.438   33.626  -0.0632   6.5239  -0.0632   6.5239  -0.0632   6.5239   51.438   33.626   51.438   33.626 0.000000 0.000000 
1 1 1    0    3   61 o   59.965   36.266   3.3903   6.1202   3.3903   6.1202   3.3903   6.1202   59.965   36.266   59.965   36.266 0.000000 0.000000 
1 1 1    0    3   62 o   67.642   39.744   5.1847   6.9604   5.1847   6.9604   5.1847   6.9604   67.642   39.744   67.642   39.744 0.000000 0.000000 
1 1 1    0    3   63 o   52.098   32.238   2.1367   5.0909   2.1367   5.0909   2.1367   5.0909   52.098   32.238   52.098   32.238 0.000000 0.000000 
1 1 1    0    3   64 o  132.831   28.250   15.992   5.0489   15.992   5.0489   15.992   5.0489  132.831   28.250  132.831   28.250 0.000000 0.000000 
1 1 1    0    3   65 o   33.413   23.552  -4.8394   4.7755  -4.8394   4.7755  -4.8394   4.7755   33.413   23.552   33.413   23.552 0.000000 0.000000 
1 1 1    0    3   66 o   42.070   27.891  -0.4031   4.7393  -0.4031   4.7393  -0.4031   4.7393   42.070   27.891   42.070   27.891 0.000000 0.000000 
1 1 1    0    4    1 o  737.984   11.235  417.216   12.685  417.216   12.685  417.216   12.685  737.984   11.235  737.984   11.235 0.000000 0.000000 
1 1 1    0    4    2 o  487.802   6.4303  182.219   4.7993  182.219   4.7993  182.219   4.7993  487.802   6.4303  487.802   6.4303 0.000000 0.000000 
1 1 1    0    4    3 o  1051.48   10.215  846.582   16.436  846.582   16.436  846.582   16.436  1051.48   10.215  1051.48   10.215 0.000000 0.000000 
1 1 1    0    4    4 o  1552.13   14.138  1845.02   33.583  1845.02   33.583  1845.02   33.583  1552.13   14.138  1552.13   14.138 0.000000 0.000000 
1 1 1    0    4    5 f  731.146   8.0144  409.324   8.9665  409.324   8.9665  409.324   8.9665  731.146   8.0144  731.146   8.0144 0.000000 0.000000 
1 1 1    0    4    6 o  864.506   8.9601  572.262   11.854  572.262   11.854  572.262   11.854  864.506   8.9601  864.506   8.9601 0.000000 0.000000 
1 1 1    0    4    7 o  718.460   8.0605  395.252   8.8616  395.252   8.8616  395.252   8.8616  718.460   8.0605  718.460   8.0605 0.000000 0.000000 
1 1 1    0    4    8 o  433.974   9.5500  144.374   6.3367  144.374   6.3367  144.374   6.3367  433.974   9.5500  433.974   9.5500 0.000000 0.000000 
1 1 1    0    4    9 f  460.769   5.5812  162.566   3.9349  162.566   3.9349  162.566   3.9349  460.769   5.5812  460.769   5.5812 0.000000 0.000000 
1 1 1    0    4   10 o  815.585   6.2398  509.206   7.7885  509.206   7.7885  509.206   7.7885  815.585   6.2398  815.585   6.2398 0.000000 0.000000 
1 1 1    0    4   11 o  212.668   5.0805   34.675   1.6516   34.675   1.6516   34.675   1.6516  212.668   5.0805  212.668   5.0805 0.000000 0.000000 
1 1 1    0    4   12 o  1261.85   8.5560  1218.97   16.524  1218.97   16.524  1218.97   16.524  1261.85   8.5560  1261.85   8.5560 0.000000 0.000000 
1 1 1    0    4   13 o   20.327   13.751  -0.6321   1.2610  -0.6321   1.2610  -0.6321   1.2610   20.327   13.751   20.327   13.751 0.000000 0.000000 
1 1 1    0    4   14 o  285.724   5.9010   62.565   2.5782   62.565   2.5782   62.565   2.5782  285.724   5.9010  285.724   5.9010 0.000000 0.000000 
1 1 1    0    4   15 o  993.696   8.4256  756.015   12.813  756.015   12.813  756.015   12.813  993.696   8.4256  993.696   8.4256 0.000000 0.000000 
1 1 1    0    4   16 o  357.385   7.1557   97.883   3.9108   97.883   3.9108   97.883   3.9108  357.385   7.1557  357.385   7.1557 0.000000 0.000000 
1 1 1    0    4   17 o  254.402   5.9575   49.619   2.3170   49.619   2.3170   49.619   2.3170  254.402   5.9575  254.402   5.9575 0.000000 0.000000 
1 1 1    0    4   18 o  238.929   6.2187   43.785   2.2708   43.785   2.2708   43.785   2.2708  238.929   6.2187  238.929   6.2187 0.000000 0.000000 
1 1 1    0    4   19 o   29.421   18.346   0.3936   1.6810   0.3936   1.6810   0.3936   1.6810   29.421   18.346   29.421   18.346 0.000000 0.000000 
1 1 1    0    4   20 o   38.906   20.795   1.6586   1.6909   1.6586   1.6909   1.6586   1.6909   38.906   20.795   38.906   20.795 0.000000 0.000000 
1 1 1    0    4   21 o  864.431   7.9670  572.195   10.539  572.195   10.539  572.195   10.539  864.431   7.9670  864.431   7.9670 0.000000 0.000000 
1 1 1    0    4   22 o   25.691   18.023  -2.9087   2.6968  -2.9087   2.6968  -2.9087   2.6968   25.691   18.023   25.691   18.023 0.000000 0.000000 
1 1 1    0    4   23 o  329.664   6.4905   83.285   3.2722   83.285   3.2722   83.285   3.2722  329.664   6.4905  329.664   6.4905 0.000000 0.000000 
1 1 1    0    4   24 o  691.689   6.5418  366.311   6.9245  366.311   6.9245  366.311   6.9245  691.689   6.5418  691.689   6.5418 0.000000 0.000000 
1 1 1    0    4   25 o  313.396   6.9184   75.289   3.3151   75.289   3.3151   75.289   3.3151  313.396   6.9184  313.396   6.9184 0.000000 0.000000 
1 1 1    0    4   26 o  955.429   7.5635  698.866   11.059  698.866   11.059  698.866   11.059  955.429   7.5635  955.429   7.5635 0.000000 0.000000 
1 1 1    0    4   27 o  816.571   8.1466  510.550   10.180  510.550   10.180  510.550   10.180  816.571   8.1466  816.571   8.1466 0.000000 0.000000 
1 1 1    0    4   28 o  663.140   7.9528  336.752   8.0696  336.752   8.0696  336.752   8.0696  663.140   7.9528  663.140   7.9528 0.000000 0.000000 
1 1 1    0    4   29 o  1846.27   12.169  2610.06   34.385  2610.06   34.385  2610.06   34.385  1846.27   12.169  1846.27   12.169 0.000000 0.000000 
1 1 1    0    4   30 o  1430.68   10.013  1567.13   21.924  1567.13   21.924  1567.13   21.924  1430.68   10.013  1430.68   10.013 0.000000 0.000000 
1 1 1    0    4   31 o  264.594   9.9230   53.820   4.0059   53.820   4.0059   53.820   4.0059  264.594   9.9230  264.594   9.9230 0.000000 0.000000 
1 1 1    0    4   32 o   43.831   26.995   1.1151   3.5296   1.1151   3.5296   1.1151   3.5296   43.831   26.995   43.831   26.995 0.000000 0.000000 
1 1 1    0    4   33 o  566.131   7.5453  245.464   6.5357  245.464   6.5357  245.464   6.5357  566.131   7.5453  566.131   7.5453 0.000000 0.000000 
1 1 1    0    4   34 o  859.006   9.0359  565.072   11.878  565.072   11.878  565.072   11.878  859.006   9.0359  859.006   9.0359 0.000000 0.000000 
1 1 1    0    4   35 o  330.844   12.118   84.154   6.1179   84.154   6.1179   84.154   6.1179  330.844   12.118  330.844   12.118 0.000000 0.000000 
1 1 1    0    4   36 o  540.110   8.4836  223.490   7.0096  223.490   7.0096  223.490   7.0096  540.110   8.4836  540.110   8.4836 0.000000 0.000000 
1 1 1    0    4   37 o  466.649   9.2953  166.921   6.6334  166.921   6.6334  166.921   6.6334  466.649   9.2953  466.649   9.2953 0.000000 0.000000 
1 1 1    0    4   38 o  246.598   14.682   47.083   5.4969   47.083   5.4969   47.083   5.4969  246.598   14.682  246.598   14.682 0.000000 0.000000 
1 1 1    0    4   39 o  1033.56   10.225  818.275   16.173  818.275   16.173  818.275   16.173  1033.56   10.225  1033.56   10.225 0.000000 0.000000 
1 1 1    0    4   40 o  366.935   15.924  103.799   8.9055  103.799   8.9055  103.799   8.9055  366.935   15.924  366.935   15.924 0.000000 0.000000 
1 1 1    0    4   41 o  260.293   14.308   52.403   5.6611   52.403   5.6611   52.403   5.6611  260.293   14.308  260.293   14.308 0.000000 0.000000 
1 1 1    0    4   42 o  203.342   17.815   32.456   5.4468   32.456   5.4468   32.456   5.4468  203.342   17.815  203.342   17.815 0.000000 0.000000 
1 1 1    0    4   43 o  138.074   27.434   16.297   5.1499   16.297   5.1499   16.297   5.1499  138.074   27.434  138.074   27.434 0.000000 0.000000 
1 1 1    0    4   44 o  239.857   14.624   44.632   5.3234   44.632   5.3234   44.632   5.3234  239.857   14.624  239.857   14.624 0.000000 0.000000 
1 1 1    0    4   45 f  673.599   8.6119  347.781   8.8759  347.781   8.8759  347.781   8.8759  673.599   8.6119  673.599   8.6119 0.000000 0.000000 
1 1 1    0    4   46 o  135.502   29.739   16.071   5.3989   16.071   5.3989   16.071   5.3989  135.502   29.739  135.502   29.739 0.000000 0.000000 
1 1 1    0    4   47 o  167.812   23.426   22.965   5.6816   22.965   5.6816   22.965   5.6816  167.812   23.426  167.812   23.426 0.000000 0.000000 
1 1 1    0    4   48 o  652.697   8.7145  326.701   8.7026  326.701   8.7026  326.701   8.7026  652.697   8.7145  652.697   8.7145 0.000000 0.000000 
1 1 1    0    4   49 o  182.284   24.885   27.131   6.5766   27.131   6.5766   27.131   6.5766  182.284   24.885  182.284   24.885 0.000000 0.000000 
1 1 1    0    4   50 o   92.103   41.841   9.7572   6.3801   9.7572   6.3801   9.7572   6.3801   92.103   41.841   92.103   41.841 0.000000 0.000000 
1 1 1    0    4   51 o  252.460   16.051   49.714   6.1448   49.714   6.1448   49.714   6.1448  252.460   16.051  252.460   16.051 0.000000 0.000000 
1 1 1    0    4   52 o   90.362   42.616   9.6051   6.6532   9.6051   6.6532   9.6051   6.6532   90.362   42.616   90.362   42.616 0.000000 0.000000 
1 1 1    0    4   53 o  103.509   34.758   10.828   4.9174   10.828   4.9174   10.828   4.9174  103.509   34.758  103.509   34.758 0.000000 0.000000 
1 1 1    0    4   54 o  324.912   12.621   81.625   6.2553   81.625   6.2553   81.625   6.2553  324.912   12.621  324.912   12.621 0.000000 0.000000 
1 1 1    0    4   55 o   97.815   36.733   10.211   5.1386   10.211   5.1386   10.211   5.1386   97.815   36.733   97.815   36.733 0.000000 0.000000 
1 1 1    0    4   56 o  100.632   37.160   10.766   5.3040   10.766   5.3040   10.766   5.3040  100.632   37.160  100.632   37.160 0.000000 0.000000 
1 1 1    0    4   57 o  344.826   13.727   92.217   7.2190   92.217   7.2190   92.217   7.2190  344.826   13.727  344.826   13.727 0.000000 0.000000 
1 1 1    0    4   58 o   57.031   35.278   2.3378   6.0909   2.3378   6.0909   2.3378   6.0909   57.031   35.278   57.031   35.278 0.000000 0.000000 
1 1 1    0    4   59 o   58.885   35.163   3.3150   5.6085   3.3150   5.6085   3.3150   5.6085   58.885   35.163   58.885   35.163 0.000000 0.000000 
1 1 1    0    4   60 o  183.292   23.952   27.805   6.4022   27.805   6.4022   27.805   6.4022  183.292   23.952  183.292   23.952 0.000000 0.000000 
1 1 1    0    4   61 o  130.991   35.364   16.517   6.1282   16.517   6.1282   16.517   6.1282  130.991   35.364  130.991   35.364 0.000000 0.000000 
1 1 1    0    4   62 o   73.005   39.343   6.6947   6.0995   6.6947   6.0995   6.6947   6.0995   73.005   39.343   73.005   39.343 0.000000 0.000000 
1 1 1    0    4   63 o   51.701   32.138   2.0054   5.1182   2.0054   5.1182   2.0054   5.1182   51.701   32.138   51.701   32.138 0.000000 0.000000 
1 1 1    0    4   64 o   66.148   35.656   5.5369   5.0110   5.5369   5.0110   5.5369   5.0110   66.148   35.656   66.148   35.656 0.000000 0.000000 
1 1 1    0    4   65 o   45.513   29.538   0.5170   4.9063   0.5170   4.9063   0.5170   4.9063   45.513   29.538   45.513   29.538 0.000000 0.000000 
1 1 1    0    4   66 o   40.218   27.126  -1.3199   4.8376  -1.3199   4.8376  -1.3199   4.8376   40.218   27.126   40.218   27.126 0.000000 0.000000 
1 1 1    0    5    1 o  729.606   11.259  407.804   12.567  407.804   12.567  407.804   12.567  729.606   11.259  729.606   11.259 0.000000 0.000000 
1 1 1    0    5    2 o  866.942   8.9149  575.488   11.827  575.488   11.827  575.488   11.827  866.942   8.9149  866.942   8.9149 0.000000 0.000000 
1 1 1    0    5    3 o  412.298   6.2348  130.196   3.9326  130.196   3.9326  130.196   3.9326  412.298   6.2348  412.298   6.2348 0.000000 0.000000 
1 1 1    0    5    4 o  828.357   8.6699  525.402   10.990  525.402   10.990  525.402   10.990  828.357   8.6699  828.357   8.6699 0.000000 0.000000 
1 1 1    0    5    5 o  923.174   9.3651  652.571   13.230  652.571   13.230  652.571   13.230  923.174   9.3651  923.174   9.3651 0.000000 0.000000 
1 1 1    0    5    6 o  1062.41   14.729  864.737   23.941  864.737   23.941  864.737   23.941  1062.41   14.729  1062.41   14.729 0.000000 0.000000 
1 1 1    0    5    7 o  1328.99   17.652  1353.39   35.893  1353.39   35.893  1353.39   35.893  1328.99   17.652  1328.99   17.652 0.000000 0.000000 
1 1 1    0    5    8 o  1134.11   11.030  984.912   19.143  984.912   19.143  984.912   19.143  1134.11   11.030  1134.11   11.030 0.000000 0.000000 
1 1 1    0    5    9 o  1141.52   11.116  997.818   19.418  997.818   19.418  997.818   19.418  1141.52   11.116  1141.52   11.116 0.000000 0.000000 
1 1 1    0    5   10 o  1093.16   10.815  915.065   18.092  915.065   18.092  915.065   18.092  1093.16   10.815  1093.16   10.815 0.000000 0.000000 
1 1 1    0    5   11 o  1395.06   10.694  1490.12   22.833  1490.12   22.833  1490.12   22.833  1395.06   10.694  1395.06   10.694 0.000000 0.000000 
1 1 1    0    5   12 o  376.947   4.9249  108.805   2.8404  108.805   2.8404  108.805   2.8404  376.947   4.9249  376.947   4.9249 0.000000 0.000000 
1 1 1    0    5   13 o  1619.92   10.551  2009.14   26.159  2009.14   26.159  2009.14   26.159  1619.92   10.551  1619.92   10.551 0.000000 0.000000 
1 1 1    0    5   14 o  556.305   7.6305  237.019   6.4946  237.019   6.4946  237.019   6.4946  556.305   7.6305  556.305   7.6305 0.000000 0.000000 
1 1 1    0    5   15 o  476.364   6.1988  173.776   4.5181  173.776   4.5181  173.776   4.5181  476.364   6.1988  476.364   6.1988 0.000000 0.000000 
1 1 1    0    5   16 o  358.658   5.3182   98.521   2.9181   98.521   2.9181   98.521   2.9181  358.658   5.3182  358.658   5.3182 0.000000 0.000000 
1 1 1    0    5   17 o  131.335   8.5590   13.372   1.7038   13.372   1.7038   13.372   1.7038  131.335   8.5590  131.335   8.5590 0.000000 0.000000 
1 1 1    0    5   18 o  207.989   6.5925   33.213   2.0940   33.213   2.0940   33.213   2.0940  207.989   6.5925  207.989   6.5925 0.000000 0.000000 
1 1 1    0    5   19 o  409.894   8.4190  128.788   5.2770  128.788   5.2770  128.788   5.2770  409.894   8.4190  409.894   8.4190 0.000000 0.000000 
1 1 1    0    5   20 o  421.391   5.7904  135.996   3.7332  135.996   3.7332  135.996   3.7332  421.391   5.7904  421.391   5.7904 0.000000 0.000000 
1 1 1    0    5   21 o  585.511   6.8978  262.536   6.1799  262.536   6.1799  262.536   6.1799  585.511   6.8978  585.511   6.8978 0.000000 0.000000 
1 1 1    0    5   22 f  527.549   7.0816  213.157   5.7159  213.157   5.7159  213.157   5.7159  527.549   7.0816  527.549   7.0816 0.000000 0.000000 
1 1 1    0    5   23 o  382.894   6.2221  112.308   3.6444  112.308   3.6444  112.308   3.6444  382.894   6.2221  382.894   6.2221 0.000000 0.000000 
1 1 1    0    5   24 f  1116.09   8.2104  953.714   14.024  953.714   14.024  953.714   14.024  1116.09   8.2104  1116.09   8.2104 0.000000 0.000000 
1 1 1    0    5   25 o  798.305   6.9517  487.915   8.4928  487.915   8.4928  487.915   8.4928  798.305   6.9517  798.305   6.9517 0.000000 0.000000 
1 1 1    0    5   26 o   93.361   19.639   7.4968   2.4708   7.4968   2.4708   7.4968   2.4708   93.361   19.639   93.361   19.639 0.000000 0.000000 
1 1 1    0    5   27 o   51.180   26.903   2.9040   2.7919   2.9040   2.7919   2.9040   2.7919   51.180   26.903   51.180   26.903 0.000000 0.000000 
1 1 1    0    5   28 o  1270.29   10.547  1235.56   20.504  1235.56   20.504  1235.56   20.504  1270.29   10.547  1270.29   10.547 0.000000 0.000000 
1 1 1    0    5   29 o  812.631   7.3033  505.583   9.0825  505.583   9.0825  505.583   9.0825  812.631   7.3033  812.631   7.3033 0.000000 0.000000 
1 1 1    0    5   30 o  537.513   7.0954  221.261   5.8353  221.261   5.8353  221.261   5.8353  537.513   7.0954  537.513   7.0954 0.000000 0.000000 
1 1 1    0    5   31 o  109.661   23.240   10.361   3.4307   10.361   3.4307   10.361   3.4307  109.661   23.240  109.661   23.240 0.000000 0.000000 
1 1 1    0    5   32 o  873.860   7.8408  584.671   10.486  584.671   10.486  584.671   10.486  873.860   7.8408  873.860   7.8408 0.000000 0.000000 
1 1 1    0    5   33 o  405.583   8.4866  126.088   5.2633  126.088   5.2633  126.088   5.2633  405.583   8.4866  405.583   8.4866 0.000000 0.000000 
1 1 1    0    5   34 o  102.254   33.578   10.244   4.6618   10.244   4.6618   10.244   4.6618  102.254   33.578  102.254   33.578 0.000000 0.000000 
1 1 1    0    5   35 o  308.053   12.965   73.059   6.0887   73.059   6.0887   73.059   6.0887  308.053   12.965  308.053   12.965 0.000000 0.000000 
1 1 1    0    5   36 o  134.771   25.086   15.293   4.6486   15.293   4.6486   15.293   4.6486  134.771   25.086  134.771   25.086 0.000000 0.000000 
1 1 1    0    5   37 o  306.827   12.004   72.428   5.6180   72.428   5.6180   72.428   5.6180  306.827   12.004  306.827   12.004 0.000000 0.000000 
1 1 1    0    5   38 o  402.951   10.003  124.559   6.1612  124.559   6.1612  124.559   6.1612  402.951   10.003  402.951   10.003 0.000000 0.000000 
1 1 1    0    5   39 o  362.996   12.061  101.264   6.6847  101.264   6.6847  101.264   6.6847  362.996   12.061  362.996   12.061 0.000000 0.000000 
1 1 1    0    5   40 o  471.732   11.441  170.762   8.2500  170.762   8.2500  170.762   8.2500  471.732   11.441  471.732   11.441 0.000000 0.000000 
1 1 1    0    5   41 o  1357.94   10.244  1412.70   21.290  1412.70   21.290  1412.70   21.290  1357.94   10.244  1357.94   10.244 0.000000 0.000000 
1 1 1    0    5   42 o   82.156   37.219   7.5712   5.0471   7.5712   5.0471   7.5712   5.0471   82.156   37.219   82.156   37.219 0.000000 0.000000 
1 1 1    0    5   43 f  227.199   16.123   40.209   5.5419   40.209   5.5419   40.209   5.5419  227.199   16.123  227.199   16.123 0.000000 0.000000 
1 1 1    0    5   44 o   51.034   31.617   1.4473   4.9115   1.4473   4.9115   1.4473   4.9115   51.034   31.617   51.034   31.617 0.000000 0.000000 
1 1 1    0    5   45 o   74.227   36.321   6.3128   4.8861   6.3128   4.8861   6.3128   4.8861   74.227   36.321   74.227   36.321 0.000000 0.000000 
1 1 1    0    5   46 o  627.154   12.196  302.075   11.697  302.075   11.697  302.075   11.697  627.154   12.196  627.154   12.196 0.000000 0.000000 
1 1 1    0    5   47 o   43.908   28.946  -0.9296   4.9891  -0.9296   4.9891  -0.9296   4.9891   43.908   28.946   43.908   28.946 0.000000 0.000000 
1 1 1    0    5   48 o   87.474   41.689   8.8613   6.3843   8.8613   6.3843   8.8613   6.3843   87.474   41.689   87.474   41.689 0.000000 0.000000 
1 1 1    0    5   49 o  200.417   21.777   32.126   6.4803   32.126   6.4803   32.126   6.4803  200.417   21.777  200.417   21.777 0.000000 0.000000 
1 1 1    0    5   50 o  422.819   10.162  137.417   6.5678  137.417   6.5678  137.417   6.5678  422.819   10.162  422.819   10.162 0.000000 0.000000 
1 1 1    0    5   51 f  118.607   35.049   13.521   5.5325   13.521   5.5325   13.521   5.5325  118.607   35.049  118.607   35.049 0.000000 0.000000 
1 1 1    0    5   52 o  521.567   11.622  209.388   9.2675  209.388   9.2675  209.388   9.2675  521.567   11.622  521.567   11.622 0.000000 0.000000 
1 1 1    0    5   53 o  189.959   18.632   28.716   5.2978   28.716   5.2978   28.716   5.2978  189.959   18.632  189.959   18.632 0.000000 0.000000 
1 1 1    0    5   54 o  213.749   16.736   35.956   5.3984   35.956   5.3984   35.956   5.3984  213.749   16.736  213.749   16.736 0.000000 0.000000 
1 1 1    0    5   55 o  143.470   26.145   17.585   5.1770   17.585   5.1770   17.585   5.1770  143.470   26.145  143.470   26.145 0.000000 0.000000 
1 1 1    0    5   56 o  128.966   31.661   15.221   5.4124   15.221   5.4124   15.221   5.4124  128.966   31.661  128.966   31.661 0.000000 0.000000 
1 1 1    0    5   57 o   71.386   38.095   6.0653   5.6663   6.0653   5.6663   6.0653   5.6663   71.386   38.095   71.386   38.095 0.000000 0.000000 
1 1 1    0    5   58 o  387.333   13.932  116.374   8.2357  116.374   8.2357  116.374   8.2357  387.333   13.932  387.333   13.932 0.000000 0.000000 
1 1 1    0    5   59 o   57.314   35.645   2.2835   6.3040   2.2835   6.3040   2.2835   6.3040   57.314   35.645   57.314   35.645 0.000000 0.000000 
1 1 1    0    5   60 o  141.842   29.160   17.835   5.5928   17.835   5.5928   17.835   5.5928  141.842   29.160  141.842   29.160 0.000000 0.000000 
1 1 1    0    5   61 o   58.773   34.558   3.6317   5.2697   3.6317   5.2697   3.6317   5.2697   58.773   34.558   58.773   34.558 0.000000 0.000000 
1 1 1    0    5   62 o  285.984   21.060   65.669   9.1039   65.669   9.1039   65.669   9.1039  285.984   21.060  285.984   21.060 0.000000 0.000000 
1 1 1    0    5   63 o   37.353   26.147  -4.9440   5.5877  -4.9440   5.5877  -4.9440   5.5877   37.353   26.147   37.353   26.147 0.000000 0.000000 
1 1 1    0    5   64 o   65.910   36.172   5.4956   5.2501   5.4956   5.2501   5.4956   5.2501   65.910   36.172   65.910   36.172 0.000000 0.000000 
1 1 1    0    5   65 o   75.544   36.872   7.3485   5.0304   7.3485   5.0304   7.3485   5.0304   75.544   36.872   75.544   36.872 0.000000 0.000000 
1 1 1    0    5   66 o   36.241   25.135  -3.2610   4.8467  -3.2610   4.8467  -3.2610   4.8467   36.241   25.135   36.241   25.135 0.000000 0.000000 
1 1 1    0    6    2 o   30.193   15.629   1.0172   0.9314   1.0172   0.9314   1.0172   0.9314   30.193   15.629   30.193   15.629 0.000000 0.000000 
1 1 1    0    6    3 o  477.510   6.6230  174.621   4.8386  174.621   4.8386  174.621   4.8386  477.510   6.6230  477.510   6.6230 0.000000 0.000000 
1 1 1    0    6    4 o  360.349   8.8604   99.575   4.8804   99.575   4.8804   99.575   4.8804  360.349   8.8604  360.349   8.8604 0.000000 0.000000 
1 1 1    0    6    5 f  1273.81   17.007  1243.27   33.146  1243.27   33.146  1243.27   33.146  1273.81   17.007  1273.81   17.007 0.000000 0.000000 
1 1 1    0    6    6 o  149.018   7.5338   17.127   1.7084   17.127   1.7084   17.127   1.7084  149.018   7.5338  149.018   7.5338 0.000000 0.000000 
1 1 1    0    6    7 o  695.317   7.9828  370.203   8.4934  370.203   8.4934  370.203   8.4934  695.317   7.9828  695.317   7.9828 0.000000 0.000000 
1 1 1    0    6    8 o  528.107   7.1868  213.587   5.8069  213.587   5.8069  213.587   5.8069  528.107   7.1868  528.107   7.1868 0.000000 0.000000 
1 1 1    0    6    9 o  893.960   9.3683  611.936   12.816  611.936   12.816  611.936   12.816  893.960   9.3683  893.960   9.3683 0.000000 0.000000 
1 1 1    0    6   10 o  973.965   9.9955  726.382   14.898  726.382   14.898  726.382   14.898  973.965   9.9955  973.965   9.9955 0.000000 0.000000 
1 1 1    0    6   11 o  761.327   8.6409  443.843   10.066  443.843   10.066  443.843   10.066  761.327   8.6409  761.327   8.6409 0.000000 0.000000 
1 1 1    0    6   12 o  419.634   5.8270  134.856   3.7411  134.856   3.7411  134.856   3.7411  419.634   5.8270  419.634   5.8270 0.000000 0.000000 
1 1 1    0    6   13 o  614.288   7.8266  288.981   7.3562  288.981   7.3562  288.981   7.3562  614.288   7.8266  614.288   7.8266 0.000000 0.000000 
1 1 1    0    6   14 o  498.385   6.1666  190.203   4.7025  190.203   4.7025  190.203   4.7025  498.385   6.1666  498.385   6.1666 0.000000 0.000000 
1 1 1    0    6   15 o  266.411   6.5304   54.424   2.6593   54.424   2.6593   54.424   2.6593  266.411   6.5304  266.411   6.5304 0.000000 0.000000 
1 1 1    0    6   16 o  514.751   5.4633  202.875   4.3034  202.875   4.3034  202.875   4.3034  514.751   5.4633  514.751   5.4633 0.000000 0.000000 
1 1 1    0    6   17 o  231.462   6.1137   41.093   2.1626   41.093   2.1626   41.093   2.1626  231.462   6.1137  231.462   6.1137 0.000000 0.000000 
1 1 1    0    6   18 o  778.298   6.4776  463.772   7.7155  463.772   7.7155  463.772   7.7155  778.298   6.4776  778.298   6.4776 0.000000 0.000000 
1 1 1    0    6   19 o  116.009   9.9925   10.532   1.7441   10.532   1.7441   10.532   1.7441  116.009   9.9925  116.009   9.9925 0.000000 0.000000 
1 1 1    0    6   20 o  897.850   8.1126  617.292   11.147  617.292   11.147  617.292   11.147  897.850   8.1126  897.850   8.1126 0.000000 0.000000 
1 1 1    0    6   21 o  475.109   8.2751  172.966   6.0137  172.966   6.0137  172.966   6.0137  475.109   8.2751  475.109   8.2751 0.000000 0.000000 
1 1 1    0    6   22 o  345.069   7.2734   91.270   3.8377   91.270   3.8377   91.270   3.8377  345.069   7.2734  345.069   7.2734 0.000000 0.000000 
1 1 1    0    6   23 o  400.376   6.1834  122.787   3.7873  122.787   3.7873  122.787   3.7873  400.376   6.1834  400.376   6.1834 0.000000 0.000000 
1 1 1    0    6   24 o  460.487   6.3252  162.398   4.4563  162.398   4.4563  162.398   4.4563  460.487   6.3252  460.487   6.3252 0.000000 0.000000 
1 1 1    0    6   25 o   28.575   18.945  -0.5940   2.1870  -0.5940   2.1870  -0.5940   2.1870   28.575   18.945   28.575   18.945 0.000000 0.000000 
1 1 1    0    6   26 o   59.393   26.128   3.8842   2.4877   3.8842   2.4877   3.8842   2.4877   59.393   26.128   59.393   26.128 0.000000 0.000000 
1 1 1    0    6   27 o  116.840   19.618   11.300   3.2112   11.300   3.2112   11.300   3.2112  116.840   19.618  116.840   19.618 0.000000 0.000000 
1 1 1    0    6   28 o  268.651   8.4283   55.408   3.4580   55.408   3.4580   55.408   3.4580  268.651   8.4283  268.651   8.4283 0.000000 0.000000 
1 1 1    0    6   29 f  517.165   6.9911  204.829   5.5318  204.829   5.5318  204.829   5.5318  517.165   6.9911  517.165   6.9911 0.000000 0.000000 
1 1 1    0    6   30 o  196.608   11.652   29.905   3.4784   29.905   3.4784   29.905   3.4784  196.608   11.652  196.608   11.652 0.000000 0.000000 
1 1 1    0    6   31 o  572.172   7.3412  250.713   6.4269  250.713   6.4269  250.713   6.4269  572.172   7.3412  572.172   7.3412 0.000000 0.000000 
1 1 1    0    6   32 o   84.815   30.122   7.2655   3.5615   7.2655   3.5615   7.2655   3.5615   84.815   30.122   84.815   30.122 0.000000 0.000000 
1 1 1    0    6   33 o  362.954   9.9468  101.080   5.5165  101.080   5.5165  101.080   5.5165  362.954   9.9468  362.954   9.9468 0.000000 0.000000 
1 1 1    0    6   34 o  987.130   9.8489  746.236   14.878  746.236   14.878  746.236   14.878  987.130   9.8489  987.130   9.8489 0.000000 0.000000 
1 1 1    0    6   35 o  1634.26   11.296  2045.35   28.254  2045.35   28.254  2045.35   28.254  1634.26   11.296  1634.26   11.296 0.000000 0.000000 
1 1 1    0    6   36 o  427.105   9.2980  139.860   6.0719  139.860   6.0719  139.860   6.0719  427.105   9.2980  427.105   9.2980 0.000000 0.000000 
1 1 1    0    6   37 o  541.862   8.6980  224.964   7.2098  224.964   7.2098  224.964   7.2098  541.862   8.6980  541.862   8.6980 0.000000 0.000000 
1 1 1    0    6   38 o  167.182   20.228   22.357   4.9748   22.357   4.9748   22.357   4.9748  167.182   20.228  167.182   20.228 0.000000 0.000000 
1 1 1    0    6   39 o  189.589   19.687   28.451   5.5718   28.451   5.5718   28.451   5.5718  189.589   19.687  189.589   19.687 0.000000 0.000000 
1 1 1    0    6   40 o  658.122   10.266  331.971   10.335  331.971   10.335  331.971   10.335  658.122   10.266  658.122   10.266 0.000000 0.000000 
1 1 1    0    6   41 o  666.617   8.7036  340.481   8.8772  340.481   8.8772  340.481   8.8772  666.617   8.7036  666.617   8.7036 0.000000 0.000000 
1 1 1    0    6   42 o  204.759   16.480   32.789   5.0881   32.789   5.0881   32.789   5.0881  204.759   16.480  204.759   16.480 0.000000 0.000000 
1 1 1    0    6   43 o  145.373   23.610   17.486   4.8378   17.486   4.8378   17.486   4.8378  145.373   23.610  145.373   23.610 0.000000 0.000000 
1 1 1    0    6   44 o   58.204   33.214   3.4069   4.6444   3.4069   4.6444   3.4069   4.6444   58.204   33.214   58.204   33.214 0.000000 0.000000 
1 1 1    0    6   45 o  250.299   15.254   48.640   5.7942   48.640   5.7942   48.640   5.7942  250.299   15.254  250.299   15.254 0.000000 0.000000 
1 1 1    0    6   46 o   47.854   33.325  -7.8201   8.7521  -7.8201   8.7521  -7.8201   8.7521   47.854   33.325   47.854   33.325 0.000000 0.000000 
1 1 1    0    6   47 o   71.453   39.150   5.6568   6.1386   5.6568   6.1386   5.6568   6.1386   71.453   39.150   71.453   39.150 0.000000 0.000000 
1 1 1    0    6   48 o   54.501   32.153   2.6840   4.5889   2.6840   4.5889   2.6840   4.5889   54.501   32.153   54.501   32.153 0.000000 0.000000 
1 1 1    0    6   49 o   96.167   34.865   9.5708   4.7135   9.5708   4.7135   9.5708   4.7135   96.167   34.865   96.167   34.865 0.000000 0.000000 
1 1 1    0    6   50 o  115.223   31.651   12.400   4.8268   12.400   4.8268   12.400   4.8268  115.223   31.651  115.223   31.651 0.000000 0.000000 
1 1 1    0    6   51 o  201.916   26.545   33.365   7.8105   33.365   7.8105   33.365   7.8105  201.916   26.545  201.916   26.545 0.000000 0.000000 
1 1 1    0    6   52 o  157.876   22.506   20.480   5.1186   20.480   5.1186   20.480   5.1186  157.876   22.506  157.876   22.506 0.000000 0.000000 
1 1 1    0    6   53 o   75.924   35.755   6.7058   4.6818   6.7058   4.6818   6.7058   4.6818   75.924   35.755   75.924   35.755 0.000000 0.000000 
1 1 1    0    6   54 o  206.749   17.087   33.724   5.3222   33.724   5.3222   33.724   5.3222  206.749   17.087  206.749   17.087 0.000000 0.000000 
1 1 1    0    6   55 o  408.476   10.894  128.575   6.8001  128.575   6.8001  128.575   6.8001  408.476   10.894  408.476   10.894 0.000000 0.000000 
1 1 1    0    6   56 o  127.495   36.091   15.609   6.0999   15.609   6.0999   15.609   6.0999  127.495   36.091  127.495   36.091 0.000000 0.000000 
1 1 1    0    6   57 o   53.334   34.021   1.0075   6.1570   1.0075   6.1570   1.0075   6.1570   53.334   34.021   53.334   34.021 0.000000 0.000000 
1 1 1    0    6   58 o   82.868   40.552   8.3433   6.0910   8.3433   6.0910   8.3433   6.0910   82.868   40.552   82.868   40.552 0.000000 0.000000 
1 1 1    0    6   59 o  218.717   18.011   37.992   5.9356   37.992   5.9356   37.992   5.9356  218.717   18.011  218.717   18.011 0.000000 0.000000 
1 1 1    0    6   60 o   62.022   35.477   4.3146   5.3151   4.3146   5.3151   4.3146   5.3151   62.022   35.477   62.022   35.477 0.000000 0.000000 
1 1 1    0    6   61 o  111.989   38.699   13.320   5.9777   13.320   5.9777   13.320   5.9777  111.989   38.699  111.989   38.699 0.000000 0.000000 
1 1 1    0    6   62 o  124.110   40.848   16.263   6.8878   16.263   6.8878   16.263   6.8878  124.110   40.848  124.110   40.848 0.000000 0.000000 
1 1 1    0    6   63 o  129.007   29.674   15.320   5.1014   15.320   5.1014   15.320   5.1014  129.007   29.674  129.007   29.674 0.000000 0.000000 
1 1 1    0    6   64 o  103.831   38.967   12.221   5.7844   12.221   5.7844   12.221   5.7844  103.831   38.967  103.831   38.967 0.000000 0.000000 
1 1 1    0    6   65 o  166.073   25.217   23.844   5.9722   23.844   5.9722   23.844   5.9722  166.073   25.217  166.073   25.217 0.000000 0.000000 
1 1 1    0    7    2 o  600.336   10.385  276.136   9.5365  276.136   9.5365  276.136   9.5365  600.336   10.385  600.336   10.385 0.000000 0.000000 
1 1 1    0    7    3 o  561.299   10.109  241.407   8.6790  241.407   8.6790  241.407   8.6790  561.299   10.109  561.299   10.109 0.000000 0.000000 
1 1 1    0    7    4 o  1763.77   15.928  2382.74   42.993  2382.74   42.993  2382.74   42.993  1763.77   15.928  1763.77   15.928 0.000000 0.000000 
1 1 1    0    7    5 o  504.421   6.9158  194.858   5.3373  194.858   5.3373  194.858   5.3373  504.421   6.9158  504.421   6.9158 0.000000 0.000000 
1 1 1    0    7    6 o  641.621   7.6765  315.240   7.5366  315.240   7.5366  315.240   7.5366  641.621   7.6765  641.621   7.6765 0.000000 0.000000 
1 1 1    0    7    7 o  898.927   9.3438  618.750   12.853  618.750   12.853  618.750   12.853  898.927   9.3438  898.927   9.3438 0.000000 0.000000 
1 1 1    0    7    8 o  433.140   6.8320  143.703   4.5269  143.703   4.5269  143.703   4.5269  433.140   6.8320  433.140   6.8320 0.000000 0.000000 
1 1 1    0    7    9 o  504.299   7.2399  194.777   5.5858  194.777   5.5858  194.777   5.5858  504.299   7.2399  504.299   7.2399 0.000000 0.000000 
1 1 1    0    7   10 o  1202.21   11.658  1106.79   21.447  1106.79   21.447  1106.79   21.447  1202.21   11.658  1202.21   11.658 0.000000 0.000000 
1 1 1    0    7   11 o  1466.20   13.756  1646.46   30.865  1646.46   30.865  1646.46   30.865  1466.20   13.756  1466.20   13.756 0.000000 0.000000 
1 1 1    0    7   12 o  1164.96   16.182  1039.98   28.842  1039.98   28.842  1039.98   28.842  1164.96   16.182  1164.96   16.182 0.000000 0.000000 
1 1 1    0    7   13 o   86.148   12.103   6.0090   1.5055   6.0090   1.5055   6.0090   1.5055   86.148   12.103   86.148   12.103 0.000000 0.000000 
1 1 1    0    7   14 o  461.568   7.6852  163.213   5.4261  163.213   5.4261  163.213   5.4261  461.568   7.6852  461.568   7.6852 0.000000 0.000000 
1 1 1    0    7   15 o  427.938   6.1508  140.258   4.0270  140.258   4.0270  140.258   4.0270  427.938   6.1508  427.938   6.1508 0.000000 0.000000 
1 1 1    0    7   16 o  325.109   6.5036   81.001   3.2334   81.001   3.2334   81.001   3.2334  325.109   6.5036  325.109   6.5036 0.000000 0.000000 
1 1 1    0    7   17 o  341.735   5.5558   89.459   2.9044   89.459   2.9044   89.459   2.9044  341.735   5.5558  341.735   5.5558 0.000000 0.000000 
1 1 1    0    7   18 o  624.742   6.9450  298.882   6.6393  298.882   6.6393  298.882   6.6393  624.742   6.9450  624.742   6.9450 0.000000 0.000000 
1 1 1    0    7   19 o   24.650   16.242  -0.3258   1.5674  -0.3258   1.5674  -0.3258   1.5674   24.650   16.242   24.650   16.242 0.000000 0.000000 
1 1 1    0    7   20 o   22.650   15.487  -1.0899   1.6916  -1.0899   1.6916  -1.0899   1.6916   22.650   15.487   22.650   15.487 0.000000 0.000000 
1 1 1    0    7   21 o  898.493   10.080  618.342   13.859  618.342   13.859  618.342   13.859  898.493   10.080  898.493   10.080 0.000000 0.000000 
1 1 1    0    7   22 o  617.889   6.2201  292.322   5.8813  292.322   5.8813  292.322   5.8813  617.889   6.2201  617.889   6.2201 0.000000 0.000000 
1 1 1    0    7   23 o  505.478   6.2167  195.660   4.8082  195.660   4.8082  195.660   4.8082  505.478   6.2167  505.478   6.2167 0.000000 0.000000 
1 1 1    0    7   24 o  622.907   6.4298  297.087   6.1290  297.087   6.1290  297.087   6.1290  622.907   6.4298  622.907   6.4298 0.000000 0.000000 
1 1 1    0    7   25 o  127.941   12.080   12.864   2.3171   12.864   2.3171   12.864   2.3171  127.941   12.080  127.941   12.080 0.000000 0.000000 
1 1 1    0    7   26 o  913.742   8.4778  639.268   11.855  639.268   11.855  639.268   11.855  913.742   8.4778  913.742   8.4778 0.000000 0.000000 
1 1 1    0    7   27 o  406.926   8.2320  126.905   5.1226  126.905   5.1226  126.905   5.1226  406.926   8.2320  406.926   8.2320 0.000000 0.000000 
1 1 1    0    7   28 o  565.794   6.7583  245.128   5.8509  245.128   5.8509  245.128   5.8509  565.794   6.7583  565.794   6.7583 0.000000 0.000000 
1 1 1    0    7   29 o  191.576   10.882   28.368   3.1674   28.368   3.1674   28.368   3.1674  191.576   10.882  191.576   10.882 0.000000 0.000000 
1 1 1    0    7   30 o  365.606   7.9955  102.463   4.4695  102.463   4.4695  102.463   4.4695  365.606   7.9955  365.606   7.9955 0.000000 0.000000 
1 1 1    0    7   31 o  577.308   7.3592  255.234   6.5006  255.234   6.5006  255.234   6.5006  577.308   7.3592  577.308   7.3592 0.000000 0.000000 
1 1 1    0    7   32 o  1613.03   11.051  1992.31   27.281  1992.31   27.281  1992.31   27.281  1613.03   11.051  1613.03   11.051 0.000000 0.000000 
1 1 1    0    7   33 o  563.909   8.6802  243.603   7.4882  243.603   7.4882  243.603   7.4882  563.909   8.6802  563.909   8.6802 0.000000 0.000000 
1 1 1    0    7   34 o  164.259   21.491   21.719   5.1470   21.719   5.1470   21.719   5.1470  164.259   21.491  164.259   21.491 0.000000 0.000000 
1 1 1    0    7   35 o  849.515   8.2212  552.620   10.688  552.620   10.688  552.620   10.688  849.515   8.2212  849.515   8.2212 0.000000 0.000000 
1 1 1    0    7   36 o  736.714   8.1960  415.654   9.2395  415.654   9.2395  415.654   9.2395  736.714   8.1960  736.714   8.1960 0.000000 0.000000 
1 1 1    0    7   37 o  500.654   8.9527  192.090   6.8556  192.090   6.8556  192.090   6.8556  500.654   8.9527  500.654   8.9527 0.000000 0.000000 
1 1 1    0    7   38 o  823.412   9.5468  519.365   12.029  519.365   12.029  519.365   12.029  823.412   9.5468  823.412   9.5468 0.000000 0.000000 
1 1 1    0    7   39 o  746.260   8.6687  426.587   9.8988  426.587   9.8988  426.587   9.8988  746.260   8.6687  746.260   8.6687 0.000000 0.000000 
1 1 1    0    7   40 o  398.343   12.628  121.950   7.6820  121.950   7.6820  121.950   7.6820  398.343   12.628  398.343   12.628 0.000000 0.000000 
1 1 1    0    7   41 o  411.074   9.9661  129.666   6.2624  129.666   6.2624  129.666   6.2624  411.074   9.9661  411.074   9.9661 0.000000 0.000000 
1 1 1    0    7   42 o  335.851   11.155   86.719   5.7198   86.719   5.7198   86.719   5.7198  335.851   11.155  335.851   11.155 0.000000 0.000000 
1 1 1    0    7   43 o  235.931   14.130   43.155   5.0608   43.155   5.0608   43.155   5.0608  235.931   14.130  235.931   14.130 0.000000 0.000000 
1 1 1    0    7   44 o  308.461   14.764   73.528   6.9344   73.528   6.9344   73.528   6.9344  308.461   14.764  308.461   14.764 0.000000 0.000000 
1 1 1    0    7   45 o  361.641   15.585  101.012   8.5903  101.012   8.5903  101.012   8.5903  361.641   15.585  361.641   15.585 0.000000 0.000000 
1 1 1    0    7   46 o  417.430   12.077  134.017   7.7018  134.017   7.7018  134.017   7.7018  417.430   12.077  417.430   12.077 0.000000 0.000000 
1 1 1    0    7   47 f  494.346   9.2003  187.521   6.9560  187.521   6.9560  187.521   6.9560  494.346   9.2003  494.346   9.2003 0.000000 0.000000 
1 1 1    0    7   48 o   30.001   21.416  -6.5006   4.4114  -6.5006   4.4114  -6.5006   4.4114   30.001   21.416   30.001   21.416 0.000000 0.000000 
1 1 1    0    7   49 o  315.793   11.750   76.888   5.6615   76.888   5.6615   76.888   5.6615  315.793   11.750  315.793   11.750 0.000000 0.000000 
1 1 1    0    7   50 o   39.325   26.638  -2.2757   4.7627  -2.2757   4.7627  -2.2757   4.7627   39.325   26.638   39.325   26.638 0.000000 0.000000 
1 1 1    0    7   51 o  205.304   22.698   33.890   6.9101   33.890   6.9101   33.890   6.9101  205.304   22.698  205.304   22.698 0.000000 0.000000 
1 1 1    0    7   52 o  357.238   11.117   98.343   6.0655   98.343   6.0655   98.343   6.0655  357.238   11.117  357.238   11.117 0.000000 0.000000 
1 1 1    0    7   53 o  102.345   34.543   10.614   4.8395   10.614   4.8395   10.614   4.8395  102.345   34.543  102.345   34.543 0.000000 0.000000 
1 1 1    0    7   54 o  292.593   13.071   66.329   5.8273   66.329   5.8273   66.329   5.8273  292.593   13.071  292.593   13.071 0.000000 0.000000 
1 1 1    0    7   55 o  201.756   20.202   32.575   6.0952   32.575   6.0952   32.575   6.0952  201.756   20.202  201.756   20.202 0.000000 0.000000 
1 1 1    0    7   56 o  149.917   31.121   19.837   6.2995   19.837   6.2995   19.837   6.2995  149.917   31.121  149.917   31.121 0.000000 0.000000 
1 1 1    0    7   57 o  139.889   33.190   17.867   6.1690   17.867   6.1690   17.867   6.1690  139.889   33.190  139.889   33.190 0.000000 0.000000 
1 1 1    0    7   58 o   75.534   37.228   6.8664   5.1486   6.8664   5.1486   6.8664   5.1486   75.534   37.228   75.534   37.228 0.000000 0.000000 
1 1 1    0    7   59 o   59.827   34.794   3.7898   5.2450   3.7898   5.2450   3.7898   5.2450   59.827   34.794   59.827   34.794 0.000000 0.000000 
1 1 1    0    7   60 o  282.119   14.035   62.116   6.0264   62.116   6.0264   62.116   6.0264  282.119   14.035  282.119   14.035 0.000000 0.000000 
1 1 1    0    7   61 o  126.555   33.936   15.369   5.6807   15.369   5.6807   15.369   5.6807  126.555   33.936  126.555   33.936 0.000000 0.000000 
1 1 1    0    7   62 o   45.733   31.150  -2.8116   6.6979  -2.8116   6.6979  -2.8116   6.6979   45.733   31.150   45.733   31.150 0.000000 0.000000 
1 1 1    0    7   63 o  203.943   18.011   33.457   5.5214   33.457   5.5214   33.457   5.5214  203.943   18.011  203.943   18.011 0.000000 0.000000 
1 1 1    0    7   64 o  104.950   36.336   11.922   5.2638   11.922   5.2638   11.922   5.2638  104.950   36.336  104.950   36.336 0.000000 0.000000 
1 1 1    0    7   65 o  275.333   17.833   60.839   7.4431   60.839   7.4431   60.839   7.4431  275.333   17.833  275.333   17.833 0.000000 0.000000 
1 1 1    0    8    2 o  222.550   9.4480   38.117   3.2052   38.117   3.2052   38.117   3.2052  222.550   9.4480  222.550   9.4480 0.000000 0.000000 
1 1 1    0    8    3 o   54.406   17.195   2.8529   1.2590   2.8529   1.2590   2.8529   1.2590   54.406   17.195   54.406   17.195 0.000000 0.000000 
1 1 1    0    8    4 o  599.052   7.4533  274.805   6.8317  274.805   6.8317  274.805   6.8317  599.052   7.4533  599.052   7.4533 0.000000 0.000000 
1 1 1    0    8    5 o  176.124   7.3755   23.867   1.9804   23.867   1.9804   23.867   1.9804  176.124   7.3755  176.124   7.3755 0.000000 0.000000 
1 1 1    0    8    6 o  1289.52   12.230  1273.38   24.135  1273.38   24.135  1273.38   24.135  1289.52   12.230  1289.52   12.230 0.000000 0.000000 
1 1 1    0    8    7 o  148.064   8.3068   16.938   1.8690   16.938   1.8690   16.938   1.8690  148.064   8.3068  148.064   8.3068 0.000000 0.000000 
1 1 1    0    8    8 o  214.331   7.3213   35.284   2.3955   35.284   2.3955   35.284   2.3955  214.331   7.3213  214.331   7.3213 0.000000 0.000000 
1 1 1    0    8    9 o  858.914   9.2214  564.914   12.120  564.914   12.120  564.914   12.120  858.914   9.2214  858.914   9.2214 0.000000 0.000000 
1 1 1    0    8   10 o  733.239   11.941  411.945   13.393  411.945   13.393  411.945   13.393  733.239   11.941  733.239   11.941 0.000000 0.000000 
1 1 1    0    8   11 o  815.100   12.775  509.073   15.930  509.073   15.930  509.073   15.930  815.100   12.775  815.100   12.775 0.000000 0.000000 
1 1 1    0    8   12 o  639.224   8.0914  312.925   7.9139  312.925   7.9139  312.925   7.9139  639.224   8.0914  639.224   8.0914 0.000000 0.000000 
1 1 1    0    8   13 o  844.070   9.3411  545.607   12.065  545.607   12.065  545.607   12.065  844.070   9.3411  844.070   9.3411 0.000000 0.000000 
1 1 1    0    8   14 o  910.292   9.8143  634.604   13.671  634.604   13.671  634.604   13.671  910.292   9.8143  910.292   9.8143 0.000000 0.000000 
1 1 1    0    8   15 o   28.424   17.901   0.2715   1.6433   0.2715   1.6433   0.2715   1.6433   28.424   17.901   28.424   17.901 0.000000 0.000000 
1 1 1    0    8   16 o  616.727   6.7850  291.254   6.4031  291.254   6.4031  291.254   6.4031  616.727   6.7850  616.727   6.7850 0.000000 0.000000 
1 1 1    0    8   17 o  848.047   9.6406  550.852   12.510  550.852   12.510  550.852   12.510  848.047   9.6406  848.047   9.6406 0.000000 0.000000 
1 1 1    0    8   18 o  194.545   11.386   29.280   3.3639   29.280   3.3639   29.280   3.3639  194.545   11.386  194.545   11.386 0.000000 0.000000 
1 1 1    0    8   19 o  1008.71   10.651  779.379   16.440  779.379   16.440  779.379   16.440  1008.71   10.651  1008.71   10.651 0.000000 0.000000 
1 1 1    0    8   20 o  1513.01   11.733  1753.37   27.168  1753.37   27.168  1753.37   27.168  1513.01   11.733  1513.01   11.733 0.000000 0.000000 
1 1 1    0    8   21 o  321.539   6.3560   79.230   3.1254   79.230   3.1254   79.230   3.1254  321.539   6.3560  321.539   6.3560 0.000000 0.000000 
1 1 1    0    8   22 o  656.197   6.3005  329.680   6.3269  329.680   6.3269  329.680   6.3269  656.197   6.3005  656.197   6.3005 0.000000 0.000000 
1 1 1    0    8   23 o  477.616   6.1732  174.691   4.5113  174.691   4.5113  174.691   4.5113  477.616   6.1732  477.616   6.1732 0.000000 0.000000 
1 1 1    0    8   24 o  155.567   9.9267   18.752   2.3416   18.752   2.3416   18.752   2.3416  155.567   9.9267  155.567   9.9267 0.000000 0.000000 
1 1 1    0    8   25 o  861.542   8.2010  568.318   10.812  568.318   10.812  568.318   10.812  861.542   8.2010  861.542   8.2010 0.000000 0.000000 
1 1 1    0    8   26 o  477.768   7.7026  174.856   5.6295  174.856   5.6295  174.856   5.6295  477.768   7.7026  477.768   7.7026 0.000000 0.000000 
1 1 1    0    8   27 o  1193.37   10.162  1090.44   18.559  1090.44   18.559  1090.44   18.559  1193.37   10.162  1193.37   10.162 0.000000 0.000000 
1 1 1    0    8   28 o  491.947   7.6382  185.377   5.7484  185.377   5.7484  185.377   5.7484  491.947   7.6382  491.947   7.6382 0.000000 0.000000 
1 1 1    0    8   29 o  585.141   8.3986  262.248   7.5186  262.248   7.5186  262.248   7.5186  585.141   8.3986  585.141   8.3986 0.000000 0.000000 
1 1 1    0    8   30 o  2002.53   13.090  3070.92   40.120  3070.92   40.120  3070.92   40.120  2002.53   13.090  2002.53   13.090 0.000000 0.000000 
1 1 1    0    8   31 o  997.320   8.2129  761.533   12.535  761.533   12.535  761.533   12.535  997.320   8.2129  997.320   8.2129 0.000000 0.000000 
1 1 1    0    8   32 o  1031.11   9.6010  814.146   15.150  814.146   15.150  814.146   15.150  1031.11   9.6010  1031.11   9.6010 0.000000 0.000000 
1 1 1    0    8   33 o  933.718   8.1876  667.541   11.700  667.541   11.700  667.541   11.700  933.718   8.1876  933.718   8.1876 0.000000 0.000000 
1 1 1    0    8   34 f   81.307   36.126   7.3226   4.7543   7.3226   4.7543   7.3226   4.7543   81.307   36.126   81.307   36.126 0.000000 0.000000 
1 1 1    0    8   35 o  594.155   8.0909  270.398   7.3550  270.398   7.3550  270.398   7.3550  594.155   8.0909  594.155   8.0909 0.000000 0.000000 
1 1 1    0    8   36 f  494.700   8.6521  187.531   6.5469  187.531   6.5469  187.531   6.5469  494.700   8.6521  494.700   8.6521 0.000000 0.000000 
1 1 1    0    8   37 o  458.355   9.1877  161.049   6.4400  161.049   6.4400  161.049   6.4400  458.355   9.1877  458.355   9.1877 0.000000 0.000000 
1 1 1    0    8   38 o  1267.82   11.149  1231.33   21.631  1231.33   21.631  1231.33   21.631  1267.82   11.149  1267.82   11.149 0.000000 0.000000 
1 1 1    0    8   39 o  371.673   12.868  106.221   7.3004  106.221   7.3004  106.221   7.3004  371.673   12.868  371.673   12.868 0.000000 0.000000 
1 1 1    0    8   40 o  407.322   9.8800  127.297   6.1516  127.297   6.1516  127.297   6.1516  407.322   9.8800  407.322   9.8800 0.000000 0.000000 
1 1 1    0    8   41 o  584.729   8.6762  262.023   7.7613  262.023   7.7613  262.023   7.7613  584.729   8.6762  584.729   8.6762 0.000000 0.000000 
1 1 1    0    8   42 f  246.184   13.951   46.924   5.2182   46.924   5.2182   46.924   5.2182  246.184   13.951  246.184   13.951 0.000000 0.000000 
1 1 1    0    8   43 o  379.931   12.752  111.063   7.3965  111.063   7.3965  111.063   7.3965  379.931   12.752  379.931   12.752 0.000000 0.000000 
1 1 1    0    8   44 o  108.787   39.578   12.217   6.0630   12.217   6.0630   12.217   6.0630  108.787   39.578  108.787   39.578 0.000000 0.000000 
1 1 1    0    8   45 o   41.132   27.445  -1.4977   4.7146  -1.4977   4.7146  -1.4977   4.7146   41.132   27.445   41.132   27.445 0.000000 0.000000 
1 1 1    0    8   46 f   72.899   37.179   6.1101   5.2236   6.1101   5.2236   6.1101   5.2236   72.899   37.179   72.899   37.179 0.000000 0.000000 
1 1 1    0    8   47 o   57.883   32.803   3.4676   4.4890   3.4676   4.4890   3.4676   4.4890   57.883   32.803   57.883   32.803 0.000000 0.000000 
1 1 1    0    8   48 o  812.269   8.7020  505.952   10.816  505.952   10.816  505.952   10.816  812.269   8.7020  812.269   8.7020 0.000000 0.000000 
1 1 1    0    8   49 o  200.799   16.027   31.633   4.8538   31.633   4.8538   31.633   4.8538  200.799   16.027  200.799   16.027 0.000000 0.000000 
1 1 1    0    8   50 o  122.426   29.126   13.442   4.7369   13.442   4.7369   13.442   4.7369  122.426   29.126  122.426   29.126 0.000000 0.000000 
1 1 1    0    8   51 o  322.875   14.938   80.834   7.3464   80.834   7.3464   80.834   7.3464  322.875   14.938  322.875   14.938 0.000000 0.000000 
1 1 1    0    8   52 o  223.283   14.867   38.933   5.0293   38.933   5.0293   38.933   5.0293  223.283   14.867  223.283   14.867 0.000000 0.000000 
1 1 1    0    8   53 o   47.970   31.280  -0.2657   5.5924  -0.2657   5.5924  -0.2657   5.5924   47.970   31.280   47.970   31.280 0.000000 0.000000 
1 1 1    0    8   54 o  447.187   12.098  154.238   8.2670  154.238   8.2670  154.238   8.2670  447.187   12.098  447.187   12.098 0.000000 0.000000 
1 1 1    0    8   55 o  158.665   22.814   20.794   5.2079   20.794   5.2079   20.794   5.2079  158.665   22.814  158.665   22.814 0.000000 0.000000 
1 1 1    0    8   56 o   81.760   37.225   7.8047   5.0512   7.8047   5.0512   7.8047   5.0512   81.760   37.225   81.760   37.225 0.000000 0.000000 
1 1 1    0    8   57 o  314.360   16.034   77.148   7.6693   77.148   7.6693   77.148   7.6693  314.360   16.034  314.360   16.034 0.000000 0.000000 
1 1 1    0    8   58 o   66.756   35.952   5.2793   5.0902   5.2793   5.0902   5.2793   5.0902   66.756   35.952   66.756   35.952 0.000000 0.000000 
1 1 1    0    8   59 o   95.008   37.876   10.088   5.3296   10.088   5.3296   10.088   5.3296   95.008   37.876   95.008   37.876 0.000000 0.000000 
1 1 1    0    8   60 o  291.577   13.767   66.291   6.1131   66.291   6.1131   66.291   6.1131  291.577   13.767  291.577   13.767 0.000000 0.000000 
1 1 1    0    8   61 o  238.112   17.229   44.985   6.2038   44.985   6.2038   44.985   6.2038  238.112   17.229  238.112   17.229 0.000000 0.000000 
1 1 1    0    8   62 o   75.304   41.240   7.2452   6.8072   7.2452   6.8072   7.2452   6.8072   75.304   41.240   75.304   41.240 0.000000 0.000000 
1 1 1    0    8   63 o   37.608   26.052  -3.5791   5.1670  -3.5791   5.1670  -3.5791   5.1670   37.608   26.052   37.608   26.052 0.000000 0.000000 
1 1 1    0    8   64 o   94.678   37.819   10.464   5.3104   10.464   5.3104   10.464   5.3104   94.678   37.819   94.678   37.819 0.000000 0.000000 
1 1 1    0    8   65 o   61.124   34.513   4.6983   4.9446   4.6983   4.9446   4.6983   4.9446   61.124   34.513   61.124   34.513 0.000000 0.000000 
1 1 1    0    9    2 o  1778.02   22.812  2423.48   62.059  2423.48   62.059  2423.48   62.059  1778.02   22.812  1778.02   22.812 0.000000 0.000000 
1 1 1    0    9    3 o  508.608   7.1368  198.113   5.5534  198.113   5.5534  198.113   5.5534  508.608   7.1368  508.608   7.1368 0.000000 0.000000 
1 1 1    0    9    4 o  2064.36   18.441  3264.83   58.259  3264.83   58.259  3264.83   58.259  2064.36   18.441  2064.36   18.441 0.000000 0.000000 
1 1 1    0    9    5 o  917.726   9.5524  644.913   13.415  644.913   13.415  644.913   13.415  917.726   9.5524  917.726   9.5524 0.000000 0.000000 
1 1 1    0    9    6 o  1437.45   13.420  1582.44   29.521  1582.44   29.521  1582.44   29.521  1437.45   13.420  1437.45   13.420 0.000000 0.000000 
1 1 1    0    9    7 f  1630.01   14.952  2035.05   37.298  2035.05   37.298  2035.05   37.298  1630.01   14.952  1630.01   14.952 0.000000 0.000000 
1 1 1    0    9    8 o  698.930   11.593  374.299   12.394  374.299   12.394  374.299   12.394  698.930   11.593  698.930   11.593 0.000000 0.000000 
1 1 1    0    9    9 o  1150.65   15.961  1014.57   28.099  1014.57   28.099  1014.57   28.099  1150.65   15.961  1150.65   15.961 0.000000 0.000000 
1 1 1    0    9   10 o  228.415   7.7592   40.074   2.7057   40.074   2.7057   40.074   2.7057  228.415   7.7592  228.415   7.7592 0.000000 0.000000 
1 1 1    0    9   11 o  627.758   8.0029  301.802   7.6869  301.802   7.6869  301.802   7.6869  627.758   8.0029  627.758   8.0029 0.000000 0.000000 
1 1 1    0    9   12 o  1244.34   12.087  1185.92   23.016  1185.92   23.016  1185.92   23.016  1244.34   12.087  1244.34   12.087 0.000000 0.000000 
1 1 1    0    9   13 o  289.586   7.9928   64.341   3.5367   64.341   3.5367   64.341   3.5367  289.586   7.9928  289.586   7.9928 0.000000 0.000000 
1 1 1    0    9   14 o  521.433   7.9074  208.279   6.3077  208.279   6.3077  208.279   6.3077  521.433   7.9074  521.433   7.9074 0.000000 0.000000 
1 1 1    0    9   15 o  249.316   8.9195   47.770   3.3939   47.770   3.3939   47.770   3.3939  249.316   8.9195  249.316   8.9195 0.000000 0.000000 
1 1 1    0    9   16 o  198.680   10.398   30.472   3.1424   30.472   3.1424   30.472   3.1424  198.680   10.398  198.680   10.398 0.000000 0.000000 
1 1 1    0    9   17 o  161.420   8.9218   20.131   2.1889   20.131   2.1889   20.131   2.1889  161.420   8.9218  161.420   8.9218 0.000000 0.000000 
1 1 1    0    9   18 o  467.653   7.9700  167.570   5.7012  167.570   5.7012  167.570   5.7012  467.653   7.9700  467.653   7.9700 0.000000 0.000000 
1 1 1    0    9   19 o   49.559   27.489   2.5754   3.0687   2.5754   3.0687   2.5754   3.0687   49.559   27.489   49.559   27.489 0.000000 0.000000 
1 1 1    0    9   20 o  1012.57   10.925  785.347   16.928  785.347   16.928  785.347   16.928  1012.57   10.925  1012.57   10.925 0.000000 0.000000 
1 1 1    0    9   21 o  503.962   8.9092  194.615   6.8675  194.615   6.8675  194.615   6.8675  503.962   8.9092  503.962   8.9092 0.000000 0.000000 
1 1 1    0    9   22 o  799.694   7.9457  489.677   9.7237  489.677   9.7237  489.677   9.7237  799.694   7.9457  799.694   7.9457 0.000000 0.000000 
1 1 1    0    9   23 o  1368.49   9.4703  1433.86   19.835  1433.86   19.835  1433.86   19.835  1368.49   9.4703  1368.49   9.4703 0.000000 0.000000 
1 1 1    0    9   24 o  232.729   8.3289   41.619   2.9583   41.619   2.9583   41.619   2.9583  232.729   8.3289  232.729   8.3289 0.000000 0.000000 
1 1 1    0    9   25 o  897.690   8.3595  617.000   11.484  617.000   11.484  617.000   11.484  897.690   8.3595  897.690   8.3595 0.000000 0.000000 
1 1 1    0    9   26 o  508.320   9.4316  197.998   7.3325  197.998   7.3325  197.998   7.3325  508.320   9.4316  508.320   9.4316 0.000000 0.000000 
1 1 1    0    9   27 o  1156.26   8.5981  1023.54   15.215  1023.54   15.215  1023.54   15.215  1156.26   8.5981  1156.26   8.5981 0.000000 0.000000 
1 1 1    0    9   28 o  1244.93   9.0711  1186.57   17.283  1186.57   17.283  1186.57   17.283  1244.93   9.0711  1244.93   9.0711 0.000000 0.000000 
1 1 1    0    9   29 o  926.255   7.7941  656.853   11.048  656.853   11.048  656.853   11.048  926.255   7.7941  926.255   7.7941 0.000000 0.000000 
1 1 1    0    9   30 o  294.929   8.9488   66.769   4.0313   66.769   4.0313   66.769   4.0313  294.929   8.9488  294.929   8.9488 0.000000 0.000000 
1 1 1    0    9   31 o   56.045   29.412   3.4892   3.3329   3.4892   3.3329   3.4892   3.3329   56.045   29.412   56.045   29.412 0.000000 0.000000 
1 1 1    0    9   32 o  726.618   8.6769  404.346   9.6472  404.346   9.6472  404.346   9.6472  726.618   8.6769  726.618   8.6769 0.000000 0.000000 
1 1 1    0    9   33 o  1117.37   10.385  956.153   17.758  956.153   17.758  956.153   17.758  1117.37   10.385  1117.37   10.385 0.000000 0.000000 
1 1 1    0    9   34 o  397.593   8.9904  121.207   5.4650  121.207   5.4650  121.207   5.4650  397.593   8.9904  397.593   8.9904 0.000000 0.000000 
1 1 1    0    9   35 o  153.414   19.201   18.870   4.3175   18.870   4.3175   18.870   4.3175  153.414   19.201  153.414   19.201 0.000000 0.000000 
1 1 1    0    9   36 o  1014.54   8.7334  788.209   13.560  788.209   13.560  788.209   13.560  1014.54   8.7334  1014.54   8.7334 0.000000 0.000000 
1 1 1    0    9   37 o  150.455   21.342   18.379   4.6294   18.379   4.6294   18.379   4.6294  150.455   21.342  150.455   21.342 0.000000 0.000000 
1 1 1    0    9   38 o  268.276   13.346   55.550   5.4492   55.550   5.4492   55.550   5.4492  268.276   13.346  268.276   13.346 0.000000 0.000000 
1 1 1    0    9   39 f  177.746   24.492   25.616   6.3032   25.616   6.3032   25.616   6.3032  177.746   24.492  177.746   24.492 0.000000 0.000000 
1 1 1    0    9   40 o  342.146   10.657   89.937   5.5689   89.937   5.5689   89.937   5.5689  342.146   10.657  342.146   10.657 0.000000 0.000000 
1 1 1    0    9   41 o  375.127   12.511  108.219   7.1657  108.219   7.1657  108.219   7.1657  375.127   12.511  375.127   12.511 0.000000 0.000000 
1 1 1    0    9   42 o  484.875   11.413  180.490   8.4597  180.490   8.4597  180.490   8.4597  484.875   11.413  484.875   11.413 0.000000 0.000000 
1 1 1    0    9   43 o   80.686   34.657   7.1775   4.3851   7.1775   4.3851   7.1775   4.3851   80.686   34.657   80.686   34.657 0.000000 0.000000 
1 1 1    0    9   44 o  262.366   13.045   53.199   5.2092   53.199   5.2092   53.199   5.2092  262.366   13.045  262.366   13.045 0.000000 0.000000 
1 1 1    0    9   45 o  113.704   28.164   11.634   4.2427   11.634   4.2427   11.634   4.2427  113.704   28.164  113.704   28.164 0.000000 0.000000 
1 1 1    0    9   46 o  430.651   11.627  142.593   7.6517  142.593   7.6517  142.593   7.6517  430.651   11.627  430.651   11.627 0.000000 0.000000 
1 1 1    0    9   47 o   84.226   33.801   7.6455   4.2361   7.6455   4.2361   7.6455   4.2361   84.226   33.801   84.226   33.801 0.000000 0.000000 
1 1 1    0    9   48 o  213.083   15.324   35.466   4.9385   35.466   4.9385   35.466   4.9385  213.083   15.324  213.083   15.324 0.000000 0.000000 
1 1 1    0    9   49 o   32.899   23.020  -4.2947   4.3169  -4.2947   4.3169  -4.2947   4.3169   32.899   23.020   32.899   23.020 0.000000 0.000000 
1 1 1    0    9   50 o   56.353   32.078   3.3020   4.3176   3.3020   4.3176   3.3020   4.3176   56.353   32.078   56.353   32.078 0.000000 0.000000 
1 1 1    0    9   51 o  182.697   24.477   27.321   6.5001   27.321   6.5001   27.321   6.5001  182.697   24.477  182.697   24.477 0.000000 0.000000 
1 1 1    0    9   52 o  190.995   20.375   29.226   5.7857   29.226   5.7857   29.226   5.7857  190.995   20.375  190.995   20.375 0.000000 0.000000 
1 1 1    0    9   53 o  281.882   15.615   61.900   6.6900   61.900   6.6900   61.900   6.6900  281.882   15.615  281.882   15.615 0.000000 0.000000 
1 1 1    0    9   54 o  195.974   17.464   30.425   5.1429   30.425   5.1429   30.425   5.1429  195.974   17.464  195.974   17.464 0.000000 0.000000 
1 1 1    0    9   55 o  180.737   18.997   26.181   5.1224   26.181   5.1224   26.181   5.1224  180.737   18.997  180.737   18.997 0.000000 0.000000 
1 1 1    0    9   56 o  308.450   13.545   73.839   6.3669   73.839   6.3669   73.839   6.3669  308.450   13.545  308.450   13.545 0.000000 0.000000 
1 1 1    0    9   57 o  204.980   20.441   33.737   6.2669   33.737   6.2669   33.737   6.2669  204.980   20.441  204.980   20.441 0.000000 0.000000 
1 1 1    0    9   58 o   67.814   36.039   5.5005   5.0513   5.5005   5.0513   5.5005   5.0513   67.814   36.039   67.814   36.039 0.000000 0.000000 
1 1 1    0    9   59 o   81.935   37.387   7.9719   5.0965   7.9719   5.0965   7.9719   5.0965   81.935   37.387   81.935   37.387 0.000000 0.000000 
1 1 1    0    9   60 f   95.583   38.543   10.373   5.5004   10.373   5.5004   10.373   5.5004   95.583   38.543   95.583   38.543 0.000000 0.000000 
1 1 1    0    9   61 o  195.968   18.624   30.906   5.4706   30.906   5.4706   30.906   5.4706  195.968   18.624  195.968   18.624 0.000000 0.000000 
1 1 1    0    9   62 o  101.830   49.742   13.924   9.1578   13.924   9.1578   13.924   9.1578  101.830   49.742  101.830   49.742 0.000000 0.000000 
1 1 1    0    9   63 o   40.384   27.377  -1.8819   5.0509  -1.8819   5.0509  -1.8819   5.0509   40.384   27.377   40.384   27.377 0.000000 0.000000 
1 1 1    0    9   64 o   31.660   22.650  -7.0118   5.0416  -7.0118   5.0416  -7.0118   5.0416   31.660   22.650   31.660   22.650 0.000000 0.000000 
1 1 1    0    9   65 o   35.505   24.810  -4.0173   4.9655  -4.0173   4.9655  -4.0173   4.9655   35.505   24.810   35.505   24.810 0.000000 0.000000 
1 1 1    0   10    2 o  2070.62   26.214  3288.41   83.051  3288.41   83.051  3288.41   83.051  2070.62   26.214  2070.62   26.214 0.000000 0.000000 
1 1 1    0   10    3 o  1185.38   16.325  1076.69   29.607  1076.69   29.607  1076.69   29.607  1185.38   16.325  1185.38   16.325 0.000000 0.000000 
1 1 1    0   10    4 o  1702.98   15.547  2221.44   40.518  2221.44   40.518  2221.44   40.518  1702.98   15.547  1702.98   15.547 0.000000 0.000000 
1 1 1    0   10    5 o  943.201   9.7974  681.234   14.141  681.234   14.141  681.234   14.141  943.201   9.7974  943.201   9.7974 0.000000 0.000000 
1 1 1    0   10    6 o  664.499   11.402  338.347   11.589  338.347   11.589  338.347   11.589  664.499   11.402  664.499   11.402 0.000000 0.000000 
1 1 1    0   10    7 o  1522.51   19.991  1776.91   46.569  1776.91   46.569  1776.91   46.569  1522.51   19.991  1522.51   19.991 0.000000 0.000000 
1 1 1    0   10    8 o  506.797   7.3555  196.721   5.7031  196.721   5.7031  196.721   5.7031  506.797   7.3555  506.797   7.3555 0.000000 0.000000 
1 1 1    0   10    9 o  1651.86   15.181  2090.27   38.375  2090.27   38.375  2090.27   38.375  1651.86   15.181  1651.86   15.181 0.000000 0.000000 
1 1 1    0   10   10 o  837.506   9.2204  537.149   11.817  537.149   11.817  537.149   11.817  837.506   9.2204  837.506   9.2204 0.000000 0.000000 
1 1 1    0   10   11 o   30.840   19.208   0.4436   1.8372   0.4436   1.8372   0.4436   1.8372   30.840   19.208   30.840   19.208 0.000000 0.000000 
1 1 1    0   10   12 f   50.034   23.463   2.8083   2.0137   2.8083   2.0137   2.8083   2.0137   50.034   23.463   50.034   23.463 0.000000 0.000000 
1 1 1    0   10   13 o  721.182   8.6960  398.343   9.5960  398.343   9.5960  398.343   9.5960  721.182   8.6960  721.182   8.6960 0.000000 0.000000 
1 1 1    0   10   14 o  363.599   7.8919  101.349   4.3875  101.349   4.3875  101.349   4.3875  363.599   7.8919  363.599   7.8919 0.000000 0.000000 
1 1 1    0   10   15 f  333.995   8.2010   85.554   4.1868   85.554   4.1868   85.554   4.1868  333.995   8.2010  333.995   8.2010 0.000000 0.000000 
1 1 1    0   10   16 o  458.435   8.0824  161.040   5.6674  161.040   5.6674  161.040   5.6674  458.435   8.0824  458.435   8.0824 0.000000 0.000000 
1 1 1    0   10   17 o   64.799   32.500   4.7453   3.9529   4.7453   3.9529   4.7453   3.9529   64.799   32.500   64.799   32.500 0.000000 0.000000 
1 1 1    0   10   18 o  579.060   8.6862  256.879   7.6949  256.879   7.6949  256.879   7.6949  579.060   8.6862  579.060   8.6862 0.000000 0.000000 
1 1 1    0   10   19 o  222.026   11.093   38.028   3.7483   38.028   3.7483   38.028   3.7483  222.026   11.093  222.026   11.093 0.000000 0.000000 
1 1 1    0   10   20 o  678.630   9.1778  352.765   9.5293  352.765   9.5293  352.765   9.5293  678.630   9.1778  678.630   9.1778 0.000000 0.000000 
1 1 1    0   10   21 o  716.360   7.6010  392.948   8.3322  392.948   8.3322  392.948   8.3322  716.360   7.6010  716.360   7.6010 0.000000 0.000000 
1 1 1    0   10   22 o  877.357   8.2882  589.389   11.128  589.389   11.128  589.389   11.128  877.357   8.2882  877.357   8.2882 0.000000 0.000000 
1 1 1    0   10   23 o  1529.02   14.651  1790.82   34.281  1790.82   34.281  1790.82   34.281  1529.02   14.651  1529.02   14.651 0.000000 0.000000 
1 1 1    0   10   24 o  672.541   9.0668  346.424   9.3296  346.424   9.3296  346.424   9.3296  672.541   9.0668  672.541   9.0668 0.000000 0.000000 
1 1 1    0   10   25 o  419.406   7.8500  134.782   5.0354  134.782   5.0354  134.782   5.0354  419.406   7.8500  419.406   7.8500 0.000000 0.000000 
1 1 1    0   10   26 o  307.838   7.1940   72.653   3.3855   72.653   3.3855   72.653   3.3855  307.838   7.1940  307.838   7.1940 0.000000 0.000000 
1 1 1    0   10   27 o   63.374   25.774   4.2897   2.4535   4.2897   2.4535   4.2897   2.4535   63.374   25.774   63.374   25.774 0.000000 0.000000 
1 1 1    0   10   28 o  471.394   7.0558  170.200   5.0884  170.200   5.0884  170.200   5.0884  471.394   7.0558  471.394   7.0558 0.000000 0.000000 
1 1 1    0   10   29 o  372.265   7.8420  106.218   4.4639  106.218   4.4639  106.218   4.4639  372.265   7.8420  372.265   7.8420 0.000000 0.000000 
1 1 1    0   10   30 o  648.327   7.3543  321.862   7.2959  321.862   7.2959  321.862   7.2959  648.327   7.3543  648.327   7.3543 0.000000 0.000000 
1 1 1    0   10   31 f  455.188   8.5664  158.778   5.9636  158.778   5.9636  158.778   5.9636  455.188   8.5664  455.188   8.5664 0.000000 0.000000 
1 1 1    0   10   32 o  1317.43   9.6233  1328.96   19.403  1328.96   19.403  1328.96   19.403  1317.43   9.6233  1317.43   9.6233 0.000000 0.000000 
1 1 1    0   10   33 f  249.583   13.668   48.135   5.1857   48.135   5.1857   48.135   5.1857  249.583   13.668  249.583   13.668 0.000000 0.000000 
1 1 1    0   10   34 o   94.682   30.400   8.7084   3.8870   8.7084   3.8870   8.7084   3.8870   94.682   30.400   94.682   30.400 0.000000 0.000000 
1 1 1    0   10   35 o  204.176   14.080   32.386   4.3523   32.386   4.3523   32.386   4.3523  204.176   14.080  204.176   14.080 0.000000 0.000000 
1 1 1    0   10   36 o  1059.22   8.9095  859.182   14.442  859.182   14.442  859.182   14.442  1059.22   8.9095  1059.22   8.9095 0.000000 0.000000 
1 1 1    0   10   37 o  296.467   11.866   67.643   5.3652   67.643   5.3652   67.643   5.3652  296.467   11.866  296.467   11.866 0.000000 0.000000 
1 1 1    0   10   38 o  273.615   11.984   57.679   4.9970   57.679   4.9970   57.679   4.9970  273.615   11.984  273.615   11.984 0.000000 0.000000 
1 1 1    0   10   39 o  182.999   22.546   26.868   6.0581   26.868   6.0581   26.868   6.0581  182.999   22.546  182.999   22.546 0.000000 0.000000 
1 1 1    0   10   40 o  156.491   26.402   20.368   5.7836   20.368   5.7836   20.368   5.7836  156.491   26.402  156.491   26.402 0.000000 0.000000 
1 1 1    0   10   41 o  111.275   37.857   12.382   5.7807   12.382   5.7807   12.382   5.7807  111.275   37.857  111.275   37.857 0.000000 0.000000 
1 1 1    0   10   42 o  599.278   8.5122  275.253   7.8045  275.253   7.8045  275.253   7.8045  599.278   8.5122  599.278   8.5122 0.000000 0.000000 
1 1 1    0   10   43 f  334.834   10.534   86.185   5.3868   86.185   5.3868   86.185   5.3868  334.834   10.534  334.834   10.534 0.000000 0.000000 
1 1 1    0   10   44 o   68.684   33.866   5.3991   4.2615   5.3991   4.2615   5.3991   4.2615   68.684   33.866   68.684   33.866 0.000000 0.000000 
1 1 1    0   10   45 o  185.015   18.980   27.167   5.2454   27.167   5.2454   27.167   5.2454  185.015   18.980  185.015   18.980 0.000000 0.000000 
1 1 1    0   10   46 o  353.253   9.9348   95.906   5.3621   95.906   5.3621   95.906   5.3621  353.253   9.9348  353.253   9.9348 0.000000 0.000000 
1 1 1    0   10   47 o  101.498   31.410   9.9745   4.2720   9.9745   4.2720   9.9745   4.2720  101.498   31.410  101.498   31.410 0.000000 0.000000 
1 1 1    0   10   48 o   87.224   32.803   7.9839   4.0948   7.9839   4.0948   7.9839   4.0948   87.224   32.803   87.224   32.803 0.000000 0.000000 
1 1 1    0   10   49 o  356.389   11.188   97.811   6.0893   97.811   6.0893   97.811   6.0893  356.389   11.188  356.389   11.188 0.000000 0.000000 
1 1 1    0   10   50 o  305.634   13.965   72.343   6.5021   72.343   6.5021   72.343   6.5021  305.634   13.965  305.634   13.965 0.000000 0.000000 
1 1 1    0   10   51 o  497.747   17.568  192.177   13.347  192.177   13.347  192.177   13.347  497.747   17.568  497.747   17.568 0.000000 0.000000 
1 1 1    0   10   52 o   60.125   32.904   4.0614   4.3299   4.0614   4.3299   4.0614   4.3299   60.125   32.904   60.125   32.904 0.000000 0.000000 
1 1 1    0   10   53 o  308.733   11.834   73.644   5.5737   73.644   5.5737   73.644   5.5737  308.733   11.834  308.733   11.834 0.000000 0.000000 
1 1 1    0   10   54 o  126.443   26.637   14.013   4.5378   14.013   4.5378   14.013   4.5378  126.443   26.637  126.443   26.637 0.000000 0.000000 
1 1 1    0   10   55 o   41.784   27.601  -0.7867   4.5739  -0.7867   4.5739  -0.7867   4.5739   41.784   27.601   41.784   27.601 0.000000 0.000000 
1 1 1    0   10   56 o   39.174   26.310  -1.5485   4.4600  -1.5485   4.4600  -1.5485   4.4600   39.174   26.310   39.174   26.310 0.000000 0.000000 
1 1 1    0   10   57 o  148.453   29.094   19.252   5.8856   19.252   5.8856   19.252   5.8856  148.453   29.094  148.453   29.094 0.000000 0.000000 
1 1 1    0   10   58 o   41.166   27.712  -1.7643   5.0024  -1.7643   5.0024  -1.7643   5.0024   41.166   27.712   41.166   27.712 0.000000 0.000000 
1 1 1    0   10   59 o  216.033   16.858   36.973   5.4964   36.973   5.4964   36.973   5.4964  216.033   16.858  216.033   16.858 0.000000 0.000000 
1 1 1    0   10   60 o   73.032   37.424   6.6039   5.3071   6.6039   5.3071   6.6039   5.3071   73.032   37.424   73.032   37.424 0.000000 0.000000 
1 1 1    0   10   61 o  190.014   19.122   29.195   5.4323   29.195   5.4323   29.195   5.4323  190.014   19.122  190.014   19.122 0.000000 0.000000 
1 1 1    0   10   62 o   95.727   43.372   11.478   6.8536   11.478   6.8536   11.478   6.8536   95.727   43.372   95.727   43.372 0.000000 0.000000 
1 1 1    0   10   63 o   54.955   32.993   3.1066   4.9913   3.1066   4.9913   3.1066   4.9913   54.955   32.993   54.955   32.993 0.000000 0.000000 
1 1 1    0   10   64 f   49.515   31.152   1.7433   4.9619   1.7433   4.9619   1.7433   4.9619   49.515   31.152   49.515   31.152 0.000000 0.000000 
1 1 1    0   10   65 o   40.731   27.326  -1.0104   4.7867  -1.0104   4.7867  -1.0104   4.7867   40.731   27.326   40.731   27.326 0.000000 0.000000 
1 1 1    0   11    4 f  842.083   12.971  543.331   16.709  543.331   16.709  543.331   16.709  842.083   12.971  842.083   12.971 0.000000 0.000000 
1 1 1    0   11    5 o  659.412   8.1054  332.992   8.1782  332.992   8.1782  332.992   8.1782  659.412   8.1054  659.412   8.1054 0.000000 0.000000 
1 1 1    0   11    6 o  688.932   8.2921  363.472   8.7411  363.472   8.7411  363.472   8.7411  688.932   8.2921  688.932   8.2921 0.000000 0.000000 
1 1 1    0   11    7 o   96.966   13.486   7.6059   1.8909   7.6059   1.8909   7.6059   1.8909   96.966   13.486   96.966   13.486 0.000000 0.000000 
1 1 1    0   11    8 o  556.127   7.6890  236.876   6.5422  236.876   6.5422  236.876   6.5422  556.127   7.6890  556.127   7.6890 0.000000 0.000000 
1 1 1    0   11    9 o  406.088   7.3544  126.354   4.5679  126.354   4.5679  126.354   4.5679  406.088   7.3544  406.088   7.3544 0.000000 0.000000 
1 1 1    0   11   10 o   36.376   20.901   1.2721   1.8575   1.2721   1.8575   1.2721   1.8575   36.376   20.901   36.376   20.901 0.000000 0.000000 
1 1 1    0   11   11 o  663.048   8.3291  336.711   8.4501  336.711   8.4501  336.711   8.4501  663.048   8.3291  663.048   8.3291 0.000000 0.000000 
1 1 1    0   11   12 o  175.074   10.386   23.715   2.7608   23.715   2.7608   23.715   2.7608  175.074   10.386  175.074   10.386 0.000000 0.000000 
1 1 1    0   11   13 o  256.386   8.4031   50.485   3.2896   50.485   3.2896   50.485   3.2896  256.386   8.4031  256.386   8.4031 0.000000 0.000000 
1 1 1    0   11   14 o  665.932   8.5338  339.674   8.6952  339.674   8.6952  339.674   8.6952  665.932   8.5338  665.932   8.5338 0.000000 0.000000 
1 1 1    0   11   15 o  557.470   11.651  238.301   9.9318  238.301   9.9318  238.301   9.9318  557.470   11.651  557.470   11.651 0.000000 0.000000 
1 1 1    0   11   16 o  138.912   21.738   15.840   4.2843   15.840   4.2843   15.840   4.2843  138.912   21.738  138.912   21.738 0.000000 0.000000 
1 1 1    0   11   17 o  254.770   9.7759   49.915   3.7995   49.915   3.7995   49.915   3.7995  254.770   9.7759  254.770   9.7759 0.000000 0.000000 
1 1 1    0   11   18 o  363.148   8.7928  101.137   4.8810  101.137   4.8810  101.137   4.8810  363.148   8.7928  363.148   8.7928 0.000000 0.000000 
1 1 1    0   11   19 o  801.988   9.7277  492.634   11.937  492.634   11.937  492.634   11.937  801.988   9.7277  801.988   9.7277 0.000000 0.000000 
1 1 1    0   11   20 o  143.220   11.804   16.023   2.5472   16.023   2.5472   16.023   2.5472  143.220   11.804  143.220   11.804 0.000000 0.000000 
1 1 1    0   11   21 o  663.208   9.2345  336.905   9.3701  336.905   9.3701  336.905   9.3701  663.208   9.2345  663.208   9.2345 0.000000 0.000000 
1 1 1    0   11   22 o  466.428   8.3336  166.690   5.9453  166.690   5.9453  166.690   5.9453  466.428   8.3336  466.428   8.3336 0.000000 0.000000 
1 1 1    0   11   24 o  477.141   7.5080  174.388   5.4802  174.388   5.4802  174.388   5.4802  477.141   7.5080  477.141   7.5080 0.000000 0.000000 
1 1 1    0   11   25 o  379.336   7.9811  110.289   4.6294  110.289   4.6294  110.289   4.6294  379.336   7.9811  379.336   7.9811 0.000000 0.000000 
1 1 1    0   11   26 o  623.406   7.9318  297.620   7.5658  297.620   7.5658  297.620   7.5658  623.406   7.9318  623.406   7.9318 0.000000 0.000000 
1 1 1    0   11   27 o  2431.18   17.878  4528.10   66.520  4528.10   66.520  4528.10   66.520  2431.18   17.878  2431.18   17.878 0.000000 0.000000 
1 1 1    0   11   28 f  466.002   8.6002  166.399   6.1296  166.399   6.1296  166.399   6.1296  466.002   8.6002  466.002   8.6002 0.000000 0.000000 
1 1 1    0   11   29 o  119.574   23.033   12.099   3.7641   12.099   3.7641   12.099   3.7641  119.574   23.033  119.574   23.033 0.000000 0.000000 
1 1 1    0   11   30 o  195.020   13.565   29.545   4.0043   29.545   4.0043   29.545   4.0043  195.020   13.565  195.020   13.565 0.000000 0.000000 
1 1 1    0   11   31 o  1224.84   9.2840  1148.70   17.403  1148.70   17.403  1148.70   17.403  1224.84   9.2840  1224.84   9.2840 0.000000 0.000000 
1 1 1    0   11   32 o  745.619   9.1634  425.804   10.454  425.804   10.454  425.804   10.454  745.619   9.1634  745.619   9.1634 0.000000 0.000000 
1 1 1    0   11   33 o  453.410   8.3846  157.541   5.8144  157.541   5.8144  157.541   5.8144  453.410   8.3846  453.410   8.3846 0.000000 0.000000 
1 1 1    0   11   34 o  174.517   15.329   23.867   4.0221   23.867   4.0221   23.867   4.0221  174.517   15.329  174.517   15.329 0.000000 0.000000 
1 1 1    0   11   35 o  798.852   8.1088  488.705   9.9127  488.705   9.9127  488.705   9.9127  798.852   8.1088  798.852   8.1088 0.000000 0.000000 
1 1 1    0   11   36 f  977.218   9.5709  731.419   14.313  731.419   14.313  731.419   14.313  977.218   9.5709  977.218   9.5709 0.000000 0.000000 
1 1 1    0   11   37 o  569.606   8.2625  248.570   7.2003  248.570   7.2003  248.570   7.2003  569.606   8.2625  569.606   8.2625 0.000000 0.000000 
1 1 1    0   11   38 o  691.054   9.9816  365.972   10.553  365.972   10.553  365.972   10.553  691.054   9.9816  691.054   9.9816 0.000000 0.000000 
1 1 1    0   11   39 o   66.892   36.789   4.8124   5.4436   4.8124   5.4436   4.8124   5.4436   66.892   36.789   66.892   36.789 0.000000 0.000000 
1 1 1    0   11   40 o  334.442   10.310   85.933   5.2666   85.933   5.2666   85.933   5.2666  334.442   10.310  334.442   10.310 0.000000 0.000000 
1 1 1    0   11   41 o   32.935   22.790  -3.2038   3.9277  -3.2038   3.9277  -3.2038   3.9277   32.935   22.790   32.935   22.790 0.000000 0.000000 
1 1 1    0   11   42 o  518.470   8.6435  206.089   6.8550  206.089   6.8550  206.089   6.8550  518.470   8.6435  518.470   8.6435 0.000000 0.000000 
1 1 1    0   11   43 o  344.150   10.960   91.073   5.7600   91.073   5.7600   91.073   5.7600  344.150   10.960  344.150   10.960 0.000000 0.000000 
1 1 1    0   11   44 o  542.797   8.6359  225.921   7.1708  225.921   7.1708  225.921   7.1708  542.797   8.6359  542.797   8.6359 0.000000 0.000000 
1 1 1    0   11   45 o  139.676   27.669   16.733   5.2569   16.733   5.2569   16.733   5.2569  139.676   27.669  139.676   27.669 0.000000 0.000000 
1 1 1    0   11   46 o   92.114   31.557   8.5332   3.9976   8.5332   3.9976   8.5332   3.9976   92.114   31.557   92.114   31.557 0.000000 0.000000 
1 1 1    0   11   47 o  282.161   11.715   61.428   5.0396   61.428   5.0396   61.428   5.0396  282.161   11.715  282.161   11.715 0.000000 0.000000 
1 1 1    0   11   48 o  162.291   19.063   21.145   4.5643   21.145   4.5643   21.145   4.5643  162.291   19.063  162.291   19.063 0.000000 0.000000 
1 1 1    0   11   49 o  405.645   11.964  126.753   7.4139  126.753   7.4139  126.753   7.4139  405.645   11.964  405.645   11.964 0.000000 0.000000 
1 1 1    0   11   50 f  229.415   32.971   43.881   10.884   43.881   10.884   43.881   10.884  229.415   32.971  229.415   32.971 0.000000 0.000000 
1 1 1    0   11   51 o   43.928   27.828   0.6632   4.0364   0.6632   4.0364   0.6632   4.0364   43.928   27.828   43.928   27.828 0.000000 0.000000 
1 1 1    0   11   52 o   39.912   26.339  -0.7412   4.1484  -0.7412   4.1484  -0.7412   4.1484   39.912   26.339   39.912   26.339 0.000000 0.000000 
1 1 1    0   11   53 o  183.058   17.934   26.676   4.9144   26.676   4.9144   26.676   4.9144  183.058   17.934  183.058   17.934 0.000000 0.000000 
1 1 1    0   11   54 o  252.472   13.535   49.562   5.1960   49.562   5.1960   49.562   5.1960  252.472   13.535  252.472   13.535 0.000000 0.000000 
1 1 1    0   11   55 o   33.933   23.675  -4.0765   4.4750  -4.0765   4.4750  -4.0765   4.4750   33.933   23.675   33.933   23.675 0.000000 0.000000 
1 1 1    0   11   56 o   38.105   25.858  -2.1412   4.5295  -2.1412   4.5295  -2.1412   4.5295   38.105   25.858   38.105   25.858 0.000000 0.000000 
1 1 1    0   11   57 o   83.813   39.177   8.3915   5.6103   8.3915   5.6103   8.3915   5.6103   83.813   39.177   83.813   39.177 0.000000 0.000000 
1 1 1    0   11   58 o  142.939   24.778   17.429   4.9327   17.429   4.9327   17.429   4.9327  142.939   24.778  142.939   24.778 0.000000 0.000000 
1 1 1    0   11   59 o  197.583   18.165   31.230   5.3869   31.230   5.3869   31.230   5.3869  197.583   18.165  197.583   18.165 0.000000 0.000000 
1 1 1    0   11   60 o  316.784   15.167   78.572   7.3156   78.572   7.3156   78.572   7.3156  316.784   15.167  316.784   15.167 0.000000 0.000000 
1 1 1    0   11   61 o   42.279   29.477  -5.4287   6.9023  -5.4287   6.9023  -5.4287   6.9023   42.279   29.477   42.279   29.477 0.000000 0.000000 
1 1 1    0   11   62 o   96.149   38.486   10.676   5.4961   10.676   5.4961   10.676   5.4961   96.149   38.486   96.149   38.486 0.000000 0.000000 
1 1 1    0   11   63 o   39.113   26.667  -2.1672   4.9338  -2.1672   4.9338  -2.1672   4.9338   39.113   26.667   39.113   26.667 0.000000 0.000000 
1 1 1    0   11   64 o   58.237   33.776   4.0469   4.9219   4.0469   4.9219   4.0469   4.9219   58.237   33.776   58.237   33.776 0.000000 0.000000 
1 1 1    0   12    2 o  1167.00   16.262  1043.74   29.036  1043.74   29.036  1043.74   29.036  1167.00   16.262  1167.00   16.262 0.000000 0.000000 
1 1 1    0   12    3 o  740.199   12.190  419.851   13.803  419.851   13.803  419.851   13.803  740.199   12.190  740.199   12.190 0.000000 0.000000 
1 1 1    0   12    4 o  1633.98   15.074  2045.35   37.692  2045.35   37.692  2045.35   37.692  1633.98   15.074  1633.98   15.074 0.000000 0.000000 
1 1 1    0   12    5 o   29.555   18.650   0.2710   1.7933   0.2710   1.7933   0.2710   1.7933   29.555   18.650   29.555   18.650 0.000000 0.000000 
1 1 1    0   12    6 o  255.897   7.6840   50.261   3.0036   50.261   3.0036   50.261   3.0036  255.897   7.6840  255.897   7.6840 0.000000 0.000000 
1 1 1    0   12    7 o  551.456   7.7617  232.924   6.5485  232.924   6.5485  232.924   6.5485  551.456   7.7617  551.456   7.7617 0.000000 0.000000 
1 1 1    0   12    8 o  805.966   9.1128  497.484   11.239  497.484   11.239  497.484   11.239  805.966   9.1128  805.966   9.1128 0.000000 0.000000 
1 1 1    0   12    9 o  323.392   7.5969   80.190   3.7557   80.190   3.7557   80.190   3.7557  323.392   7.5969  323.392   7.5969 0.000000 0.000000 
1 1 1    0   12   10 o  547.188   7.8894  229.351   6.6046  229.351   6.6046  229.351   6.6046  547.188   7.8894  547.188   7.8894 0.000000 0.000000 
1 1 1    0   12   11 o   46.853   23.599   2.4728   2.0894   2.4728   2.0894   2.4728   2.0894   46.853   23.599   46.853   23.599 0.000000 0.000000 
1 1 1    0   12   12 o  927.888   9.9916  659.449   14.187  659.449   14.187  659.449   14.187  927.888   9.9916  927.888   9.9916 0.000000 0.000000 
1 1 1    0   12   13 o  717.334   8.7911  394.126   9.6491  394.126   9.6491  394.126   9.6491  717.334   8.7911  717.334   8.7911 0.000000 0.000000 
1 1 1    0   12   14 f  1040.80   15.318  830.479   24.391  830.479   24.391  830.479   24.391  1040.80   15.318  1040.80   15.318 0.000000 0.000000 
1 1 1    0   12   16 f  924.333   10.155  654.404   14.364  654.404   14.364  654.404   14.364  924.333   10.155  924.333   10.155 0.000000 0.000000 
1 1 1    0   12   17 o  868.266   9.9315  577.415   13.195  577.415   13.195  577.415   13.195  868.266   9.9315  868.266   9.9315 0.000000 0.000000 
1 1 1    0   12   18 o  432.019   8.6891  143.052   5.7405  143.052   5.7405  143.052   5.7405  432.019   8.6891  432.019   8.6891 0.000000 0.000000 
1 1 1    0   12   19 o  386.138   9.0627  114.330   5.3497  114.330   5.3497  114.330   5.3497  386.138   9.0627  386.138   9.0627 0.000000 0.000000 
1 1 1    0   12   20 o  1368.24   13.428  1433.95   28.117  1433.95   28.117  1433.95   28.117  1368.24   13.428  1368.24   13.428 0.000000 0.000000 
1 1 1    0   12   21 o  180.210   10.285   25.104   2.8157   25.104   2.8157   25.104   2.8157  180.210   10.285  180.210   10.285 0.000000 0.000000 
1 1 1    0   12   22 o   60.389   26.939   4.0346   2.6432   4.0346   2.6432   4.0346   2.6432   60.389   26.939   60.389   26.939 0.000000 0.000000 
1 1 1    0   12   23 o  1101.20   9.4955  928.463   16.002  928.463   16.002  928.463   16.002  1101.20   9.4955  1101.20   9.4955 0.000000 0.000000 
1 1 1    0   12   24 o   51.087   26.986   2.8846   2.8195   2.8846   2.8195   2.8846   2.8195   51.087   26.986   51.087   26.986 0.000000 0.000000 
1 1 1    0   12   25 o  1509.37   11.959  1744.50   27.624  1744.50   27.624  1744.50   27.624  1509.37   11.959  1509.37   11.959 0.000000 0.000000 
1 1 1    0   12   26 o  146.018   15.088   16.844   3.2897   16.844   3.2897   16.844   3.2897  146.018   15.088  146.018   15.088 0.000000 0.000000 
1 1 1    0   12   27 o  181.638   13.570   25.683   3.7245   25.683   3.7245   25.683   3.7245  181.638   13.570  181.638   13.570 0.000000 0.000000 
1 1 1    0   12   28 o  369.620   9.1885  104.777   5.1911  104.777   5.1911  104.777   5.1911  369.620   9.1885  369.620   9.1885 0.000000 0.000000 
1 1 1    0   12   29 o  142.029   22.605   16.588   4.5413   16.588   4.5413   16.588   4.5413  142.029   22.605  142.029   22.605 0.000000 0.000000 
1 1 1    0   12   30 o  1010.18   11.854  781.673   18.322  781.673   18.322  781.673   18.322  1010.18   11.854  1010.18   11.854 0.000000 0.000000 
1 1 1    0   12   31 o  513.775   12.747  202.510   10.010  202.510   10.010  202.510   10.010  513.775   12.747  513.775   12.747 0.000000 0.000000 
1 1 1    0   12   32 o  1228.74   13.647  1156.76   25.659  1156.76   25.659  1156.76   25.659  1228.74   13.647  1228.74   13.647 0.000000 0.000000 
1 1 1    0   12   33 o  109.007   34.850   11.534   5.1253   11.534   5.1253   11.534   5.1253  109.007   34.850  109.007   34.850 0.000000 0.000000 
1 1 1    0   12   34 o  663.564   8.0341  337.232   8.1573  337.232   8.1573  337.232   8.1573  663.564   8.0341  663.564   8.0341 0.000000 0.000000 
1 1 1    0   12   35 o  333.397   19.594   86.114   9.9198   86.114   9.9198   86.114   9.9198  333.397   19.594  333.397   19.594 0.000000 0.000000 
1 1 1    0   12   36 o  898.896   9.4579  618.917   13.010  618.917   13.010  618.917   13.010  898.896   9.4579  898.896   9.4579 0.000000 0.000000 
1 1 1    0   12   37 o  360.776   12.293  100.061   6.7703  100.061   6.7703  100.061   6.7703  360.776   12.293  360.776   12.293 0.000000 0.000000 
1 1 1    0   12   38 o  461.466   11.069  163.413   7.8081  163.413   7.8081  163.413   7.8081  461.466   11.069  461.466   11.069 0.000000 0.000000 
1 1 1    0   12   39 o  167.338   17.433   22.176   4.3542   22.176   4.3542   22.176   4.3542  167.338   17.433  167.338   17.433 0.000000 0.000000 
1 1 1    0   12   40 o   33.770   23.105  -2.4272   3.7771  -2.4272   3.7771  -2.4272   3.7771   33.770   23.105   33.770   23.105 0.000000 0.000000 
1 1 1    0   12   41 o  677.709   8.2588  351.940   8.5641  351.940   8.5641  351.940   8.5641  677.709   8.2588  677.709   8.2588 0.000000 0.000000 
1 1 1    0   12   42 o  419.001   9.7852  134.751   6.2679  134.751   6.2679  134.751   6.2679  419.001   9.7852  419.001   9.7852 0.000000 0.000000 
1 1 1    0   12   43 o   67.038   32.242   5.1240   3.8274   5.1240   3.8274   5.1240   3.8274   67.038   32.242   67.038   32.242 0.000000 0.000000 
1 1 1    0   12   44 o  150.714   22.832   18.671   4.9092   18.671   4.9092   18.671   4.9092  150.714   22.832  150.714   22.832 0.000000 0.000000 
1 1 1    0   12   45 o  328.683   12.304   83.258   6.1702   83.258   6.1702   83.258   6.1702  328.683   12.304  328.683   12.304 0.000000 0.000000 
1 1 1    0   12   46 o  305.543   10.566   71.867   4.9279   71.867   4.9279   71.867   4.9279  305.543   10.566  305.543   10.566 0.000000 0.000000 
1 1 1    0   12   47 o   51.243   31.087   1.9812   4.5248   1.9812   4.5248   1.9812   4.5248   51.243   31.087   51.243   31.087 0.000000 0.000000 
1 1 1    0   12   48 o   71.450   36.440   5.9312   5.0181   5.9312   5.0181   5.9312   5.0181   71.450   36.440   71.450   36.440 0.000000 0.000000 
1 1 1    0   12   49 o   78.701   32.761   6.8158   3.9390   6.8158   3.9390   6.8158   3.9390   78.701   32.761   78.701   32.761 0.000000 0.000000 
1 1 1    0   12   50 o  278.537   15.905   60.417   6.7303   60.417   6.7303   60.417   6.7303  278.537   15.905  278.537   15.905 0.000000 0.000000 
1 1 1    0   12   51 o  265.761   12.337   54.674   4.9938   54.674   4.9938   54.674   4.9938  265.761   12.337  265.761   12.337 0.000000 0.000000 
1 1 1    0   12   52 o  160.700   19.201   20.840   4.5446   20.840   4.5446   20.840   4.5446  160.700   19.201  160.700   19.201 0.000000 0.000000 
1 1 1    0   12   53 o  224.816   14.343   39.455   4.8895   39.455   4.8895   39.455   4.8895  224.816   14.343  224.816   14.343 0.000000 0.000000 
1 1 1    0   12   54 o   32.046   22.611  -5.0829   4.4372  -5.0829   4.4372  -5.0829   4.4372   32.046   22.611   32.046   22.611 0.000000 0.000000 
1 1 1    0   12   55 o  136.699   24.819   15.963   4.6855   15.963   4.6855   15.963   4.6855  136.699   24.819  136.699   24.819 0.000000 0.000000 
1 1 1    0   12   56 o  232.535   19.110   42.929   6.6961   42.929   6.6961   42.929   6.6961  232.535   19.110  232.535   19.110 0.000000 0.000000 
1 1 1    0   12   57 o   46.332   29.515   0.7379   4.6154   0.7379   4.6154   0.7379   4.6154   46.332   29.515   46.332   29.515 0.000000 0.000000 
1 1 1    0   12   58 o   93.671   35.390   9.5109   4.7551   9.5109   4.7551   9.5109   4.7551   93.671   35.390   93.671   35.390 0.000000 0.000000 
1 1 1    0   12   59 o  220.100   17.540   38.508   5.8228   38.508   5.8228   38.508   5.8228  220.100   17.540  220.100   17.540 0.000000 0.000000 
1 1 1    0   12   60 o   66.059   35.879   5.3160   5.1097   5.3160   5.1097   5.3160   5.1097   66.059   35.879   66.059   35.879 0.000000 0.000000 
1 1 1    0   12   61 o   90.282   43.424   10.437   6.9427   10.437   6.9427   10.437   6.9427   90.282   43.424   90.282   43.424 0.000000 0.000000 
1 1 1    0   12   62 o  116.560   32.882   13.378   5.0796   13.378   5.0796   13.378   5.0796  116.560   32.882  116.560   32.882 0.000000 0.000000 
1 1 1    0   12   63 o  153.577   24.625   20.377   5.3424   20.377   5.3424   20.377   5.3424  153.577   24.625  153.577   24.625 0.000000 0.000000 
1 1 1    0   12   64 o  244.933   18.566   48.510   6.8683   48.510   6.8683   48.510   6.8683  244.933   18.566  244.933   18.566 0.000000 0.000000 
1 1 1    0   13    2 o  789.460   12.738  477.638   15.383  477.638   15.383  477.638   15.383  789.460   12.738  789.460   12.738 0.000000 0.000000 
1 1 1    0   13    3 o  1522.18   20.161  1776.91   46.954  1776.91   46.954  1776.91   46.954  1522.18   20.161  1522.18   20.161 0.000000 0.000000 
1 1 1    0   13    4 o  1665.91   21.755  2128.90   55.452  2128.90   55.452  2128.90   55.452  1665.91   21.755  1665.91   21.755 0.000000 0.000000 
1 1 1    0   13    5 o  163.615   9.7001   20.710   2.4097   20.710   2.4097   20.710   2.4097  163.615   9.7001  163.615   9.7001 0.000000 0.000000 
1 1 1    0   13    6 o  457.931   7.5819  160.658   5.3110  160.658   5.3110  160.658   5.3110  457.931   7.5819  457.931   7.5819 0.000000 0.000000 
1 1 1    0   13    7 o  735.083   8.7400  413.845   9.8306  413.845   9.8306  413.845   9.8306  735.083   8.7400  735.083   8.7400 0.000000 0.000000 
1 1 1    0   13    8 o  141.857   11.026   15.686   2.3608   15.686   2.3608   15.686   2.3608  141.857   11.026  141.857   11.026 0.000000 0.000000 
1 1 1    0   13    9 o  1000.80   10.459  767.162   16.018  767.162   16.018  767.162   16.018  1000.80   10.459  1000.80   10.459 0.000000 0.000000 
1 1 1    0   13   10 o  307.669   7.9663   72.611   3.7459   72.611   3.7459   72.611   3.7459  307.669   7.9663  307.669   7.9663 0.000000 0.000000 
1 1 1    0   13   11 o  962.907   10.244  710.179   15.094  710.179   15.094  710.179   15.094  962.907   10.244  962.907   10.244 0.000000 0.000000 
1 1 1    0   13   12 o  109.017   24.234   10.353   3.5340   10.353   3.5340   10.353   3.5340  109.017   24.234  109.017   24.234 0.000000 0.000000 
1 1 1    0   13   13 o  157.748   17.173   19.736   4.0219   19.736   4.0219   19.736   4.0219  157.748   17.173  157.748   17.173 0.000000 0.000000 
1 1 1    0   13   14 o  484.459   8.1333  179.823   6.0272  179.823   6.0272  179.823   6.0272  484.459   8.1333  484.459   8.1333 0.000000 0.000000 
1 1 1    0   13   15 o   67.905   26.422   4.8385   2.6179   4.8385   2.6179   4.8385   2.6179   67.905   26.422   67.905   26.422 0.000000 0.000000 
1 1 1    0   13   16 o  486.678   8.3898  181.480   6.2455  181.480   6.2455  181.480   6.2455  486.678   8.3898  486.678   8.3898 0.000000 0.000000 
1 1 1    0   13   17 o  341.284   8.9495   89.349   4.6678   89.349   4.6678   89.349   4.6678  341.284   8.9495  341.284   8.9495 0.000000 0.000000 
1 1 1    0   13   18 o  898.050   10.171  617.667   13.976  617.667   13.976  617.667   13.976  898.050   10.171  898.050   10.171 0.000000 0.000000 
1 1 1    0   13   19 o  1047.78   11.191  840.796   17.943  840.796   17.943  840.796   17.943  1047.78   11.191  1047.78   11.191 0.000000 0.000000 
1 1 1    0   13   20 o   57.295   32.380   3.3110   4.3575   3.3110   4.3575   3.3110   4.3575   57.295   32.380   57.295   32.380 0.000000 0.000000 
1 1 1    0   13   21 o  726.737   13.319  404.792   14.804  404.792   14.804  404.792   14.804  726.737   13.319  726.737   13.319 0.000000 0.000000 
1 1 1    0   13   22 o  1630.16   12.596  2034.94   31.425  2034.94   31.425  2034.94   31.425  1630.16   12.596  1630.16   12.596 0.000000 0.000000 
1 1 1    0   13   23 o  502.413   9.7980  193.446   7.5283  193.446   7.5283  193.446   7.5283  502.413   9.7980  502.413   9.7980 0.000000 0.000000 
1 1 1    0   13   24 o  410.761   7.8492  129.289   4.9309  129.289   4.9309  129.289   4.9309  410.761   7.8492  410.761   7.8492 0.000000 0.000000 
1 1 1    0   13   25 o   38.808   24.137   0.7262   2.8906   0.7262   2.8906   0.7262   2.8906   38.808   24.137   38.808   24.137 0.000000 0.000000 
1 1 1    0   13   26 o   32.939   22.029  -1.1188   3.0686  -1.1188   3.0686  -1.1188   3.0686   32.939   22.029   32.939   22.029 0.000000 0.000000 
1 1 1    0   13   27 o  524.245   8.1376  210.527   6.5263  210.527   6.5263  210.527   6.5263  524.245   8.1376  524.245   8.1376 0.000000 0.000000 
1 1 1    0   13   28 o  375.673   12.935  108.450   7.4179  108.450   7.4179  108.450   7.4179  375.673   12.935  375.673   12.935 0.000000 0.000000 
1 1 1    0   13   29 o  460.838   10.488  162.844   7.3894  162.844   7.3894  162.844   7.3894  460.838   10.488  460.838   10.488 0.000000 0.000000 
1 1 1    0   13   30 o  534.134   9.0218  218.595   7.3711  218.595   7.3711  218.595   7.3711  534.134   9.0218  534.134   9.0218 0.000000 0.000000 
1 1 1    0   13   31 o   64.404   39.270   2.7913   7.3028   2.7913   7.3028   2.7913   7.3028   64.404   39.270   64.404   39.270 0.000000 0.000000 
1 1 1    0   13   32 o   90.621   36.072   8.7151   4.8362   8.7151   4.8362   8.7151   4.8362   90.621   36.072   90.621   36.072 0.000000 0.000000 
1 1 1    0   13   33 o  187.635   17.953   27.715   5.0476   27.715   5.0476   27.715   5.0476  187.635   17.953  187.635   17.953 0.000000 0.000000 
1 1 1    0   13   34 o  518.495   9.8517  206.068   7.8122  206.068   7.8122  206.068   7.8122  518.495   9.8517  518.495   9.8517 0.000000 0.000000 
1 1 1    0   13   35 o  621.114   10.956  295.721   10.409  295.721   10.409  295.721   10.409  621.114   10.956  621.114   10.956 0.000000 0.000000 
1 1 1    0   13   36 o  368.949   11.965  104.602   6.7407  104.602   6.7407  104.602   6.7407  368.949   11.965  368.949   11.965 0.000000 0.000000 
1 1 1    0   13   37 o  342.274   12.702   90.134   6.6336   90.134   6.6336   90.134   6.6336  342.274   12.702  342.274   12.702 0.000000 0.000000 
1 1 1    0   13   38 o  459.707   8.7073  162.013   6.1219  162.013   6.1219  162.013   6.1219  459.707   8.7073  459.707   8.7073 0.000000 0.000000 
1 1 1    0   13   39 o  368.433   9.5426  104.187   5.3732  104.187   5.3732  104.187   5.3732  368.433   9.5426  368.433   9.5426 0.000000 0.000000 
1 1 1    0   13   40 o   40.106   26.081  -0.2875   3.8513  -0.2875   3.8513  -0.2875   3.8513   40.106   26.081   40.106   26.081 0.000000 0.000000 
1 1 1    0   13   41 o   57.867   30.977   3.7125   3.7574   3.7125   3.7574   3.7125   3.7574   57.867   30.977   57.867   30.977 0.000000 0.000000 
1 1 1    0   13   42 o   65.484   32.281   4.8956   3.8715   4.8956   3.8715   4.8956   3.8715   65.484   32.281   65.484   32.281 0.000000 0.000000 
1 1 1    0   13   43 o  402.825   9.0500  124.534   5.5737  124.534   5.5737  124.534   5.5737  402.825   9.0500  402.825   9.0500 0.000000 0.000000 
1 1 1    0   13   44 o   57.352   32.407   3.4110   4.3638   3.4110   4.3638   3.4110   4.3638   57.352   32.407   57.352   32.407 0.000000 0.000000 
1 1 1    0   13   45 f  234.597   12.366   42.594   4.4122   42.594   4.4122   42.594   4.4122  234.597   12.366  234.597   12.366 0.000000 0.000000 
1 1 1    0   13   46 o  493.020   10.745  186.756   8.1001  186.756   8.1001  186.756   8.1001  493.020   10.745  493.020   10.745 0.000000 0.000000 
1 1 1    0   13   47 o  252.335   16.080   49.622   6.1529   49.622   6.1529   49.622   6.1529  252.335   16.080  252.335   16.080 0.000000 0.000000 
1 1 1    0   13   48 o  467.586   8.8499  167.859   6.3288  167.859   6.3288  167.859   6.3288  467.586   8.8499  467.586   8.8499 0.000000 0.000000 
1 1 1    0   13   49 o   48.733   31.282   0.3821   5.3069   0.3821   5.3069   0.3821   5.3069   48.733   31.282   48.733   31.282 0.000000 0.000000 
1 1 1    0   13   50 o  297.645   10.875   68.328   4.9393   68.328   4.9393   68.328   4.9393  297.645   10.875  297.645   10.875 0.000000 0.000000 
1 1 1    0   13   51 o  191.794   14.790   28.858   4.2825   28.858   4.2825   28.858   4.2825  191.794   14.790  191.794   14.790 0.000000 0.000000 
1 1 1    0   13   52 o   49.796   29.510   2.2523   3.8960   2.2523   3.8960   2.2523   3.8960   49.796   29.510   49.796   29.510 0.000000 0.000000 
1 1 1    0   13   53 o  450.962   9.5579  156.416   6.5907  156.416   6.5907  156.416   6.5907  450.962   9.5579  450.962   9.5579 0.000000 0.000000 
1 1 1    0   13   54 o   37.207   25.243  -2.0662   4.3115  -2.0662   4.3115  -2.0662   4.3115   37.207   25.243   37.207   25.243 0.000000 0.000000 
1 1 1    0   13   55 o  110.370   30.281   11.488   4.4233   11.488   4.4233   11.488   4.4233  110.370   30.281  110.370   30.281 0.000000 0.000000 
1 1 1    0   13   56 o   43.976   29.180  -1.0253   5.2056  -1.0253   5.2056  -1.0253   5.2056   43.976   29.180   43.976   29.180 0.000000 0.000000 
1 1 1    0   13   57 o   56.558   32.764   3.3601   4.6226   3.3601   4.6226   3.3601   4.6226   56.558   32.764   56.558   32.764 0.000000 0.000000 
1 1 1    0   13   58 o   65.767   34.686   5.2080   4.6528   5.2080   4.6528   5.2080   4.6528   65.767   34.686   65.767   34.686 0.000000 0.000000 
1 1 1    0   13   59 o  174.411   21.394   24.989   5.4811   24.989   5.4811   24.989   5.4811  174.411   21.394  174.411   21.394 0.000000 0.000000 
1 1 1    0   13   60 o   53.589   32.749   2.4748   5.1047   2.4748   5.1047   2.4748   5.1047   53.589   32.749   53.589   32.749 0.000000 0.000000 
1 1 1    0   13   61 o  162.863   33.808   24.267   7.4342   24.267   7.4342   24.267   7.4342  162.863   33.808  162.863   33.808 0.000000 0.000000 
1 1 1    0   13   62 o   50.289   31.218   1.9988   4.8129   1.9988   4.8129   1.9988   4.8129   50.289   31.218   50.289   31.218 0.000000 0.000000 
1 1 1    0   13   63 o  133.389   27.468   16.108   4.9531   16.108   4.9531   16.108   4.9531  133.389   27.468  133.389   27.468 0.000000 0.000000 
1 1 1    0   14    2 o  162.200   14.352   20.621   3.4990   20.621   3.4990   20.621   3.4990  162.200   14.352  162.200   14.352 0.000000 0.000000 
1 1 1    0   14    3 f  995.537   14.693  759.703   22.379  759.703   22.379  759.703   22.379  995.537   14.693  995.537   14.693 0.000000 0.000000 
1 1 1    0   14    4 o  428.263   10.773  140.703   7.0518  140.703   7.0518  140.703   7.0518  428.263   10.773  428.263   10.773 0.000000 0.000000 
1 1 1    0   14    5 o  316.912   7.7776   77.022   3.7676   77.022   3.7676   77.022   3.7676  316.912   7.7776  316.912   7.7776 0.000000 0.000000 
1 1 1    0   14    6 o  552.391   7.9946  233.739   6.7563  233.739   6.7563  233.739   6.7563  552.391   7.9946  552.391   7.9946 0.000000 0.000000 
1 1 1    0   14    7 o  1267.37   12.370  1230.48   23.991  1230.48   23.991  1230.48   23.991  1267.37   12.370  1267.37   12.370 0.000000 0.000000 
1 1 1    0   14    8 o  177.288   9.9910   24.294   2.6915   24.294   2.6915   24.294   2.6915  177.288   9.9910  177.288   9.9910 0.000000 0.000000 
1 1 1    0   14    9 o  326.402   8.0703   81.709   4.0263   81.709   4.0263   81.709   4.0263  326.402   8.0703  326.402   8.0703 0.000000 0.000000 
1 1 1    0   14   10 o  406.871   11.263  127.056   7.0021  127.056   7.0021  127.056   7.0021  406.871   11.263  406.871   11.263 0.000000 0.000000 
1 1 1    0   14   11 o  237.739   12.929   43.670   4.6728   43.670   4.6728   43.670   4.6728  237.739   12.929  237.739   12.929 0.000000 0.000000 
1 1 1    0   14   12 o  402.974   8.1132  124.464   4.9996  124.464   4.9996  124.464   4.9996  402.974   8.1132  402.974   8.1132 0.000000 0.000000 
1 1 1    0   14   13 o  284.296   8.8416   62.055   3.8390   62.055   3.8390   62.055   3.8390  284.296   8.8416  284.296   8.8416 0.000000 0.000000 
1 1 1    0   14   14 o  1291.48   12.710  1277.67   25.118  1277.67   25.118  1277.67   25.118  1291.48   12.710  1291.48   12.710 0.000000 0.000000 
1 1 1    0   14   15 o  445.940   8.3367  152.390   5.6859  152.390   5.6859  152.390   5.6859  445.940   8.3367  445.940   8.3367 0.000000 0.000000 
1 1 1    0   14   16 o  430.080   8.5145  141.760   5.6001  141.760   5.6001  141.760   5.6001  430.080   8.5145  430.080   8.5145 0.000000 0.000000 
1 1 1    0   14   17 o  1042.50   11.069  832.346   17.659  832.346   17.659  832.346   17.659  1042.50   11.069  1042.50   11.069 0.000000 0.000000 
1 1 1    0   14   18 o  200.221   11.965   31.020   3.6369   31.020   3.6369   31.020   3.6369  200.221   11.965  200.221   11.965 0.000000 0.000000 
1 1 1    0   14   19 o  1177.49   16.921  1062.57   30.483  1062.57   30.483  1062.57   30.483  1177.49   16.921  1177.49   16.921 0.000000 0.000000 
1 1 1    0   14   20 o  495.392   9.4040  188.064   7.1249  188.064   7.1249  188.064   7.1249  495.392   9.4040  495.392   9.4040 0.000000 0.000000 
1 1 1    0   14   21 f  286.444   10.993   63.090   4.8036   63.090   4.8036   63.090   4.8036  286.444   10.993  286.444   10.993 0.000000 0.000000 
1 1 1    0   14   22 o  665.859   9.7143  339.611   9.8959  339.611   9.8959  339.611   9.8959  665.859   9.7143  665.859   9.7143 0.000000 0.000000 
1 1 1    0   14   23 o  492.360   9.9370  185.799   7.4818  185.799   7.4818  185.799   7.4818  492.360   9.9370  492.360   9.9370 0.000000 0.000000 
1 1 1    0   14   24 o  1213.32   10.239  1127.21   19.012  1127.21   19.012  1127.21   19.012  1213.32   10.239  1213.32   10.239 0.000000 0.000000 
1 1 1    0   14   25 o   49.688   27.202   2.6366   2.9606   2.6366   2.9606   2.6366   2.9606   49.688   27.202   49.688   27.202 0.000000 0.000000 
1 1 1    0   14   26 o  1608.99   12.615  1982.57   31.064  1982.57   31.064  1982.57   31.064  1608.99   12.615  1608.99   12.615 0.000000 0.000000 
1 1 1    0   14   27 o  458.716   8.5916  161.244   6.0276  161.244   6.0276  161.244   6.0276  458.716   8.5916  458.716   8.5916 0.000000 0.000000 
1 1 1    0   14   28 o  441.557   10.707  149.536   7.2271  149.536   7.2271  149.536   7.2271  441.557   10.707  441.557   10.707 0.000000 0.000000 
1 1 1    0   14   29 o  886.041   9.2057  601.200   12.482  601.200   12.482  601.200   12.482  886.041   9.2057  886.041   9.2057 0.000000 0.000000 
1 1 1    0   14   30 o  714.054   11.654  390.729   12.730  390.729   12.730  390.729   12.730  714.054   11.654  714.054   11.654 0.000000 0.000000 
1 1 1    0   14   31 o  260.326   12.807   52.275   5.0751   52.275   5.0751   52.275   5.0751  260.326   12.807  260.326   12.807 0.000000 0.000000 
1 1 1    0   14   32 o  919.867   9.7545  648.070   13.731  648.070   13.731  648.070   13.731  919.867   9.7545  919.867   9.7545 0.000000 0.000000 
1 1 1    0   14   33 o  1207.81   13.371  1117.82   24.712  1117.82   24.712  1117.82   24.712  1207.81   13.371  1207.81   13.371 0.000000 0.000000 
1 1 1    0   14   34 o  492.136   11.179  185.770   8.4111  185.770   8.4111  185.770   8.4111  492.136   11.179  492.136   11.179 0.000000 0.000000 
1 1 1    0   14   35 o  829.264   9.7601  526.819   12.385  526.819   12.385  526.819   12.385  829.264   9.7601  829.264   9.7601 0.000000 0.000000 
1 1 1    0   14   36 o  721.628   9.6043  399.008   10.604  399.008   10.604  399.008   10.604  721.628   9.6043  721.628   9.6043 0.000000 0.000000 
1 1 1    0   14   37 o  588.234   9.9950  265.258   8.9933  265.258   8.9933  265.258   8.9933  588.234   9.9950  588.234   9.9950 0.000000 0.000000 
1 1 1    0   14   38 o  193.837   19.229   29.690   5.5763   29.690   5.5763   29.690   5.5763  193.837   19.229  193.837   19.229 0.000000 0.000000 
1 1 1    0   14   39 o  249.485   15.468   48.301   5.8546   48.301   5.8546   48.301   5.8546  249.485   15.468  249.485   15.468 0.000000 0.000000 
1 1 1    0   14   40 o  477.210   10.740  174.790   7.8358  174.790   7.8358  174.790   7.8358  477.210   10.740  477.210   10.740 0.000000 0.000000 
1 1 1    0   14   41 o  229.337   18.708   41.235   6.4665   41.235   6.4665   41.235   6.4665  229.337   18.708  229.337   18.708 0.000000 0.000000 
1 1 1    0   14   42 o  329.495   9.7611   83.425   4.9131   83.425   4.9131   83.425   4.9131  329.495   9.7611  329.495   9.7611 0.000000 0.000000 
1 1 1    0   14   43 o   38.008   25.910  -2.6866   4.6548  -2.6866   4.6548  -2.6866   4.6548   38.008   25.910   38.008   25.910 0.000000 0.000000 
1 1 1    0   14   44 o  897.015   10.309  617.262   14.150  617.262   14.150  617.262   14.150  897.015   10.309  897.015   10.309 0.000000 0.000000 
1 1 1    0   14   45 o  206.868   16.589   33.560   5.1750   33.560   5.1750   33.560   5.1750  206.868   16.589  206.868   16.589 0.000000 0.000000 
1 1 1    0   14   46 o  265.434   11.520   54.388   4.6604   54.388   4.6604   54.388   4.6604  265.434   11.520  265.434   11.520 0.000000 0.000000 
1 1 1    0   14   47 o   72.945   32.402   5.9918   3.8246   5.9918   3.8246   5.9918   3.8246   72.945   32.402   72.945   32.402 0.000000 0.000000 
1 1 1    0   14   48 o   48.477   28.462   2.1813   3.5647   2.1813   3.5647   2.1813   3.5647   48.477   28.462   48.477   28.462 0.000000 0.000000 
1 1 1    0   14   49 o  111.370   35.841   12.323   5.3934   12.323   5.3934   12.323   5.3934  111.370   35.841  111.370   35.841 0.000000 0.000000 
1 1 1    0   14   50 o  524.614   8.9115  211.363   7.1512  211.363   7.1512  211.363   7.1512  524.614   8.9115  524.614   8.9115 0.000000 0.000000 
1 1 1    0   14   51 o  202.752   14.063   32.129   4.3159   32.129   4.3159   32.129   4.3159  202.752   14.063  202.752   14.063 0.000000 0.000000 
1 1 1    0   14   52 o  226.123   13.527   39.820   4.6433   39.820   4.6433   39.820   4.6433  226.123   13.527  226.123   13.527 0.000000 0.000000 
1 1 1    0   14   53 o  159.569   19.490   20.624   4.5705   20.624   4.5705   20.624   4.5705  159.569   19.490  159.569   19.490 0.000000 0.000000 
1 1 1    0   14   54 o  423.251   9.8347  137.909   6.3636  137.909   6.3636  137.909   6.3636  423.251   9.8347  423.251   9.8347 0.000000 0.000000 
1 1 1    0   14   55 o   60.728   34.657   4.0070   5.0571   4.0070   5.0571   4.0070   5.0571   60.728   34.657   60.728   34.657 0.000000 0.000000 
1 1 1    0   14   56 f   87.198   33.862   8.2715   4.3033   8.2715   4.3033   8.2715   4.3033   87.198   33.862   87.198   33.862 0.000000 0.000000 
1 1 1    0   14   57 o   62.869   33.670   4.6808   4.4412   4.6808   4.4412   4.6808   4.4412   62.869   33.670   62.869   33.670 0.000000 0.000000 
1 1 1    0   14   58 o   98.007   35.097   10.201   4.8110   10.201   4.8110   10.201   4.8110   98.007   35.097   98.007   35.097 0.000000 0.000000 
1 1 1    0   14   59 o  407.527   14.361  129.431   8.9326  129.431   8.9326  129.431   8.9326  407.527   14.361  407.527   14.361 0.000000 0.000000 
1 1 1    0   14   60 o   44.834   30.728  -3.4213   6.7437  -3.4213   6.7437  -3.4213   6.7437   44.834   30.728   44.834   30.728 0.000000 0.000000 
1 1 1    0   14   61 o   84.772   35.947   8.4522   4.7277   8.4522   4.7277   8.4522   4.7277   84.772   35.947   84.772   35.947 0.000000 0.000000 
1 1 1    0   14   62 o  137.545   26.425   16.809   4.9697   16.809   4.9697   16.809   4.9697  137.545   26.425  137.545   26.425 0.000000 0.000000 
1 1 1    0   14   63 o   59.620   33.464   4.4160   4.6116   4.4160   4.6116   4.4160   4.6116   59.620   33.464   59.620   33.464 0.000000 0.000000 
1 1 1    0   15    2 o  904.747   13.977  627.471   19.345  627.471   19.345  627.471   19.345  904.747   13.977  904.747   13.977 0.000000 0.000000 
1 1 1    0   15    3 o  669.515   12.095  343.617   12.385  343.617   12.385  343.617   12.385  669.515   12.095  669.515   12.095 0.000000 0.000000 
1 1 1    0   15    4 o  784.313   12.913  471.521   15.492  471.521   15.492  471.521   15.492  784.313   12.913  784.313   12.913 0.000000 0.000000 
1 1 1    0   15    5 o  961.513   14.485  708.693   21.308  708.693   21.308  708.693   21.308  961.513   14.485  961.513   14.485 0.000000 0.000000 
1 1 1    0   15    6 o  306.720   11.537   72.347   5.3990   72.347   5.3990   72.347   5.3990  306.720   11.537  306.720   11.537 0.000000 0.000000 
1 1 1    0   15    7 o  777.545   12.992  463.427   15.452  463.427   15.452  463.427   15.452  777.545   12.992  777.545   12.992 0.000000 0.000000 
1 1 1    0   15    8 o  449.484   11.414  155.009   7.8415  155.009   7.8415  155.009   7.8415  449.484   11.414  449.484   11.414 0.000000 0.000000 
1 1 1    0   15   10 o  295.890   8.5749   67.193   3.8762   67.193   3.8762   67.193   3.8762  295.890   8.5749  295.890   8.5749 0.000000 0.000000 
1 1 1    0   15   11 o  164.841   11.690   21.119   2.9155   21.119   2.9155   21.119   2.9155  164.841   11.690  164.841   11.690 0.000000 0.000000 
1 1 1    0   15   12 o  1236.82   12.301  1171.74   23.282  1171.74   23.282  1171.74   23.282  1236.82   12.301  1236.82   12.301 0.000000 0.000000 
1 1 1    0   15   13 o  808.384   9.5430  500.493   11.804  500.493   11.804  500.493   11.804  808.384   9.5430  808.384   9.5430 0.000000 0.000000 
1 1 1    0   15   14 o  1134.53   11.629  985.828   20.190  985.828   20.190  985.828   20.190  1134.53   11.629  1134.53   11.629 0.000000 0.000000 
1 1 1    0   15   15 o  812.261   9.6517  505.290   11.996  505.290   11.996  505.290   11.996  812.261   9.6517  812.261   9.6517 0.000000 0.000000 
1 1 1    0   15   16 o   91.340   25.555   7.7197   3.0918   7.7197   3.0918   7.7197   3.0918   91.340   25.555   91.340   25.555 0.000000 0.000000 
1 1 1    0   15   17 o  297.086   12.941   67.961   5.8592   67.961   5.8592   67.961   5.8592  297.086   12.941  297.086   12.941 0.000000 0.000000 
1 1 1    0   15   18 o  104.778   30.278   10.268   4.2127   10.268   4.2127   10.268   4.2127  104.778   30.278  104.778   30.278 0.000000 0.000000 
1 1 1    0   15   19 o  144.331   16.838   16.594   3.5874   16.594   3.5874   16.594   3.5874  144.331   16.838  144.331   16.838 0.000000 0.000000 
1 1 1    0   15   20 o  592.693   9.2663  269.098   8.4017  269.098   8.4017  269.098   8.4017  592.693   9.2663  592.693   9.2663 0.000000 0.000000 
1 1 1    0   15   21 o  258.158   12.258   51.368   4.8186   51.368   4.8186   51.368   4.8186  258.158   12.258  258.158   12.258 0.000000 0.000000 
1 1 1    0   15   22 o   38.579   25.576  -1.0739   3.9841  -1.0739   3.9841  -1.0739   3.9841   38.579   25.576   38.579   25.576 0.000000 0.000000 
1 1 1    0   15   23 o   78.255   34.833   6.7768   4.4197   6.7768   4.4197   6.7768   4.4197   78.255   34.833   78.255   34.833 0.000000 0.000000 
1 1 1    0   15   24 o  1601.65   15.448  1965.08   37.863  1965.08   37.863  1965.08   37.863  1601.65   15.448  1601.65   15.448 0.000000 0.000000 
1 1 1    0   15   25 o  1041.14   9.4413  829.998   15.043  829.998   15.043  829.998   15.043  1041.14   9.4413  1041.14   9.4413 0.000000 0.000000 
1 1 1    0   15   26 o   42.867   27.088   0.5430   3.7980   0.5430   3.7980   0.5430   3.7980   42.867   27.088   42.867   27.088 0.000000 0.000000 
1 1 1    0   15   27 o  603.694   10.153  279.249   9.3761  279.249   9.3761  279.249   9.3761  603.694   10.153  603.694   10.153 0.000000 0.000000 
1 1 1    0   15   28 f  621.305   8.5043  295.668   8.0841  295.668   8.0841  295.668   8.0841  621.305   8.5043  621.305   8.5043 0.000000 0.000000 
1 1 1    0   15   29 o  620.260   11.916  294.918   11.304  294.918   11.304  294.918   11.304  620.260   11.916  620.260   11.916 0.000000 0.000000 
1 1 1    0   15   30 o  1948.85   18.464  2911.52   55.068  2911.52   55.068  2911.52   55.068  1948.85   18.464  1948.85   18.464 0.000000 0.000000 
1 1 1    0   15   31 o  374.344   10.439  107.548   5.9710  107.548   5.9710  107.548   5.9710  374.344   10.439  374.344   10.439 0.000000 0.000000 
1 1 1    0   15   32 o  469.198   14.008  169.090   10.039  169.090   10.039  169.090   10.039  469.198   14.008  469.198   14.008 0.000000 0.000000 
1 1 1    0   15   33 o  268.437   14.200   55.668   5.7973   55.668   5.7973   55.668   5.7973  268.437   14.200  268.437   14.200 0.000000 0.000000 
1 1 1    0   15   34 o  1289.93   11.336  1274.70   22.378  1274.70   22.378  1274.70   22.378  1289.93   11.336  1289.93   11.336 0.000000 0.000000 
1 1 1    0   15   35 o  198.231   17.124   30.800   5.1064   30.800   5.1064   30.800   5.1064  198.231   17.124  198.231   17.124 0.000000 0.000000 
1 1 1    0   15   36 o   75.893   35.998   6.5206   4.7544   6.5206   4.7544   6.5206   4.7544   75.893   35.998   75.893   35.998 0.000000 0.000000 
1 1 1    0   15   37 o  796.084   9.8374  485.661   11.983  485.661   11.983  485.661   11.983  796.084   9.8374  796.084   9.8374 0.000000 0.000000 
1 1 1    0   15   38 o  829.674   9.9159  527.565   12.588  527.565   12.588  527.565   12.588  829.674   9.9159  829.674   9.9159 0.000000 0.000000 
1 1 1    0   15   39 o  288.446   13.750   64.245   6.0392   64.245   6.0392   64.245   6.0392  288.446   13.750  288.446   13.750 0.000000 0.000000 
1 1 1    0   15   40 o   61.818   35.576   3.7645   5.3951   3.7645   5.3951   3.7645   5.3951   61.818   35.576   61.818   35.576 0.000000 0.000000 
1 1 1    0   15   41 o  396.179   13.292  120.832   8.0395  120.832   8.0395  120.832   8.0395  396.179   13.292  396.179   13.292 0.000000 0.000000 
1 1 1    0   15   42 o  473.542   16.553  172.993   11.965  172.993   11.965  172.993   11.965  473.542   16.553  473.542   16.553 0.000000 0.000000 
1 1 1    0   15   43 o  153.501   46.557   22.900   9.5466   22.900   9.5466   22.900   9.5466  153.501   46.557  153.501   46.557 0.000000 0.000000 
1 1 1    0   15   44 o  161.567   22.858   21.327   5.3265   21.327   5.3265   21.327   5.3265  161.567   22.858  161.567   22.858 0.000000 0.000000 
1 1 1    0   15   45 o  488.796   11.239  183.645   8.3985  183.645   8.3985  183.645   8.3985  488.796   11.239  488.796   11.239 0.000000 0.000000 
1 1 1    0   15   46 o   84.512   38.404   8.1649   5.3752   8.1649   5.3752   8.1649   5.3752   84.512   38.404   84.512   38.404 0.000000 0.000000 
1 1 1    0   15   47 o  307.013   10.610   72.613   4.9723   72.613   4.9723   72.613   4.9723  307.013   10.610  307.013   10.610 0.000000 0.000000 
1 1 1    0   15   48 o  453.301   11.592  158.193   8.0312  158.193   8.0312  158.193   8.0312  453.301   11.592  453.301   11.592 0.000000 0.000000 
1 1 1    0   15   49 o  249.253   16.373   48.557   6.1847   48.557   6.1847   48.557   6.1847  249.253   16.373  249.253   16.373 0.000000 0.000000 
1 1 1    0   15   50 f  276.665   11.126   59.110   4.6942   59.110   4.6942   59.110   4.6942  276.665   11.126  276.665   11.126 0.000000 0.000000 
1 1 1    0   15   51 o  200.669   15.034   31.583   4.5582   31.583   4.5582   31.583   4.5582  200.669   15.034  200.669   15.034 0.000000 0.000000 
1 1 1    0   15   52 o  158.060   18.078   20.089   4.2258   20.089   4.2258   20.089   4.2258  158.060   18.078  158.060   18.078 0.000000 0.000000 
1 1 1    0   15   53 o   72.137   33.731   6.0649   4.1590   6.0649   4.1590   6.0649   4.1590   72.137   33.731   72.137   33.731 0.000000 0.000000 
1 1 1    0   15   54 o  320.375   11.298   79.301   5.5248   79.301   5.5248   79.301   5.5248  320.375   11.298  320.375   11.298 0.000000 0.000000 
1 1 1    0   15   55 o   83.679   39.427   8.3692   5.6934   8.3692   5.6934   8.3692   5.6934   83.679   39.427   83.679   39.427 0.000000 0.000000 
1 1 1    0   15   56 o  313.371   11.868   76.047   5.6738   76.047   5.6738   76.047   5.6738  313.371   11.868  313.371   11.868 0.000000 0.000000 
1 1 1    0   15   57 o  146.178   22.571   17.913   4.6918   17.913   4.6918   17.913   4.6918  146.178   22.571  146.178   22.571 0.000000 0.000000 
1 1 1    0   15   58 f   39.635   26.835  -1.9616   4.8218  -1.9616   4.8218  -1.9616   4.8218   39.635   26.835   39.635   26.835 0.000000 0.000000 
1 1 1    0   15   59 o   36.961   25.396  -2.8283   4.6741  -2.8283   4.6741  -2.8283   4.6741   36.961   25.396   36.961   25.396 0.000000 0.000000 
1 1 1    0   15   60 o   79.017   41.749   8.1104   6.7495   8.1104   6.7495   8.1104   6.7495   79.017   41.749   79.017   41.749 0.000000 0.000000 
1 1 1    0   15   61 o   54.435   32.082   3.1963   4.5600   3.1963   4.5600   3.1963   4.5600   54.435   32.082   54.435   32.082 0.000000 0.000000 
1 1 1    0   15   62 o   52.279   31.404   2.7906   4.5274   2.7906   4.5274   2.7906   4.5274   52.279   31.404   52.279   31.404 0.000000 0.000000 
1 1 1    0   15   63 o  123.906   31.061   14.738   5.0956   14.738   5.0956   14.738   5.0956  123.906   31.061  123.906   31.061 0.000000 0.000000 
1 1 1    0   16    2 o  434.490   11.202  144.844   7.4384  144.844   7.4384  144.844   7.4384  434.490   11.202  434.490   11.202 0.000000 0.000000 
1 1 1    0   16    3 o  370.513   11.242  105.410   6.3623  105.410   6.3623  105.410   6.3623  370.513   11.242  370.513   11.242 0.000000 0.000000 
1 1 1    0   16    4 o  960.564   14.607  707.281   21.465  707.281   21.465  707.281   21.465  960.564   14.607  960.564   14.607 0.000000 0.000000 
1 1 1    0   16    5 o  958.334   14.580  703.987   21.376  703.987   21.376  703.987   21.376  958.334   14.580  958.334   14.580 0.000000 0.000000 
1 1 1    0   16    6 o  186.254   10.382   26.807   2.9387   26.807   2.9387   26.807   2.9387  186.254   10.382  186.254   10.382 0.000000 0.000000 
1 1 1    0   16    7 o  322.360   8.3988   79.713   4.1377   79.713   4.1377   79.713   4.1377  322.360   8.3988  322.360   8.3988 0.000000 0.000000 
1 1 1    0   16    8 o   73.796   25.321   5.4223   2.5709   5.4223   2.5709   5.4223   2.5709   73.796   25.321   73.796   25.321 0.000000 0.000000 
1 1 1    0   16    9 o  183.193   10.935   25.969   3.0412   25.969   3.0412   25.969   3.0412  183.193   10.935  183.193   10.935 0.000000 0.000000 
1 1 1    0   16   10 o  403.179   8.2558  124.591   5.0900  124.591   5.0900  124.591   5.0900  403.179   8.2558  403.179   8.2558 0.000000 0.000000 
1 1 1    0   16   11 o  893.458   10.088  611.371   13.792  611.371   13.792  611.371   13.792  893.458   10.088  893.458   10.088 0.000000 0.000000 
1 1 1    0   16   12 o  518.234   8.4447  205.749   6.6945  205.749   6.6945  205.749   6.6945  518.234   8.4447  518.234   8.4447 0.000000 0.000000 
1 1 1    0   16   13 o  231.710   10.122   41.337   3.5744   41.337   3.5744   41.337   3.5744  231.710   10.122  231.710   10.122 0.000000 0.000000 
1 1 1    0   16   14 o  972.015   10.614  723.570   15.787  723.570   15.787  723.570   15.787  972.015   10.614  972.015   10.614 0.000000 0.000000 
1 1 1    0   16   15 o  1451.51   13.986  1613.72   31.066  1613.72   31.066  1613.72   31.066  1451.51   13.986  1451.51   13.986 0.000000 0.000000 
1 1 1    0   16   16 f  544.345   12.140  227.196   10.104  227.196   10.104  227.196   10.104  544.345   12.140  544.345   12.140 0.000000 0.000000 
1 1 1    0   16   17 o  840.862   10.033  541.480   12.909  541.480   12.909  541.480   12.909  840.862   10.033  840.862   10.033 0.000000 0.000000 
1 1 1    0   16   18 f  638.540   9.2052  312.303   8.9926  312.303   8.9926  312.303   8.9926  638.540   9.2052  638.540   9.2052 0.000000 0.000000 
1 1 1    0   16   19 o  543.557   9.2521  226.358   7.6926  226.358   7.6926  226.358   7.6926  543.557   9.2521  543.557   9.2521 0.000000 0.000000 
1 1 1    0   16   20 o  2432.63   21.841  4535.30   81.310  4535.30   81.310  4535.30   81.310  2432.63   21.841  2432.63   21.841 0.000000 0.000000 
1 1 1    0   16   21 o  808.206   10.236  500.273   12.658  500.273   12.658  500.273   12.658  808.206   10.236  808.206   10.236 0.000000 0.000000 
1 1 1    0   16   22 o  559.524   9.8356  239.878   8.4176  239.878   8.4176  239.878   8.4176  559.524   9.8356  559.524   9.8356 0.000000 0.000000 
1 1 1    0   16   23 o  1053.09   11.715  849.381   18.878  849.381   18.878  849.381   18.878  1053.09   11.715  1053.09   11.715 0.000000 0.000000 
1 1 1    0   16   24 o   95.002   36.467   9.4225   5.0142   9.4225   5.0142   9.4225   5.0142   95.002   36.467   95.002   36.467 0.000000 0.000000 
1 1 1    0   16   25 o   77.389   43.170   6.2446   7.6166   6.2446   7.6166   6.2446   7.6166   77.389   43.170   77.389   43.170 0.000000 0.000000 
1 1 1    0   16   27 o  443.426   9.0460  150.713   6.1339  150.713   6.1339  150.713   6.1339  443.426   9.0460  443.426   9.0460 0.000000 0.000000 
1 1 1    0   16   28 o  489.859   12.164  184.089   9.1079  184.089   9.1079  184.089   9.1079  489.859   12.164  489.859   12.164 0.000000 0.000000 
1 1 1    0   16   29 o  289.403   11.222   64.420   4.9541   64.420   4.9541   64.420   4.9541  289.403   11.222  289.403   11.222 0.000000 0.000000 
1 1 1    0   16   30 o  745.324   9.1302  425.484   10.412  425.484   10.412  425.484   10.412  745.324   9.1302  745.324   9.1302 0.000000 0.000000 
1 1 1    0   16   31 o  779.690   9.3763  465.643   11.186  465.643   11.186  465.643   11.186  779.690   9.3763  779.690   9.3763 0.000000 0.000000 
1 1 1    0   16   32 o  188.061   18.160   27.861   5.1155   27.861   5.1155   27.861   5.1155  188.061   18.160  188.061   18.160 0.000000 0.000000 
1 1 1    0   16   33 o  741.736   9.3903  421.475   10.657  421.475   10.657  421.475   10.657  741.736   9.3903  741.736   9.3903 0.000000 0.000000 
1 1 1    0   16   34 o  935.345   9.8346  670.206   14.076  670.206   14.076  670.206   14.076  935.345   9.8346  935.345   9.8346 0.000000 0.000000 
1 1 1    0   16   35 f  800.682   9.6345  491.198   11.804  491.198   11.804  491.198   11.804  800.682   9.6345  800.682   9.6345 0.000000 0.000000 
1 1 1    0   16   36 o  194.055   17.797   29.617   5.1839   29.617   5.1839   29.617   5.1839  194.055   17.797  194.055   17.797 0.000000 0.000000 
1 1 1    0   16   37 o   44.463   28.659   0.0070   4.5128   0.0070   4.5128   0.0070   4.5128   44.463   28.659   44.463   28.659 0.000000 0.000000 
1 1 1    0   16   38 o  222.460   16.140   38.576   5.4292   38.576   5.4292   38.576   5.4292  222.460   16.140  222.460   16.140 0.000000 0.000000 
1 1 1    0   16   39 o  251.506   26.225   50.368   9.8444   50.368   9.8444   50.368   9.8444  251.506   26.225  251.506   26.225 0.000000 0.000000 
1 1 1    0   16   40 o  361.520   13.324  100.678   7.3500  100.678   7.3500  100.678   7.3500  361.520   13.324  361.520   13.324 0.000000 0.000000 
1 1 1    0   16   41 o  239.885   27.136   46.175   9.6350   46.175   9.6350   46.175   9.6350  239.885   27.136  239.885   27.136 0.000000 0.000000 
1 1 1    0   16   42 o  137.490   48.557   19.497   9.2864   19.497   9.2864   19.497   9.2864  137.490   48.557  137.490   48.557 0.000000 0.000000 
1 1 1    0   16   43 o  466.672   11.158  167.351   7.9596  167.351   7.9596  167.351   7.9596  466.672   11.158  466.672   11.158 0.000000 0.000000 
1 1 1    0   16   44 o  175.223   21.178   24.714   5.4596   24.714   5.4596   24.714   5.4596  175.223   21.178  175.223   21.178 0.000000 0.000000 
1 1 1    0   16   45 o   88.803   39.023   8.9029   5.5496   8.9029   5.5496   8.9029   5.5496   88.803   39.023   88.803   39.023 0.000000 0.000000 
1 1 1    0   16   46 o   93.176   36.414   9.3179   4.9635   9.3179   4.9635   9.3179   4.9635   93.176   36.414   93.176   36.414 0.000000 0.000000 
1 1 1    0   16   47 o   41.614   27.725  -1.3400   4.7796  -1.3400   4.7796  -1.3400   4.7796   41.614   27.725   41.614   27.725 0.000000 0.000000 
1 1 1    0   16   48 o   61.672   34.826   4.0790   5.0354   4.0790   5.0354   4.0790   5.0354   61.672   34.826   61.672   34.826 0.000000 0.000000 
1 1 1    0   16   49 o  187.041   21.663   28.221   5.9851   28.221   5.9851   28.221   5.9851  187.041   21.663  187.041   21.663 0.000000 0.000000 
1 1 1    0   16   50 o  258.518   16.097   52.200   6.3130   52.200   6.3130   52.200   6.3130  258.518   16.097  258.518   16.097 0.000000 0.000000 
1 1 1    0   16   51 o  225.661   18.341   40.223   6.2389   40.223   6.2389   40.223   6.2389  225.661   18.341  225.661   18.341 0.000000 0.000000 
1 1 1    0   16   52 o   48.223   31.588  -0.4520   5.8008  -0.4520   5.8008  -0.4520   5.8008   48.223   31.588   48.223   31.588 0.000000 0.000000 
1 1 1    0   16   53 o  206.838   19.628   34.149   6.0854   34.149   6.0854   34.149   6.0854  206.838   19.628  206.838   19.628 0.000000 0.000000 
1 1 1    0   16   54 o  134.160   23.081   15.227   4.3186   15.227   4.3186   15.227   4.3186  134.160   23.081  134.160   23.081 0.000000 0.000000 
1 1 1    0   16   55 f   51.355   32.028   1.6243   5.1248   1.6243   5.1248   1.6243   5.1248   51.355   32.028   51.355   32.028 0.000000 0.000000 
1 1 1    0   16   56 o   38.367   25.792  -1.4929   4.3055  -1.4929   4.3055  -1.4929   4.3055   38.367   25.792   38.367   25.792 0.000000 0.000000 
1 1 1    0   16   57 o  175.581   19.672   25.010   5.1166   25.010   5.1166   25.010   5.1166  175.581   19.672  175.581   19.672 0.000000 0.000000 
1 1 1    0   16   58 o  231.016   20.596   42.979   7.1495   42.979   7.1495   42.979   7.1495  231.016   20.596  231.016   20.596 0.000000 0.000000 
1 1 1    0   16   59 o  193.814   17.894   30.157   5.2043   30.157   5.2043   30.157   5.2043  193.814   17.894  193.814   17.894 0.000000 0.000000 
1 1 1    0   16   60 o  231.562   20.217   43.395   7.0400   43.395   7.0400   43.395   7.0400  231.562   20.217  231.562   20.217 0.000000 0.000000 
1 1 1    0   16   61 o  280.419   15.398   62.134   6.5634   62.134   6.5634   62.134   6.5634  280.419   15.398  280.419   15.398 0.000000 0.000000 
1 1 1    0   16   62 o   46.949   29.537   1.4851   4.4609   1.4851   4.4609   1.4851   4.4609   46.949   29.537   46.949   29.537 0.000000 0.000000 
1 1 1    0   17    2 o  431.910   11.622  143.150   7.6705  143.150   7.6705  143.150   7.6705  431.910   11.622  431.910   11.622 0.000000 0.000000 
1 1 1    0   17    3 o  310.547   12.235   74.192   5.7954   74.192   5.7954   74.192   5.7954  310.547   12.235  310.547   12.235 0.000000 0.000000 
1 1 1    0   17    4 o  483.713   11.789  179.479   8.7167  179.479   8.7167  179.479   8.7167  483.713   11.789  483.713   11.789 0.000000 0.000000 
1 1 1    0   17    5 o  328.279   12.016   82.850   6.0193   82.850   6.0193   82.850   6.0193  328.279   12.016  328.279   12.016 0.000000 0.000000 
1 1 1    0   17    6 o  1090.67   15.953  911.795   26.618  911.795   26.618  911.795   26.618  1090.67   15.953  1090.67   15.953 0.000000 0.000000 
1 1 1    0   17    7 f  1097.60   11.359  922.703   19.078  922.703   19.078  922.703   19.078  1097.60   11.359  1097.60   11.359 0.000000 0.000000 
1 1 1    0   17    8 o  240.725   10.040   44.595   3.6848   44.595   3.6848   44.595   3.6848  240.725   10.040  240.725   10.040 0.000000 0.000000 
1 1 1    0   17    9 o  744.227   9.2738  424.201   10.560  424.201   10.560  424.201   10.560  744.227   9.2738  744.227   9.2738 0.000000 0.000000 
1 1 1    0   17   10 o  473.513   8.3896  171.793   6.0763  171.793   6.0763  171.793   6.0763  473.513   8.3896  473.513   8.3896 0.000000 0.000000 
1 1 1    0   17   11 o  701.624   9.1033  377.026   9.7725  377.026   9.7725  377.026   9.7725  701.624   9.1033  701.624   9.1033 0.000000 0.000000 
1 1 1    0   17   12 o  380.232   8.7160  110.844   5.0666  110.844   5.0666  110.844   5.0666  380.232   8.7160  380.232   8.7160 0.000000 0.000000 
1 1 1    0   17   13 o   79.253   27.763   6.3050   3.0509   6.3050   3.0509   6.3050   3.0509   79.253   27.763   79.253   27.763 0.000000 0.000000 
1 1 1    0   17   14 o  1038.37   15.633  826.243   24.834  826.243   24.834  826.243   24.834  1038.37   15.633  1038.37   15.633 0.000000 0.000000 
1 1 1    0   17   15 f  1326.42   13.151  1347.44   26.695  1347.44   26.695  1347.44   26.695  1326.42   13.151  1326.42   13.151 0.000000 0.000000 
1 1 1    0   17   16 o  450.236   8.9740  155.354   6.1788  155.354   6.1788  155.354   6.1788  450.236   8.9740  450.236   8.9740 0.000000 0.000000 
1 1 1    0   17   17 o  643.777   9.3175  317.448   9.1770  317.448   9.1770  317.448   9.1770  643.777   9.3175  643.777   9.3175 0.000000 0.000000 
1 1 1    0   17   18 o  1307.28   13.097  1308.84   26.200  1308.84   26.200  1308.84   26.200  1307.28   13.097  1307.28   13.097 0.000000 0.000000 
1 1 1    0   17   19 f  1261.26   12.837  1218.33   24.776  1218.33   24.776  1218.33   24.776  1261.26   12.837  1261.26   12.837 0.000000 0.000000 
1 1 1    0   17   20 o  571.390   9.6091  250.136   8.3986  250.136   8.3986  250.136   8.3986  571.390   9.6091  571.390   9.6091 0.000000 0.000000 
1 1 1    0   17   21 o  289.736   12.250   64.615   5.4105   64.615   5.4105   64.615   5.4105  289.736   12.250  289.736   12.250 0.000000 0.000000 
1 1 1    0   17   22 o  556.069   9.9351  236.938   8.4500  236.938   8.4500  236.938   8.4500  556.069   9.9351  556.069   9.9351 0.000000 0.000000 
1 1 1    0   17   23 o  1370.89   13.816  1439.54   28.983  1439.54   28.983  1439.54   28.983  1370.89   13.816  1370.89   13.816 0.000000 0.000000 
1 1 1    0   17   24 o  193.295   31.620   30.870   8.6033   30.870   8.6033   30.870   8.6033  193.295   31.620  193.295   31.620 0.000000 0.000000 
1 1 1    0   17   25 f  147.354   27.058   18.237   5.4954   18.237   5.4954   18.237   5.4954  147.354   27.058  147.354   27.058 0.000000 0.000000 
1 1 1    0   17   26 o  501.724   11.398  193.038   8.7428  193.038   8.7428  193.038   8.7428  501.724   11.398  501.724   11.398 0.000000 0.000000 
1 1 1    0   17   27 o  420.256   12.817  135.627   8.2272  135.627   8.2272  135.627   8.2272  420.256   12.817  420.256   12.817 0.000000 0.000000 
1 1 1    0   17   28 o  882.682   9.2837  596.684   12.540  596.684   12.540  596.684   12.540  882.682   9.2837  882.682   9.2837 0.000000 0.000000 
1 1 1    0   17   29 o  787.130   9.1449  474.533   11.015  474.533   11.015  474.533   11.015  787.130   9.1449  787.130   9.1449 0.000000 0.000000 
1 1 1    0   17   30 o  170.471   17.016   22.927   4.3386   22.927   4.3386   22.927   4.3386  170.471   17.016  170.471   17.016 0.000000 0.000000 
1 1 1    0   17   31 o  862.674   11.002  570.188   14.521  570.188   14.521  570.188   14.521  862.674   11.002  862.674   11.002 0.000000 0.000000 
1 1 1    0   17   32 o  194.496   16.177   29.590   4.7393   29.590   4.7393   29.590   4.7393  194.496   16.177  194.496   16.177 0.000000 0.000000 
1 1 1    0   17   33 o   42.511   27.464  -0.0995   4.1767  -0.0995   4.1767  -0.0995   4.1767   42.511   27.464   42.511   27.464 0.000000 0.000000 
1 1 1    0   17   34 o  619.413   9.4345  294.031   8.9401  294.031   8.9401  294.031   8.9401  619.413   9.4345  619.413   9.4345 0.000000 0.000000 
1 1 1    0   17   35 o  581.014   9.4896  258.758   8.4342  258.758   8.4342  258.758   8.4342  581.014   9.4896  581.014   9.4896 0.000000 0.000000 
1 1 1    0   17   36 o   38.456   25.928  -1.9762   4.4119  -1.9762   4.4119  -1.9762   4.4119   38.456   25.928   38.456   25.928 0.000000 0.000000 
1 1 1    0   17   37 o  101.120   32.859   10.025   4.4993   10.025   4.4993   10.025   4.4993  101.120   32.859  101.120   32.859 0.000000 0.000000 
1 1 1    0   17   38 o  153.692   21.467   19.198   4.7680   19.198   4.7680   19.198   4.7680  153.692   21.467  153.692   21.467 0.000000 0.000000 
1 1 1    0   17   39 o  470.133   25.577  172.138   18.281  172.138   18.281  172.138   18.281  470.133   25.577  470.133   25.577 0.000000 0.000000 
1 1 1    0   17   40 o  717.632   13.801  395.695   15.147  395.695   15.147  395.695   15.147  717.632   13.801  717.632   13.801 0.000000 0.000000 
1 1 1    0   17   41 o   33.599   24.693 -24.1355   8.6715 -24.1355   8.6715 -24.1355   8.6715   33.599   24.693   33.599   24.693 0.000000 0.000000 
1 1 1    0   17   42 o   69.824   42.794   3.4603   8.7733   3.4603   8.7733   3.4603   8.7733   69.824   42.794   69.824   42.794 0.000000 0.000000 
1 1 1    0   17   43 o  100.398   35.347   10.287   4.9304   10.287   4.9304   10.287   4.9304  100.398   35.347  100.398   35.347 0.000000 0.000000 
1 1 1    0   17   44 o  104.060   35.639   10.949   5.0996   10.949   5.0996   10.949   5.0996  104.060   35.639  104.060   35.639 0.000000 0.000000 
1 1 1    0   17   45 o   41.957   28.146  -1.8230   5.0753  -1.8230   5.0753  -1.8230   5.0753   41.957   28.146   41.957   28.146 0.000000 0.000000 
1 1 1    0   17   46 o  565.512   10.601  245.766   9.1686  245.766   9.1686  245.766   9.1686  565.512   10.601  565.512   10.601 0.000000 0.000000 
1 1 1    0   17   47 o  327.730   13.268   83.033   6.6309   83.033   6.6309   83.033   6.6309  327.730   13.268  327.730   13.268 0.000000 0.000000 
1 1 1    0   17   48 o   48.818   30.733   1.0465   4.8379   1.0465   4.8379   1.0465   4.8379   48.818   30.733   48.818   30.733 0.000000 0.000000 
1 1 1    0   17   49 o   55.541   33.262   2.6842   5.0481   2.6842   5.0481   2.6842   5.0481   55.541   33.262   55.541   33.262 0.000000 0.000000 
1 1 1    0   17   50 o  297.240   15.204   68.713   6.8758   68.713   6.8758   68.713   6.8758  297.240   15.204  297.240   15.204 0.000000 0.000000 
1 1 1    0   17   51 o  119.504   37.085   14.120   5.9411   14.120   5.9411   14.120   5.9411  119.504   37.085  119.504   37.085 0.000000 0.000000 
1 1 1    0   17   52 f  370.639   22.852  108.618   12.851  108.618   12.851  108.618   12.851  370.639   22.852  370.639   22.852 0.000000 0.000000 
1 1 1    0   17   53 o   81.738   38.955   7.9630   5.5743   7.9630   5.5743   7.9630   5.5743   81.738   38.955   81.738   38.955 0.000000 0.000000 
1 1 1    0   17   54 o   84.152   50.281   7.7184   11.482   7.7184   11.482   7.7184   11.482   84.152   50.281   84.152   50.281 0.000000 0.000000 
1 1 1    0   17   55 o   82.570   40.508   8.3234   6.0842   8.3234   6.0842   8.3234   6.0842   82.570   40.508   82.570   40.508 0.000000 0.000000 
1 1 1    0   17   56 o  244.327   21.147   47.884   7.7720   47.884   7.7720   47.884   7.7720  244.327   21.147  244.327   21.147 0.000000 0.000000 
1 1 1    0   17   57 o   58.699   35.844   3.0354   6.1047   3.0354   6.1047   3.0354   6.1047   58.699   35.844   58.699   35.844 0.000000 0.000000 
1 1 1    0   17   58 o   53.734   34.724   0.8279   6.6826   0.8279   6.6826   0.8279   6.6826   53.734   34.724   53.734   34.724 0.000000 0.000000 
1 1 1    0   17   59 o  304.363   24.098   75.488   11.065   75.488   11.065   75.488   11.065  304.363   24.098  304.363   24.098 0.000000 0.000000 
1 1 1    0   17   60 o   53.004   34.062   1.2976   6.3136   1.2976   6.3136   1.2976   6.3136   53.004   34.062   53.004   34.062 0.000000 0.000000 
1 1 1    0   17   61 o   92.637   35.250   9.6642   4.7019   9.6642   4.7019   9.6642   4.7019   92.637   35.250   92.637   35.250 0.000000 0.000000 
1 1 1    0   17   62 o  114.013   31.768   12.862   4.7961   12.862   4.7961   12.862   4.7961  114.013   31.768  114.013   31.768 0.000000 0.000000 
1 1 1    0   18    2 o  1275.94   17.945  1247.98   35.031  1247.98   35.031  1247.98   35.031  1275.94   17.945  1275.94   17.945 0.000000 0.000000 
1 1 1    0   18    3 o  689.513   12.801  364.417   13.499  364.417   13.499  364.417   13.499  689.513   12.801  689.513   12.801 0.000000 0.000000 
1 1 1    0   18    4 f  1059.02   15.806  859.560   25.608  859.560   25.608  859.560   25.608  1059.02   15.806  1059.02   15.806 0.000000 0.000000 
1 1 1    0   18    5 o  306.986   12.657   72.526   5.9243   72.526   5.9243   72.526   5.9243  306.986   12.657  306.986   12.657 0.000000 0.000000 
1 1 1    0   18    6 o  754.032   13.211  435.757   15.236  435.757   15.236  435.757   15.236  754.032   13.211  754.032   13.211 0.000000 0.000000 
1 1 1    0   18    7 o  2083.57   18.903  3326.69   60.272  3326.69   60.272  3326.69   60.272  2083.57   18.903  2083.57   18.903 0.000000 0.000000 
1 1 1    0   18    8 o  654.022   8.9171  327.614   8.9229  327.614   8.9229  327.614   8.9229  654.022   8.9171  654.022   8.9171 0.000000 0.000000 
1 1 1    0   18    9 o  1152.03   11.807  1016.40   20.816  1016.40   20.816  1016.40   20.816  1152.03   11.807  1152.03   11.807 0.000000 0.000000 
1 1 1    0   18   10 o  269.014   9.6586   55.612   3.9654   55.612   3.9654   55.612   3.9654  269.014   9.6586  269.014   9.6586 0.000000 0.000000 
1 1 1    0   18   11 f  671.311   12.686  345.405   13.024  345.405   13.024  345.405   13.024  671.311   12.686  671.311   12.686 0.000000 0.000000 
1 1 1    0   18   12 o  1904.38   24.731  2781.12   72.061  2781.12   72.061  2781.12   72.061  1904.38   24.731  1904.38   24.731 0.000000 0.000000 
1 1 1    0   18   13 o  1023.39   11.082  802.056   17.354  802.056   17.354  802.056   17.354  1023.39   11.082  1023.39   11.082 0.000000 0.000000 
1 1 1    0   18   14 o  1144.43   11.898  1003.01   20.836  1003.01   20.836  1003.01   20.836  1144.43   11.898  1144.43   11.898 0.000000 0.000000 
1 1 1    0   18   15 o  854.407   10.171  559.062   13.297  559.062   13.297  559.062   13.297  854.407   10.171  854.407   10.171 0.000000 0.000000 
1 1 1    0   18   16 f  1081.66   11.571  896.004   19.152  896.004   19.152  896.004   19.152  1081.66   11.571  1081.66   11.571 0.000000 0.000000 
1 1 1    0   18   17 o  1225.81   12.562  1150.78   23.564  1150.78   23.564  1150.78   23.564  1225.81   12.562  1225.81   12.562 0.000000 0.000000 
1 1 1    0   18   18 o  636.185   9.5607  310.028   9.3052  310.028   9.3052  310.028   9.3052  636.185   9.5607  636.185   9.5607 0.000000 0.000000 
1 1 1    0   18   19 o  1127.45   12.021  973.526   20.739  973.526   20.739  973.526   20.739  1127.45   12.021  1127.45   12.021 0.000000 0.000000 
1 1 1    0   18   20 o  795.224   10.300  484.356   12.532  484.356   12.532  484.356   12.532  795.224   10.300  795.224   10.300 0.000000 0.000000 
1 1 1    0   18   22 o  1350.42   13.818  1396.91   28.556  1396.91   28.556  1396.91   28.556  1350.42   13.818  1350.42   13.818 0.000000 0.000000 
1 1 1    0   18   23 o  841.958   15.672  543.519   20.182  543.519   20.182  543.519   20.182  841.958   15.672  841.958   15.672 0.000000 0.000000 
1 1 1    0   18   24 o  461.353   11.155  163.249   7.8671  163.249   7.8671  163.249   7.8671  461.353   11.155  461.353   11.155 0.000000 0.000000 
1 1 1    0   18   25 o  759.246   10.998  441.639   12.774  441.639   12.774  441.639   12.774  759.246   10.998  759.246   10.998 0.000000 0.000000 
1 1 1    0   18   26 o  396.228   12.823  120.604   7.7582  120.604   7.7582  120.604   7.7582  396.228   12.823  396.228   12.823 0.000000 0.000000 
1 1 1    0   18   27 o  1158.80   12.948  1028.76   22.960  1028.76   22.960  1028.76   22.960  1158.80   12.948  1158.80   12.948 0.000000 0.000000 
1 1 1    0   18   28 o  459.087   13.051  161.809   9.1541  161.809   9.1541  161.809   9.1541  459.087   13.051  459.087   13.051 0.000000 0.000000 
1 1 1    0   18   29 o  280.652   11.675   60.632   4.9957   60.632   4.9957   60.632   4.9957  280.652   11.675  280.652   11.675 0.000000 0.000000 
1 1 1    0   18   30 o  1032.34   11.808  816.527   18.652  816.527   18.652  816.527   18.652  1032.34   11.808  1032.34   11.808 0.000000 0.000000 
1 1 1    0   18   31 o   51.784   30.663   2.2810   4.2003   2.2810   4.2003   2.2810   4.2003   51.784   30.663   51.784   30.663 0.000000 0.000000 
1 1 1    0   18   32 o   82.114   32.812   7.1752   3.9969   7.1752   3.9969   7.1752   3.9969   82.114   32.812   82.114   32.812 0.000000 0.000000 
1 1 1    0   18   33 o  218.320   14.956   37.048   4.9439   37.048   4.9439   37.048   4.9439  218.320   14.956  218.320   14.956 0.000000 0.000000 
1 1 1    0   18   34 f   95.336   32.766   9.0924   4.3001   9.0924   4.3001   9.0924   4.3001   95.336   32.766   95.336   32.766 0.000000 0.000000 
1 1 1    0   18   35 o  198.094   16.767   30.750   5.0002   30.750   5.0002   30.750   5.0002  198.094   16.767  198.094   16.767 0.000000 0.000000 
1 1 1    0   18   36 f  511.724   9.6671  200.821   7.5658  200.821   7.5658  200.821   7.5658  511.724   9.6671  511.724   9.6671 0.000000 0.000000 
1 1 1    0   18   37 o  182.985   18.188   26.474   4.9786   26.474   4.9786   26.474   4.9786  182.985   18.188  182.985   18.188 0.000000 0.000000 
1 1 1    0   18   38 o  223.018   47.187   43.670   14.169   43.670   14.169   43.670   14.169  223.018   47.187  223.018   47.187 0.000000 0.000000 
1 1 1    0   18   39 o  263.468   14.476   53.765   5.7976   53.765   5.7976   53.765   5.7976  263.468   14.476  263.468   14.476 0.000000 0.000000 
1 1 1    0   18   40 o   44.253   28.190   0.4303   4.2096   0.4303   4.2096   0.4303   4.2096   44.253   28.190   44.253   28.190 0.000000 0.000000 
1 1 1    0   18   41 o   72.707   43.269   4.7176   8.4378   4.7176   8.4378   4.7176   8.4378   72.707   43.269   72.707   43.269 0.000000 0.000000 
1 1 1    0   18   42 o  200.672   16.357   31.587   4.9474   31.587   4.9474   31.587   4.9474  200.672   16.357  200.672   16.357 0.000000 0.000000 
1 1 1    0   18   43 o  153.920   22.155   19.397   4.9056   19.397   4.9056   19.397   4.9056  153.920   22.155  153.920   22.155 0.000000 0.000000 
1 1 1    0   18   44 o  147.276   24.020   18.064   4.9823   18.064   4.9823   18.064   4.9823  147.276   24.020  147.276   24.020 0.000000 0.000000 
1 1 1    0   18   45 o   39.577   26.502  -1.5271   4.4649  -1.5271   4.4649  -1.5271   4.4649   39.577   26.502   39.577   26.502 0.000000 0.000000 
1 1 1    0   18   46 o  204.779   17.595   33.077   5.4212   33.077   5.4212   33.077   5.4212  204.779   17.595  204.779   17.595 0.000000 0.000000 
1 1 1    0   18   47 o   50.414   31.544   1.3043   5.0117   1.3043   5.0117   1.3043   5.0117   50.414   31.544   50.414   31.544 0.000000 0.000000 
1 1 1    0   18   48 o   66.134   35.289   5.0445   4.8617   5.0445   4.8617   5.0445   4.8617   66.134   35.289   66.134   35.289 0.000000 0.000000 
1 1 1    0   18   49 o  129.944   30.925   15.248   5.3381   15.248   5.3381   15.248   5.3381  129.944   30.925  129.944   30.925 0.000000 0.000000 
1 1 1    0   18   50 o  239.779   17.829   45.247   6.4604   45.247   6.4604   45.247   6.4604  239.779   17.829  239.779   17.829 0.000000 0.000000 
1 1 1    0   18   51 o   45.383   29.951  -0.8332   5.3660  -0.8332   5.3660  -0.8332   5.3660   45.383   29.951   45.383   29.951 0.000000 0.000000 
1 1 1    0   18   52 o  246.778   16.751   47.811   6.2604   47.811   6.2604   47.811   6.2604  246.778   16.751  246.778   16.751 0.000000 0.000000 
1 1 1    0   18   53 o   53.208   37.271 -10.0081   11.407 -10.0081   11.407 -10.0081   11.407   53.208   37.271   53.208   37.271 0.000000 0.000000 
1 1 1    0   18   54 o   68.788   39.118   5.3657   6.4125   5.3657   6.4125   5.3657   6.4125   68.788   39.118   68.788   39.118 0.000000 0.000000 
1 1 1    0   18   55 o  116.496   39.935   14.247   6.3990   14.247   6.3990   14.247   6.3990  116.496   39.935  116.496   39.935 0.000000 0.000000 
1 1 1    0   18   56 o  121.340   41.591   15.628   6.9413   15.628   6.9413   15.628   6.9413  121.340   41.591  121.340   41.591 0.000000 0.000000 
1 1 1    0   18   57 o   94.839   40.506   10.602   5.9957   10.602   5.9957   10.602   5.9957   94.839   40.506   94.839   40.506 0.000000 0.000000 
1 1 1    0   18   58 o  199.830   22.182   32.756   6.5709   32.756   6.5709   32.756   6.5709  199.830   22.182  199.830   22.182 0.000000 0.000000 
1 1 1    0   18   59 o  206.814   22.085   35.164   6.7901   35.164   6.7901   35.164   6.7901  206.814   22.085  206.814   22.085 0.000000 0.000000 
1 1 1    0   18   60 o  255.328   24.336   54.059   9.3122   54.059   9.3122   54.059   9.3122  255.328   24.336  255.328   24.336 0.000000 0.000000 
1 1 1    0   18   61 o   48.604   31.666   0.5757   5.7134   0.5757   5.7134   0.5757   5.7134   48.604   31.666   48.604   31.666 0.000000 0.000000 
1 1 1    0   19    2 o  1287.54   18.070  1270.56   35.595  1270.56   35.595  1270.56   35.595  1287.54   18.070  1287.54   18.070 0.000000 0.000000 
1 1 1    0   19    3 o  498.739   12.071  190.773   9.2029  190.773   9.2029  190.773   9.2029  498.739   12.071  498.739   12.071 0.000000 0.000000 
1 1 1    0   19    4 o  220.203   14.885   37.637   4.9644   37.637   4.9644   37.637   4.9644  220.203   14.885  220.203   14.885 0.000000 0.000000 
1 1 1    0   19    5 o   70.004   33.049   5.5077   4.0023   5.5077   4.0023   5.5077   4.0023   70.004   33.049   70.004   33.049 0.000000 0.000000 
1 1 1    0   19    6 o  320.447   13.320   79.029   6.5074   79.029   6.5074   79.029   6.5074  320.447   13.320  320.447   13.320 0.000000 0.000000 
1 1 1    0   19    8 o  811.950   13.779  505.214   17.113  505.214   17.113  505.214   17.113  811.950   13.779  811.950   13.779 0.000000 0.000000 
1 1 1    0   19    9 o  1810.69   23.723  2513.83   65.722  2513.83   65.722  2513.83   65.722  1810.69   23.723  1810.69   23.723 0.000000 0.000000 
1 1 1    0   19   10 o  1105.21   11.603  935.434   19.624  935.434   19.624  935.434   19.624  1105.21   11.603  1105.21   11.603 0.000000 0.000000 
1 1 1    0   19   11 o  1300.05   12.950  1294.37   25.763  1294.37   25.763  1294.37   25.763  1300.05   12.950  1300.05   12.950 0.000000 0.000000 
1 1 1    0   19   12 o  849.401   10.103  552.526   13.131  552.526   13.131  552.526   13.131  849.401   10.103  849.401   10.103 0.000000 0.000000 
1 1 1    0   19   13 o  170.924   14.563   22.853   3.7462   22.853   3.7462   22.853   3.7462  170.924   14.563  170.924   14.563 0.000000 0.000000 
1 1 1    0   19   14 o  415.503   9.5299  132.363   6.0536  132.363   6.0536  132.363   6.0536  415.503   9.5299  415.503   9.5299 0.000000 0.000000 
1 1 1    0   19   15 o  1426.93   14.019  1559.48   30.612  1559.48   30.612  1559.48   30.612  1426.93   14.019  1426.93   14.019 0.000000 0.000000 
1 1 1    0   19   16 o  901.527   10.592  622.443   14.611  622.443   14.611  622.443   14.611  901.527   10.592  901.527   10.592 0.000000 0.000000 
1 1 1    0   19   17 o  183.076   15.502   26.214   4.2724   26.214   4.2724   26.214   4.2724  183.076   15.502  183.076   15.502 0.000000 0.000000 
1 1 1    0   19   18 f  254.448   12.627   49.936   4.8903   49.936   4.8903   49.936   4.8903  254.448   12.627  254.448   12.627 0.000000 0.000000 
1 1 1    0   19   19 o  1530.58   14.823  1794.52   34.718  1794.52   34.718  1794.52   34.718  1530.58   14.823  1530.58   14.823 0.000000 0.000000 
1 1 1    0   19   20 o  646.391   9.9845  320.088   9.8732  320.088   9.8732  320.088   9.8732  646.391   9.9845  646.391   9.9845 0.000000 0.000000 
1 1 1    0   19   21 f  1116.32   17.252  955.276   29.462  955.276   29.462  955.276   29.462  1116.32   17.252  1116.32   17.252 0.000000 0.000000 
1 1 1    0   19   22 o  886.839   11.275  602.452   15.300  602.452   15.300  602.452   15.300  886.839   11.275  886.839   11.275 0.000000 0.000000 
1 1 1    0   19   23 o  622.394   10.557  296.833   10.050  296.833   10.050  296.833   10.050  622.394   10.557  622.394   10.557 0.000000 0.000000 
1 1 1    0   19   24 o  844.192   11.130  545.942   14.376  545.942   14.376  545.942   14.376  844.192   11.130  844.192   11.130 0.000000 0.000000 
1 1 1    0   19   25 o  156.572   29.090   20.643   6.2647   20.643   6.2647   20.643   6.2647  156.572   29.090  156.572   29.090 0.000000 0.000000 
1 1 1    0   19   26 o   74.984   39.535   6.2569   6.0432   6.2569   6.0432   6.2569   6.0432   74.984   39.535   74.984   39.535 0.000000 0.000000 
1 1 1    0   19   27 o  797.094   11.726  486.862   14.300  486.862   14.300  486.862   14.300  797.094   11.726  797.094   11.726 0.000000 0.000000 
1 1 1    0   19   28 o  539.532   12.191  223.280   10.056  223.280   10.056  223.280   10.056  539.532   12.191  539.532   12.191 0.000000 0.000000 
1 1 1    0   19   29 o  100.645   49.929   11.548   9.2857   11.548   9.2857   11.548   9.2857  100.645   49.929  100.645   49.929 0.000000 0.000000 
1 1 1    0   19   30 o  194.331   15.341   29.478   4.4976   29.478   4.4976   29.478   4.4976  194.331   15.341  194.331   15.341 0.000000 0.000000 
1 1 1    0   19   31 o  824.050   9.3983  520.202   11.851  520.202   11.851  520.202   11.851  824.050   9.3983  824.050   9.3983 0.000000 0.000000 
1 1 1    0   19   32 o  277.977   12.172   59.542   5.1563   59.542   5.1563   59.542   5.1563  277.977   12.172  277.977   12.172 0.000000 0.000000 
1 1 1    0   19   33 o   64.142   32.760   4.6533   4.0592   4.6533   4.0592   4.6533   4.0592   64.142   32.760   64.142   32.760 0.000000 0.000000 
1 1 1    0   19   34 f   26.949   19.372  -6.6355   3.8780  -6.6355   3.8780  -6.6355   3.8780   26.949   19.372   26.949   19.372 0.000000 0.000000 
1 1 1    0   19   35 o  408.819   10.314  128.297   6.4449  128.297   6.4449  128.297   6.4449  408.819   10.314  408.819   10.314 0.000000 0.000000 
1 1 1    0   19   36 o  238.842   23.732   45.216   8.4794   45.216   8.4794   45.216   8.4794  238.842   23.732  238.842   23.732 0.000000 0.000000 
1 1 1    0   19   37 o   87.312   53.310   5.7062   13.499   5.7062   13.499   5.7062   13.499   87.312   53.310   87.312   53.310 0.000000 0.000000 
1 1 1    0   19   38 o  392.997   10.859  118.671   6.5207  118.671   6.5207  118.671   6.5207  392.997   10.859  392.997   10.859 0.000000 0.000000 
1 1 1    0   19   39 o   67.445   33.790   5.2110   4.2704   5.2110   4.2704   5.2110   4.2704   67.445   33.790   67.445   33.790 0.000000 0.000000 
1 1 1    0   19   40 o   84.379   46.148   8.0076   8.5110   8.0076   8.5110   8.0076   8.5110   84.379   46.148   84.379   46.148 0.000000 0.000000 
1 1 1    0   19   41 o  319.723   12.203   78.797   5.9523   78.797   5.9523   78.797   5.9523  319.723   12.203  319.723   12.203 0.000000 0.000000 
1 1 1    0   19   42 o  453.363   10.627  157.938   7.3652  157.938   7.3652  157.938   7.3652  453.363   10.627  453.363   10.627 0.000000 0.000000 
1 1 1    0   19   43 o  252.147   14.791   49.404   5.6635   49.404   5.6635   49.404   5.6635  252.147   14.791  252.147   14.791 0.000000 0.000000 
1 1 1    0   19   44 o  310.857   12.849   74.647   6.0899   74.647   6.0899   74.647   6.0899  310.857   12.849  310.857   12.849 0.000000 0.000000 
1 1 1    0   19   45 o  383.402   11.967  113.283   7.0072  113.283   7.0072  113.283   7.0072  383.402   11.967  383.402   11.967 0.000000 0.000000 
1 1 1    0   19   46 o  241.233   15.592   45.413   5.7021   45.413   5.7021   45.413   5.7021  241.233   15.592  241.233   15.592 0.000000 0.000000 
1 1 1    0   19   47 o  198.044   19.189   31.196   5.6913   31.196   5.6913   31.196   5.6913  198.044   19.189  198.044   19.189 0.000000 0.000000 
1 1 1    0   19   48 o   66.181   35.047   5.0788   4.7645   5.0788   4.7645   5.0788   4.7645   66.181   35.047   66.181   35.047 0.000000 0.000000 
1 1 1    0   19   49 o  333.438   13.468   86.072   6.8481   86.072   6.8481   86.072   6.8481  333.438   13.468  333.438   13.468 0.000000 0.000000 
1 1 1    0   19   50 o   61.216   35.910   3.7222   5.6660   3.7222   5.6660   3.7222   5.6660   61.216   35.910   61.216   35.910 0.000000 0.000000 
1 1 1    0   19   51 o   62.524   34.971   4.3677   5.0130   4.3677   5.0130   4.3677   5.0130   62.524   34.971   62.524   34.971 0.000000 0.000000 
1 1 1    0   19   52 o   67.818   37.222   5.3389   5.5595   5.3389   5.5595   5.3389   5.5595   67.818   37.222   67.818   37.222 0.000000 0.000000 
1 1 1    0   19   53 o  274.773   30.993   62.529   12.608   62.529   12.608   62.529   12.608  274.773   30.993  274.773   30.993 0.000000 0.000000 
1 1 1    0   19   54 o  250.582   18.072   49.633   6.8486   49.633   6.8486   49.633   6.8486  250.582   18.072  250.582   18.072 0.000000 0.000000 
1 1 1    0   19   55 o   81.653   41.922   8.3309   6.6668   8.3309   6.6668   8.3309   6.6668   81.653   41.922   81.653   41.922 0.000000 0.000000 
1 1 1    0   19   56 o  101.472   40.023   11.625   5.9742   11.625   5.9742   11.625   5.9742  101.472   40.023  101.472   40.023 0.000000 0.000000 
1 1 1    0   19   57 o   52.252   33.343   1.2257   5.9208   1.2257   5.9208   1.2257   5.9208   52.252   33.343   52.252   33.343 0.000000 0.000000 
1 1 1    0   19   58 o   44.112   29.785  -1.8825   5.8618  -1.8825   5.8618  -1.8825   5.8618   44.112   29.785   44.112   29.785 0.000000 0.000000 
1 1 1    0   19   59 o  116.652   37.457   14.260   5.9008   14.260   5.9008   14.260   5.9008  116.652   37.457  116.652   37.457 0.000000 0.000000 
1 1 1    0   19   60 o  212.659   20.228   36.967   6.4473   36.967   6.4473   36.967   6.4473  212.659   20.228  212.659   20.228 0.000000 0.000000 
1 1 1    0   20    6 o  731.452   13.616  410.063   15.232  410.063   15.232  410.063   15.232  731.452   13.616  731.452   13.616 0.000000 0.000000 
1 1 1    0   20    7 o  587.721   12.987  264.842   11.670  264.842   11.670  264.842   11.670  587.721   12.987  587.721   12.987 0.000000 0.000000 
1 1 1    0   20    8 o  1229.01   12.501  1156.75   23.511  1156.75   23.511  1156.75   23.511  1229.01   12.501  1229.01   12.501 0.000000 0.000000 
1 1 1    0   20    9 o  229.866   11.548   40.756   4.0395   40.756   4.0395   40.756   4.0395  229.866   11.548  229.866   11.548 0.000000 0.000000 
1 1 1    0   20   10 o  565.769   9.1913  245.215   7.9547  245.215   7.9547  245.215   7.9547  565.769   9.1913  565.769   9.1913 0.000000 0.000000 
1 1 1    0   20   11 o  526.227   9.2950  212.169   7.4814  212.169   7.4814  212.169   7.4814  526.227   9.2950  526.227   9.2950 0.000000 0.000000 
1 1 1    0   20   12 o  424.951   9.4176  138.436   6.1188  138.436   6.1188  138.436   6.1188  424.951   9.4176  424.951   9.4176 0.000000 0.000000 
1 1 1    0   20   13 o  427.193   9.5220  139.904   6.2192  139.904   6.2192  139.904   6.2192  427.193   9.5220  427.193   9.5220 0.000000 0.000000 
1 1 1    0   20   14 o  504.512   9.4260  195.045   7.2732  195.045   7.2732  195.045   7.2732  504.512   9.4260  504.512   9.4260 0.000000 0.000000 
1 1 1    0   20   15 o  123.282   24.628   12.946   4.1242   12.946   4.1242   12.946   4.1242  123.282   24.628  123.282   24.628 0.000000 0.000000 
1 1 1    0   20   16 o  821.002   10.305  516.248   12.946  516.248   12.946  516.248   12.946  821.002   10.305  821.002   10.305 0.000000 0.000000 
1 1 1    0   20   17 o  144.583   20.409   16.945   4.2575   16.945   4.2575   16.945   4.2575  144.583   20.409  144.583   20.409 0.000000 0.000000 
1 1 1    0   20   18 o  237.307   14.113   43.579   5.0846   43.579   5.0846   43.579   5.0846  237.307   14.113  237.307   14.113 0.000000 0.000000 
1 1 1    0   20   19 o  825.013   14.931  521.778   18.841  521.778   18.841  521.778   18.841  825.013   14.931  825.013   14.931 0.000000 0.000000 
1 1 1    0   20   20 o  800.348   14.970  491.097   18.324  491.097   18.324  491.097   18.324  800.348   14.970  800.348   14.970 0.000000 0.000000 
1 1 1    0   20   21 o  106.863   35.448   11.233   5.1586   11.233   5.1586   11.233   5.1586  106.863   35.448  106.863   35.448 0.000000 0.000000 
1 1 1    0   20   22 o  1264.57   13.288  1225.02   25.713  1225.02   25.713  1225.02   25.713  1264.57   13.288  1264.57   13.288 0.000000 0.000000 
1 1 1    0   20   23 o  420.738   11.897  135.873   7.6476  135.873   7.6476  135.873   7.6476  420.738   11.897  420.738   11.897 0.000000 0.000000 
1 1 1    0   20   24 o  825.709   11.261  522.344   14.226  522.344   14.226  522.344   14.226  825.709   11.261  825.709   11.261 0.000000 0.000000 
1 1 1    0   20   25 o  679.598   11.159  353.936   11.601  353.936   11.601  353.936   11.601  679.598   11.159  679.598   11.159 0.000000 0.000000 
1 1 1    0   20   26 o  303.730   15.684   71.243   7.2469   71.243   7.2469   71.243   7.2469  303.730   15.684  303.730   15.684 0.000000 0.000000 
1 1 1    0   20   27 o  851.605   16.010  556.319   20.852  556.319   20.852  556.319   20.852  851.605   16.010  851.605   16.010 0.000000 0.000000 
1 1 1    0   20   28 o  408.962   17.755  128.939   11.067  128.939   11.067  128.939   11.067  408.962   17.755  408.962   17.755 0.000000 0.000000 
1 1 1    0   20   29 o   52.212   34.086  -0.7380   6.6702  -0.7380   6.6702  -0.7380   6.6702   52.212   34.086   52.212   34.086 0.000000 0.000000 
1 1 1    0   20   30 o  608.575   12.273  284.079   11.422  284.079   11.422  284.079   11.422  608.575   12.273  608.575   12.273 0.000000 0.000000 
1 1 1    0   20   31 o  161.345   18.091   20.710   4.3234   20.710   4.3234   20.710   4.3234  161.345   18.091  161.345   18.091 0.000000 0.000000 
1 1 1    0   20   32 o  458.032   9.7341  160.905   6.8174  160.905   6.8174  160.905   6.8174  458.032   9.7341  458.032   9.7341 0.000000 0.000000 
1 1 1    0   20   33 o  332.900   11.098   85.196   5.6407   85.196   5.6407   85.196   5.6407  332.900   11.098  332.900   11.098 0.000000 0.000000 
1 1 1    0   20   34 o  146.448   41.229   20.084   8.0011   20.084   8.0011   20.084   8.0011  146.448   41.229  146.448   41.229 0.000000 0.000000 
1 1 1    0   20   35 o  190.264   31.991   30.229   8.5252   30.229   8.5252   30.229   8.5252  190.264   31.991  190.264   31.991 0.000000 0.000000 
1 1 1    0   20   36 o   57.493   32.598   3.3739   4.4355   3.3739   4.4355   3.3739   4.4355   57.493   32.598   57.493   32.598 0.000000 0.000000 
1 1 1    0   20   37 o  338.094   11.295   87.933   5.8304   87.933   5.8304   87.933   5.8304  338.094   11.295  338.094   11.295 0.000000 0.000000 
1 1 1    0   20   38 o  631.437   9.5878  305.794   9.2617  305.794   9.2617  305.794   9.2617  631.437   9.5878  631.437   9.5878 0.000000 0.000000 
1 1 1    0   20   39 o  286.340   20.826   64.199   9.0166   64.199   9.0166   64.199   9.0166  286.340   20.826  286.340   20.826 0.000000 0.000000 
1 1 1    0   20   40 o   56.832   31.400   3.4887   3.9865   3.4887   3.9865   3.4887   3.9865   56.832   31.400   56.832   31.400 0.000000 0.000000 
1 1 1    0   20   41 o  348.712   11.196   93.593   5.9618   93.593   5.9618   93.593   5.9618  348.712   11.196  348.712   11.196 0.000000 0.000000 
1 1 1    0   20   42 o  510.487   11.229  200.306   8.7644  200.306   8.7644  200.306   8.7644  510.487   11.229  510.487   11.229 0.000000 0.000000 
1 1 1    0   20   43 o  174.022   18.315   24.125   4.7547   24.125   4.7547   24.125   4.7547  174.022   18.315  174.022   18.315 0.000000 0.000000 
1 1 1    0   20   44 o  191.353   17.259   28.924   4.9603   28.924   4.9603   28.924   4.9603  191.353   17.259  191.353   17.259 0.000000 0.000000 
1 1 1    0   20   45 o  204.905   16.828   33.040   5.1959   33.040   5.1959   33.040   5.1959  204.905   16.828  204.905   16.828 0.000000 0.000000 
1 1 1    0   20   46 o   51.968   31.468   2.1318   4.6192   2.1318   4.6192   2.1318   4.6192   51.968   31.468   51.968   31.468 0.000000 0.000000 
1 1 1    0   20   47 o  180.714   20.534   26.280   5.4905   26.280   5.4905   26.280   5.4905  180.714   20.534  180.714   20.534 0.000000 0.000000 
1 1 1    0   20   48 o   87.390   37.846   8.6732   5.2226   8.6732   5.2226   8.6732   5.2226   87.390   37.846   87.390   37.846 0.000000 0.000000 
1 1 1    0   20   49 o  186.181   22.342   28.129   6.1244   28.129   6.1244   28.129   6.1244  186.181   22.342  186.181   22.342 0.000000 0.000000 
1 1 1    0   20   50 f   34.596   24.158  -4.3465   4.6863  -4.3465   4.6863  -4.3465   4.6863   34.596   24.158   34.596   24.158 0.000000 0.000000 
1 1 1    0   20   51 o  187.139   20.994   28.290   5.8192   28.290   5.8192   28.290   5.8192  187.139   20.994  187.139   20.994 0.000000 0.000000 
1 1 1    0   20   52 o   65.364   43.299  -0.9935   11.384  -0.9935   11.384  -0.9935   11.384   65.364   43.299   65.364   43.299 0.000000 0.000000 
1 1 1    0   20   53 o   56.566   34.742   2.4864   5.8103   2.4864   5.8103   2.4864   5.8103   56.566   34.742   56.566   34.742 0.000000 0.000000 
1 1 1    0   20   54 o   28.938   21.189 -14.6878   5.9669 -14.6878   5.9669 -14.6878   5.9669   28.938   21.189   28.938   21.189 0.000000 0.000000 
1 1 1    0   20   55 o  139.424   33.144   17.963   6.1390   17.963   6.1390   17.963   6.1390  139.424   33.144  139.424   33.144 0.000000 0.000000 
1 1 1    0   20   56 o   65.252   37.160   4.9592   5.7975   4.9592   5.7975   4.9592   5.7975   65.252   37.160   65.252   37.160 0.000000 0.000000 
1 1 1    0   20   57 o   47.374   31.165  -0.2790   5.7348  -0.2790   5.7348  -0.2790   5.7348   47.374   31.165   47.374   31.165 0.000000 0.000000 
1 1 1    0   20   58 o   50.288   32.531   0.7518   5.8863   0.7518   5.8863   0.7518   5.8863   50.288   32.531   50.288   32.531 0.000000 0.000000 
1 1 1    0   20   59 o   57.443   34.903   3.3296   5.7231   3.3296   5.7231   3.3296   5.7231   57.443   34.903   57.443   34.903 0.000000 0.000000 
1 1 1    0   20   60 o   92.372   41.973   10.957   6.4205   10.957   6.4205   10.957   6.4205   92.372   41.973   92.372   41.973 0.000000 0.000000 
1 1 1    0   21    2 o  1105.17   16.600  935.982   28.066  935.982   28.066  935.982   28.066  1105.17   16.600  1105.17   16.600 0.000000 0.000000 
1 1 1    0   21    3 o  228.592   17.466   40.715   6.0292   40.715   6.0292   40.715   6.0292  228.592   17.466  228.592   17.466 0.000000 0.000000 
1 1 1    0   21    4 o  740.466   13.717  420.227   15.534  420.227   15.534  420.227   15.534  740.466   13.717  740.466   13.717 0.000000 0.000000 
1 1 1    0   21    5 o  1033.39   15.969  818.338   25.245  818.338   25.245  818.338   25.245  1033.39   15.969  1033.39   15.969 0.000000 0.000000 
1 1 1    0   21    6 o  2403.74   30.621  4433.80  112.620  4433.80  112.620  4433.80  112.620  2403.74   30.621  2403.74   30.621 0.000000 0.000000 
1 1 1    0   21    7 o  1624.68   21.931  2023.49   54.516  2023.49   54.516  2023.49   54.516  1624.68   21.931  1624.68   21.931 0.000000 0.000000 
1 1 1    0   21    8 f  192.587   20.386   29.355   5.8553   29.355   5.8553   29.355   5.8553  192.587   20.386  192.587   20.386 0.000000 0.000000 
1 1 1    0   21    9 o  150.641   17.048   18.036   3.8009   18.036   3.8009   18.036   3.8009  150.641   17.048  150.641   17.048 0.000000 0.000000 
1 1 1    0   21   10 o  917.785   10.637  645.086   14.938  645.086   14.938  645.086   14.938  917.785   10.637  917.785   10.637 0.000000 0.000000 
1 1 1    0   21   11 o  272.080   11.222   56.961   4.6553   56.961   4.6553   56.961   4.6553  272.080   11.222  272.080   11.222 0.000000 0.000000 
1 1 1    0   21   12 o  597.800   9.4625  273.765   8.6534  273.765   8.6534  273.765   8.6534  597.800   9.4625  597.800   9.4625 0.000000 0.000000 
1 1 1    0   21   13 o  944.559   10.925  683.299   15.791  683.299   15.791  683.299   15.791  944.559   10.925  944.559   10.925 0.000000 0.000000 
1 1 1    0   21   14 o  385.226   10.105  113.838   5.9490  113.838   5.9490  113.838   5.9490  385.226   10.105  385.226   10.105 0.000000 0.000000 
1 1 1    0   21   15 o  323.237   11.142   80.275   5.4975   80.275   5.4975   80.275   5.4975  323.237   11.142  323.237   11.142 0.000000 0.000000 
1 1 1    0   21   16 o   35.225   24.056  -2.5316   4.0524  -2.5316   4.0524  -2.5316   4.0524   35.225   24.056   35.225   24.056 0.000000 0.000000 
1 1 1    0   21   17 o  836.623   14.954  536.555   19.136  536.555   19.136  536.555   19.136  836.623   14.954  836.623   14.954 0.000000 0.000000 
1 1 1    0   21   18 o  1292.59   18.697  1280.92   36.974  1280.92   36.974  1280.92   36.974  1292.59   18.697  1292.59   18.697 0.000000 0.000000 
1 1 1    0   21   19 o  201.112   17.489   31.681   5.2900   31.681   5.2900   31.681   5.2900  201.112   17.489  201.112   17.489 0.000000 0.000000 
1 1 1    0   21   20 o   31.656   22.624  -7.6391   4.9807  -7.6391   4.9807  -7.6391   4.9807   31.656   22.624   31.656   22.624 0.000000 0.000000 
1 1 1    0   21   21 o  1744.68   16.691  2332.58   44.563  2332.58   44.563  2332.58   44.563  1744.68   16.691  1744.68   16.691 0.000000 0.000000 
1 1 1    0   21   22 o  153.269   26.150   19.515   5.5985   19.515   5.5985   19.515   5.5985  153.269   26.150  153.269   26.150 0.000000 0.000000 
1 1 1    0   21   23 o  496.546   11.577  189.106   8.7881  189.106   8.7881  189.106   8.7881  496.546   11.577  496.546   11.577 0.000000 0.000000 
1 1 1    0   21   24 o  555.317   11.602  236.453   9.8519  236.453   9.8519  236.453   9.8519  555.317   11.602  555.317   11.602 0.000000 0.000000 
1 1 1    0   21   25 o   59.370   35.796   2.6463   5.9266   2.6463   5.9266   2.6463   5.9266   59.370   35.796   59.370   35.796 0.000000 0.000000 
1 1 1    0   21   26 o  699.552   15.399  375.522   16.470  375.522   16.470  375.522   16.470  699.552   15.399  699.552   15.399 0.000000 0.000000 
1 1 1    0   21   27 o  465.684   12.565  166.477   8.9415  166.477   8.9415  166.477   8.9415  465.684   12.565  465.684   12.565 0.000000 0.000000 
1 1 1    0   21   28 o  732.450   11.820  411.259   13.244  411.259   13.244  411.259   13.244  732.450   11.820  732.450   11.820 0.000000 0.000000 
1 1 1    0   21   29 o  750.270   11.809  431.541   13.553  431.541   13.553  431.541   13.553  750.270   11.809  750.270   11.809 0.000000 0.000000 
1 1 1    0   21   30 o  363.639   14.987  101.891   8.3095  101.891   8.3095  101.891   8.3095  363.639   14.987  363.639   14.987 0.000000 0.000000 
1 1 1    0   21   31 o   49.985   33.228  -1.9093   6.7990  -1.9093   6.7990  -1.9093   6.7990   49.985   33.228   49.985   33.228 0.000000 0.000000 
1 1 1    0   21   32 o  402.761   10.174  124.508   6.2629  124.508   6.2629  124.508   6.2629  402.761   10.174  402.761   10.174 0.000000 0.000000 
1 1 1    0   21   33 o  588.255   12.677  265.658   11.402  265.658   11.402  265.658   11.402  588.255   12.677  588.255   12.677 0.000000 0.000000 
1 1 1    0   21   34 o  406.620   12.011  127.084   7.4605  127.084   7.4605  127.084   7.4605  406.620   12.011  406.620   12.011 0.000000 0.000000 
1 1 1    0   21   35 o  290.145   13.093   64.963   5.7876   64.963   5.7876   64.963   5.7876  290.145   13.093  290.145   13.093 0.000000 0.000000 
1 1 1    0   21   36 o  411.484   9.9234  129.990   6.2419  129.990   6.2419  129.990   6.2419  411.484   9.9234  411.484   9.9234 0.000000 0.000000 
1 1 1    0   21   37 o  199.526   15.222   31.104   4.5866   31.104   4.5866   31.104   4.5866  199.526   15.222  199.526   15.222 0.000000 0.000000 
1 1 1    0   21   38 o  540.118   13.960  224.456   11.524  224.456   11.524  224.456   11.524  540.118   13.960  540.118   13.960 0.000000 0.000000 
1 1 1    0   21   39 o   69.851   32.340   5.5371   3.8191   5.5371   3.8191   5.5371   3.8191   69.851   32.340   69.851   32.340 0.000000 0.000000 
1 1 1    0   21   40 o  720.257   9.5972  397.990   10.576  397.990   10.576  397.990   10.576  720.257   9.5972  720.257   9.5972 0.000000 0.000000 
1 1 1    0   21   41 o  311.850   12.686   75.066   6.0324   75.066   6.0324   75.066   6.0324  311.850   12.686  311.850   12.686 0.000000 0.000000 
1 1 1    0   21   42 o   29.785   20.977  -4.2734   3.7641  -4.2734   3.7641  -4.2734   3.7641   29.785   20.977   29.785   20.977 0.000000 0.000000 
1 1 1    0   21   43 o  320.355   12.325   79.214   6.0234   79.214   6.0234   79.214   6.0234  320.355   12.325  320.355   12.325 0.000000 0.000000 
1 1 1    0   21   44 o   35.638   24.300  -2.3234   4.0991  -2.3234   4.0991  -2.3234   4.0991   35.638   24.300   35.638   24.300 0.000000 0.000000 
1 1 1    0   21   45 o  192.308   17.337   29.241   5.0077   29.241   5.0077   29.241   5.0077  192.308   17.337  192.308   17.337 0.000000 0.000000 
1 1 1    0   21   46 o  155.509   21.682   19.815   4.8739   19.815   4.8739   19.815   4.8739  155.509   21.682  155.509   21.682 0.000000 0.000000 
1 1 1    0   21   47 o  263.829   14.599   54.155   5.8541   54.155   5.8541   54.155   5.8541  263.829   14.599  263.829   14.599 0.000000 0.000000 
1 1 1    0   21   48 o  232.594   17.664   42.591   6.2054   42.591   6.2054   42.591   6.2054  232.594   17.664  232.594   17.664 0.000000 0.000000 
1 1 1    0   21   49 o   72.435   35.615   6.1986   4.7075   6.1986   4.7075   6.1986   4.7075   72.435   35.615   72.435   35.615 0.000000 0.000000 
1 1 1    0   21   50 o   56.599   33.807   2.9219   5.1869   2.9219   5.1869   2.9219   5.1869   56.599   33.807   56.599   33.807 0.000000 0.000000 
1 1 1    0   21   51 o  225.561   39.645   44.702   12.424   44.702   12.424   44.702   12.424  225.561   39.645  225.561   39.645 0.000000 0.000000 
1 1 1    0   21   52 o   77.780   48.628   4.8868   11.888   4.8868   11.888   4.8868   11.888   77.780   48.628   77.780   48.628 0.000000 0.000000 
1 1 1    0   21   53 o  185.297   23.036   28.186   6.2613   28.186   6.2613   28.186   6.2613  185.297   23.036  185.297   23.036 0.000000 0.000000 
1 1 1    0   21   54 o   43.269   29.852  -4.2793   6.6151  -4.2793   6.6151  -4.2793   6.6151   43.269   29.852   43.269   29.852 0.000000 0.000000 
1 1 1    0   21   55 o   62.667   36.432   4.3340   5.7471   4.3340   5.7471   4.3340   5.7471   62.667   36.432   62.667   36.432 0.000000 0.000000 
1 1 1    0   21   56 o  157.154   27.513   21.430   6.0112   21.430   6.0112   21.430   6.0112  157.154   27.513  157.154   27.513 0.000000 0.000000 
1 1 1    0   21   57 o  143.686   31.520   18.922   6.0682   18.922   6.0682   18.922   6.0682  143.686   31.520  143.686   31.520 0.000000 0.000000 
1 1 1    0   21   58 o   48.742   31.792   0.3788   5.7837   0.3788   5.7837   0.3788   5.7837   48.742   31.792   48.742   31.792 0.000000 0.000000 
1 1 1    0   21   59 o  132.590   34.005   17.068   5.9654   17.068   5.9654   17.068   5.9654  132.590   34.005  132.590   34.005 0.000000 0.000000 
1 1 1    0   22    2 o  2415.85   30.793  4478.98  113.825  4478.98  113.825  4478.98  113.825  2415.85   30.793  2415.85   30.793 0.000000 0.000000 
1 1 1    0   22    3 o  424.878   13.481  138.633   8.7470  138.633   8.7470  138.633   8.7470  424.878   13.481  424.878   13.481 0.000000 0.000000 
1 1 1    0   22    4 o  1163.33   17.219  1037.16   30.645  1037.16   30.645  1037.16   30.645  1163.33   17.219  1163.33   17.219 0.000000 0.000000 
1 1 1    0   22    5 o  311.410   14.895   74.766   7.0628   74.766   7.0628   74.766   7.0628  311.410   14.895  311.410   14.895 0.000000 0.000000 
1 1 1    0   22    6 o  1496.49   20.569  1716.67   47.094  1716.67   47.094  1716.67   47.094  1496.49   20.569  1496.49   20.569 0.000000 0.000000 
1 1 1    0   22    7 o  515.493   13.152  203.855   10.362  203.855   10.362  203.855   10.362  515.493   13.152  515.493   13.152 0.000000 0.000000 
1 1 1    0   22    8 o   39.932   27.388  -3.6893   5.3797  -3.6893   5.3797  -3.6893   5.3797   39.932   27.388   39.932   27.388 0.000000 0.000000 
1 1 1    0   22    9 o  559.867   9.4731  240.151   8.1127  240.151   8.1127  240.151   8.1127  559.867   9.4731  559.867   9.4731 0.000000 0.000000 
1 1 1    0   22   10 o  515.787   9.5116  203.858   7.5034  203.858   7.5034  203.858   7.5034  515.787   9.5116  515.787   9.5116 0.000000 0.000000 
1 1 1    0   22   11 o  1309.22   13.251  1312.84   26.549  1312.84   26.549  1312.84   26.549  1309.22   13.251  1309.22   13.251 0.000000 0.000000 
1 1 1    0   22   12 o  2116.24   19.345  3431.93   62.650  3431.93   62.650  3431.93   62.650  2116.24   19.345  2116.24   19.345 0.000000 0.000000 
1 1 1    0   22   13 o  108.437   29.074   10.745   4.1701   10.745   4.1701   10.745   4.1701  108.437   29.074  108.437   29.074 0.000000 0.000000 
1 1 1    0   22   14 o  287.881   17.535   64.187   7.6609   64.187   7.6609   64.187   7.6609  287.881   17.535  287.881   17.535 0.000000 0.000000 
1 1 1    0   22   15 o  233.406   19.785   42.634   6.9515   42.634   6.9515   42.634   6.9515  233.406   19.785  233.406   19.785 0.000000 0.000000 
1 1 1    0   22   16 o  352.258   15.909   95.622   8.5382   95.622   8.5382   95.622   8.5382  352.258   15.909  352.258   15.909 0.000000 0.000000 
1 1 1    0   22   17 o  747.545   10.502  428.088   12.011  428.088   12.011  428.088   12.011  747.545   10.502  747.545   10.502 0.000000 0.000000 
1 1 1    0   22   18 o  712.683   10.518  389.121   11.468  389.121   11.468  389.121   11.468  712.683   10.518  712.683   10.518 0.000000 0.000000 
1 1 1    0   22   19 o  842.119   10.969  543.250   14.133  543.250   14.133  543.250   14.133  842.119   10.969  842.119   10.969 0.000000 0.000000 
1 1 1    0   22   20 o  774.119   10.947  459.109   12.966  459.109   12.966  459.109   12.966  774.119   10.947  774.119   10.947 0.000000 0.000000 
1 1 1    0   22   21 o  221.762   18.287   38.449   6.1102   38.449   6.1102   38.449   6.1102  221.762   18.287  221.762   18.287 0.000000 0.000000 
1 1 1    0   22   22 o  1097.98   12.476  923.601   20.961  923.601   20.961  923.601   20.961  1097.98   12.476  1097.98   12.476 0.000000 0.000000 
1 1 1    0   22   23 o  160.591   27.365   21.432   6.1400   21.432   6.1400   21.432   6.1400  160.591   27.365  160.591   27.365 0.000000 0.000000 
1 1 1    0   22   24 o  699.143   15.274  375.052   16.328  375.052   16.328  375.052   16.328  699.143   15.274  699.143   15.274 0.000000 0.000000 
1 1 1    0   22   25 o  192.150   30.474   30.428   8.2877   30.428   8.2877   30.428   8.2877  192.150   30.474  192.150   30.474 0.000000 0.000000 
1 1 1    0   22   26 o  979.648   12.219  735.473   18.316  735.473   18.316  735.473   18.316  979.648   12.219  979.648   12.219 0.000000 0.000000 
1 1 1    0   22   27 o  1335.65   14.150  1367.55   28.921  1367.55   28.921  1367.55   28.921  1335.65   14.150  1335.65   14.150 0.000000 0.000000 
1 1 1    0   22   28 o  638.823   11.860  312.964   11.588  312.964   11.588  312.964   11.588  638.823   11.860  638.823   11.860 0.000000 0.000000 
1 1 1    0   22   29 o  475.953   13.004  173.992   9.4573  173.992   9.4573  173.992   9.4573  475.953   13.004  475.953   13.004 0.000000 0.000000 
1 1 1    0   22   30 f  185.477   26.173   28.001   7.0045   28.001   7.0045   28.001   7.0045  185.477   26.173  185.477   26.173 0.000000 0.000000 
1 1 1    0   22   31 o  143.663   36.388   18.685   6.9188   18.685   6.9188   18.685   6.9188  143.663   36.388  143.663   36.388 0.000000 0.000000 
1 1 1    0   22   32 o   86.482   42.576   8.5796   6.7309   8.5796   6.7309   8.5796   6.7309   86.482   42.576   86.482   42.576 0.000000 0.000000 
1 1 1    0   22   33 o  647.104   10.882  321.200   10.771  321.200   10.771  321.200   10.771  647.104   10.882  647.104   10.882 0.000000 0.000000 
1 1 1    0   22   34 o  180.093   17.369   25.602   4.6856   25.602   4.6856   25.602   4.6856  180.093   17.369  180.093   17.369 0.000000 0.000000 
1 1 1    0   22   35 o  824.671   9.5361  521.365   12.034  521.365   12.034  521.365   12.034  824.671   9.5361  824.671   9.5361 0.000000 0.000000 
1 1 1    0   22   36 o  239.200   12.427   44.247   4.5218   44.247   4.5218   44.247   4.5218  239.200   12.427  239.200   12.427 0.000000 0.000000 
1 1 1    0   22   37 f  216.223   25.315   37.594   8.0778   37.594   8.0778   37.594   8.0778  216.223   25.315  216.223   25.315 0.000000 0.000000 
1 1 1    0   22   38 o   46.040   28.193   1.4068   3.8007   1.4068   3.8007   1.4068   3.8007   46.040   28.193   46.040   28.193 0.000000 0.000000 
1 1 1    0   22   39 o  548.358   9.8172  230.804   8.2339  230.804   8.2339  230.804   8.2339  548.358   9.8172  548.358   9.8172 0.000000 0.000000 
1 1 1    0   22   40 o  173.119   17.644   23.797   4.5640   23.797   4.5640   23.797   4.5640  173.119   17.644  173.119   17.644 0.000000 0.000000 
1 1 1    0   22   41 o  549.500   9.9226  231.874   8.3396  231.874   8.3396  231.874   8.3396  549.500   9.9226  549.500   9.9226 0.000000 0.000000 
1 1 1    0   22   42 o  164.475   19.028   21.710   4.6234   21.710   4.6234   21.710   4.6234  164.475   19.028  164.475   19.028 0.000000 0.000000 
1 1 1    0   22   43 o   32.238   22.231  -2.7049   3.6587  -2.7049   3.6587  -2.7049   3.6587   32.238   22.231   32.238   22.231 0.000000 0.000000 
1 1 1    0   22   44 o   28.085   20.058  -5.7598   3.8894  -5.7598   3.8894  -5.7598   3.8894   28.085   20.058   28.085   20.058 0.000000 0.000000 
1 1 1    0   22   45 o  364.265   12.055  102.361   6.7044  102.361   6.7044  102.361   6.7044  364.265   12.055  364.265   12.055 0.000000 0.000000 
1 1 1    0   22   46 o  288.664   14.114   64.664   6.2023   64.664   6.2023   64.664   6.2023  288.664   14.114  288.664   14.114 0.000000 0.000000 
1 1 1    0   22   47 o  341.067   14.443   90.187   7.5091   90.187   7.5091   90.187   7.5091  341.067   14.443  341.067   14.443 0.000000 0.000000 
1 1 1    0   22   48 o   40.911   27.331  -1.3844   4.7009  -1.3844   4.7009  -1.3844   4.7009   40.911   27.331   40.911   27.331 0.000000 0.000000 
1 1 1    0   22   49 o  150.543   25.210   19.129   5.3193   19.129   5.3193   19.129   5.3193  150.543   25.210  150.543   25.210 0.000000 0.000000 
1 1 1    0   22   50 o   81.165   36.445   7.6380   4.8369   7.6380   4.8369   7.6380   4.8369   81.165   36.445   81.165   36.445 0.000000 0.000000 
1 1 1    0   22   51 o  122.181   58.075   19.220   12.381   19.220   12.381   19.220   12.381  122.181   58.075  122.181   58.075 0.000000 0.000000 
1 1 1    0   22   52 o   97.890   38.707   10.654   5.5820   10.654   5.5820   10.654   5.5820   97.890   38.707   97.890   38.707 0.000000 0.000000 
1 1 1    0   22   53 o  238.303   20.702   45.513   7.4200   45.513   7.4200   45.513   7.4200  238.303   20.702  238.303   20.702 0.000000 0.000000 
1 1 1    0   22   54 o   68.479   37.988   5.6265   5.8610   5.6265   5.8610   5.6265   5.8610   68.479   37.988   68.479   37.988 0.000000 0.000000 
1 1 1    0   22   55 o   67.195   37.362   5.4447   5.6843   5.4447   5.6843   5.4447   5.6843   67.195   37.362   67.195   37.362 0.000000 0.000000 
1 1 1    0   22   56 o   44.521   29.865  -1.4206   5.7140  -1.4206   5.7140  -1.4206   5.7140   44.521   29.865   44.521   29.865 0.000000 0.000000 
1 1 1    0   22   57 o  164.669   27.265   23.580   6.3055   23.580   6.3055   23.580   6.3055  164.669   27.265  164.669   27.265 0.000000 0.000000 
1 1 1    0   22   58 f   94.688   40.713   10.996   6.0504   10.996   6.0504   10.996   6.0504   94.688   40.713   94.688   40.713 0.000000 0.000000 
1 1 1    0   23    2 o  416.975   13.572  133.550   8.6415  133.550   8.6415  133.550   8.6415  416.975   13.572  416.975   13.572 0.000000 0.000000 
1 1 1    0   23    3 o  376.166   14.005  108.798   8.0386  108.798   8.0386  108.798   8.0386  376.166   14.005  376.166   14.005 0.000000 0.000000 
1 1 1    0   23    4 o  1315.79   18.714  1327.03   37.673  1327.03   37.673  1327.03   37.673  1315.79   18.714  1315.79   18.714 0.000000 0.000000 
1 1 1    0   23    5 o  378.586   14.165  110.210   8.1823  110.210   8.1823  110.210   8.1823  378.586   14.165  378.586   14.165 0.000000 0.000000 
1 1 1    0   23    6 o   53.175   32.353   1.9266   4.9323   1.9266   4.9323   1.9266   4.9323   53.175   32.353   53.175   32.353 0.000000 0.000000 
1 1 1    0   23    7 o  389.339   13.904  116.516   8.2620  116.516   8.2620  116.516   8.2620  389.339   13.904  389.339   13.904 0.000000 0.000000 
1 1 1    0   23    8 o  667.892   13.856  342.017   14.152  342.017   14.152  342.017   14.152  667.892   13.856  667.892   13.856 0.000000 0.000000 
1 1 1    0   23    9 o  582.901   13.720  260.607   12.226  260.607   12.226  260.607   12.226  582.901   13.720  582.901   13.720 0.000000 0.000000 
1 1 1    0   23   10 o   60.518   32.501   4.0008   4.1491   4.0008   4.1491   4.0008   4.1491   60.518   32.501   60.518   32.501 0.000000 0.000000 
1 1 1    0   23   11 o  181.033   25.085   26.531   6.5699   26.531   6.5699   26.531   6.5699  181.033   25.085  181.033   25.085 0.000000 0.000000 
1 1 1    0   23   12 o  831.841   14.860  530.437   18.906  530.437   18.906  530.437   18.906  831.841   14.860  831.841   14.860 0.000000 0.000000 
1 1 1    0   23   13 o  1186.66   17.792  1079.51   32.301  1079.51   32.301  1079.51   32.301  1186.66   17.792  1186.66   17.792 0.000000 0.000000 
1 1 1    0   23   14 o  671.158   10.133  345.091   10.404  345.091   10.404  345.091   10.404  671.158   10.133  671.158   10.133 0.000000 0.000000 
1 1 1    0   23   15 o  963.355   11.335  710.859   16.708  710.859   16.708  710.859   16.708  963.355   11.335  963.355   11.335 0.000000 0.000000 
1 1 1    0   23   16 o  1963.46   18.285  2954.70   54.942  2954.70   54.942  2954.70   54.942  1963.46   18.285  1963.46   18.285 0.000000 0.000000 
1 1 1    0   23   17 o  209.928   17.457   34.459   5.5200   34.459   5.5200   34.459   5.5200  209.928   17.457  209.928   17.457 0.000000 0.000000 
1 1 1    0   23   18 o  342.570   12.620   90.233   6.5971   90.233   6.5971   90.233   6.5971  342.570   12.620  342.570   12.620 0.000000 0.000000 
1 1 1    0   23   19 o  957.779   11.595  702.745   16.993  702.745   16.993  702.745   16.993  957.779   11.595  957.779   11.595 0.000000 0.000000 
1 1 1    0   23   20 o  1492.08   14.916  1705.96   34.059  1705.96   34.059  1705.96   34.059  1492.08   14.916  1492.08   14.916 0.000000 0.000000 
1 1 1    0   23   21 o  117.813   36.533   13.328   5.7693   13.328   5.7693   13.328   5.7693  117.813   36.533  117.813   36.533 0.000000 0.000000 
1 1 1    0   23   22 o  549.714   15.537  232.090   13.049  232.090   13.049  232.090   13.049  549.714   15.537  549.714   15.537 0.000000 0.000000 
1 1 1    0   23   23 o  451.294   16.390  156.703   11.288  156.703   11.288  156.703   11.288  451.294   16.390  451.294   16.390 0.000000 0.000000 
1 1 1    0   23   24 o  183.725   23.740   27.176   6.3692   27.176   6.3692   27.176   6.3692  183.725   23.740  183.725   23.740 0.000000 0.000000 
1 1 1    0   23   25 o   51.120   32.946   0.0020   5.9613   0.0020   5.9613   0.0020   5.9613   51.120   32.946   51.120   32.946 0.000000 0.000000 
1 1 1    0   23   26 o  415.655   13.416  132.800   8.5151  132.800   8.5151  132.800   8.5151  415.655   13.416  415.655   13.416 0.000000 0.000000 
1 1 1    0   23   27 o  520.301   12.317  207.769   9.7964  207.769   9.7964  207.769   9.7964  520.301   12.317  520.301   12.317 0.000000 0.000000 
1 1 1    0   23   28 o  105.467   42.584   11.956   6.7117   11.956   6.7117   11.956   6.7117  105.467   42.584  105.467   42.584 0.000000 0.000000 
1 1 1    0   23   29 o  215.037   21.761   36.613   6.9943   36.613   6.9943   36.613   6.9943  215.037   21.761  215.037   21.761 0.000000 0.000000 
1 1 1    0   23   30 o  395.028   14.140  120.127   8.5246  120.127   8.5246  120.127   8.5246  395.028   14.140  395.028   14.140 0.000000 0.000000 
1 1 1    0   23   31 o  138.324   37.130   17.633   6.7936   17.633   6.7936   17.633   6.7936  138.324   37.130  138.324   37.130 0.000000 0.000000 
1 1 1    0   23   32 o  793.827   18.145  484.979   22.022  484.979   22.022  484.979   22.022  793.827   18.145  793.827   18.145 0.000000 0.000000 
1 1 1    0   23   33 o  163.529   34.270   23.215   7.5561   23.215   7.5561   23.215   7.5561  163.529   34.270  163.529   34.270 0.000000 0.000000 
1 1 1    0   23   34 o  115.047   25.871   11.613   3.9760   11.613   3.9760   11.613   3.9760  115.047   25.871  115.047   25.871 0.000000 0.000000 
1 1 1    0   23   35 o   37.469   24.562  -0.5065   3.5166  -0.5065   3.5166  -0.5065   3.5166   37.469   24.562   37.469   24.562 0.000000 0.000000 
1 1 1    0   23   36 o  584.564   13.283  262.720   11.871  262.720   11.871  262.720   11.871  584.564   13.283  584.564   13.283 0.000000 0.000000 
1 1 1    0   23   37 o  254.988   12.304   50.247   4.7766   50.247   4.7766   50.247   4.7766  254.988   12.304  254.988   12.304 0.000000 0.000000 
1 1 1    0   23   38 o  364.947   10.376  102.402   5.7857  102.402   5.7857  102.402   5.7857  364.947   10.376  364.947   10.376 0.000000 0.000000 
1 1 1    0   23   39 o  181.924   15.698   26.026   4.2963   26.026   4.2963   26.026   4.2963  181.924   15.698  181.924   15.698 0.000000 0.000000 
1 1 1    0   23   40 o  227.862   14.180   40.389   4.9016   40.389   4.9016   40.389   4.9016  227.862   14.180  227.862   14.180 0.000000 0.000000 
1 1 1    0   23   41 o   62.301   32.839   4.4377   4.1684   4.4377   4.1684   4.4377   4.1684   62.301   32.839   62.301   32.839 0.000000 0.000000 
1 1 1    0   23   42 o  213.064   14.382   35.415   4.6412   35.415   4.6412   35.415   4.6412  213.064   14.382  213.064   14.382 0.000000 0.000000 
1 1 1    0   23   43 o  143.383   21.242   16.924   4.3612   16.924   4.3612   16.924   4.3612  143.383   21.242  143.383   21.242 0.000000 0.000000 
1 1 1    0   23   44 o  429.617   10.920  142.069   7.1705  142.069   7.1705  142.069   7.1705  429.617   10.920  429.617   10.920 0.000000 0.000000 
1 1 1    0   23   45 o  455.902   11.009  160.005   7.6719  160.005   7.6719  160.005   7.6719  455.902   11.009  455.902   11.009 0.000000 0.000000 
1 1 1    0   23   47 o  848.264   10.976  553.547   14.245  553.547   14.245  553.547   14.245  848.264   10.976  848.264   10.976 0.000000 0.000000 
1 1 1    0   23   48 o  533.223   12.157  219.271   9.9102  219.271   9.9102  219.271   9.9102  533.223   12.157  533.223   12.157 0.000000 0.000000 
1 1 1    0   23   49 o  281.124   14.615   61.537   6.2501   61.537   6.2501   61.537   6.2501  281.124   14.615  281.124   14.615 0.000000 0.000000 
1 1 1    0   23   50 o   85.374   51.145   7.8953   11.943   7.8953   11.943   7.8953   11.943   85.374   51.145   85.374   51.145 0.000000 0.000000 
1 1 1    0   23   51 o  193.346   20.997   30.233   6.0280   30.233   6.0280   30.233   6.0280  193.346   20.997  193.346   20.997 0.000000 0.000000 
1 1 1    0   23   52 o   38.372   26.802  -5.1172   5.7773  -5.1172   5.7773  -5.1172   5.7773   38.372   26.802   38.372   26.802 0.000000 0.000000 
1 1 1    0   23   53 o  206.383   20.932   34.463   6.4564   34.463   6.4564   34.463   6.4564  206.383   20.932  206.383   20.932 0.000000 0.000000 
1 1 1    0   23   54 o   39.917   27.468  -3.3959   5.5153  -3.3959   5.5153  -3.3959   5.5153   39.917   27.468   39.917   27.468 0.000000 0.000000 
1 1 1    0   23   55 o  178.058   24.927   26.699   6.4122   26.699   6.4122   26.699   6.4122  178.058   24.927  178.058   24.927 0.000000 0.000000 
1 1 1    0   23   56 o   48.390   31.624   0.1921   5.7638   0.1921   5.7638   0.1921   5.7638   48.390   31.624   48.390   31.624 0.000000 0.000000 
1 1 1    0   23   57 o  134.969   33.103   17.346   5.9226   17.346   5.9226   17.346   5.9226  134.969   33.103  134.969   33.103 0.000000 0.000000 
1 1 1    0   23   58 o   37.030   26.243  -6.7844   6.2000  -6.7844   6.2000  -6.7844   6.2000   37.030   26.243   37.030   26.243 0.000000 0.000000 
1 1 1    0   24    2 o  431.003   13.760  142.680   9.0565  142.680   9.0565  142.680   9.0565  431.003   13.760  431.003   13.760 0.000000 0.000000 
1 1 1    0   24    3 o  1302.60   18.677  1300.68   37.221  1300.68   37.221  1300.68   37.221  1302.60   18.677  1302.60   18.677 0.000000 0.000000 
1 1 1    0   24    4 o  740.064   14.012  419.851   15.859  419.851   15.859  419.851   15.859  740.064   14.012  740.064   14.012 0.000000 0.000000 
1 1 1    0   24    5 o  292.025   16.001   65.900   7.1030   65.900   7.1030   65.900   7.1030  292.025   16.001  292.025   16.001 0.000000 0.000000 
1 1 1    0   24    6 o  681.544   13.833  356.134   14.417  356.134   14.417  356.134   14.417  681.544   13.833  681.544   13.833 0.000000 0.000000 
1 1 1    0   24    7 o  418.233   14.002  134.398   8.9410  134.398   8.9410  134.398   8.9410  418.233   14.002  418.233   14.002 0.000000 0.000000 
1 1 1    0   24    8 o  414.230   14.128  131.856   8.9339  131.856   8.9339  131.856   8.9339  414.230   14.128  414.230   14.128 0.000000 0.000000 
1 1 1    0   24    9 o  824.498   14.774  521.120   18.632  521.120   18.632  521.120   18.632  824.498   14.774  824.498   14.774 0.000000 0.000000 
1 1 1    0   24   10 o  845.886   14.924  548.507   19.309  548.507   19.309  548.507   19.309  845.886   14.924  845.886   14.924 0.000000 0.000000 
1 1 1    0   24   11 o  992.438   11.422  754.411   17.345  754.411   17.345  754.411   17.345  992.438   11.422  992.438   11.422 0.000000 0.000000 
1 1 1    0   24   12 f  620.758   10.308  295.258   9.7878  295.258   9.7878  295.258   9.7878  620.758   10.308  620.758   10.308 0.000000 0.000000 
1 1 1    0   24   13 o  1128.63   12.353  975.741   21.335  975.741   21.335  975.741   21.335  1128.63   12.353  1128.63   12.353 0.000000 0.000000 
1 1 1    0   24   14 o   46.017   29.631   0.0074   4.8073   0.0074   4.8073   0.0074   4.8073   46.017   29.631   46.017   29.631 0.000000 0.000000 
1 1 1    0   24   15 o  841.953   11.033  543.049   14.213  543.049   14.213  543.049   14.213  841.953   11.033  841.953   11.033 0.000000 0.000000 
1 1 1    0   24   16 o   97.868   37.206   9.9683   5.2404   9.9683   5.2404   9.9683   5.2404   97.868   37.206   97.868   37.206 0.000000 0.000000 
1 1 1    0   24   17 o   35.300   24.739  -5.3261   5.0441  -5.3261   5.0441  -5.3261   5.0441   35.300   24.739   35.300   24.739 0.000000 0.000000 
1 1 1    0   24   18 o  208.495   18.672   34.110   5.8489   34.110   5.8489   34.110   5.8489  208.495   18.672  208.495   18.672 0.000000 0.000000 
1 1 1    0   24   19 o  339.170   13.436   88.525   6.9503   88.525   6.9503   88.525   6.9503  339.170   13.436  339.170   13.436 0.000000 0.000000 
1 1 1    0   24   20 f  323.038   18.432   80.770   9.0460   80.770   9.0460   80.770   9.0460  323.038   18.432  323.038   18.432 0.000000 0.000000 
1 1 1    0   24   21 o  338.113   18.986   88.478   9.7549   88.478   9.7549   88.478   9.7549  338.113   18.986  338.113   18.986 0.000000 0.000000 
1 1 1    0   24   22 o  822.992   11.472  519.047   14.445  519.047   14.445  519.047   14.445  822.992   11.472  822.992   11.472 0.000000 0.000000 
1 1 1    0   24   23 o  319.299   14.768   78.629   7.1822   78.629   7.1822   78.629   7.1822  319.299   14.768  319.299   14.768 0.000000 0.000000 
1 1 1    0   24   24 o  263.862   17.074   54.053   6.8297   54.053   6.8297   54.053   6.8297  263.862   17.074  263.862   17.074 0.000000 0.000000 
1 1 1    0   24   25 o  459.163   12.629  161.908   8.8605  161.908   8.8605  161.908   8.8605  459.163   12.629  459.163   12.629 0.000000 0.000000 
1 1 1    0   24   26 o  619.709   11.830  294.567   11.212  294.567   11.212  294.567   11.212  619.709   11.830  619.709   11.830 0.000000 0.000000 
1 1 1    0   24   27 o   52.688   33.690   0.4133   6.0825   0.4133   6.0825   0.4133   6.0825   52.688   33.690   52.688   33.690 0.000000 0.000000 
1 1 1    0   24   28 o  152.457   31.681   20.062   6.5204   20.062   6.5204   20.062   6.5204  152.457   31.681  152.457   31.681 0.000000 0.000000 
1 1 1    0   24   29 o  436.635   13.130  146.570   8.7575  146.570   8.7575  146.570   8.7575  436.635   13.130  436.635   13.130 0.000000 0.000000 
1 1 1    0   24   30 o  109.713   54.064   13.995   10.858   13.995   10.858   13.995   10.858  109.713   54.064  109.713   54.064 0.000000 0.000000 
1 1 1    0   24   31 o  489.113   20.077  184.938   14.973  184.938   14.973  184.938   14.973  489.113   20.077  489.113   20.077 0.000000 0.000000 
1 1 1    0   24   32 o  130.147   39.075   16.229   6.7832   16.229   6.7832   16.229   6.7832  130.147   39.075  130.147   39.075 0.000000 0.000000 
1 1 1    0   24   33 o  416.361   14.639  133.583   9.3032  133.583   9.3032  133.583   9.3032  416.361   14.639  416.361   14.639 0.000000 0.000000 
1 1 1    0   24   34 o  186.437   27.358   28.549   7.3147   28.549   7.3147   28.549   7.3147  186.437   27.358  186.437   27.358 0.000000 0.000000 
1 1 1    0   24   35 o  367.731   16.031  104.542   8.9844  104.542   8.9844  104.542   8.9844  367.731   16.031  367.731   16.031 0.000000 0.000000 
1 1 1    0   24   36 o  236.990   12.422   43.461   4.4778   43.461   4.4778   43.461   4.4778  236.990   12.422  236.990   12.422 0.000000 0.000000 
1 1 1    0   24   37 o  199.927   15.029   31.246   4.5394   31.246   4.5394   31.246   4.5394  199.927   15.029  199.927   15.029 0.000000 0.000000 
1 1 1    0   24   38 f   51.335   28.868   2.7629   3.4409   2.7629   3.4409   2.7629   3.4409   51.335   28.868   51.335   28.868 0.000000 0.000000 
1 1 1    0   24   39 f  869.877   9.9301  580.737   13.218  580.737   13.218  580.737   13.218  869.877   9.9301  869.877   9.9301 0.000000 0.000000 
1 1 1    0   24   40 o   29.183   20.419  -3.3990   3.3962  -3.3990   3.3962  -3.3990   3.3962   29.183   20.419   29.183   20.419 0.000000 0.000000 
1 1 1    0   24   41 o  259.314   13.004   52.093   5.1319   52.093   5.1319   52.093   5.1319  259.314   13.004  259.314   13.004 0.000000 0.000000 
1 1 1    0   24   42 o  124.269   23.974   13.217   4.0707   13.217   4.0707   13.217   4.0707  124.269   23.974  124.269   23.974 0.000000 0.000000 
1 1 1    0   24   43 o   38.033   25.081  -0.6750   3.7504  -0.6750   3.7504  -0.6750   3.7504   38.033   25.081   38.033   25.081 0.000000 0.000000 
1 1 1    0   24   44 o  448.588   10.954  154.905   7.5113  154.905   7.5113  154.905   7.5113  448.588   10.954  448.588   10.954 0.000000 0.000000 
1 1 1    0   24   45 o  131.055   27.383   15.016   4.8407   15.016   4.8407   15.016   4.8407  131.055   27.383  131.055   27.383 0.000000 0.000000 
1 1 1    0   24   46 o  581.279   10.689  259.986   9.5026  259.986   9.5026  259.986   9.5026  581.279   10.689  581.279   10.689 0.000000 0.000000 
1 1 1    0   24   47 o  304.734   14.488   72.154   6.7231   72.154   6.7231   72.154   6.7231  304.734   14.488  304.734   14.488 0.000000 0.000000 
1 1 1    0   24   48 o  351.152   13.023   95.450   6.9778   95.450   6.9778   95.450   6.9778  351.152   13.023  351.152   13.023 0.000000 0.000000 
1 1 1    0   24   49 o   77.963   48.610   4.8885   11.798   4.8885   11.798   4.8885   11.798   77.963   48.610   77.963   48.610 0.000000 0.000000 
1 1 1    0   24   51 o   79.401   40.263   7.7633   6.1061   7.7633   6.1061   7.7633   6.1061   79.401   40.263   79.401   40.263 0.000000 0.000000 
1 1 1    0   24   52 o  345.551   22.084   95.232   11.571   95.232   11.571   95.232   11.571  345.551   22.084  345.551   22.084 0.000000 0.000000 
1 1 1    0   24   53 o  270.721   25.599   59.962   10.390   59.962   10.390   59.962   10.390  270.721   25.599  270.721   25.599 0.000000 0.000000 
1 1 1    0   24   54 o   73.849   39.254   6.8753   5.9936   6.8753   5.9936   6.8753   5.9936   73.849   39.254   73.849   39.254 0.000000 0.000000 
1 1 1    0   24   55 o   90.126   40.796   10.045   6.0631   10.045   6.0631   10.045   6.0631   90.126   40.796   90.126   40.796 0.000000 0.000000 
1 1 1    0   24   56 o  174.253   24.984   25.854   6.2662   25.854   6.2662   25.854   6.2662  174.253   24.984  174.253   24.984 0.000000 0.000000 
1 1 1    0   24   57 o   88.252   42.869   10.330   6.7861   10.330   6.7861   10.330   6.7861   88.252   42.869   88.252   42.869 0.000000 0.000000 
1 1 1    0   25    2 f  466.168   14.011  166.867   9.9770  166.867   9.9770  166.867   9.9770  466.168   14.011  466.168   14.011 0.000000 0.000000 
1 1 1    0   25    3 o   99.562   40.094   10.569   5.9543   10.569   5.9543   10.569   5.9543   99.562   40.094   99.562   40.094 0.000000 0.000000 
1 1 1    0   25    4 o  224.281   19.472   39.406   6.5686   39.406   6.5686   39.406   6.5686  224.281   19.472  224.281   19.472 0.000000 0.000000 
1 1 1    0   25    5 o  502.167   14.386  193.596   11.037  193.596   11.037  193.596   11.037  502.167   14.386  502.167   14.386 0.000000 0.000000 
1 1 1    0   25    6 o  195.212   23.984   30.512   6.8764   30.512   6.8764   30.512   6.8764  195.212   23.984  195.212   23.984 0.000000 0.000000 
1 1 1    0   25    7 o  108.460   39.974   12.084   6.1438   12.084   6.1438   12.084   6.1438  108.460   39.974  108.460   39.974 0.000000 0.000000 
1 1 1    0   25    8 o  845.981   15.243  548.696   19.724  548.696   19.724  548.696   19.724  845.981   15.243  845.981   15.243 0.000000 0.000000 
1 1 1    0   25    9 o  708.471   14.800  384.934   16.034  384.934   16.034  384.934   16.034  708.471   14.800  708.471   14.800 0.000000 0.000000 
1 1 1    0   25   10 o   45.793   30.836  -2.7265   6.2034  -2.7265   6.2034  -2.7265   6.2034   45.793   30.836   45.793   30.836 0.000000 0.000000 
1 1 1    0   25   11 o  278.656   13.549   59.886   5.7479   59.886   5.7479   59.886   5.7479  278.656   13.549  278.656   13.549 0.000000 0.000000 
1 1 1    0   25   12 o  575.288   10.637  253.654   9.3589  253.654   9.3589  253.654   9.3589  575.288   10.637  575.288   10.637 0.000000 0.000000 
1 1 1    0   25   13 o  696.985   10.625  372.205   11.329  372.205   11.329  372.205   11.329  696.985   10.625  696.985   10.625 0.000000 0.000000 
1 1 1    0   25   14 o  592.829   10.588  269.346   9.6002  269.346   9.6002  269.346   9.6002  592.829   10.588  592.829   10.588 0.000000 0.000000 
1 1 1    0   25   15 o   65.857   36.085   4.6494   5.2152   4.6494   5.2152   4.6494   5.2152   65.857   36.085   65.857   36.085 0.000000 0.000000 
1 1 1    0   25   16 o  432.665   11.911  143.682   7.8744  143.682   7.8744  143.682   7.8744  432.665   11.911  432.665   11.911 0.000000 0.000000 
1 1 1    0   25   17 o  790.495   11.212  478.800   13.560  478.800   13.560  478.800   13.560  790.495   11.212  790.495   11.212 0.000000 0.000000 
1 1 1    0   25   18 o  273.346   20.584   58.267   8.5000   58.267   8.5000   58.267   8.5000  273.346   20.584  273.346   20.584 0.000000 0.000000 
1 1 1    0   25   19 o  451.200   16.075  156.609   11.070  156.609   11.070  156.609   11.070  451.200   16.075  451.200   16.075 0.000000 0.000000 
1 1 1    0   25   20 o  570.933   11.178  249.931   9.7596  249.931   9.7596  249.931   9.7596  570.933   11.178  570.933   11.178 0.000000 0.000000 
1 1 1    0   25   21 o  352.292   13.431   95.502   7.2184   95.502   7.2184   95.502   7.2184  352.292   13.431  352.292   13.431 0.000000 0.000000 
1 1 1    0   25   22 o  688.687   11.295  363.586   11.899  363.586   11.899  363.586   11.899  688.687   11.295  688.687   11.295 0.000000 0.000000 
1 1 1    0   25   23 o   92.941   40.654   9.5659   6.0241   9.5659   6.0241   9.5659   6.0241   92.941   40.654   92.941   40.654 0.000000 0.000000 
1 1 1    0   25   24 o  653.150   11.499  327.135   11.488  327.135   11.488  327.135   11.488  653.150   11.499  653.150   11.499 0.000000 0.000000 
1 1 1    0   25   25 o  403.851   13.627  125.446   8.4019  125.446   8.4019  125.446   8.4019  403.851   13.627  403.851   13.627 0.000000 0.000000 
1 1 1    0   25   26 o  234.247   19.773   43.035   6.9733   43.035   6.9733   43.035   6.9733  234.247   19.773  234.247   19.773 0.000000 0.000000 
1 1 1    0   25   27 o  393.914   13.568  119.398   8.1587  119.398   8.1587  119.398   8.1587  393.914   13.568  393.914   13.568 0.000000 0.000000 
1 1 1    0   25   28 o  329.275   15.125   83.711   7.5864   83.711   7.5864   83.711   7.5864  329.275   15.125  329.275   15.125 0.000000 0.000000 
1 1 1    0   25   29 o  165.636   47.474   25.985   10.435   25.985   10.435   25.985   10.435  165.636   47.474  165.636   47.474 0.000000 0.000000 
1 1 1    0   25   30 o  412.254   14.001  130.848   8.8117  130.848   8.8117  130.848   8.8117  412.254   14.001  412.254   14.001 0.000000 0.000000 
1 1 1    0   25   31 o  337.691   15.920   88.161   8.1871   88.161   8.1871   88.161   8.1871  337.691   15.920  337.691   15.920 0.000000 0.000000 
1 1 1    0   25   32 o  629.424   12.574  304.289   12.103  304.289   12.103  304.289   12.103  629.424   12.574  629.424   12.574 0.000000 0.000000 
1 1 1    0   25   33 o  167.976   29.954   23.808   6.9717   23.808   6.9717   23.808   6.9717  167.976   29.954  167.976   29.954 0.000000 0.000000 
1 1 1    0   25   34 o  797.856   12.718  488.953   15.523  488.953   15.523  488.953   15.523  797.856   12.718  797.856   12.718 0.000000 0.000000 
1 1 1    0   25   35 o  172.559   31.019   25.227   7.4056   25.227   7.4056   25.227   7.4056  172.559   31.019  172.559   31.019 0.000000 0.000000 
1 1 1    0   25   36 o  114.742   49.892   14.983   9.0747   14.983   9.0747   14.983   9.0747  114.742   49.892  114.742   49.892 0.000000 0.000000 
1 1 1    0   25   37 o   51.728   29.461   2.7314   3.6444   2.7314   3.6444   2.7314   3.6444   51.728   29.461   51.728   29.461 0.000000 0.000000 
1 1 1    0   25   38 o  269.668   11.808   56.165   4.8525   56.165   4.8525   56.165   4.8525  269.668   11.808  269.668   11.808 0.000000 0.000000 
1 1 1    0   25   39 o  315.222   11.006   76.567   5.2955   76.567   5.2955   76.567   5.2955  315.222   11.006  315.222   11.006 0.000000 0.000000 
1 1 1    0   25   40 o  147.858   18.882   17.686   4.0830   17.686   4.0830   17.686   4.0830  147.858   18.882  147.858   18.882 0.000000 0.000000 
1 1 1    0   25   41 o  379.973   10.683  111.132   6.2019  111.132   6.2019  111.132   6.2019  379.973   10.683  379.973   10.683 0.000000 0.000000 
1 1 1    0   25   42 f  321.988   11.765   80.008   5.7806   80.008   5.7806   80.008   5.7806  321.988   11.765  321.988   11.765 0.000000 0.000000 
1 1 1    0   25   43 o  110.422   29.548   11.323   4.3155   11.323   4.3155   11.323   4.3155  110.422   29.548  110.422   29.548 0.000000 0.000000 
1 1 1    0   25   44 o   68.892   35.079   5.5711   4.6461   5.5711   4.6461   5.5711   4.6461   68.892   35.079   68.892   35.079 0.000000 0.000000 
1 1 1    0   25   45 o  328.296   12.213   83.292   6.1178   83.292   6.1178   83.292   6.1178  328.296   12.213  328.296   12.213 0.000000 0.000000 
1 1 1    0   25   46 o  288.141   13.707   64.448   6.0140   64.448   6.0140   64.448   6.0140  288.141   13.707  288.141   13.707 0.000000 0.000000 
1 1 1    0   25   47 o  767.300   11.909  453.645   13.979  453.645   13.979  453.645   13.979  767.300   11.909  767.300   11.909 0.000000 0.000000 
1 1 1    0   25   48 o  279.897   30.215   64.426   12.563   64.426   12.563   64.426   12.563  279.897   30.215  279.897   30.215 0.000000 0.000000 
1 1 1    0   25   49 o  396.494   22.705  124.587   13.676  124.587   13.676  124.587   13.676  396.494   22.705  396.494   22.705 0.000000 0.000000 
1 1 1    0   25   50 o  142.117   30.992   18.123   5.9060   18.123   5.9060   18.123   5.9060  142.117   30.992  142.117   30.992 0.000000 0.000000 
1 1 1    0   25   51 o   98.049   37.434   10.550   5.2954   10.550   5.2954   10.550   5.2954   98.049   37.434   98.049   37.434 0.000000 0.000000 
1 1 1    0   25   52 o  304.471   15.986   72.717   7.4033   72.717   7.4033   72.717   7.4033  304.471   15.986  304.471   15.986 0.000000 0.000000 
1 1 1    0   25   53 o   53.179   33.436   1.7805   5.7063   1.7805   5.7063   1.7805   5.7063   53.179   33.436   53.179   33.436 0.000000 0.000000 
1 1 1    0   25   54 o   76.517   45.789   7.0669   9.5509   7.0669   9.5509   7.0669   9.5509   76.517   45.789   76.517   45.789 0.000000 0.000000 
1 1 1    0   25   55 o   69.032   38.483   6.0368   6.0483   6.0368   6.0483   6.0368   6.0483   69.032   38.483   69.032   38.483 0.000000 0.000000 
1 1 1    0   25   56 o  206.096   23.087   35.361   7.0485   35.361   7.0485   35.361   7.0485  206.096   23.087  206.096   23.087 0.000000 0.000000 
1 1 1    0   26    2 o  316.285   17.523   77.344   8.4235   77.344   8.4235   77.344   8.4235  316.285   17.523  316.285   17.523 0.000000 0.000000 
1 1 1    0   26    3 o   99.592   41.292   10.710   6.2627   10.710   6.2627   10.710   6.2627   99.592   41.292   99.592   41.292 0.000000 0.000000 
1 1 1    0   26    4 o  734.443   14.749  413.639   16.566  413.639   16.566  413.639   16.566  734.443   14.749  734.443   14.749 0.000000 0.000000 
1 1 1    0   26    5 o  1205.53   18.171  1114.33   33.512  1114.33   33.512  1114.33   33.512  1205.53   18.171  1205.53   18.171 0.000000 0.000000 
1 1 1    0   26    6 o  716.741   14.721  393.969   16.135  393.969   16.135  393.969   16.135  716.741   14.721  716.741   14.721 0.000000 0.000000 
1 1 1    0   26    7 o  977.561   16.277  732.692   24.340  732.692   24.340  732.692   24.340  977.561   16.277  977.561   16.277 0.000000 0.000000 
1 1 1    0   26    8 o  1412.97   20.159  1531.27   43.579  1531.27   43.579  1531.27   43.579  1412.97   20.159  1412.97   20.159 0.000000 0.000000 
1 1 1    0   26    9 o  1018.37   16.653  795.185   25.943  795.185   25.943  795.185   25.943  1018.37   16.653  1018.37   16.653 0.000000 0.000000 
1 1 1    0   26   10 o  307.685   18.515   73.335   8.6474   73.335   8.6474   73.335   8.6474  307.685   18.515  307.685   18.515 0.000000 0.000000 
1 1 1    0   26   11 o  1475.67   20.879  1670.56   47.138  1670.56   47.138  1670.56   47.138  1475.67   20.879  1475.67   20.879 0.000000 0.000000 
1 1 1    0   26   12 o  1292.40   13.569  1279.73   26.835  1279.73   26.835  1279.73   26.835  1292.40   13.569  1292.40   13.569 0.000000 0.000000 
1 1 1    0   26   13 o   95.977   38.621   9.8284   5.5261   9.8284   5.5261   9.8284   5.5261   95.977   38.621   95.977   38.621 0.000000 0.000000 
1 1 1    0   26   14 f  1240.17   13.237  1178.43   25.121  1178.43   25.121  1178.43   25.121  1240.17   13.237  1240.17   13.237 0.000000 0.000000 
1 1 1    0   26   15 o  1112.13   17.507  948.688   29.784  948.688   29.784  948.688   29.784  1112.13   17.507  1112.13   17.507 0.000000 0.000000 
1 1 1    0   26   16 o  163.621   34.010   23.049   7.5121   23.049   7.5121   23.049   7.5121  163.621   34.010  163.621   34.010 0.000000 0.000000 
1 1 1    0   26   17 o  771.806   11.126  456.482   13.137  456.482   13.137  456.482   13.137  771.806   11.126  771.806   11.126 0.000000 0.000000 
1 1 1    0   26   18 o  330.093   13.590   83.903   6.8398   83.903   6.8398   83.903   6.8398  330.093   13.590  330.093   13.590 0.000000 0.000000 
1 1 1    0   26   19 o  342.948   13.316   90.518   6.9662   90.518   6.9662   90.518   6.9662  342.948   13.316  342.948   13.316 0.000000 0.000000 
1 1 1    0   26   20 o  169.536   25.523   23.528   6.1799   23.528   6.1799   23.528   6.1799  169.536   25.523  169.536   25.523 0.000000 0.000000 
1 1 1    0   26   21 o   64.418   36.939   4.0845   5.7836   4.0845   5.7836   4.0845   5.7836   64.418   36.939   64.418   36.939 0.000000 0.000000 
1 1 1    0   26   22 o  150.625   29.090   19.277   5.9859   19.277   5.9859   19.277   5.9859  150.625   29.090  150.625   29.090 0.000000 0.000000 
1 1 1    0   26   23 o  628.692   11.446  303.135   11.007  303.135   11.007  303.135   11.007  628.692   11.446  628.692   11.446 0.000000 0.000000 
1 1 1    0   26   24 o  670.038   11.450  344.308   11.735  344.308   11.735  344.308   11.735  670.038   11.450  670.038   11.450 0.000000 0.000000 
1 1 1    0   26   25 o   59.471   35.689   2.8171   5.8358   2.8171   5.8358   2.8171   5.8358   59.471   35.689   59.471   35.689 0.000000 0.000000 
1 1 1    0   26   26 o   42.946   29.067  -2.7567   5.6466  -2.7567   5.6466  -2.7567   5.6466   42.946   29.067   42.946   29.067 0.000000 0.000000 
1 1 1    0   26   27 o  532.603   18.387  218.725   14.949  218.725   14.949  218.725   14.949  532.603   18.387  532.603   18.387 0.000000 0.000000 
1 1 1    0   26   28 o  147.909   51.587   22.353   10.562   22.353   10.562   22.353   10.562  147.909   51.587  147.909   51.587 0.000000 0.000000 
1 1 1    0   26   29 o   51.449   33.287  -0.1115   6.1659  -0.1115   6.1659  -0.1115   6.1659   51.449   33.287   51.449   33.287 0.000000 0.000000 
1 1 1    0   26   30 o  584.110   12.440  262.056   11.111  262.056   11.111  262.056   11.111  584.110   12.440  584.110   12.440 0.000000 0.000000 
1 1 1    0   26   31 o  471.570   13.483  171.091   9.7141  171.091   9.7141  171.091   9.7141  471.570   13.483  471.570   13.483 0.000000 0.000000 
1 1 1    0   26   32 o  105.986   42.501   12.162   6.6991   12.162   6.6991   12.162   6.6991  105.986   42.501  105.986   42.501 0.000000 0.000000 
1 1 1    0   26   33 o  253.166   20.179   50.335   7.7051   50.335   7.7051   50.335   7.7051  253.166   20.179  253.166   20.179 0.000000 0.000000 
1 1 1    0   26   34 o  191.949   26.950   30.180   7.4700   30.180   7.4700   30.180   7.4700  191.949   26.950  191.949   26.950 0.000000 0.000000 
1 1 1    0   26   35 o  510.904   17.562  201.784   13.696  201.784   13.696  201.784   13.696  510.904   17.562  510.904   17.562 0.000000 0.000000 
1 1 1    0   26   36 o  167.740   33.245   24.341   7.5846   24.341   7.5846   24.341   7.5846  167.740   33.245  167.740   33.245 0.000000 0.000000 
1 1 1    0   26   37 o   72.848   41.978   5.4975   7.5264   5.4975   7.5264   5.4975   7.5264   72.848   41.978   72.848   41.978 0.000000 0.000000 
1 1 1    0   26   38 o   88.195   30.459   7.8725   3.7044   7.8725   3.7044   7.8725   3.7044   88.195   30.459   88.195   30.459 0.000000 0.000000 
1 1 1    0   26   39 f  353.415   12.332   96.344   6.6527   96.344   6.6527   96.344   6.6527  353.415   12.332  353.415   12.332 0.000000 0.000000 
1 1 1    0   26   40 o  451.297   16.944  157.857   11.667  157.857   11.667  157.857   11.667  451.297   16.944  451.297   16.944 0.000000 0.000000 
1 1 1    0   26   41 o  174.031   15.983   23.940   4.1748   23.940   4.1748   23.940   4.1748  174.031   15.983  174.031   15.983 0.000000 0.000000 
1 1 1    0   26   42 o  151.561   18.182   18.506   4.0572   18.506   4.0572   18.506   4.0572  151.561   18.182  151.561   18.182 0.000000 0.000000 
1 1 1    0   26   43 o  418.990   12.785  135.505   8.1819  135.505   8.1819  135.505   8.1819  418.990   12.785  418.990   12.785 0.000000 0.000000 
1 1 1    0   26   44 o  141.665   49.954   21.370   9.8376   21.370   9.8376   21.370   9.8376  141.665   49.954  141.665   49.954 0.000000 0.000000 
1 1 1    0   26   45 o   61.453   32.368   4.3864   4.0475   4.3864   4.0475   4.3864   4.0475   61.453   32.368   61.453   32.368 0.000000 0.000000 
1 1 1    0   26   46 o   74.891   34.600   6.5241   4.3707   6.5241   4.3707   6.5241   4.3707   74.891   34.600   74.891   34.600 0.000000 0.000000 
1 1 1    0   26   47 o  132.017   55.495   20.759   11.284   20.759   11.284   20.759   11.284  132.017   55.495  132.017   55.495 0.000000 0.000000 
1 1 1    0   26   48 o  282.003   29.526   65.366   12.425   65.366   12.425   65.366   12.425  282.003   29.526  282.003   29.526 0.000000 0.000000 
1 1 1    0   26   49 o   53.093   32.687   2.1065   5.1708   2.1065   5.1708   2.1065   5.1708   53.093   32.687   53.093   32.687 0.000000 0.000000 
1 1 1    0   26   50 o   63.507   35.031   4.7285   4.9523   4.7285   4.9523   4.7285   4.9523   63.507   35.031   63.507   35.031 0.000000 0.000000 
1 1 1    0   26   51 o   52.290   32.234   2.0897   5.0424   2.0897   5.0424   2.0897   5.0424   52.290   32.234   52.290   32.234 0.000000 0.000000 
1 1 1    0   26   52 o   85.549   39.630   8.9454   5.7354   8.9454   5.7354   8.9454   5.7354   85.549   39.630   85.549   39.630 0.000000 0.000000 
1 1 1    0   26   53 o  154.191   27.942   20.836   5.9522   20.836   5.9522   20.836   5.9522  154.191   27.942  154.191   27.942 0.000000 0.000000 
1 1 1    0   26   54 o  162.220   25.505   22.598   5.8651   22.598   5.8651   22.598   5.8651  162.220   25.505  162.220   25.505 0.000000 0.000000 
1 1 1    0   26   55 o   55.663   35.200   2.1994   6.4270   2.1994   6.4270   2.1994   6.4270   55.663   35.200   55.663   35.200 0.000000 0.000000 
1 1 1    0   27    2 o  1365.69   19.836  1430.56   41.445  1430.56   41.445  1430.56   41.445  1365.69   19.836  1365.69   19.836 0.000000 0.000000 
1 1 1    0   27    3 o   78.535   42.457   6.7321   7.1242   6.7321   7.1242   6.7321   7.1242   78.535   42.457   78.535   42.457 0.000000 0.000000 
1 1 1    0   27    4 o  180.838   30.335   27.124   7.6866   27.124   7.6866   27.124   7.6866  180.838   30.335  180.838   30.335 0.000000 0.000000 
1 1 1    0   27    5 o  781.348   15.369  468.227   18.365  468.227   18.365  468.227   18.365  781.348   15.369  781.348   15.369 0.000000 0.000000 
1 1 1    0   27    6 o  694.652   14.966  370.158   15.896  370.158   15.896  370.158   15.896  694.652   14.966  694.652   14.966 0.000000 0.000000 
1 1 1    0   27    7 o  526.174   15.041  212.608   12.091  212.608   12.091  212.608   12.091  526.174   15.041  526.174   15.041 0.000000 0.000000 
1 1 1    0   27    8 o  268.660   20.342   56.281   8.2547   56.281   8.2547   56.281   8.2547  268.660   20.342  268.660   20.342 0.000000 0.000000 
1 1 1    0   27    9 o  1938.99   25.776  2887.48   76.470  2887.48   76.470  2887.48   76.470  1938.99   25.776  1938.99   25.776 0.000000 0.000000 
1 1 1    0   27   10 o  148.748   39.093   20.160   7.6901   20.160   7.6901   20.160   7.6901  148.748   39.093  148.748   39.093 0.000000 0.000000 
1 1 1    0   27   11 o  1931.40   26.113  2865.83   77.164  2865.83   77.164  2865.83   77.164  1931.40   26.113  1931.40   26.113 0.000000 0.000000 
1 1 1    0   27   12 o  1008.84   16.908  780.691   26.092  780.691   26.092  780.691   26.092  1008.84   16.908  1008.84   16.908 0.000000 0.000000 
1 1 1    0   27   13 o  586.159   15.272  263.807   13.681  263.807   13.681  263.807   13.681  586.159   15.272  586.159   15.272 0.000000 0.000000 
1 1 1    0   27   14 o  721.837   11.125  399.325   12.285  399.325   12.285  399.325   12.285  721.837   11.125  721.837   11.125 0.000000 0.000000 
1 1 1    0   27   15 o  636.036   10.922  310.093   10.626  310.093   10.626  310.093   10.626  636.036   10.922  636.036   10.922 0.000000 0.000000 
1 1 1    0   27   16 o  305.342   14.758   71.948   6.8608   71.948   6.8608   71.948   6.8608  305.342   14.758  305.342   14.758 0.000000 0.000000 
1 1 1    0   27   17 o   36.647   25.560  -4.9832   5.2032  -4.9832   5.2032  -4.9832   5.2032   36.647   25.560   36.647   25.560 0.000000 0.000000 
1 1 1    0   27   18 o  879.645   11.633  593.063   15.657  593.063   15.657  593.063   15.657  879.645   11.633  879.645   11.633 0.000000 0.000000 
1 1 1    0   27   19 o  477.923   11.979  175.326   8.7506  175.326   8.7506  175.326   8.7506  477.923   11.979  477.923   11.979 0.000000 0.000000 
1 1 1    0   27   20 o  121.996   36.011   14.088   5.8459   14.088   5.8459   14.088   5.8459  121.996   36.011  121.996   36.011 0.000000 0.000000 
1 1 1    0   27   21 o  166.336   24.785   22.638   5.8978   22.638   5.8978   22.638   5.8978  166.336   24.785  166.336   24.785 0.000000 0.000000 
1 1 1    0   27   22 o  262.078   17.100   53.375   6.7924   53.375   6.7924   53.375   6.7924  262.078   17.100  262.078   17.100 0.000000 0.000000 
1 1 1    0   27   23 o  333.754   14.227   85.886   7.2381   85.886   7.2381   85.886   7.2381  333.754   14.227  333.754   14.227 0.000000 0.000000 
1 1 1    0   27   24 o   36.378   25.600  -6.2912   5.5716  -6.2912   5.5716  -6.2912   5.5716   36.378   25.600   36.378   25.600 0.000000 0.000000 
1 1 1    0   27   25 o  443.045   18.659  151.621   12.603  151.621   12.603  151.621   12.603  443.045   18.659  443.045   18.659 0.000000 0.000000 
1 1 1    0   27   26 o  438.294   19.123  148.515   12.773  148.515   12.773  148.515   12.773  438.294   19.123  438.294   19.123 0.000000 0.000000 
1 1 1    0   27   27 o  144.462   33.454   18.496   6.4357   18.496   6.4357   18.496   6.4357  144.462   33.454  144.462   33.454 0.000000 0.000000 
1 1 1    0   27   28 o  274.116   17.676   58.469   7.3457   58.469   7.3457   58.469   7.3457  274.116   17.676  274.116   17.676 0.000000 0.000000 
1 1 1    0   27   29 o   40.412   28.082  -5.3311   6.1247  -5.3311   6.1247  -5.3311   6.1247   40.412   28.082   40.412   28.082 0.000000 0.000000 
1 1 1    0   27   30 o  245.162   19.744   47.172   7.2986   47.172   7.2986   47.172   7.2986  245.162   19.744  245.162   19.744 0.000000 0.000000 
1 1 1    0   27   31 o  218.813   22.034   38.043   7.2082   38.043   7.2082   38.043   7.2082  218.813   22.034  218.813   22.034 0.000000 0.000000 
1 1 1    0   27   32 o   53.835   35.073  -0.4271   7.0073  -0.4271   7.0073  -0.4271   7.0073   53.835   35.073   53.835   35.073 0.000000 0.000000 
1 1 1    0   27   33 o  255.623   25.920   52.187   9.9025   52.187   9.9025   52.187   9.9025  255.623   25.920  255.623   25.920 0.000000 0.000000 
1 1 1    0   27   34 o  253.695   26.576   51.585   10.061   51.585   10.061   51.585   10.061  253.695   26.576  253.695   26.576 0.000000 0.000000 
1 1 1    0   27   35 o  409.158   15.667  129.427   9.7792  129.427   9.7792  129.427   9.7792  409.158   15.667  409.158   15.667 0.000000 0.000000 
1 1 1    0   27   36 o  160.334   34.069   22.587   7.3504   22.587   7.3504   22.587   7.3504  160.334   34.069  160.334   34.069 0.000000 0.000000 
1 1 1    0   27   37 o  104.311   45.569   12.437   7.5690   12.437   7.5690   12.437   7.5690  104.311   45.569  104.311   45.569 0.000000 0.000000 
1 1 1    0   27   38 o  324.568   19.083   82.269   9.4053   82.269   9.4053   82.269   9.4053  324.568   19.083  324.568   19.083 0.000000 0.000000 
1 1 1    0   27   39 o  190.150   15.383   28.402   4.4099   28.402   4.4099   28.402   4.4099  190.150   15.383  190.150   15.383 0.000000 0.000000 
1 1 1    0   27   40 o  148.772   19.055   17.932   4.1443   17.932   4.1443   17.932   4.1443  148.772   19.055  148.772   19.055 0.000000 0.000000 
1 1 1    0   27   41 o   72.413   32.505   5.9664   3.8475   5.9664   3.8475   5.9664   3.8475   72.413   32.505   72.413   32.505 0.000000 0.000000 
1 1 1    0   27   42 o  167.006   19.610   22.485   4.8318   22.485   4.8318   22.485   4.8318  167.006   19.610  167.006   19.610 0.000000 0.000000 
1 1 1    0   27   43 o  192.997   15.919   29.348   4.6289   29.348   4.6289   29.348   4.6289  192.997   15.919  192.997   15.919 0.000000 0.000000 
1 1 1    0   27   44 o  321.934   12.440   80.159   6.1090   80.159   6.1090   80.159   6.1090  321.934   12.440  321.934   12.440 0.000000 0.000000 
1 1 1    0   27   45 o   87.325   35.351   8.4155   4.6218   8.4155   4.6218   8.4155   4.6218   87.325   35.351   87.325   35.351 0.000000 0.000000 
1 1 1    0   27   46 o  105.757   52.774   14.201   10.399   14.201   10.399   14.201   10.399  105.757   52.774  105.757   52.774 0.000000 0.000000 
1 1 1    0   27   47 o  267.436   28.793   58.746   11.441   58.746   11.441   58.746   11.441  267.436   28.793  267.436   28.793 0.000000 0.000000 
1 1 1    0   27   48 o  343.546   14.568   91.848   7.6291   91.848   7.6291   91.848   7.6291  343.546   14.568  343.546   14.568 0.000000 0.000000 
1 1 1    0   27   49 o   73.019   36.655   6.4886   5.0312   6.4886   5.0312   6.4886   5.0312   73.019   36.655   73.019   36.655 0.000000 0.000000 
1 1 1    0   27   50 o   66.686   35.718   5.3753   4.9985   5.3753   4.9985   5.3753   4.9985   66.686   35.718   66.686   35.718 0.000000 0.000000 
1 1 1    0   27   51 o  103.515   38.066   11.681   5.5777   11.681   5.5777   11.681   5.5777  103.515   38.066  103.515   38.066 0.000000 0.000000 
1 1 1    0   27   52 o  155.035   45.156   24.779   9.3030   24.779   9.3030   24.779   9.3030  155.035   45.156  155.035   45.156 0.000000 0.000000 
1 1 1    0   27   53 o  129.492   34.202   16.231   5.8567   16.231   5.8567   16.231   5.8567  129.492   34.202  129.492   34.202 0.000000 0.000000 
1 1 1    0   27   54 o  154.741   31.161   21.766   6.5414   21.766   6.5414   21.766   6.5414  154.741   31.161  154.741   31.161 0.000000 0.000000 
1 1 1    0   28    1 o  523.941   14.940  210.820   11.959  210.820   11.959  210.820   11.959  523.941   14.940  523.941   14.940 0.000000 0.000000 
1 1 1    0   28    2 o  626.975   14.684  301.641   14.074  301.641   14.074  301.641   14.074  626.975   14.684  626.975   14.684 0.000000 0.000000 
1 1 1    0   28    3 o  679.774   14.971  354.534   15.560  354.534   15.560  354.534   15.560  679.774   14.971  679.774   14.971 0.000000 0.000000 
1 1 1    0   28    4 o  385.368   16.691  114.445   9.8035  114.445   9.8035  114.445   9.8035  385.368   16.691  385.368   16.691 0.000000 0.000000 
1 1 1    0   28    5 o  448.458   16.335  154.727   11.179  154.727   11.179  154.727   11.179  448.458   16.335  448.458   16.335 0.000000 0.000000 
1 1 1    0   28    6 o  215.397   26.268   37.176   8.3163   37.176   8.3163   37.176   8.3163  215.397   26.268  215.397   26.268 0.000000 0.000000 
1 1 1    0   28   11 o  245.148   23.138   47.350   8.5045   47.350   8.5045   47.350   8.5045  245.148   23.138  245.148   23.138 0.000000 0.000000 
1 1 1    0   28   12 o  972.068   16.866  725.069   25.077  725.069   25.077  725.069   25.077  972.068   16.866  972.068   16.866 0.000000 0.000000 
1 1 1    0   28   13 o  764.629   11.132  448.087   13.022  448.087   13.022  448.087   13.022  764.629   11.132  764.629   11.132 0.000000 0.000000 
1 1 1    0   28   14 o  439.472   12.003  148.284   8.0607  148.284   8.0607  148.284   8.0607  439.472   12.003  439.472   12.003 0.000000 0.000000 
1 1 1    0   28   15 o  864.463   11.551  572.766   15.278  572.766   15.278  572.766   15.278  864.463   11.551  864.463   11.551 0.000000 0.000000 
1 1 1    0   28   16 f   93.011   38.751   9.3945   5.5103   9.3945   5.5103   9.3945   5.5103   93.011   38.751   93.011   38.751 0.000000 0.000000 
1 1 1    0   28   17 o  665.811   11.328  339.909   11.537  339.909   11.537  339.909   11.537  665.811   11.328  665.811   11.328 0.000000 0.000000 
1 1 1    0   28   18 f   70.013   37.606   5.4173   5.5556   5.4173   5.5556   5.4173   5.5556   70.013   37.606   70.013   37.606 0.000000 0.000000 
1 1 1    0   28   19 o  488.688   11.799  183.317   8.8141  183.317   8.8141  183.317   8.8141  488.688   11.799  488.688   11.799 0.000000 0.000000 
1 1 1    0   28   20 o  426.666   12.403  139.878   8.0843  139.878   8.0843  139.878   8.0843  426.666   12.403  426.666   12.403 0.000000 0.000000 
1 1 1    0   28   21 o  460.353   12.117  162.768   8.5248  162.768   8.5248  162.768   8.5248  460.353   12.117  460.353   12.117 0.000000 0.000000 
1 1 1    0   28   22 o  469.403   12.142  169.236   8.7109  169.236   8.7109  169.236   8.7109  469.403   12.142  469.403   12.142 0.000000 0.000000 
1 1 1    0   28   23 o  754.625   16.945  437.921   19.550  437.921   19.550  437.921   19.550  754.625   16.945  754.625   16.945 0.000000 0.000000 
1 1 1    0   28   24 o  180.930   40.562   28.903   9.8071   28.903   9.8071   28.903   9.8071  180.930   40.562  180.930   40.562 0.000000 0.000000 
1 1 1    0   28   25 o  195.599   22.843   30.645   6.5952   30.645   6.5952   30.645   6.5952  195.599   22.843  195.599   22.843 0.000000 0.000000 
1 1 1    0   28   26 o   69.408   39.180   5.0324   6.3699   5.0324   6.3699   5.0324   6.3699   69.408   39.180   69.408   39.180 0.000000 0.000000 
1 1 1    0   28   27 o  232.761   19.606   42.569   6.8709   42.569   6.8709   42.569   6.8709  232.761   19.606  232.761   19.606 0.000000 0.000000 
1 1 1    0   28   28 o  173.580   26.519   24.841   6.5574   24.841   6.5574   24.841   6.5574  173.580   26.519  173.580   26.519 0.000000 0.000000 
1 1 1    0   28   29 f   50.798   33.165  -0.5656   6.3166  -0.5656   6.3166  -0.5656   6.3166   50.798   33.165   50.798   33.165 0.000000 0.000000 
1 1 1    0   28   30 o  515.029   13.215  204.049   10.402  204.049   10.402  204.049   10.402  515.029   13.215  515.029   13.215 0.000000 0.000000 
1 1 1    0   28   31 o  311.789   18.041   75.611   8.5439   75.611   8.5439   75.611   8.5439  311.789   18.041  311.789   18.041 0.000000 0.000000 
1 1 1    0   28   32 f  386.463   19.841  116.139   11.666  116.139   11.666  116.139   11.666  386.463   19.841  386.463   19.841 0.000000 0.000000 
1 1 1    0   28   33 o   60.600   37.531   2.2681   6.9147   2.2681   6.9147   2.2681   6.9147   60.600   37.531   60.600   37.531 0.000000 0.000000 
1 1 1    0   28   34 o  174.193   31.184   25.787   7.5212   25.787   7.5212   25.787   7.5212  174.193   31.184  174.193   31.184 0.000000 0.000000 
1 1 1    0   28   35 o  116.763   44.836   14.683   7.5789   14.683   7.5789   14.683   7.5789  116.763   44.836  116.763   44.836 0.000000 0.000000 
1 1 1    0   28   36 o  121.189   45.388   15.681   7.8561   15.681   7.8561   15.681   7.8561  121.189   45.388  121.189   45.388 0.000000 0.000000 
1 1 1    0   28   37 o   79.689   43.329   7.3390   7.4593   7.3390   7.4593   7.3390   7.4593   79.689   43.329   79.689   43.329 0.000000 0.000000 
1 1 1    0   28   38 o  192.248   30.164   30.961   8.2235   30.961   8.2235   30.961   8.2235  192.248   30.164  192.248   30.164 0.000000 0.000000 
1 1 1    0   28   39 o   84.695   44.630   8.5376   7.6978   8.5376   7.6978   8.5376   7.6978   84.695   44.630   84.695   44.630 0.000000 0.000000 
1 1 1    0   28   40 o  505.103   12.014  196.529   9.2763  196.529   9.2763  196.529   9.2763  505.103   12.014  505.103   12.014 0.000000 0.000000 
1 1 1    0   28   41 o  111.007   31.136   11.642   4.5789   11.642   4.5789   11.642   4.5789  111.007   31.136  111.007   31.136 0.000000 0.000000 
1 1 1    0   28   42 o  305.308   23.053   73.940   10.632   73.940   10.632   73.940   10.632  305.308   23.053  305.308   23.053 0.000000 0.000000 
1 1 1    0   28   43 o  231.964   14.043   41.949   4.9441   41.949   4.9441   41.949   4.9441  231.964   14.043  231.964   14.043 0.000000 0.000000 
1 1 1    0   28   44 o  214.813   14.776   36.134   4.8056   36.134   4.8056   36.134   4.8056  214.813   14.776  214.813   14.776 0.000000 0.000000 
1 1 1    0   28   46 o  242.915   33.610   49.957   11.814   49.957   11.814   49.957   11.814  242.915   33.610  242.915   33.610 0.000000 0.000000 
1 1 1    0   28   47 o  202.625   19.646   32.931   5.9617   32.931   5.9617   32.931   5.9617  202.625   19.646  202.625   19.646 0.000000 0.000000 
1 1 1    0   28   48 o   40.234   27.358  -2.4070   5.1220  -2.4070   5.1220  -2.4070   5.1220   40.234   27.358   40.234   27.358 0.000000 0.000000 
1 1 1    0   28   49 o   84.621   48.730   8.9451   10.132   8.9451   10.132   8.9451   10.132   84.621   48.730   84.621   48.730 0.000000 0.000000 
1 1 1    0   28   50 o  126.651   31.410   14.961   5.2700   14.961   5.2700   14.961   5.2700  126.651   31.410  126.651   31.410 0.000000 0.000000 
1 1 1    0   28   51 o  202.006   19.620   33.021   5.9349   33.021   5.9349   33.021   5.9349  202.006   19.620  202.006   19.620 0.000000 0.000000 
1 1 1    0   28   52 o   79.361   38.847   7.9888   5.5903   7.9888   5.5903   7.9888   5.5903   79.361   38.847   79.361   38.847 0.000000 0.000000 
1 1 1    0   28   53 o   98.163   42.463   11.889   6.5754   11.889   6.5754   11.889   6.5754   98.163   42.463   98.163   42.463 0.000000 0.000000 
1 1 1    0   29    5 o  1072.51   17.461  882.619   28.647  882.619   28.647  882.619   28.647  1072.51   17.461  1072.51   17.461 0.000000 0.000000 
1 1 1    0   29    6 o  423.727   16.484  138.256   10.654  138.256   10.654  138.256   10.654  423.727   16.484  423.727   16.484 0.000000 0.000000 
1 1 1    0   29    7 o  1144.98   18.038  1006.10   31.595  1006.10   31.595  1006.10   31.595  1144.98   18.038  1144.98   18.038 0.000000 0.000000 
1 1 1    0   29    8 o  1053.84   17.467  852.313   28.158  852.313   28.158  852.313   28.158  1053.84   17.467  1053.84   17.467 0.000000 0.000000 
1 1 1    0   29    9 f  1202.82   18.604  1110.57   34.233  1110.57   34.233  1110.57   34.233  1202.82   18.604  1202.82   18.604 0.000000 0.000000 
1 1 1    0   29   10 o  103.455   45.515   11.896   7.5491   11.896   7.5491   11.896   7.5491  103.455   45.515  103.455   45.515 0.000000 0.000000 
1 1 1    0   29   11 o  422.404   17.092  137.503   11.010  137.503   11.010  137.503   11.010  422.404   17.092  422.404   17.092 0.000000 0.000000 
1 1 1    0   29   12 o  119.310   45.980   15.002   7.9587   15.002   7.9587   15.002   7.9587  119.310   45.980  119.310   45.980 0.000000 0.000000 
1 1 1    0   29   13 o  256.146   23.210   51.641   8.9280   51.641   8.9280   51.641   8.9280  256.146   23.210  256.146   23.210 0.000000 0.000000 
1 1 1    0   29   14 o  1340.96   14.137  1378.87   29.009  1378.87   29.009  1378.87   29.009  1340.96   14.137  1340.96   14.137 0.000000 0.000000 
1 1 1    0   29   15 o  419.044   12.105  134.891   7.7492  134.891   7.7492  134.891   7.7492  419.044   12.105  419.044   12.105 0.000000 0.000000 
1 1 1    0   29   16 o  101.672   37.945   10.727   5.5007   10.727   5.5007   10.727   5.5007  101.672   37.945  101.672   37.945 0.000000 0.000000 
1 1 1    0   29   17 o   56.906   34.295   2.4823   5.4346   2.4823   5.4346   2.4823   5.4346   56.906   34.295   56.906   34.295 0.000000 0.000000 
1 1 1    0   29   18 o  104.562   37.413   11.153   5.4696   11.153   5.4696   11.153   5.4696  104.562   37.413  104.562   37.413 0.000000 0.000000 
1 1 1    0   29   19 o  589.561   11.358  266.667   10.241  266.667   10.241  266.667   10.241  589.561   11.358  589.561   11.358 0.000000 0.000000 
1 1 1    0   29   20 f  376.216   13.355  108.945   7.6683  108.945   7.6683  108.945   7.6683  376.216   13.355  376.216   13.355 0.000000 0.000000 
1 1 1    0   29   21 o  1293.11   19.876  1286.56   39.319  1286.56   39.319  1286.56   39.319  1293.11   19.876  1293.11   19.876 0.000000 0.000000 
1 1 1    0   29   22 o   44.287   31.228  -9.7504   8.4208  -9.7504   8.4208  -9.7504   8.4208   44.287   31.228   44.287   31.228 0.000000 0.000000 
1 1 1    0   29   23 f  514.094   12.202  203.003   9.5895  203.003   9.5895  203.003   9.5895  514.094   12.202  514.094   12.202 0.000000 0.000000 
1 1 1    0   29   24 o  307.755   16.289   73.358   7.6238   73.358   7.6238   73.358   7.6238  307.755   16.289  307.755   16.289 0.000000 0.000000 
1 1 1    0   29   25 o  130.460   35.992   15.849   6.2156   15.849   6.2156   15.849   6.2156  130.460   35.992  130.460   35.992 0.000000 0.000000 
1 1 1    0   29   26 o  738.970   11.965  419.190   13.526  419.190   13.526  419.190   13.526  738.970   11.965  738.970   11.965 0.000000 0.000000 
1 1 1    0   29   27 o   64.567   37.331   4.1014   5.9836   4.1014   5.9836   4.1014   5.9836   64.567   37.331   64.567   37.331 0.000000 0.000000 
1 1 1    0   29   28 o  271.694   17.796   57.531   7.3279   57.531   7.3279   57.531   7.3279  271.694   17.796  271.694   17.796 0.000000 0.000000 
1 1 1    0   29   29 o  589.429   12.750  267.089   11.491  267.089   11.491  267.089   11.491  589.429   12.750  589.429   12.750 0.000000 0.000000 
1 1 1    0   29   30 o  675.638   17.031  352.087   17.587  352.087   17.587  352.087   17.587  675.638   17.031  675.638   17.031 0.000000 0.000000 
1 1 1    0   29   31 f   79.965   41.806   7.4167   6.7147   7.4167   6.7147   7.4167   6.7147   79.965   41.806   79.965   41.806 0.000000 0.000000 
1 1 1    0   29   32 o  431.013   14.566  143.366   9.5847  143.366   9.5847  143.366   9.5847  431.013   14.566  431.013   14.566 0.000000 0.000000 
1 1 1    0   29   33 o  186.206   28.421   28.789   7.5401   28.789   7.5401   28.789   7.5401  186.206   28.421  186.206   28.421 0.000000 0.000000 
1 1 1    0   29   34 f  155.243   36.996   21.795   7.6285   21.795   7.6285   21.795   7.6285  155.243   36.996  155.243   36.996 0.000000 0.000000 
1 1 1    0   29   35 o  375.799   17.304  109.643   9.9056  109.643   9.9056  109.643   9.9056  375.799   17.304  375.799   17.304 0.000000 0.000000 
1 1 1    0   29   36 o   77.660   43.284   6.7916   7.6494   6.7916   7.6494   6.7916   7.6494   77.660   43.284   77.660   43.284 0.000000 0.000000 
1 1 1    0   29   37 o  320.272   19.096   80.190   9.2851   80.190   9.2851   80.190   9.2851  320.272   19.096  320.272   19.096 0.000000 0.000000 
1 1 1    0   29   38 o   93.286   45.842   10.432   7.7975   10.432   7.7975   10.432   7.7975   93.286   45.842   93.286   45.842 0.000000 0.000000 
1 1 1    0   29   39 o  126.945   64.191   20.743   15.495   20.743   15.495   20.743   15.495  126.945   64.191  126.945   64.191 0.000000 0.000000 
1 1 1    0   29   40 o  251.715   13.190   49.188   5.0501   49.188   5.0501   49.188   5.0501  251.715   13.190  251.715   13.190 0.000000 0.000000 
1 1 1    0   29   41 o  163.554   17.115   21.352   4.1771   21.352   4.1771   21.352   4.1771  163.554   17.115  163.554   17.115 0.000000 0.000000 
1 1 1    0   29   42 o  151.842   18.921   18.683   4.2132   18.683   4.2132   18.683   4.2132  151.842   18.921  151.842   18.921 0.000000 0.000000 
1 1 1    0   29   43 o  111.708   50.643   15.073   9.3450   15.073   9.3450   15.073   9.3450  111.708   50.643  111.708   50.643 0.000000 0.000000 
1 1 1    0   29   44 o  197.878   38.852   34.853   10.473   34.853   10.473   34.853   10.473  197.878   38.852  197.878   38.852 0.000000 0.000000 
1 1 1    0   29   45 o   40.577   26.787  -0.6864   4.2964  -0.6864   4.2964  -0.6864   4.2964   40.577   26.787   40.577   26.787 0.000000 0.000000 
1 1 1    0   29   46 o  191.914   20.301   29.725   5.8108   29.725   5.8108   29.725   5.8108  191.914   20.301  191.914   20.301 0.000000 0.000000 
1 1 1    0   29   47 o  197.729   19.797   31.474   5.8539   31.474   5.8539   31.474   5.8539  197.729   19.797  197.729   19.797 0.000000 0.000000 
1 1 1    0   29   48 o   31.720   22.608  -6.5937   4.8453  -6.5937   4.8453  -6.5937   4.8453   31.720   22.608   31.720   22.608 0.000000 0.000000 
1 1 1    0   29   49 o  166.614   48.388   28.616   10.710   28.616   10.710   28.616   10.710  166.614   48.388  166.614   48.388 0.000000 0.000000 
1 1 1    0   29   50 o  127.001   32.904   15.365   5.5277   15.365   5.5277   15.365   5.5277  127.001   32.904  127.001   32.904 0.000000 0.000000 
1 1 1    0   29   51 o   83.511   47.435   9.4425   9.4147   9.4425   9.4147   9.4425   9.4147   83.511   47.435   83.511   47.435 0.000000 0.000000 
1 1 1    0   29   52 o   37.447   26.131  -4.4106   5.4556  -4.4106   5.4556  -4.4106   5.4556   37.447   26.131   37.447   26.131 0.000000 0.000000 
1 1 1    0   30    1 o  812.452   15.840  506.626   19.681  506.626   19.681  506.626   19.681  812.452   15.840  812.452   15.840 0.000000 0.000000 
1 1 1    0   30    2 o  284.919   20.059   63.218   8.6482   63.218   8.6482   63.218   8.6482  284.919   20.059  284.919   20.059 0.000000 0.000000 
1 1 1    0   30    3 o  447.681   16.093  154.256   10.995  154.256   10.995  154.256   10.995  447.681   16.093  447.681   16.093 0.000000 0.000000 
1 1 1    0   30    4 o  241.384   22.262   45.872   8.0643   45.872   8.0643   45.872   8.0643  241.384   22.262  241.384   22.262 0.000000 0.000000 
1 1 1    0   30    5 o  328.916   18.492   83.782   9.2423   83.782   9.2423   83.782   9.2423  328.916   18.492  328.916   18.492 0.000000 0.000000 
1 1 1    0   30    6 o  709.553   15.422  386.534   16.732  386.534   16.732  386.534   16.732  709.553   15.422  709.553   15.422 0.000000 0.000000 
1 1 1    0   30    7 o   54.316   35.615  -1.0823   7.4006  -1.0823   7.4006  -1.0823   7.4006   54.316   35.615   54.316   35.615 0.000000 0.000000 
1 1 1    0   30    8 o  995.925   17.113  761.492   26.069  761.492   26.069  761.492   26.069  995.925   17.113  995.925   17.113 0.000000 0.000000 
1 1 1    0   30    9 o  640.940   15.641  315.571   15.324  315.571   15.324  315.571   15.324  640.940   15.641  640.940   15.641 0.000000 0.000000 
1 1 1    0   30   10 o  777.645   15.957  464.368   18.975  464.368   18.975  464.368   18.975  777.645   15.957  777.645   15.957 0.000000 0.000000 
1 1 1    0   30   11 o  418.883   16.720  135.245   10.681  135.245   10.681  135.245   10.681  418.883   16.720  418.883   16.720 0.000000 0.000000 
1 1 1    0   30   12 o  507.862   16.488  198.490   12.786  198.490   12.786  198.490   12.786  507.862   16.488  507.862   16.488 0.000000 0.000000 
1 1 1    0   30   13 o  186.744   31.670   29.091   8.2707   29.091   8.2707   29.091   8.2707  186.744   31.670  186.744   31.670 0.000000 0.000000 
1 1 1    0   30   14 o  473.425   16.543  172.609   11.954  172.609   11.954  172.609   11.954  473.425   16.543  473.425   16.543 0.000000 0.000000 
1 1 1    0   30   15 o  452.876   12.124  157.533   8.3907  157.533   8.3907  157.533   8.3907  452.876   12.124  452.876   12.124 0.000000 0.000000 
1 1 1    0   30   16 o  496.493   11.820  189.252   8.9707  189.252   8.9707  189.252   8.9707  496.493   11.820  496.493   11.820 0.000000 0.000000 
1 1 1    0   30   17 o  278.330   15.784   60.018   6.6750   60.018   6.6750   60.018   6.6750  278.330   15.784  278.330   15.784 0.000000 0.000000 
1 1 1    0   30   18 o  999.814   17.540  768.456   26.824  768.456   26.824  768.456   26.824  999.814   17.540  999.814   17.540 0.000000 0.000000 
1 1 1    0   30   19 o  374.289   19.084  108.516   10.869  108.516   10.869  108.516   10.869  374.289   19.084  374.289   19.084 0.000000 0.000000 
1 1 1    0   30   20 o  787.345   11.784  475.582   14.194  475.582   14.194  475.582   14.194  787.345   11.784  787.345   11.784 0.000000 0.000000 
1 1 1    0   30   21 o  387.584   13.459  115.659   7.9625  115.659   7.9625  115.659   7.9625  387.584   13.459  387.584   13.459 0.000000 0.000000 
1 1 1    0   30   22 o  927.321   12.260  659.853   17.395  659.853   17.395  659.853   17.395  927.321   12.260  927.321   12.260 0.000000 0.000000 
1 1 1    0   30   23 o  627.783   11.986  302.595   11.508  302.595   11.508  302.595   11.508  627.783   11.986  627.783   11.986 0.000000 0.000000 
1 1 1    0   30   24 o  465.845   13.160  166.932   9.3666  166.932   9.3666  166.932   9.3666  465.845   13.160  465.845   13.160 0.000000 0.000000 
1 1 1    0   30   25 o  337.753   15.124   88.160   7.7832   88.160   7.7832   88.160   7.7832  337.753   15.124  337.753   15.124 0.000000 0.000000 
1 1 1    0   30   27 o  564.048   12.741  244.604   10.987  244.604   10.987  244.604   10.987  564.048   12.741  564.048   12.741 0.000000 0.000000 
1 1 1    0   30   28 o  236.789   26.823   45.119   9.3998   45.119   9.3998   45.119   9.3998  236.789   26.823  236.789   26.823 0.000000 0.000000 
1 1 1    0   30   29 o  259.371   19.691   52.788   7.7139   52.788   7.7139   52.788   7.7139  259.371   19.691  259.371   19.691 0.000000 0.000000 
1 1 1    0   30   30 o  341.170   16.421   90.243   8.5300   90.243   8.5300   90.243   8.5300  341.170   16.421  341.170   16.421 0.000000 0.000000 
1 1 1    0   30   31 o  127.096   41.135   16.097   7.0730   16.097   7.0730   16.097   7.0730  127.096   41.135  127.096   41.135 0.000000 0.000000 
1 1 1    0   30   32 o  359.089   16.743  100.022   9.1571  100.022   9.1571  100.022   9.1571  359.089   16.743  359.089   16.743 0.000000 0.000000 
1 1 1    0   30   33 f   71.616   40.861   5.4494   7.0271   5.4494   7.0271   5.4494   7.0271   71.616   40.861   71.616   40.861 0.000000 0.000000 
1 1 1    0   30   34 f   92.193   44.815   10.068   7.4185   10.068   7.4185   10.068   7.4185   92.193   44.815   92.193   44.815 0.000000 0.000000 
1 1 1    0   30   35 o   73.711   42.642   5.6641   7.8142   5.6641   7.8142   5.6641   7.8142   73.711   42.642   73.711   42.642 0.000000 0.000000 
1 1 1    0   30   36 o  155.411   39.911   22.447   8.2062   22.447   8.2062   22.447   8.2062  155.411   39.911  155.411   39.911 0.000000 0.000000 
1 1 1    0   30   37 o  214.639   52.568   43.369   14.958   43.369   14.958   43.369   14.958  214.639   52.568  214.639   52.568 0.000000 0.000000 
1 1 1    0   30   38 o  513.972   23.977  207.431   18.769  207.431   18.769  207.431   18.769  513.972   23.977  513.972   23.977 0.000000 0.000000 
1 1 1    0   30   39 f  402.484   17.872  126.124   10.961  126.124   10.961  126.124   10.961  402.484   17.872  402.484   17.872 0.000000 0.000000 
1 1 1    0   30   40 o  215.245   30.767   38.699   9.5364   38.699   9.5364   38.699   9.5364  215.245   30.767  215.245   30.767 0.000000 0.000000 
1 1 1    0   30   41 o   44.354   27.163   1.3851   3.5289   1.3851   3.5289   1.3851   3.5289   44.354   27.163   44.354   27.163 0.000000 0.000000 
1 1 1    0   30   42 o  117.566   51.998   16.592   9.8512   16.592   9.8512   16.592   9.8512  117.566   51.998  117.566   51.998 0.000000 0.000000 
1 1 1    0   30   43 o  272.347   13.639   57.676   5.6532   57.676   5.6532   57.676   5.6532  272.347   13.639  272.347   13.639 0.000000 0.000000 
1 1 1    0   30   44 f   35.960   24.643  -2.6320   4.3355  -2.6320   4.3355  -2.6320   4.3355   35.960   24.643   35.960   24.643 0.000000 0.000000 
1 1 1    0   30   45 o  241.313   15.939   45.759   5.8284   45.759   5.8284   45.759   5.8284  241.313   15.939  241.313   15.939 0.000000 0.000000 
1 1 1    0   30   46 o  361.333   13.558  101.422   7.4743  101.422   7.4743  101.422   7.4743  361.333   13.558  361.333   13.558 0.000000 0.000000 
1 1 1    0   30   47 o  161.458   22.780   21.697   5.3071   21.697   5.3071   21.697   5.3071  161.458   22.780  161.458   22.780 0.000000 0.000000 
1 1 1    0   30   48 o  160.924   46.367   26.445   9.9059   26.445   9.9059   26.445   9.9059  160.924   46.367  160.924   46.367 0.000000 0.000000 
1 1 1    0   30   49 o   96.566   39.067   10.755   5.6457   10.755   5.6457   10.755   5.6457   96.566   39.067   96.566   39.067 0.000000 0.000000 
1 1 1    0   30   50 o  145.452   27.459   18.675   5.4776   18.675   5.4776   18.675   5.4776  145.452   27.459  145.452   27.459 0.000000 0.000000 
1 1 1    0   30   51 o   38.038   26.365  -3.6895   5.3122  -3.6895   5.3122  -3.6895   5.3122   38.038   26.365   38.038   26.365 0.000000 0.000000 
1 1 1    0   31    1 o  752.128   15.411  434.345   17.725  434.345   17.725  434.345   17.725  752.128   15.411  752.128   15.411 0.000000 0.000000 
1 1 1    0   31    2 o  310.016   19.467   74.653   9.1540   74.653   9.1540   74.653   9.1540  310.016   19.467  310.016   19.467 0.000000 0.000000 
1 1 1    0   31    3 o  382.238   16.987  112.751   9.8935  112.751   9.8935  112.751   9.8935  382.238   16.987  382.238   16.987 0.000000 0.000000 
1 1 1    0   31    4 o  688.825   15.433  364.417   16.253  364.417   16.253  364.417   16.253  688.825   15.433  688.825   15.433 0.000000 0.000000 
1 1 1    0   31    5 o  499.096   15.766  191.620   12.017  191.620   12.017  191.620   12.017  499.096   15.766  499.096   15.766 0.000000 0.000000 
1 1 1    0   31    6 o   88.087   43.946   8.8808   7.2099   8.8808   7.2099   8.8808   7.2099   88.087   43.946   88.087   43.946 0.000000 0.000000 
1 1 1    0   31    7 o  1337.58   19.838  1375.03   40.594  1375.03   40.594  1375.03   40.594  1337.58   19.838  1337.58   19.838 0.000000 0.000000 
1 1 1    0   31    8 o  291.678   20.858   66.361   9.2027   66.361   9.2027   66.361   9.2027  291.678   20.858  291.678   20.858 0.000000 0.000000 
1 1 1    0   31    9 o  437.280   16.866  147.385   11.251  147.385   11.251  147.385   11.251  437.280   16.866  437.280   16.866 0.000000 0.000000 
1 1 1    0   31   10 o  616.266   15.860  291.947   14.938  291.947   14.938  291.947   14.938  616.266   15.860  616.266   15.860 0.000000 0.000000 
1 1 1    0   31   11 o  375.263   17.424  108.798   9.9589  108.798   9.9589  108.798   9.9589  375.263   17.424  375.263   17.424 0.000000 0.000000 
1 1 1    0   31   12 o  699.715   15.924  376.275   17.035  376.275   17.035  376.275   17.035  699.715   15.924  699.715   15.924 0.000000 0.000000 
1 1 1    0   31   13 o  326.839   20.015   83.020   9.9270   83.020   9.9270   83.020   9.9270  326.839   20.015  326.839   20.015 0.000000 0.000000 
1 1 1    0   31   14 o  224.052   27.625   40.442   9.0871   40.442   9.0871   40.442   9.0871  224.052   27.625  224.052   27.625 0.000000 0.000000 
1 1 1    0   31   15 o  352.210   19.923   96.281   10.662   96.281   10.662   96.281   10.662  352.210   19.923  352.210   19.923 0.000000 0.000000 
1 1 1    0   31   16 o  279.231   22.240   61.147   9.3668   61.147   9.3668   61.147   9.3668  279.231   22.240  279.231   22.240 0.000000 0.000000 
1 1 1    0   31   17 o  141.802   31.312   17.605   5.9442   17.605   5.9442   17.605   5.9442  141.802   31.312  141.802   31.312 0.000000 0.000000 
1 1 1    0   31   18 o  428.571   12.508  141.216   8.1890  141.216   8.1890  141.216   8.1890  428.571   12.508  428.571   12.508 0.000000 0.000000 
1 1 1    0   31   19 o   44.696   30.009  -2.2284   5.7929  -2.2284   5.7929  -2.2284   5.7929   44.696   30.009   44.696   30.009 0.000000 0.000000 
1 1 1    0   31   20 o  1068.15   12.847  875.646   20.997  875.646   20.997  875.646   20.997  1068.15   12.847  1068.15   12.847 0.000000 0.000000 
1 1 1    0   31   21 o  853.112   12.141  558.586   15.846  558.586   15.846  558.586   15.846  853.112   12.141  853.112   12.141 0.000000 0.000000 
1 1 1    0   31   22 o  360.588   14.082  100.278   7.7452  100.278   7.7452  100.278   7.7452  360.588   14.082  360.588   14.082 0.000000 0.000000 
1 1 1    0   31   23 o  720.107   11.965  398.144   13.179  398.144   13.179  398.144   13.179  720.107   11.965  720.107   11.965 0.000000 0.000000 
1 1 1    0   31   24 o   80.441   39.987   7.4885   5.9608   7.4885   5.9608   7.4885   5.9608   80.441   39.987   80.441   39.987 0.000000 0.000000 
1 1 1    0   31   25 o  261.434   18.375   53.406   7.2696   53.406   7.2696   53.406   7.2696  261.434   18.375  261.434   18.375 0.000000 0.000000 
1 1 1    0   31   26 o  117.738   47.061   15.124   8.2214   15.124   8.2214   15.124   8.2214  117.738   47.061  117.738   47.061 0.000000 0.000000 
1 1 1    0   31   27 o   70.198   40.141   5.1181   6.8015   5.1181   6.8015   5.1181   6.8015   70.198   40.141   70.198   40.141 0.000000 0.000000 
1 1 1    0   31   28 o  289.253   17.625   65.185   7.7370   65.185   7.7370   65.185   7.7370  289.253   17.625  289.253   17.625 0.000000 0.000000 
1 1 1    0   31   29 o   77.602   41.591   6.9231   6.7813   6.9231   6.7813   6.9231   6.7813   77.602   41.591   77.602   41.591 0.000000 0.000000 
1 1 1    0   31   30 o  526.498   13.644  213.554   10.979  213.554   10.979  213.554   10.979  526.498   13.644  526.498   13.644 0.000000 0.000000 
1 1 1    0   31   31 o   75.745   41.504   6.5035   6.8990   6.5035   6.8990   6.5035   6.8990   75.745   41.504   75.745   41.504 0.000000 0.000000 
1 1 1    0   31   32 o  555.115   14.029  237.544   11.903  237.544   11.903  237.544   11.903  555.115   14.029  555.115   14.029 0.000000 0.000000 
1 1 1    0   31   33 o  285.364   20.669   64.038   8.9190   64.038   8.9190   64.038   8.9190  285.364   20.669  285.364   20.669 0.000000 0.000000 
1 1 1    0   31   34 o   68.402   41.250   4.0398   7.8730   4.0398   7.8730   4.0398   7.8730   68.402   41.250   68.402   41.250 0.000000 0.000000 
1 1 1    0   31   35 o  439.068   15.935  149.288   10.677  149.288   10.677  149.288   10.677  439.068   15.935  439.068   15.935 0.000000 0.000000 
1 1 1    0   31   36 o   58.980   41.202 -11.6233   13.665 -11.6233   13.665 -11.6233   13.665   58.980   41.202   58.980   41.202 0.000000 0.000000 
1 1 1    0   31   37 o  188.155   32.966   30.308   8.6224   30.308   8.6224   30.308   8.6224  188.155   32.966  188.155   32.966 0.000000 0.000000 
1 1 1    0   31   38 o  469.263   16.234  170.744   11.629  170.744   11.629  170.744   11.629  469.263   16.234  469.263   16.234 0.000000 0.000000 
1 1 1    0   31   39 o  148.964   44.198   21.870   8.7672   21.870   8.7672   21.870   8.7672  148.964   44.198  148.964   44.198 0.000000 0.000000 
1 1 1    0   31   41 o  263.085   26.557   56.129   10.444   56.129   10.444   56.129   10.444  263.085   26.557  263.085   26.557 0.000000 0.000000 
1 1 1    0   31   42 o  221.439   16.037   38.559   5.3702   38.559   5.3702   38.559   5.3702  221.439   16.037  221.439   16.037 0.000000 0.000000 
1 1 1    0   31   43 o   60.795   33.830   4.1972   4.6646   4.1972   4.6646   4.1972   4.6646   60.795   33.830   60.795   33.830 0.000000 0.000000 
1 1 1    0   31   44 o   30.690   21.910  -6.5724   4.6203  -6.5724   4.6203  -6.5724   4.6203   30.690   21.910   30.690   21.910 0.000000 0.000000 
1 1 1    0   31   45 o  135.519   26.516   16.032   4.8980   16.032   4.8980   16.032   4.8980  135.519   26.516  135.519   26.516 0.000000 0.000000 
1 1 1    0   31   46 o  303.830   24.433   74.649   11.193   74.649   11.193   74.649   11.193  303.830   24.433  303.830   24.433 0.000000 0.000000 
1 1 1    0   31   47 o   38.533   26.302  -2.4508   4.8306  -2.4508   4.8306  -2.4508   4.8306   38.533   26.302   38.533   26.302 0.000000 0.000000 
1 1 1    0   31   48 o   37.647   25.976  -3.2638   5.0114  -3.2638   5.0114  -3.2638   5.0114   37.647   25.976   37.647   25.976 0.000000 0.000000 
1 1 1    0   31   49 o  172.843   39.504   28.504   9.1050   28.504   9.1050   28.504   9.1050  172.843   39.504  172.843   39.504 0.000000 0.000000 
1 1 1    0   31   50 o  172.902   26.768   25.789   6.5787   25.789   6.5787   25.789   6.5787  172.902   26.768  172.902   26.768 0.000000 0.000000 
1 1 1    0   32    1 o  591.612   15.619  269.077   14.121  269.077   14.121  269.077   14.121  591.612   15.619  591.612   15.619 0.000000 0.000000 
1 1 1    0   32    2 o  558.990   15.581  240.278   13.307  240.278   13.307  240.278   13.307  558.990   15.581  558.990   15.581 0.000000 0.000000 
1 1 1    0   32    3 o  112.751   44.274   13.543   7.3237   13.543   7.3237   13.543   7.3237  112.751   44.274  112.751   44.274 0.000000 0.000000 
1 1 1    0   32    4 o  392.271   17.017  118.774   10.174  118.774   10.174  118.774   10.174  392.271   17.017  392.271   17.017 0.000000 0.000000 
1 1 1    0   32    5 o  383.458   17.584  113.598   10.271  113.598   10.271  113.598   10.271  383.458   17.584  383.458   17.584 0.000000 0.000000 
1 1 1    0   32    6 o  493.034   15.860  187.102   11.941  187.102   11.941  187.102   11.941  493.034   15.860  493.034   15.860 0.000000 0.000000 
1 1 1    0   32    7 o  211.921   25.980   36.122   8.0881   36.122   8.0881   36.122   8.0881  211.921   25.980  211.921   25.980 0.000000 0.000000 
1 1 1    0   32    8 o  1085.98   17.799  906.430   29.568  906.430   29.568  906.430   29.568  1085.98   17.799  1085.98   17.799 0.000000 0.000000 
1 1 1    0   32    9 o  349.525   18.107   94.586   9.6276   94.586   9.6276   94.586   9.6276  349.525   18.107  349.525   18.107 0.000000 0.000000 
1 1 1    0   32   10 o   66.975   39.585   3.9811   6.9775   3.9811   6.9775   3.9811   6.9775   66.975   39.585   66.975   39.585 0.000000 0.000000 
1 1 1    0   32   11 o  553.153   16.120  235.478   13.622  235.478   13.622  235.478   13.622  553.153   16.120  553.153   16.120 0.000000 0.000000 
1 1 1    0   32   12 o  243.210   24.770   46.983   9.0018   46.983   9.0018   46.983   9.0018  243.210   24.770  243.210   24.770 0.000000 0.000000 
1 1 1    0   32   13 o  253.067   24.291   50.700   9.2101   50.700   9.2101   50.700   9.2101  253.067   24.291  253.067   24.291 0.000000 0.000000 
1 1 1    0   32   14 o  358.474   19.324   99.669   10.533   99.669   10.533   99.669   10.533  358.474   19.324  358.474   19.324 0.000000 0.000000 
1 1 1    0   32   15 o  123.804   45.339   15.924   7.9296   15.924   7.9296   15.924   7.9296  123.804   45.339  123.804   45.339 0.000000 0.000000 
1 1 1    0   32   16 o  189.616   21.824   28.763   6.1161   28.763   6.1161   28.763   6.1161  189.616   21.824  189.616   21.824 0.000000 0.000000 
1 1 1    0   32   17 o  586.723   11.662  264.285   10.464  264.285   10.464  264.285   10.464  586.723   11.662  586.723   11.662 0.000000 0.000000 
1 1 1    0   32   18 o   42.722   28.889  -2.6053   5.5526  -2.6053   5.5526  -2.6053   5.5526   42.722   28.889   42.722   28.889 0.000000 0.000000 
1 1 1    0   32   19 o   47.927   31.517  -0.9442   5.8580  -0.9442   5.8580  -0.9442   5.8580   47.927   31.517   47.927   31.517 0.000000 0.000000 
1 1 1    0   32   20 o   89.673   39.815   9.0489   5.7748   9.0489   5.7748   9.0489   5.7748   89.673   39.815   89.673   39.815 0.000000 0.000000 
1 1 1    0   32   21 o  832.428   12.131  532.003   15.449  532.003   15.449  532.003   15.449  832.428   12.131  832.428   12.131 0.000000 0.000000 
1 1 1    0   32   22 o  224.588   19.663   39.746   6.6403   39.746   6.6403   39.746   6.6403  224.588   19.663  224.588   19.663 0.000000 0.000000 
1 1 1    0   32   23 o   51.204   34.456  -3.0089   7.7190  -3.0089   7.7190  -3.0089   7.7190   51.204   34.456   51.204   34.456 0.000000 0.000000 
1 1 1    0   32   24 o  435.298   18.139  146.727   12.038  146.727   12.038  146.727   12.038  435.298   18.139  435.298   18.139 0.000000 0.000000 
1 1 1    0   32   25 o  137.892   36.578   17.604   6.6702   17.604   6.6702   17.604   6.6702  137.892   36.578  137.892   36.578 0.000000 0.000000 
1 1 1    0   32   26 o  358.634   15.190   99.471   8.3045   99.471   8.3045   99.471   8.3045  358.634   15.190  358.634   15.190 0.000000 0.000000 
1 1 1    0   32   27 o  123.085   39.826   15.063   6.6316   15.063   6.6316   15.063   6.6316  123.085   39.826  123.085   39.826 0.000000 0.000000 
1 1 1    0   32   28 o  164.749   31.568   23.327   7.1143   23.327   7.1143   23.327   7.1143  164.749   31.568  164.749   31.568 0.000000 0.000000 
1 1 1    0   32   29 o   41.345   28.888  -6.3593   6.7267  -6.3593   6.7267  -6.3593   6.7267   41.345   28.888   41.345   28.888 0.000000 0.000000 
1 1 1    0   32   30 o  159.087   35.242   22.481   7.5027   22.481   7.5027   22.481   7.5027  159.087   35.242  159.087   35.242 0.000000 0.000000 
1 1 1    0   32   31 f   73.865   41.826   5.9328   7.2896   5.9328   7.2896   5.9328   7.2896   73.865   41.826   73.865   41.826 0.000000 0.000000 
1 1 1    0   32   32 o   48.007   32.890  -4.6352   7.7110  -4.6352   7.7110  -4.6352   7.7110   48.007   32.890   48.007   32.890 0.000000 0.000000 
1 1 1    0   32   33 o   96.562   45.773   11.050   7.6857   11.050   7.6857   11.050   7.6857   96.562   45.773   96.562   45.773 0.000000 0.000000 
1 1 1    0   32   34 o  270.418   36.264   61.034   14.252   61.034   14.252   61.034   14.252  270.418   36.264  270.418   36.264 0.000000 0.000000 
1 1 1    0   32   35 o   79.578   50.351   3.6178   13.170   3.6178   13.170   3.6178   13.170   79.578   50.351   79.578   50.351 0.000000 0.000000 
1 1 1    0   32   36 o  348.190   18.477   94.667   9.7840   94.667   9.7840   94.667   9.7840  348.190   18.477  348.190   18.477 0.000000 0.000000 
1 1 1    0   32   37 o  304.919   21.410   73.383   9.8793   73.383   9.8793   73.383   9.8793  304.919   21.410  304.919   21.410 0.000000 0.000000 
1 1 1    0   32   39 o  255.518   26.365   52.922   10.060   52.922   10.060   52.922   10.060  255.518   26.365  255.518   26.365 0.000000 0.000000 
1 1 1    0   32   40 o  211.471   32.365   37.931   9.7472   37.931   9.7472   37.931   9.7472  211.471   32.365  211.471   32.365 0.000000 0.000000 
1 1 1    0   32   41 o  119.264   56.301   18.070   11.615   18.070   11.615   18.070   11.615  119.264   56.301  119.264   56.301 0.000000 0.000000 
1 1 1    0   32   42 o   62.189   41.158  -0.8254   10.249  -0.8254   10.249  -0.8254   10.249   62.189   41.158   62.189   41.158 0.000000 0.000000 
1 1 1    0   32   43 o   83.503   36.083   8.0317   4.7487   8.0317   4.7487   8.0317   4.7487   83.503   36.083   83.503   36.083 0.000000 0.000000 
1 1 1    0   32   44 o  160.616   23.423   21.535   5.4008   21.535   5.4008   21.535   5.4008  160.616   23.423  160.616   23.423 0.000000 0.000000 
1 1 1    0   32   45 o  156.901   23.685   20.690   5.3050   20.690   5.3050   20.690   5.3050  156.901   23.685  156.901   23.685 0.000000 0.000000 
1 1 1    0   32   46 o  141.543   27.911   17.699   5.3779   17.699   5.3779   17.699   5.3779  141.543   27.911  141.543   27.911 0.000000 0.000000 
1 1 1    0   32   47 o   95.405   36.046   10.057   4.9331   10.057   4.9331   10.057   4.9331   95.405   36.046   95.405   36.046 0.000000 0.000000 
1 1 1    0   32   48 o   41.536   27.678  -0.9089   4.7675  -0.9089   4.7675  -0.9089   4.7675   41.536   27.678   41.536   27.678 0.000000 0.000000 
1 1 1    0   33    1 o   41.381   29.083  -7.7834   7.1185  -7.7834   7.1185  -7.7834   7.1185   41.381   29.083   41.381   29.083 0.000000 0.000000 
1 1 1    0   33    2 o  161.942   34.772   22.851   7.5664   22.851   7.5664   22.851   7.5664  161.942   34.772  161.942   34.772 0.000000 0.000000 
1 1 1    0   33    3 o  693.172   15.940  369.405   16.892  369.405   16.892  369.405   16.892  693.172   15.940  693.172   15.940 0.000000 0.000000 
1 1 1    0   33    4 o  295.691   19.929   68.130   8.9258   68.130   8.9258   68.130   8.9258  295.691   19.929  295.691   19.929 0.000000 0.000000 
1 1 1    0   33    5 o  790.072   16.113  479.803   19.467  479.803   19.467  479.803   19.467  790.072   16.113  790.072   16.113 0.000000 0.000000 
1 1 1    0   33    6 o   49.410   33.402  -3.4390   7.4137  -3.4390   7.4137  -3.4390   7.4137   49.410   33.402   49.410   33.402 0.000000 0.000000 
1 1 1    0   33    7 o  739.322   15.993  420.227   18.079  420.227   18.079  420.227   18.079  739.322   15.993  739.322   15.993 0.000000 0.000000 
1 1 1    0   33    8 o  301.181   20.238   70.709   9.2331   70.709   9.2331   70.709   9.2331  301.181   20.238  301.181   20.238 0.000000 0.000000 
1 1 1    0   33    9 o  364.198   18.774  102.774   10.402  102.774   10.402  102.774   10.402  364.198   18.774  364.198   18.774 0.000000 0.000000 
1 1 1    0   33   10 o  429.435   17.458  142.397   11.432  142.397   11.432  142.397   11.432  429.435   17.458  429.435   17.458 0.000000 0.000000 
1 1 1    0   33   11 o  144.427   41.507   19.727   7.9567   19.727   7.9567   19.727   7.9567  144.427   41.507  144.427   41.507 0.000000 0.000000 
1 1 1    0   33   12 o  203.329   29.261   33.882   8.5589   33.882   8.5589   33.882   8.5589  203.329   29.261  203.329   29.261 0.000000 0.000000 
1 1 1    0   33   13 o  520.627   16.870  208.937   13.412  208.937   13.412  208.937   13.412  520.627   16.870  520.627   16.870 0.000000 0.000000 
1 1 1    0   33   14 o  100.128   48.442   11.642   8.6525   11.642   8.6525   11.642   8.6525  100.128   48.442  100.128   48.442 0.000000 0.000000 
1 1 1    0   33   15 o  163.570   40.222   24.216   8.7199   24.216   8.7199   24.216   8.7199  163.570   40.222  163.570   40.222 0.000000 0.000000 
1 1 1    0   33   16 o  277.608   22.808   60.639   9.5408   60.639   9.5408   60.639   9.5408  277.608   22.808  277.608   22.808 0.000000 0.000000 
1 1 1    0   33   17 o  749.371   11.829  431.082   13.560  431.082   13.560  431.082   13.560  749.371   11.829  749.371   11.829 0.000000 0.000000 
1 1 1    0   33   19 o  168.501   25.501   23.393   6.1313   23.393   6.1313   23.393   6.1313  168.501   25.501  168.501   25.501 0.000000 0.000000 
1 1 1    0   33   20 o  705.690   12.163  382.525   13.129  382.525   13.129  382.525   13.129  705.690   12.163  705.690   12.163 0.000000 0.000000 
1 1 1    0   33   21 o  367.248   19.455  104.845   10.866  104.845   10.866  104.845   10.866  367.248   19.455  367.248   19.455 0.000000 0.000000 
1 1 1    0   33   22 o   47.744   32.740  -4.8780   7.6783  -4.8780   7.6783  -4.8780   7.6783   47.744   32.740   47.744   32.740 0.000000 0.000000 
1 1 1    0   33   23 o  327.279   15.635   82.965   7.7915   82.965   7.7915   82.965   7.7915  327.279   15.635  327.279   15.635 0.000000 0.000000 
1 1 1    0   33   24 o  378.820   14.502  110.831   8.3808  110.831   8.3808  110.831   8.3808  378.820   14.502  378.820   14.502 0.000000 0.000000 
1 1 1    0   33   25 o  295.989   17.604   68.241   7.9110   68.241   7.9110   68.241   7.9110  295.989   17.604  295.989   17.604 0.000000 0.000000 
1 1 1    0   33   26 o  184.372   26.144   27.927   6.9498   27.927   6.9498   27.927   6.9498  184.372   26.144  184.372   26.144 0.000000 0.000000 
1 1 1    0   33   27 o  109.824   42.483   12.981   6.7840   12.981   6.7840   12.981   6.7840  109.824   42.483  109.824   42.483 0.000000 0.000000 
1 1 1    0   33   28 o  177.166   29.872   26.452   7.4089   26.452   7.4089   26.452   7.4089  177.166   29.872  177.166   29.872 0.000000 0.000000 
1 1 1    0   33   29 o   72.573   41.603   5.5711   7.3324   5.5711   7.3324   5.5711   7.3324   72.573   41.603   72.573   41.603 0.000000 0.000000 
1 1 1    0   33   30 o  327.426   17.921   83.529   8.9198   83.529   8.9198   83.529   8.9198  327.426   17.921  327.426   17.921 0.000000 0.000000 
1 1 1    0   33   31 o  260.938   21.930   53.933   8.6167   53.933   8.6167   53.933   8.6167  260.938   21.930  260.938   21.930 0.000000 0.000000 
1 1 1    0   33   32 o   95.166   54.670   10.334   12.704   10.334   12.704   10.334   12.704   95.166   54.670   95.166   54.670 0.000000 0.000000 
1 1 1    0   33   33 o   75.618   48.388   2.2560   12.577   2.2560   12.577   2.2560   12.577   75.618   48.388   75.618   48.388 0.000000 0.000000 
1 1 1    0   33   34 o  135.089   44.370   18.578   8.1389   18.578   8.1389   18.578   8.1389  135.089   44.370  135.089   44.370 0.000000 0.000000 
1 1 1    0   33   35 o  234.528   24.588   44.337   8.6045   44.337   8.6045   44.337   8.6045  234.528   24.588  234.528   24.588 0.000000 0.000000 
1 1 1    0   33   36 o  824.174   14.120  524.201   17.800  524.201   17.800  524.201   17.800  824.174   14.120  824.174   14.120 0.000000 0.000000 
1 1 1    0   33   37 o  257.496   24.445   53.269   9.4351   53.269   9.4351   53.269   9.4351  257.496   24.445  257.496   24.445 0.000000 0.000000 
1 1 1    0   33   38 o  155.676   44.028   23.626   9.0857   23.626   9.0857   23.626   9.0857  155.676   44.028  155.676   44.028 0.000000 0.000000 
1 1 1    0   33   39 o  174.063   41.572   28.176   9.6097   28.176   9.6097   28.176   9.6097  174.063   41.572  174.063   41.572 0.000000 0.000000 
1 1 1    0   33   40 o   81.061   48.755   6.8705   10.941   6.8705   10.941   6.8705   10.941   81.061   48.755   81.061   48.755 0.000000 0.000000 
1 1 1    0   33   42 o   79.862   47.197   7.2332   9.9179   7.2332   9.9179   7.2332   9.9179   79.862   47.197   79.862   47.197 0.000000 0.000000 
1 1 1    0   33   43 o   57.446   38.829  -2.9152   10.011  -2.9152   10.011  -2.9152   10.011   57.446   38.829   57.446   38.829 0.000000 0.000000 
1 1 1    0   33   44 o  333.539   22.539   89.175   11.386   89.175   11.386   89.175   11.386  333.539   22.539  333.539   22.539 0.000000 0.000000 
1 1 1    0   33   45 o   65.927   41.880   3.0207   9.2120   3.0207   9.2120   3.0207   9.2120   65.927   41.880   65.927   41.880 0.000000 0.000000 
1 1 1    0   33   46 o  147.048   26.946   18.920   5.4633   18.920   5.4633   18.920   5.4633  147.048   26.946  147.048   26.946 0.000000 0.000000 
1 1 1    0   33   47 o  170.663   23.127   24.432   5.7285   24.432   5.7285   24.432   5.7285  170.663   23.127  170.663   23.127 0.000000 0.000000 
1 1 1    0   34    0 o  461.145   16.492  163.667   11.607  163.667   11.607  163.667   11.607  461.145   16.492  461.145   16.492 0.000000 0.000000 
1 1 1    0   34    1 o  740.310   15.922  421.451   18.022  421.451   18.022  421.451   18.022  740.310   15.922  740.310   15.922 0.000000 0.000000 
1 1 1    0   34    2 o  716.516   15.836  394.816   17.348  394.816   17.348  394.816   17.348  716.516   15.836  716.516   15.836 0.000000 0.000000 
1 1 1    0   34    3 o  301.057   19.731   70.615   9.0024   70.615   9.0024   70.615   9.0024  301.057   19.731  301.057   19.731 0.000000 0.000000 
1 1 1    0   34    4 o  917.091   16.914  646.859   23.724  646.859   23.724  646.859   23.724  917.091   16.914  917.091   16.914 0.000000 0.000000 
1 1 1    0   34    5 f  189.297   29.726   29.665   7.9786   29.665   7.9786   29.665   7.9786  189.297   29.726  189.297   29.726 0.000000 0.000000 
1 1 1    0   34    6 o  514.153   16.797  203.761   13.187  203.761   13.187  203.761   13.187  514.153   16.797  514.153   16.797 0.000000 0.000000 
1 1 1    0   34    7 o  514.620   16.771  204.137   13.179  204.137   13.179  204.137   13.179  514.620   16.771  514.620   16.771 0.000000 0.000000 
1 1 1    0   34    8 o  632.979   16.268  308.418   15.738  308.418   15.738  308.418   15.738  632.979   16.268  632.979   16.268 0.000000 0.000000 
1 1 1    0   34    9 o  300.779   21.157   70.709   9.6297   70.709   9.6297   70.709   9.6297  300.779   21.157  300.779   21.157 0.000000 0.000000 
1 1 1    0   34   10 f  383.950   18.349  114.163   10.728  114.163   10.728  114.163   10.728  383.950   18.349  383.950   18.349 0.000000 0.000000 
1 1 1    0   34   11 o   59.883   38.669   0.1092   8.2670   0.1092   8.2670   0.1092   8.2670   59.883   38.669   59.883   38.669 0.000000 0.000000 
1 1 1    0   34   12 o  306.680   21.342   73.533   9.9066   73.533   9.9066   73.533   9.9066  306.680   21.342  306.680   21.342 0.000000 0.000000 
1 1 1    0   34   13 o  103.233   47.216   12.216   8.1306   12.216   8.1306   12.216   8.1306  103.233   47.216  103.233   47.216 0.000000 0.000000 
1 1 1    0   34   14 o  165.577   40.436   24.818   8.8777   24.818   8.8777   24.818   8.8777  165.577   40.436  165.577   40.436 0.000000 0.000000 
1 1 1    0   34   15 o  411.705   19.115  131.386   11.987  131.386   11.987  131.386   11.987  411.705   19.115  411.705   19.115 0.000000 0.000000 
1 1 1    0   34   16 o  217.048   30.712   38.710   9.6139   38.710   9.6139   38.710   9.6139  217.048   30.712  217.048   30.712 0.000000 0.000000 
1 1 1    0   34   17 o  491.613   19.260  187.102   14.443  187.102   14.443  187.102   14.443  491.613   19.260  491.613   19.260 0.000000 0.000000 
1 1 1    0   34   18 o  573.488   16.775  253.736   14.696  253.736   14.696  253.736   14.696  573.488   16.775  573.488   16.775 0.000000 0.000000 
1 1 1    0   34   19 o   52.506   34.950  -2.0009   7.5664  -2.0009   7.5664  -2.0009   7.5664   52.506   34.950   52.506   34.950 0.000000 0.000000 
1 1 1    0   34   20 o   43.177   29.311  -2.9605   5.8322  -2.9605   5.8322  -2.9605   5.8322   43.177   29.311   43.177   29.311 0.000000 0.000000 
1 1 1    0   34   21 o  335.097   15.319   86.920   7.8200   86.920   7.8200   86.920   7.8200  335.097   15.319  335.097   15.319 0.000000 0.000000 
1 1 1    0   34   22 o  503.520   12.941  195.163   9.9590  195.163   9.9590  195.163   9.9590  503.520   12.941  503.520   12.941 0.000000 0.000000 
1 1 1    0   34   23 o  388.011   14.925  116.336   8.8340  116.336   8.8340  116.336   8.8340  388.011   14.925  388.011   14.925 0.000000 0.000000 
1 1 1    0   34   24 o  223.097   21.338   39.534   7.1334   39.534   7.1334   39.534   7.1334  223.097   21.338  223.097   21.338 0.000000 0.000000 
1 1 1    0   34   25 o  248.619   19.927   48.674   7.4711   48.674   7.4711   48.674   7.4711  248.619   19.927  248.619   19.927 0.000000 0.000000 
1 1 1    0   34   26 o  136.527   39.373   17.837   7.1370   17.837   7.1370   17.837   7.1370  136.527   39.373  136.527   39.373 0.000000 0.000000 
1 1 1    0   34   27 o  367.733   16.278  104.842   9.1215  104.842   9.1215  104.842   9.1215  367.733   16.278  367.733   16.278 0.000000 0.000000 
1 1 1    0   34   28 o   41.946   29.278  -6.3038   6.8614  -6.3038   6.8614  -6.3038   6.8614   41.946   29.278   41.946   29.278 0.000000 0.000000 
1 1 1    0   34   29 o   62.576   38.305   2.9232   7.0101   2.9232   7.0101   2.9232   7.0101   62.576   38.305   62.576   38.305 0.000000 0.000000 
1 1 1    0   34   30 o   49.350   35.150 -15.4162   11.636 -15.4162   11.636 -15.4162   11.636   49.350   35.150   49.350   35.150 0.000000 0.000000 
1 1 1    0   34   31 o   74.459   48.051   1.4146   12.738   1.4146   12.738   1.4146   12.738   74.459   48.051   74.459   48.051 0.000000 0.000000 
1 1 1    0   34   32 o  148.944   40.590   21.044   7.9997   21.044   7.9997   21.044   7.9997  148.944   40.590  148.944   40.590 0.000000 0.000000 
1 1 1    0   34   33 o   71.703   42.403   5.0784   8.0146   5.0784   8.0146   5.0784   8.0146   71.703   42.403   71.703   42.403 0.000000 0.000000 
1 1 1    0   34   34 o   63.530   39.442   2.7093   7.6846   2.7093   7.6846   2.7093   7.6846   63.530   39.442   63.530   39.442 0.000000 0.000000 
1 1 1    0   34   35 f  175.080   35.850   27.119   8.4926   27.119   8.4926   27.119   8.4926  175.080   35.850  175.080   35.850 0.000000 0.000000 
1 1 1    0   34   36 o  101.381   48.061   12.499   8.4735   12.499   8.4735   12.499   8.4735  101.381   48.061  101.381   48.061 0.000000 0.000000 
1 1 1    0   34   37 o   82.176   46.062   8.0068   8.7218   8.0068   8.7218   8.0068   8.7218   82.176   46.062   82.176   46.062 0.000000 0.000000 
1 1 1    0   34   38 o   48.144   34.192 -12.8656   10.726 -12.8656   10.726 -12.8656   10.726   48.144   34.192   48.144   34.192 0.000000 0.000000 
1 1 1    0   34   39 f  143.905   48.646   22.010   9.5875   22.010   9.5875   22.010   9.5875  143.905   48.646  143.905   48.646 0.000000 0.000000 
1 1 1    0   34   40 o   43.743   31.309 -13.6564   9.6789 -13.6564   9.6789 -13.6564   9.6789   43.743   31.309   43.743   31.309 0.000000 0.000000 
1 1 1    0   34   41 o  395.228   19.813  123.137   11.917  123.137   11.917  123.137   11.917  395.228   19.813  395.228   19.813 0.000000 0.000000 
1 1 1    0   34   42 o   76.433   46.223   6.2296   9.9415   6.2296   9.9415   6.2296   9.9415   76.433   46.223   76.433   46.223 0.000000 0.000000 
1 1 1    0   34   44 o   52.482   35.747  -3.2646   8.8217  -3.2646   8.8217  -3.2646   8.8217   52.482   35.747   52.482   35.747 0.000000 0.000000 
1 1 1    0   34   45 o  142.441   27.343   17.909   5.3262   17.909   5.3262   17.909   5.3262  142.441   27.343  142.441   27.343 0.000000 0.000000 
1 1 1    0   35    1 o  270.675   22.929   57.712   9.3427   57.712   9.3427   57.712   9.3427  270.675   22.929  270.675   22.929 0.000000 0.000000 
1 1 1    0   35    2 o  912.477   16.995  640.741   23.718  640.741   23.718  640.741   23.718  912.477   16.995  912.477   16.995 0.000000 0.000000 
1 1 1    0   35    3 o   77.197   43.112   6.4385   7.6061   6.4385   7.6061   6.4385   7.6061   77.197   43.112   77.197   43.112 0.000000 0.000000 
1 1 1    0   35    4 o  190.464   29.928   30.079   8.0814   30.079   8.0814   30.079   8.0814  190.464   29.928  190.464   29.928 0.000000 0.000000 
1 1 1    0   35    5 o   78.438   43.917   6.6380   7.9159   6.6380   7.9159   6.6380   7.9159   78.438   43.917   78.438   43.917 0.000000 0.000000 
1 1 1    0   35    6 f  321.537   19.951   80.535   9.7323   80.535   9.7323   80.535   9.7323  321.537   19.951  321.537   19.951 0.000000 0.000000 
1 1 1    0   35    7 f  349.534   18.946   94.869   10.068   94.869   10.068   94.869   10.068  349.534   18.946  349.534   18.946 0.000000 0.000000 
1 1 1    0   35    8 o  593.962   16.731  271.901   15.184  271.901   15.184  271.901   15.184  593.962   16.731  593.962   16.731 0.000000 0.000000 
1 1 1    0   35    9 o  390.097   18.535  117.927   11.010  117.927   11.010  117.927   11.010  390.097   18.535  390.097   18.535 0.000000 0.000000 
1 1 1    0   35   10 o  135.005   44.563   18.230   8.1809   18.230   8.1809   18.230   8.1809  135.005   44.563  135.005   44.563 0.000000 0.000000 
1 1 1    0   35   11 o  397.257   18.846  122.351   11.400  122.351   11.400  122.351   11.400  397.257   18.846  397.257   18.846 0.000000 0.000000 
1 1 1    0   35   12 o  159.648   43.312   23.840   9.1484   23.840   9.1484   23.840   9.1484  159.648   43.312  159.648   43.312 0.000000 0.000000 
1 1 1    0   35   13 o   56.137   37.111  -1.6028   8.2938  -1.6028   8.2938  -1.6028   8.2938   56.137   37.111   56.137   37.111 0.000000 0.000000 
1 1 1    0   35   17 o   46.909   32.699  -7.6290   8.4836  -7.6290   8.4836  -7.6290   8.4836   46.909   32.699   46.909   32.699 0.000000 0.000000 
1 1 1    0   35   18 o   56.828   34.978   2.1247   5.9175   2.1247   5.9175   2.1247   5.9175   56.828   34.978   56.828   34.978 0.000000 0.000000 
1 1 1    0   35   19 o  380.075   14.413  111.551   8.3577  111.551   8.3577  111.551   8.3577  380.075   14.413  380.075   14.413 0.000000 0.000000 
1 1 1    0   35   20 o  242.954   19.527   46.434   7.1535   46.434   7.1535   46.434   7.1535  242.954   19.527  242.954   19.527 0.000000 0.000000 
1 1 1    0   35   21 o  166.545   28.829   23.395   6.6887   23.395   6.6887   23.395   6.6887  166.545   28.829  166.545   28.829 0.000000 0.000000 
1 1 1    0   35   22 o  168.405   30.598   24.148   7.1156   24.148   7.1156   24.148   7.1156  168.405   30.598  168.405   30.598 0.000000 0.000000 
1 1 1    0   35   23 o   53.873   34.625   0.4264   6.5269   0.4264   6.5269   0.4264   6.5269   53.873   34.625   53.873   34.625 0.000000 0.000000 
1 1 1    0   35   24 o  282.777   18.436   62.515   7.9017   62.515   7.9017   62.515   7.9017  282.777   18.436  282.777   18.436 0.000000 0.000000 
1 1 1    0   35   25 o  390.948   15.661  118.315   9.3371  118.315   9.3371  118.315   9.3371  390.948   15.661  390.948   15.661 0.000000 0.000000 
1 1 1    0   35   26 o   74.021   42.135   5.9151   7.4494   5.9151   7.4494   5.9151   7.4494   74.021   42.135   74.021   42.135 0.000000 0.000000 
1 1 1    0   35   27 o  400.057   15.815  123.957   9.6495  123.957   9.6495  123.957   9.6495  400.057   15.815  400.057   15.815 0.000000 0.000000 
1 1 1    0   35   28 o  229.354   39.647   45.307   12.671   45.307   12.671   45.307   12.671  229.354   39.647  229.354   39.647 0.000000 0.000000 
1 1 1    0   35   29 o  295.148   30.868   70.766   13.596   70.766   13.596   70.766   13.596  295.148   30.868  295.148   30.868 0.000000 0.000000 
1 1 1    0   35   30 o   35.464   25.633 -13.3897   7.2420 -13.3897   7.2420 -13.3897   7.2420   35.464   25.633   35.464   25.633 0.000000 0.000000 
1 1 1    0   35   31 o   81.218   43.942   7.7830   7.6366   7.7830   7.6366   7.7830   7.6366   81.218   43.942   81.218   43.942 0.000000 0.000000 
1 1 1    0   35   32 o  561.280   14.698  243.470   12.608  243.470   12.608  243.470   12.608  561.280   14.698  561.280   14.698 0.000000 0.000000 
1 1 1    0   35   33 o   71.092   42.225   4.9600   8.0085   4.9600   8.0085   4.9600   8.0085   71.092   42.225   71.092   42.225 0.000000 0.000000 
1 1 1    0   35   34 o   59.193   38.233   0.6109   8.0891   0.6109   8.0891   0.6109   8.0891   59.193   38.233   59.193   38.233 0.000000 0.000000 
1 1 1    0   35   35 f   78.180   45.393   6.7498   8.9043   6.7498   8.9043   6.7498   8.9043   78.180   45.393   78.180   45.393 0.000000 0.000000 
1 1 1    0   35   36 o   78.540   47.185   6.2455   10.224   6.2455   10.224   6.2455   10.224   78.540   47.185   78.540   47.185 0.000000 0.000000 
1 1 1    0   35   37 o   75.093   46.648   4.6371   10.764   4.6371   10.764   4.6371   10.764   75.093   46.648   75.093   46.648 0.000000 0.000000 
1 1 1    0   35   38 o  106.021   51.200   14.249   9.6615   14.249   9.6615   14.249   9.6615  106.021   51.200  106.021   51.200 0.000000 0.000000 
1 1 1    0   35   39 o  363.583   20.548  104.481   11.352  104.481   11.352  104.481   11.352  363.583   20.548  363.583   20.548 0.000000 0.000000 
1 1 1    0   35   40 o   64.236   41.481   1.5006   9.5137   1.5006   9.5137   1.5006   9.5137   64.236   41.481   64.236   41.481 0.000000 0.000000 
1 1 1    0   35   41 o  257.211   26.661   54.517   10.238   54.517   10.238   54.517   10.238  257.211   26.661  257.211   26.661 0.000000 0.000000 
1 1 1    0   35   42 o  165.613   42.327   26.733   9.2755   26.733   9.2755   26.733   9.2755  165.613   42.327  165.613   42.327 0.000000 0.000000 
1 1 1    0   35   44 o  131.715   58.740   23.520   12.568   23.520   12.568   23.520   12.568  131.715   58.740  131.715   58.740 0.000000 0.000000 
1 1 1    0   36    0 o  748.145   16.430  430.015   18.794  430.015   18.794  430.015   18.794  748.145   16.430  748.145   16.430 0.000000 0.000000 
1 1 1    0   36    1 o  295.847   21.243   68.545   9.5055   68.545   9.5055   68.545   9.5055  295.847   21.243  295.847   21.243 0.000000 0.000000 
1 1 1    0   36    2 o  895.190   17.151  617.212   23.481  617.212   23.481  617.212   23.481  895.190   17.151  895.190   17.151 0.000000 0.000000 
1 1 1    0   36    3 o   47.060   32.309  -4.9674   7.5272  -4.9674   7.5272  -4.9674   7.5272   47.060   32.309   47.060   32.309 0.000000 0.000000 
1 1 1    0   36    4 o  618.011   16.588  294.395   15.666  294.395   15.666  294.395   15.666  618.011   16.588  618.011   16.588 0.000000 0.000000 
1 1 1    0   36    5 o  610.584   16.746  287.430   15.624  287.430   15.624  287.430   15.624  610.584   16.746  610.584   16.746 0.000000 0.000000 
1 1 1    0   36    6 o   69.039   41.129   4.2079   7.6383   4.2079   7.6383   4.2079   7.6383   69.039   41.129   69.039   41.129 0.000000 0.000000 
1 1 1    0   36    7 o  367.894   19.119  105.127   10.700  105.127   10.700  105.127   10.700  367.894   19.119  367.894   19.119 0.000000 0.000000 
1 1 1    0   36    8 o   54.969   36.276  -1.3939   7.8697  -1.3939   7.8697  -1.3939   7.8697   54.969   36.276   54.969   36.276 0.000000 0.000000 
1 1 1    0   36   14 f  151.793   47.802   22.851   9.7574   22.851   9.7574   22.851   9.7574  151.793   47.802  151.793   47.802 0.000000 0.000000 
1 1 1    0   36   15 o  241.123   29.816   47.312   10.552   47.312   10.552   47.312   10.552  241.123   29.816  241.123   29.816 0.000000 0.000000 
1 1 1    0   36   16 o  335.481   23.696   88.497   12.029   88.497   12.029   88.497   12.029  335.481   23.696  335.481   23.696 0.000000 0.000000 
1 1 1    0   36   17 o  400.081   21.202  124.798   12.900  124.798   12.900  124.798   12.900  400.081   21.202  400.081   21.202 0.000000 0.000000 
1 1 1    0   36   18 o  508.304   19.421  200.373   15.060  200.373   15.060  200.373   15.060  508.304   19.421  508.304   19.421 0.000000 0.000000 
1 1 1    0   36   19 o  229.791   21.105   41.852   7.2793   41.852   7.2793   41.852   7.2793  229.791   21.105  229.791   21.105 0.000000 0.000000 
1 1 1    0   36   20 o  131.911   38.155   16.627   6.6840   16.627   6.6840   16.627   6.6840  131.911   38.155  131.911   38.155 0.000000 0.000000 
1 1 1    0   36   21 o  363.752   15.406  102.429   8.5425  102.429   8.5425  102.429   8.5425  363.752   15.406  363.752   15.406 0.000000 0.000000 
1 1 1    0   36   22 o  165.102   31.096   23.387   7.0440   23.387   7.0440   23.387   7.0440  165.102   31.096  165.102   31.096 0.000000 0.000000 
1 1 1    0   36   23 o  100.469   43.587   11.480   6.9266   11.480   6.9266   11.480   6.9266  100.469   43.587  100.469   43.587 0.000000 0.000000 
1 1 1    0   36   24 o  214.381   23.754   36.985   7.5499   36.985   7.5499   36.985   7.5499  214.381   23.754  214.381   23.754 0.000000 0.000000 
1 1 1    0   36   25 o  202.219   25.429   33.302   7.5331   33.302   7.5331   33.302   7.5331  202.219   25.429  202.219   25.429 0.000000 0.000000 
1 1 1    0   36   26 o  420.579   23.192  138.821   14.826  138.821   14.826  138.821   14.826  420.579   23.192  420.579   23.192 0.000000 0.000000 
1 1 1    0   36   27 o   62.068   41.887  -4.0724   11.565  -4.0724   11.565  -4.0724   11.565   62.068   41.887   62.068   41.887 0.000000 0.000000 
1 1 1    0   36   28 o  176.258   32.359   26.714   7.8615   26.714   7.8615   26.714   7.8615  176.258   32.359  176.258   32.359 0.000000 0.000000 
1 1 1    0   36   29 o   67.641   40.843   3.9948   7.7380   3.9948   7.7380   3.9948   7.7380   67.641   40.843   67.641   40.843 0.000000 0.000000 
1 1 1    0   36   30 o   46.624   31.976  -4.4246   7.3305  -4.4246   7.3305  -4.4246   7.3305   46.624   31.976   46.624   31.976 0.000000 0.000000 
1 1 1    0   36   31 o   53.572   35.507  -1.3474   7.6715  -1.3474   7.6715  -1.3474   7.6715   53.572   35.507   53.572   35.507 0.000000 0.000000 
1 1 1    0   36   32 o  277.206   22.635   61.140   9.4565   61.140   9.4565   61.140   9.4565  277.206   22.635  277.206   22.635 0.000000 0.000000 
1 1 1    0   36   33 o  474.835   16.682  175.212   12.090  175.212   12.090  175.212   12.090  474.835   16.682  474.835   16.682 0.000000 0.000000 
1 1 1    0   36   34 o  159.243   51.521   26.456   11.099   26.456   11.099   26.456   11.099  159.243   51.521  159.243   51.521 0.000000 0.000000 
1 1 1    0   36   35 o   71.813   45.140   3.5463   10.392   3.5463   10.392   3.5463   10.392   71.813   45.140   71.813   45.140 0.000000 0.000000 
1 1 1    0   36   36 o  307.200   22.134   75.114   10.284   75.114   10.284   75.114   10.284  307.200   22.134  307.200   22.134 0.000000 0.000000 
1 1 1    0   36   37 o  224.742   29.241   42.202   9.5885   42.202   9.5885   42.202   9.5885  224.742   29.241  224.742   29.241 0.000000 0.000000 
1 1 1    0   36   38 o   58.691   38.801  -0.6633   9.0682  -0.6633   9.0682  -0.6633   9.0682   58.691   38.801   58.691   38.801 0.000000 0.000000 
1 1 1    0   36   39 f  113.867   50.386   16.059   9.2496   16.059   9.2496   16.059   9.2496  113.867   50.386  113.867   50.386 0.000000 0.000000 
1 1 1    0   36   40 f  192.285   35.446   33.020   9.3879   33.020   9.3879   33.020   9.3879  192.285   35.446  192.285   35.446 0.000000 0.000000 
1 1 1    0   36   41 o  178.437   36.975   29.234   8.9106   29.234   8.9106   29.234   8.9106  178.437   36.975  178.437   36.975 0.000000 0.000000 
1 1 1    0   36   42 o  180.832   36.745   30.048   9.0015   30.048   9.0015   30.048   9.0015  180.832   36.745  180.832   36.745 0.000000 0.000000 
1 1 1    0   36   43 o   65.157   43.533  -0.2792   11.932  -0.2792   11.932  -0.2792   11.932   65.157   43.533   65.157   43.533 0.000000 0.000000 
1 1 1    0   37    7 o   56.592   37.112  -0.8818   8.0407  -0.8818   8.0407  -0.8818   8.0407   56.592   37.112   56.592   37.112 0.000000 0.000000 
1 1 1    0   37    8 o  160.082   40.589   23.538   8.5995   23.538   8.5995   23.538   8.5995  160.082   40.589  160.082   40.589 0.000000 0.000000 
1 1 1    0   37    9 o  110.388   48.507   13.920   8.5749   13.920   8.5749   13.920   8.5749  110.388   48.507  110.388   48.507 0.000000 0.000000 
1 1 1    0   37   10 o  360.411   20.911  101.363   11.447  101.363   11.447  101.363   11.447  360.411   20.911  360.411   20.911 0.000000 0.000000 
1 1 1    0   37   11 o   88.811   47.718   9.1650   8.9478   9.1650   8.9478   9.1650   8.9478   88.811   47.718   88.811   47.718 0.000000 0.000000 
1 1 1    0   37   12 o  996.961   18.281  767.233   27.875  767.233   27.875  767.233   27.875  996.961   18.281  996.961   18.281 0.000000 0.000000 
1 1 1    0   37   13 o  648.163   17.530  324.512   17.362  324.512   17.362  324.512   17.362  648.163   17.530  648.163   17.530 0.000000 0.000000 
1 1 1    0   37   14 o  439.348   19.947  150.021   13.351  150.021   13.351  150.021   13.351  439.348   19.947  439.348   19.947 0.000000 0.000000 
1 1 1    0   37   15 o   95.894   49.666   10.955   9.4098   10.955   9.4098   10.955   9.4098   95.894   49.666   95.894   49.666 0.000000 0.000000 
1 1 1    0   37   16 o  284.819   26.738   64.771   11.421   64.771   11.421   64.771   11.421  284.819   26.738  284.819   26.738 0.000000 0.000000 
1 1 1    0   37   17 o  213.904   34.352   38.512   10.377   38.512   10.377   38.512   10.377  213.904   34.352  213.904   34.352 0.000000 0.000000 
1 1 1    0   37   18 o  476.326   20.438  176.467   14.839  176.467   14.839  176.467   14.839  476.326   20.438  476.326   20.438 0.000000 0.000000 
1 1 1    0   37   19 o  341.167   23.426   91.612   12.101   91.612   12.101   91.612   12.101  341.167   23.426  341.167   23.426 0.000000 0.000000 
1 1 1    0   37   20 o  253.046   20.179   50.467   7.7014   50.467   7.7014   50.467   7.7014  253.046   20.179  253.046   20.179 0.000000 0.000000 
1 1 1    0   37   21 o  348.639   16.335   94.329   8.6733   94.329   8.6733   94.329   8.6733  348.639   16.335  348.639   16.335 0.000000 0.000000 
1 1 1    0   37   22 o  331.813   17.864   85.766   9.0127   85.766   9.0127   85.766   9.0127  331.813   17.864  331.813   17.864 0.000000 0.000000 
1 1 1    0   37   23 o   62.741   41.546  -1.6555   10.465  -1.6555   10.465  -1.6555   10.465   62.741   41.546   62.741   41.546 0.000000 0.000000 
1 1 1    0   37   24 o  294.442   28.393   69.778   12.523   69.778   12.523   69.778   12.523  294.442   28.393  294.442   28.393 0.000000 0.000000 
1 1 1    0   37   25 o   73.086   41.733   5.7839   7.3380   5.7839   7.3380   5.7839   7.3380   73.086   41.733   73.086   41.733 0.000000 0.000000 
1 1 1    0   37   26 o  309.213   18.199   74.724   8.5450   74.724   8.5450   74.724   8.5450  309.213   18.199  309.213   18.199 0.000000 0.000000 
1 1 1    0   37   27 o  140.423   41.081   19.150   7.6689   19.150   7.6689   19.150   7.6689  140.423   41.081  140.423   41.081 0.000000 0.000000 
1 1 1    0   37   28 o  333.938   18.240   87.112   9.2594   87.112   9.2594   87.112   9.2594  333.938   18.240  333.938   18.240 0.000000 0.000000 
1 1 1    0   37   29 o   81.620   44.642   7.8851   7.9651   7.8851   7.9651   7.8851   7.9651   81.620   44.642   81.620   44.642 0.000000 0.000000 
1 1 1    0   37   30 o   52.778   35.026  -1.3987   7.5050  -1.3987   7.5050  -1.3987   7.5050   52.778   35.026   52.778   35.026 0.000000 0.000000 
1 1 1    0   37   31 o  214.918   28.676   38.299   8.9629   38.299   8.9629   38.299   8.9629  214.918   28.676  214.918   28.676 0.000000 0.000000 
1 1 1    0   37   32 o   69.223   43.950   2.5647   10.130   2.5647   10.130   2.5647   10.130   69.223   43.950   69.223   43.950 0.000000 0.000000 
1 1 1    0   37   33 o  121.138   53.837   17.929   10.558   17.929   10.558   17.929   10.558  121.138   53.837  121.138   53.837 0.000000 0.000000 
1 1 1    0   37   34 o   95.561   47.977   11.489   8.6195   11.489   8.6195   11.489   8.6195   95.561   47.977   95.561   47.977 0.000000 0.000000 
1 1 1    0   37   36 o   49.412   34.042  -5.1303   8.5308  -5.1303   8.5308  -5.1303   8.5308   49.412   34.042   49.412   34.042 0.000000 0.000000 
1 1 1    0   37   37 o   57.164   37.769  -0.5707   8.5724  -0.5707   8.5724  -0.5707   8.5724   57.164   37.769   57.164   37.769 0.000000 0.000000 
1 1 1    0   37   38 o  188.513   35.934   31.871   9.2748   31.871   9.2748   31.871   9.2748  188.513   35.934  188.513   35.934 0.000000 0.000000 
1 1 1    0   37   39 o  223.666   29.469   42.422   9.6020   42.422   9.6020   42.422   9.6020  223.666   29.469  223.666   29.469 0.000000 0.000000 
1 1 1    0   37   40 o  113.274   47.839   15.683   8.3788   15.683   8.3788   15.683   8.3788  113.274   47.839  113.274   47.839 0.000000 0.000000 
1 1 1    0   37   41 o   68.912   45.314   1.6423   12.106   1.6423   12.106   1.6423   12.106   68.912   45.314   68.912   45.314 0.000000 0.000000 
1 1 1    0   38    1 o  111.554   48.560   14.174   8.5965   14.174   8.5965   14.174   8.5965  111.554   48.560  111.554   48.560 0.000000 0.000000 
1 1 1    0   38    2 f  146.697   43.893   20.875   8.5843   20.875   8.5843   20.875   8.5843  146.697   43.893  146.697   43.893 0.000000 0.000000 
1 1 1    0   38    3 o  135.651   45.236   18.607   8.3696   18.607   8.3696   18.607   8.3696  135.651   45.236  135.651   45.236 0.000000 0.000000 
1 1 1    0   38    4 o  328.063   21.885   84.337   10.877   84.337   10.877   84.337   10.877  328.063   21.885  328.063   21.885 0.000000 0.000000 
1 1 1    0   38    5 o   64.472   40.484   2.0555   8.3353   2.0555   8.3353   2.0555   8.3353   64.472   40.484   64.472   40.484 0.000000 0.000000 
1 1 1    0   38    6 o  420.859   19.033  137.503   12.203  137.503   12.203  137.503   12.203  420.859   19.033  420.859   19.033 0.000000 0.000000 
1 1 1    0   38    7 o  449.249   18.735  156.515   12.832  156.515   12.832  156.515   12.832  449.249   18.735  449.249   18.735 0.000000 0.000000 
1 1 1    0   38    8 o  487.827   18.904  184.467   14.067  184.467   14.067  184.467   14.067  487.827   18.904  487.827   18.904 0.000000 0.000000 
1 1 1    0   38    9 o   76.333   45.580   5.3270   9.4226   5.3270   9.4226   5.3270   9.4226   76.333   45.580   76.333   45.580 0.000000 0.000000 
1 1 1    0   38   10 o   59.535   39.253  -1.3280   9.1806  -1.3280   9.1806  -1.3280   9.1806   59.535   39.253   59.535   39.253 0.000000 0.000000 
1 1 1    0   38   11 o  717.448   17.841  397.734   19.565  397.734   19.565  397.734   19.565  717.448   17.841  717.448   17.841 0.000000 0.000000 
1 1 1    0   38   12 o  246.938   28.339   49.354   10.346   49.354   10.346   49.354   10.346  246.938   28.339  246.938   28.339 0.000000 0.000000 
1 1 1    0   38   13 o  326.368   23.084   83.810   11.399   83.810   11.399   83.810   11.399  326.368   23.084  326.368   23.084 0.000000 0.000000 
1 1 1    0   38   14 o   72.052   44.199   3.8964   9.3775   3.8964   9.3775   3.8964   9.3775   72.052   44.199   72.052   44.199 0.000000 0.000000 
1 1 1    0   38   15 o   51.961   35.612  -5.4484   9.0580  -5.4484   9.0580  -5.4484   9.0580   51.961   35.612   51.961   35.612 0.000000 0.000000 
1 1 1    0   38   16 o   46.049   32.450  -9.9386   9.0475  -9.9386   9.0475  -9.9386   9.0475   46.049   32.450   46.049   32.450 0.000000 0.000000 
1 1 1    0   38   17 f  108.027   51.995   14.014   9.9554   14.014   9.9554   14.014   9.9554  108.027   51.995  108.027   51.995 0.000000 0.000000 
1 1 1    0   38   18 o  325.615   23.992   83.744   11.808   83.744   11.808   83.744   11.808  325.615   23.992  325.615   23.992 0.000000 0.000000 
1 1 1    0   38   19 o  129.489   53.931   19.143   10.673   19.143   10.673   19.143   10.673  129.489   53.931  129.489   53.931 0.000000 0.000000 
1 1 1    0   38   20 o   76.323   46.486   4.8931   10.207   4.8931   10.207   4.8931   10.207   76.323   46.486   76.323   46.486 0.000000 0.000000 
1 1 1    0   38   21 o  193.901   42.415   33.797   11.024   33.797   11.024   33.797   11.024  193.901   42.415  193.901   42.415 0.000000 0.000000 
1 1 1    0   38   22 o  174.469   31.070   25.979   7.5129   25.979   7.5129   25.979   7.5129  174.469   31.070  174.469   31.070 0.000000 0.000000 
1 1 1    0   38   23 o   49.983   33.415  -2.0318   7.0485  -2.0318   7.0485  -2.0318   7.0485   49.983   33.415   49.983   33.415 0.000000 0.000000 
1 1 1    0   38   24 o  317.776   18.201   78.887   8.7866   78.887   8.7866   78.887   8.7866  317.776   18.201  317.776   18.201 0.000000 0.000000 
1 1 1    0   38   25 o   71.936   41.369   5.5478   7.2867   5.5478   7.2867   5.5478   7.2867   71.936   41.369   71.936   41.369 0.000000 0.000000 
1 1 1    0   38   26 o   51.415   34.192  -1.5777   7.2114  -1.5777   7.2114  -1.5777   7.2114   51.415   34.192   51.415   34.192 0.000000 0.000000 
1 1 1    0   38   27 o   51.316   34.092  -1.4669   7.1400  -1.4669   7.1400  -1.4669   7.1400   51.316   34.092   51.316   34.092 0.000000 0.000000 
1 1 1    0   38   28 o  137.580   43.945   19.177   8.1554   19.177   8.1554   19.177   8.1554  137.580   43.945  137.580   43.945 0.000000 0.000000 
1 1 1    0   38   29 o  340.569   18.794   90.882   9.7288   90.882   9.7288   90.882   9.7288  340.569   18.794  340.569   18.794 0.000000 0.000000 
1 1 1    0   38   30 o  191.279   42.189   33.468   10.805   33.468   10.805   33.468   10.805  191.279   42.189  191.279   42.189 0.000000 0.000000 
1 1 1    0   38   31 o   84.940   48.778   8.5156   10.108   8.5156   10.108   8.5156   10.108   84.940   48.778   84.940   48.778 0.000000 0.000000 
1 1 1    0   38   32 f  162.540   41.031   24.968   8.8279   24.968   8.8279   24.968   8.8279  162.540   41.031  162.540   41.031 0.000000 0.000000 
1 1 1    0   38   33 o  176.283   35.953   27.801   8.5810   27.801   8.5810   27.801   8.5810  176.283   35.953  176.283   35.953 0.000000 0.000000 
1 1 1    0   38   34 o   67.383   41.482   3.8862   8.3264   3.8862   8.3264   3.8862   8.3264   67.383   41.482   67.383   41.482 0.000000 0.000000 
1 1 1    0   38   35 o  129.319   47.825   18.670   8.7788   18.670   8.7788   18.670   8.7788  129.319   47.825  129.319   47.825 0.000000 0.000000 
1 1 1    0   38   36 o  146.625   44.727   22.103   8.7682   22.103   8.7682   22.103   8.7682  146.625   44.727  146.625   44.727 0.000000 0.000000 
1 1 1    0   38   37 o  119.485   47.551   16.728   8.4044   16.728   8.4044   16.728   8.4044  119.485   47.551  119.485   47.551 0.000000 0.000000 
1 1 1    0   38   38 o  281.223   22.323   63.881   9.4697   63.881   9.4697   63.881   9.4697  281.223   22.323  281.223   22.323 0.000000 0.000000 
1 1 1    0   38   39 o   68.043   44.999   0.8740   12.213   0.8740   12.213   0.8740   12.213   68.043   44.999   68.043   44.999 0.000000 0.000000 
1 1 1    0   39    1 o  273.547   18.261   58.487   7.5679   58.487   7.5679   58.487   7.5679  273.547   18.261  273.547   18.261 0.000000 0.000000 
1 1 1    0   39    4 o  255.422   28.074   52.630   10.638   52.630   10.638   52.630   10.638  255.422   28.074  255.422   28.074 0.000000 0.000000 
1 1 1    0   39    5 o   62.899   40.105   1.2132   8.5451   1.2132   8.5451   1.2132   8.5451   62.899   40.105   62.899   40.105 0.000000 0.000000 
1 1 1    0   39    6 o  157.113   45.082   23.727   9.4000   23.727   9.4000   23.727   9.4000  157.113   45.082  157.113   45.082 0.000000 0.000000 
1 1 1    0   39    7 o   53.129   36.092  -4.2917   8.8730  -4.2917   8.8730  -4.2917   8.8730   53.129   36.092   53.129   36.092 0.000000 0.000000 
1 1 1    0   39    8 o  299.207   24.058   70.822   10.854   70.822   10.854   70.822   10.854  299.207   24.058  299.207   24.058 0.000000 0.000000 
1 1 1    0   39    9 o  713.576   17.745  393.593   19.354  393.593   19.354  393.593   19.354  713.576   17.745  713.576   17.745 0.000000 0.000000 
1 1 1    0   39   10 o  110.090   49.912   14.164   9.0771   14.164   9.0771   14.164   9.0771  110.090   49.912  110.090   49.912 0.000000 0.000000 
1 1 1    0   39   11 o   94.013   49.375   10.550   9.3983   10.550   9.3983   10.550   9.3983   94.013   49.375   94.013   49.375 0.000000 0.000000 
1 1 1    0   39   12 o   53.874   36.414  -3.6413   8.8045  -3.6413   8.8045  -3.6413   8.8045   53.874   36.414   53.874   36.414 0.000000 0.000000 
1 1 1    0   39   13 o   71.362   43.659   3.9510   9.0949   3.9510   9.0949   3.9510   9.0949   71.362   43.659   71.362   43.659 0.000000 0.000000 
1 1 1    0   39   14 o  465.374   19.826  168.467   14.064  168.467   14.064  168.467   14.064  465.374   19.826  465.374   19.826 0.000000 0.000000 
1 1 1    0   39   15 o  161.421   47.065   25.364   10.097   25.364   10.097   25.364   10.097  161.421   47.065  161.421   47.065 0.000000 0.000000 
1 1 1    0   39   16 o  100.410   50.877   12.226   9.7451   12.226   9.7451   12.226   9.7451  100.410   50.877  100.410   50.877 0.000000 0.000000 
1 1 1    0   39   17 o  232.418   32.578   44.884   10.937   44.884   10.937   44.884   10.937  232.418   32.578  232.418   32.578 0.000000 0.000000 
1 1 1    0   39   18 o  150.826   50.239   23.425   10.331   23.425   10.331   23.425   10.331  150.826   50.239  150.826   50.239 0.000000 0.000000 
1 1 1    0   39   19 o  652.518   19.144  330.441   19.083  330.441   19.083  330.441   19.083  652.518   19.144  652.518   19.144 0.000000 0.000000 
1 1 1    0   39   20 o   99.934   51.709   12.235   10.192   12.235   10.192   12.235   10.192   99.934   51.709   99.934   51.709 0.000000 0.000000 
1 1 1    0   39   21 o  229.504   36.452   44.762   11.838   44.762   11.838   44.762   11.838  229.504   36.452  229.504   36.452 0.000000 0.000000 
1 1 1    0   39   22 o   47.165   32.180  -3.8548   7.2153  -3.8548   7.2153  -3.8548   7.2153   47.165   32.180   47.165   32.180 0.000000 0.000000 
1 1 1    0   39   23 f   80.822   43.516   7.7378   7.4558   7.7378   7.4558   7.7378   7.4558   80.822   43.516   80.822   43.516 0.000000 0.000000 
1 1 1    0   39   25 o  105.140   45.138   12.751   7.4391   12.751   7.4391   12.751   7.4391  105.140   45.138  105.140   45.138 0.000000 0.000000 
1 1 1    0   39   26 o  320.804   18.857   80.701   9.1860   80.701   9.1860   80.701   9.1860  320.804   18.857  320.804   18.857 0.000000 0.000000 
1 1 1    0   39   27 f  188.430   35.269   31.031   9.1283   31.031   9.1283   31.031   9.1283  188.430   35.269  188.430   35.269 0.000000 0.000000 
1 1 1    0   39   28 o   99.493   51.615   12.564   10.175   12.564   10.175   12.564   10.175   99.493   51.615   99.493   51.615 0.000000 0.000000 
1 1 1    0   39   29 o  315.633   20.502   78.703   9.8090   78.703   9.8090   78.703   9.8090  315.633   20.502  315.633   20.502 0.000000 0.000000 
1 1 1    0   39   30 o   51.890   35.007  -2.7260   8.0661  -2.7260   8.0661  -2.7260   8.0661   51.890   35.007   51.890   35.007 0.000000 0.000000 
1 1 1    0   39   31 o  248.224   24.689   49.975   9.1673   49.975   9.1673   49.975   9.1673  248.224   24.689  248.224   24.689 0.000000 0.000000 
1 1 1    0   39   32 o  281.334   23.494   63.636   9.9545   63.636   9.9545   63.636   9.9545  281.334   23.494  281.334   23.494 0.000000 0.000000 
1 1 1    0   39   33 o  187.393   35.052   31.140   9.0234   31.140   9.0234   31.140   9.0234  187.393   35.052  187.393   35.052 0.000000 0.000000 
1 1 1    0   39   34 o  126.825   48.592   18.428   8.9098   18.428   8.9098   18.428   8.9098  126.825   48.592  126.825   48.592 0.000000 0.000000 
1 1 1    0   39   35 o   43.034   30.480  -9.2101   8.3224  -9.2101   8.3224  -9.2101   8.3224   43.034   30.480   43.034   30.480 0.000000 0.000000 
1 1 1    0   39   36 o   74.187   43.327   6.5844   8.1856   6.5844   8.1856   6.5844   8.1856   74.187   43.327   74.187   43.327 0.000000 0.000000 
1 1 1    0   39   37 o  236.177   25.774   46.284   9.0355   46.284   9.0355   46.284   9.0355  236.177   25.774  236.177   25.774 0.000000 0.000000 
1 1 1    0   40    0 o   42.092   30.012 -12.2821   8.5662 -12.2821   8.5662 -12.2821   8.5662   42.092   30.012   42.092   30.012 0.000000 0.000000 
1 1 1    0   40    1 o  118.466   40.294   14.279   6.5500   14.279   6.5500   14.279   6.5500  118.466   40.294  118.466   40.294 0.000000 0.000000 
1 1 1    0   40    2 o  132.759   36.230   16.521   6.3647   16.521   6.3647   16.521   6.3647  132.759   36.230  132.759   36.230 0.000000 0.000000 
1 1 1    0   40    3 o  246.563   27.000   49.034   9.8790   49.034   9.8790   49.034   9.8790  246.563   27.000  246.563   27.000 0.000000 0.000000 
1 1 1    0   40    6 o  157.861   45.986   24.169   9.6467   24.169   9.6467   24.169   9.6467  157.861   45.986  157.861   45.986 0.000000 0.000000 
1 1 1    0   40    7 o  386.080   20.395  116.327   11.975  116.327   11.975  116.327   11.975  386.080   20.395  386.080   20.395 0.000000 0.000000 
1 1 1    0   40    8 o   83.247   47.693   7.5556   9.6276   7.5556   9.6276   7.5556   9.6276   83.247   47.693   83.247   47.693 0.000000 0.000000 
1 1 1    0   40    9 o  325.116   23.564   83.405   11.585   83.405   11.585   83.405   11.585  325.116   23.564  325.116   23.564 0.000000 0.000000 
1 1 1    0   40   10 o  283.582   26.554   64.347   11.294   64.347   11.294   64.347   11.294  283.582   26.554  283.582   26.554 0.000000 0.000000 
1 1 1    0   40   11 f  450.367   20.645  158.115   14.164  158.115   14.164  158.115   14.164  450.367   20.645  450.367   20.645 0.000000 0.000000 
1 1 1    0   40   12 o  250.978   29.251   51.274   10.838   51.274   10.838   51.274   10.838  250.978   29.251  250.978   29.251 0.000000 0.000000 
1 1 1    0   40   13 o  220.049   32.625   40.460   10.278   40.460   10.278   40.460   10.278  220.049   32.625  220.049   32.625 0.000000 0.000000 
1 1 1    0   40   14 o  397.320   21.931  123.668   13.244  123.668   13.244  123.668   13.244  397.320   21.931  397.320   21.931 0.000000 0.000000 
1 1 1    0   40   15 o  494.070   19.618  189.926   14.783  189.926   14.783  189.926   14.783  494.070   19.618  494.070   19.618 0.000000 0.000000 
1 1 1    0   40   16 o  172.711   47.371   28.621   10.828   28.621   10.828   28.621   10.828  172.711   47.371  172.711   47.371 0.000000 0.000000 
1 1 1    0   40   17 o  452.376   21.169  159.903   14.584  159.903   14.584  159.903   14.584  452.376   21.169  452.376   21.169 0.000000 0.000000 
1 1 1    0   40   18 o  359.816   23.753  102.210   12.951  102.210   12.951  102.210   12.951  359.816   23.753  359.816   23.753 0.000000 0.000000 
1 1 1    0   40   19 o  579.089   19.525  260.889   17.262  260.889   17.262  260.889   17.262  579.089   19.525  579.089   19.525 0.000000 0.000000 
1 1 1    0   40   20 o  286.262   31.021   66.926   13.188   66.926   13.188   66.926   13.188  286.262   31.021  286.262   31.021 0.000000 0.000000 
1 1 1    0   40   21 o   56.246   38.624  -6.2211   10.771  -6.2211   10.771  -6.2211   10.771   56.246   38.624   56.246   38.624 0.000000 0.000000 
1 1 1    0   40   22 o  373.573   26.239  111.151   14.833  111.151   14.833  111.151   14.833  373.573   26.239  373.573   26.239 0.000000 0.000000 
1 1 1    0   40   23 o   97.552   45.991   11.456   7.7481   11.456   7.7481   11.456   7.7481   97.552   45.991   97.552   45.991 0.000000 0.000000 
1 1 1    0   40   24 o  365.650   18.330  104.523   10.200  104.523   10.200  104.523   10.200  365.650   18.330  365.650   18.330 0.000000 0.000000 
1 1 1    0   40   25 o  218.734   38.693   41.872   11.745   41.872   11.745   41.872   11.745  218.734   38.693  218.734   38.693 0.000000 0.000000 
1 1 1    0   40   26 o   65.634   42.346   1.2668   9.8846   1.2668   9.8846   1.2668   9.8846   65.634   42.346   65.634   42.346 0.000000 0.000000 
1 1 1    0   40   27 o  142.325   42.501   20.150   8.0622   20.150   8.0622   20.150   8.0622  142.325   42.501  142.325   42.501 0.000000 0.000000 
1 1 1    0   40   28 o   72.712   42.936   5.6008   8.1957   5.6008   8.1957   5.6008   8.1957   72.712   42.936   72.712   42.936 0.000000 0.000000 
1 1 1    0   40   29 o  208.081   30.169   36.570   9.0207   36.570   9.0207   36.570   9.0207  208.081   30.169  208.081   30.169 0.000000 0.000000 
1 1 1    0   40   30 o   60.489   39.138   0.9568   8.5255   0.9568   8.5255   0.9568   8.5255   60.489   39.138   60.489   39.138 0.000000 0.000000 
1 1 1    0   40   31 o  220.033   30.021   40.899   9.5777   40.899   9.5777   40.899   9.5777  220.033   30.021  220.033   30.021 0.000000 0.000000 
1 1 1    0   40   32 o   81.903   45.825   8.4743   8.6110   8.4743   8.6110   8.4743   8.6110   81.903   45.825   81.903   45.825 0.000000 0.000000 
1 1 1    0   40   33 o   49.099   33.942  -5.3355   8.6563  -5.3355   8.6563  -5.3355   8.6563   49.099   33.942   49.099   33.942 0.000000 0.000000 
1 1 1    0   40   34 o   76.993   44.555   7.2861   8.5351   7.2861   8.5351   7.2861   8.5351   76.993   44.555   76.993   44.555 0.000000 0.000000 
1 1 1    0   40   35 f  119.682   48.086   17.056   8.5704   17.056   8.5704   17.056   8.5704  119.682   48.086  119.682   48.086 0.000000 0.000000 
1 1 1    0   41    1 o  274.918   17.874   59.101   7.4486   59.101   7.4486   59.101   7.4486  274.918   17.874  274.918   17.874 0.000000 0.000000 
1 1 1    0   41    2 o   52.300   34.078  -0.2805   6.6191  -0.2805   6.6191  -0.2805   6.6191   52.300   34.078   52.300   34.078 0.000000 0.000000 
1 1 1    0   41    3 o  265.458   27.613   56.808   10.942   56.808   10.942   56.808   10.942  265.458   27.613  265.458   27.613 0.000000 0.000000 
1 1 1    0   41    4 o  210.686   33.463   37.402   9.9759   37.402   9.9759   37.402   9.9759  210.686   33.463  210.686   33.463 0.000000 0.000000 
1 1 1    0   41    5 o   76.920   45.704   5.7138   9.3883   5.7138   9.3883   5.7138   9.3883   76.920   45.704   76.920   45.704 0.000000 0.000000 
1 1 1    0   41    8 o  117.650   51.499   16.122   9.6666   16.122   9.6666   16.122   9.6666  117.650   51.499  117.650   51.499 0.000000 0.000000 
1 1 1    0   41    9 o  193.377   36.916   32.517   9.7715   32.517   9.7715   32.517   9.7715  193.377   36.916  193.377   36.916 0.000000 0.000000 
1 1 1    0   41   10 o  122.809   51.648   17.280   9.7729   17.280   9.7729   17.280   9.7729  122.809   51.648  122.809   51.648 0.000000 0.000000 
1 1 1    0   41   11 o  255.990   27.701   53.034   10.532   53.034   10.532   53.034   10.532  255.990   27.701  255.990   27.701 0.000000 0.000000 
1 1 1    0   41   12 o  114.625   51.959   15.604   9.8365   15.604   9.8365   15.604   9.8365  114.625   51.959  114.625   51.959 0.000000 0.000000 
1 1 1    0   41   13 o   73.942   45.650   4.1307   10.148   4.1307   10.148   4.1307   10.148   73.942   45.650   73.942   45.650 0.000000 0.000000 
1 1 1    0   41   14 o   73.581   45.387   4.1411   10.011   4.1411   10.011   4.1411   10.011   73.581   45.387   73.581   45.387 0.000000 0.000000 
1 1 1    0   41   15 o  363.678   23.848  104.469   13.144  104.469   13.144  104.469   13.144  363.678   23.848  363.678   23.848 0.000000 0.000000 
1 1 1    0   41   16 o  625.062   18.951  303.618   18.093  303.618   18.093  303.618   18.093  625.062   18.951  625.062   18.951 0.000000 0.000000 
1 1 1    0   41   17 o  106.864   53.009   14.155   10.466   14.155   10.466   14.155   10.466  106.864   53.009  106.864   53.009 0.000000 0.000000 
1 1 1    0   41   18 o  424.924   22.999  142.115   14.859  142.115   14.859  142.115   14.859  424.924   22.999  424.924   22.999 0.000000 0.000000 
1 1 1    0   41   19 o  124.626   56.261   18.917   11.528   18.917   11.528   18.917   11.528  124.626   56.261  124.626   56.261 0.000000 0.000000 
1 1 1    0   41   20 o  169.442   56.172   30.381   12.959   30.381   12.959   30.381   12.959  169.442   56.172  169.442   56.172 0.000000 0.000000 
1 1 1    0   41   21 o  145.099   59.530   24.894   13.056   24.894   13.056   24.894   13.056  145.099   59.530  145.099   59.530 0.000000 0.000000 
1 1 1    0   41   24 o  396.352   17.670  122.702   10.671  122.702   10.671  122.702   10.671  396.352   17.670  396.352   17.670 0.000000 0.000000 
1 1 1    0   41   25 o  466.639   16.243  169.397   11.570  169.397   11.570  169.397   11.570  466.639   16.243  466.639   16.243 0.000000 0.000000 
1 1 1    0   41   26 o   57.971   37.893   0.0302   8.2820   0.0302   8.2820   0.0302   8.2820   57.971   37.893   57.971   37.893 0.000000 0.000000 
1 1 1    0   41   27 o   45.016   31.546  -7.4967   8.1968  -7.4967   8.1968  -7.4967   8.1968   45.016   31.546   45.016   31.546 0.000000 0.000000 
1 1 1    0   41   28 o  251.558   25.407   51.640   9.5539   51.640   9.5539   51.640   9.5539  251.558   25.407  251.558   25.407 0.000000 0.000000 
1 1 1    0   41   29 o   98.588   48.195   12.447   8.6000   12.447   8.6000   12.447   8.6000   98.588   48.195   98.588   48.195 0.000000 0.000000 
1 1 1    0   41   30 o   79.181   45.148   7.7363   8.5721   7.7363   8.5721   7.7363   8.5721   79.181   45.148   79.181   45.148 0.000000 0.000000 
1 1 1    0   41   31 o   74.063   44.165   6.1831   8.8225   6.1831   8.8225   6.1831   8.8225   74.063   44.165   74.063   44.165 0.000000 0.000000 
1 1 1    0   41   32 o   87.030   46.831   10.009   8.6300   10.009   8.6300   10.009   8.6300   87.030   46.831   87.030   46.831 0.000000 0.000000 
1 1 1    0   41   33 o  125.506   58.851   21.647   12.669   21.647   12.669   21.647   12.669  125.506   58.851  125.506   58.851 0.000000 0.000000 
1 1 1    0   42    0 o  292.331   25.831   67.594   11.351   67.594   11.351   67.594   11.351  292.331   25.831  292.331   25.831 0.000000 0.000000 
1 1 1    0   42    1 o   57.643   35.694   2.1453   6.2521   2.1453   6.2521   2.1453   6.2521   57.643   35.694   57.643   35.694 0.000000 0.000000 
1 1 1    0   42    2 o  632.739   12.988  308.443   12.567  308.443   12.567  308.443   12.567  632.739   12.988  632.739   12.988 0.000000 0.000000 
1 1 1    0   42    3 o   78.309   45.986   6.2907   9.3094   6.2907   9.3094   6.2907   9.3094   78.309   45.986   78.309   45.986 0.000000 0.000000 
1 1 1    0   42    4 o  274.526   27.613   60.771   11.334   60.771   11.334   60.771   11.334  274.526   27.613  274.526   27.613 0.000000 0.000000 
1 1 1    0   42    5 o  349.446   23.907   96.469   12.650   96.469   12.650   96.469   12.650  349.446   23.907  349.446   23.907 0.000000 0.000000 
1 1 1    0   42    6 o  310.396   24.596   76.544   11.517   76.544   11.517   76.544   11.517  310.396   24.596  310.396   24.596 0.000000 0.000000 
1 1 1    0   42    7 o  377.302   22.814  111.998   13.065  111.998   13.065  111.998   13.065  377.302   22.814  377.302   22.814 0.000000 0.000000 
1 1 1    0   42   10 o  230.267   37.466   45.345   12.156   45.345   12.156   45.345   12.156  230.267   37.466  230.267   37.466 0.000000 0.000000 
1 1 1    0   42   11 o  103.714   51.765   13.261   10.006   13.261   10.006   13.261   10.006  103.714   51.765  103.714   51.765 0.000000 0.000000 
1 1 1    0   42   12 o  205.752   38.943   37.100   10.984   37.100   10.984   37.100   10.984  205.752   38.943  205.752   38.943 0.000000 0.000000 
1 1 1    0   42   13 o  283.340   29.399   65.279   12.436   65.279   12.436   65.279   12.436  283.340   29.399  283.340   29.399 0.000000 0.000000 
1 1 1    0   42   14 o  423.961   22.293  141.268   14.375  141.268   14.375  141.268   14.375  423.961   22.293  423.961   22.293 0.000000 0.000000 
1 1 1    0   42   15 o  374.114   24.534  110.963   13.911  110.963   13.911  110.963   13.911  374.114   24.534  374.114   24.534 0.000000 0.000000 
1 1 1    0   42   16 f  298.270   28.580   72.093   12.773   72.093   12.773   72.093   12.773  298.270   28.580  298.270   28.580 0.000000 0.000000 
1 1 1    0   42   17 o  358.532   26.154  102.680   14.177  102.680   14.177  102.680   14.177  358.532   26.154  358.532   26.154 0.000000 0.000000 
1 1 1    0   42   21 o   68.424   45.445  -1.2169   12.672  -1.2169   12.672  -1.2169   12.672   68.424   45.445   68.424   45.445 0.000000 0.000000 
1 1 1    0   42   22 o   51.165   36.535 -16.8373   12.876 -16.8373   12.876 -16.8373   12.876   51.165   36.535   51.165   36.535 0.000000 0.000000 
1 1 1    0   42   23 o   45.825   33.239 -23.7454   12.741 -23.7454   12.741 -23.7454   12.741   45.825   33.239   45.825   33.239 0.000000 0.000000 
1 1 1    0   42   24 o   78.995   50.659   3.7863   13.877   3.7863   13.877   3.7863   13.877   78.995   50.659   78.995   50.659 0.000000 0.000000 
1 1 1    0   42   25 o  147.025   45.529   22.179   8.9706   22.179   8.9706   22.179   8.9706  147.025   45.529  147.025   45.529 0.000000 0.000000 
1 1 1    0   42   26 o  408.679   18.209  131.138   11.339  131.138   11.339  131.138   11.339  408.679   18.209  408.679   18.209 0.000000 0.000000 
1 1 1    0   42   27 o  123.086   48.948   17.674   8.9074   17.674   8.9074   17.674   8.9074  123.086   48.948  123.086   48.948 0.000000 0.000000 
1 1 1    0   42   28 o  130.461   48.713   19.328   9.0632   19.328   9.0632   19.328   9.0632  130.461   48.713  130.461   48.713 0.000000 0.000000 
1 1 1    0   42   29 o  110.798   49.248   15.346   8.8350   15.346   8.8350   15.346   8.8350  110.798   49.248  110.798   49.248 0.000000 0.000000 
1 1 1    0   42   30 o   62.750   40.087   2.2651   8.5875   2.2651   8.5875   2.2651   8.5875   62.750   40.087   62.750   40.087 0.000000 0.000000 
1 1 1    0   43    1 o   73.371   41.318   6.0382   7.0617   6.0382   7.0617   6.0382   7.0617   73.371   41.318   73.371   41.318 0.000000 0.000000 
1 1 1    0   43    2 o  231.463   22.070   42.805   7.6557   42.805   7.6557   42.805   7.6557  231.463   22.070  231.463   22.070 0.000000 0.000000 
1 1 1    0   43    3 o   91.916   43.323   10.033   6.8748   10.033   6.8748   10.033   6.8748   91.916   43.323   91.916   43.323 0.000000 0.000000 
1 1 1    0   43    4 o  466.522   21.282  170.350   15.125  170.350   15.125  170.350   15.125  466.522   21.282  466.522   21.282 0.000000 0.000000 
1 1 1    0   43    5 o   57.753   38.576  -2.2503   9.3587  -2.2503   9.3587  -2.2503   9.3587   57.753   38.576   57.753   38.576 0.000000 0.000000 
1 1 1    0   43    6 o  388.671   22.937  119.057   13.536  119.057   13.536  119.057   13.536  388.671   22.937  388.671   22.937 0.000000 0.000000 
1 1 1    0   43    7 o   50.974   35.468  -7.9199   9.8587  -7.9199   9.8587  -7.9199   9.8587   50.974   35.468   50.974   35.468 0.000000 0.000000 
1 1 1    0   43    8 o   91.109   51.092   9.9292   10.737   9.9292   10.737   9.9292   10.737   91.109   51.092   91.109   51.092 0.000000 0.000000 
1 1 1    0   43    9 o  123.189   53.964   18.098   10.614   18.098   10.614   18.098   10.614  123.189   53.964  123.189   53.964 0.000000 0.000000 
1 1 1    0   43   13 o  117.438   55.524   17.242   11.302   17.242   11.302   17.242   11.302  117.438   55.524  117.438   55.524 0.000000 0.000000 
1 1 1    0   43   17 o  373.239   25.469  111.245   14.394  111.245   14.394  111.245   14.394  373.239   25.469  373.239   25.469 0.000000 0.000000 
1 1 1    0   43   18 o   41.736   30.421 -24.3666   11.431 -24.3666   11.431 -24.3666   11.431   41.736   30.421   41.736   30.421 0.000000 0.000000 
1 1 1    0   43   19 o  168.837   56.164   30.719   12.924   30.719   12.924   30.719   12.924  168.837   56.164  168.837   56.164 0.000000 0.000000 
1 1 1    0   43   20 o   73.655   47.771   1.9529   12.805   1.9529   12.805   1.9529   12.805   73.655   47.771   73.655   47.771 0.000000 0.000000 
1 1 1    0   43   21 o  199.669   51.772   39.388   13.674   39.388   13.674   39.388   13.674  199.669   51.772  199.669   51.772 0.000000 0.000000 
1 1 1    0   43   22 o  547.217   23.697  237.831   19.763  237.831   19.763  237.831   19.763  547.217   23.697  547.217   23.697 0.000000 0.000000 
1 1 1    0   43   23 f  270.146   37.647   63.302   14.702   63.302   14.702   63.302   14.702  270.146   37.647  270.146   37.647 0.000000 0.000000 
1 1 1    0   43   24 o  144.612   61.647   26.729   13.892   26.729   13.892   26.729   13.892  144.612   61.647  144.612   61.647 0.000000 0.000000 
1 1 1    0   43   25 o  300.489   34.126   76.723   15.173   76.723   15.173   76.723   15.173  300.489   34.126  300.489   34.126 0.000000 0.000000 
1 1 1    0   43   26 o  236.465   26.900   46.429   9.4109   46.429   9.4109   46.429   9.4109  236.465   26.900  236.465   26.900 0.000000 0.000000 
1 1 1    0   43   27 o  109.181   49.285   15.049   8.8465   15.049   8.8465   15.049   8.8465  109.181   49.285  109.181   49.285 0.000000 0.000000 
1 1 1    0   44    0 o  142.343   52.655   21.543   10.640   21.543   10.640   21.543   10.640  142.343   52.655  142.343   52.655 0.000000 0.000000 
1 1 1    0   44    1 o  304.778   19.082   72.981   8.8219   72.981   8.8219   72.981   8.8219  304.778   19.082  304.778   19.082 0.000000 0.000000 
1 1 1    0   44    2 o  544.116   14.293  228.975   11.885  228.975   11.885  228.975   11.885  544.116   14.293  544.116   14.293 0.000000 0.000000 
1 1 1    0   44    3 o  289.712   19.586   66.122   8.5940   66.122   8.5940   66.122   8.5940  289.712   19.586  289.712   19.586 0.000000 0.000000 
1 1 1    0   44    4 f  475.987   21.932  177.973   15.902  177.973   15.902  177.973   15.902  475.987   21.932  475.987   21.932 0.000000 0.000000 
1 1 1    0   44    5 o  101.055   53.256   12.941   10.962   12.941   10.962   12.941   10.962  101.055   53.256  101.055   53.256 0.000000 0.000000 
1 1 1    0   44    6 o  147.541   54.497   24.122   11.406   24.122   11.406   24.122   11.406  147.541   54.497  147.541   54.497 0.000000 0.000000 
1 1 1    0   44    7 o  235.292   36.618   47.444   12.236   47.444   12.236   47.444   12.236  235.292   36.618  235.292   36.618 0.000000 0.000000 
1 1 1    0   44   15 o  146.683   54.520   24.254   11.379   24.254   11.379   24.254   11.379  146.683   54.520  146.683   54.520 0.000000 0.000000 
1 1 1    0   44   16 o   82.612   49.459   7.4653   11.154   7.4653   11.154   7.4653   11.154   82.612   49.459   82.612   49.459 0.000000 0.000000 
1 1 1    0   44   17 o  386.483   25.075  119.621   14.690  119.621   14.690  119.621   14.690  386.483   25.075  386.483   25.075 0.000000 0.000000 
1 1 1    0   44   18 o  101.853   56.680   13.957   13.094   13.957   13.094   13.957   13.094  101.853   56.680  101.853   56.680 0.000000 0.000000 
1 1 1    0   44   19 o  460.564   24.961  169.691   17.478  169.691   17.478  169.691   17.478  460.564   24.961  460.564   24.961 0.000000 0.000000 
1 1 1    0   44   20 o  263.987   36.632   60.272   13.988   60.272   13.988   60.272   13.988  263.987   36.632  263.987   36.632 0.000000 0.000000 
1 1 1    0   44   21 f   43.831   31.825 -22.2019   11.842 -22.2019   11.842 -22.2019   11.842   43.831   31.825   43.831   31.825 0.000000 0.000000 
1 1 1    0   44   22 o  191.287   54.387   38.117   13.796   38.117   13.796   38.117   13.796  191.287   54.387  191.287   54.387 0.000000 0.000000 
1 1 1    0   44   23 o   73.459   47.134   3.5237   12.033   3.5237   12.033   3.5237   12.033   73.459   47.134   73.459   47.134 0.000000 0.000000 
1 1 1    0   44   24 o  136.058   58.859   23.915   12.633   23.915   12.633   23.915   12.633  136.058   58.859  136.058   58.859 0.000000 0.000000 
1 1 1    0   45    5 o  285.836   28.754   66.775   12.288   66.775   12.288   66.775   12.288  285.836   28.754  285.836   28.754 0.000000 0.000000 
1 1 1    0   45    6 o  133.507   53.013   20.564   10.453   20.564   10.453   20.564   10.453  133.507   53.013  133.507   53.013 0.000000 0.000000 
1 1 1    0   45    7 o  203.695   38.950   36.931   10.857   36.931   10.857   36.931   10.857  203.695   38.950  203.695   38.950 0.000000 0.000000 
1 1 1    0   45    8 o  146.146   51.459   23.256   10.449   23.256   10.449   23.256   10.449  146.146   51.459  146.146   51.459 0.000000 0.000000 
1 1 1    0   45    9 o  449.347   20.879  158.962   14.289  158.962   14.289  158.962   14.289  449.347   20.879  449.347   20.879 0.000000 0.000000 
1 1 1    0   45   10 o   81.217   47.408   7.6055   9.7923   7.6055   9.7923   7.6055   9.7923   81.217   47.408   81.217   47.408 0.000000 0.000000 
1 1 1    0   45   11 f  167.477   49.330   28.489   10.990   28.489   10.990   28.489   10.990  167.477   49.330  167.477   49.330 0.000000 0.000000 
1 1 1    0   45   12 o  302.476   27.570   74.587   12.521   74.587   12.521   74.587   12.521  302.476   27.570  302.476   27.570 0.000000 0.000000 
1 1 1    0   45   13 o   77.617   47.798   5.7411   11.063   5.7411   11.063   5.7411   11.063   77.617   47.798   77.617   47.798 0.000000 0.000000 
1 1 1    0   45   17 o  158.341   55.437   28.207   12.169   28.207   12.169   28.207   12.169  158.341   55.437  158.341   55.437 0.000000 0.000000 
1 1 1    0   45   18 o  259.319   35.719   58.164   13.412   58.164   13.412   58.164   13.412  259.319   35.719  259.319   35.719 0.000000 0.000000 
1 1 1    0   45   19 o  270.164   33.426   62.229   13.254   62.229   13.254   62.229   13.254  270.164   33.426  270.164   33.426 0.000000 0.000000 
1 1 1    0   45   20 o   65.247   43.672  -1.2621   12.102  -1.2621   12.102  -1.2621   12.102   65.247   43.672   65.247   43.672 0.000000 0.000000 
1 1 1    0   46    0 f  274.313   28.486   60.677   11.665   60.677   11.665   60.677   11.665  274.313   28.486  274.313   28.486 0.000000 0.000000 
1 1 1    0   46    1 o   59.046   36.822   2.4063   6.7734   2.4063   6.7734   2.4063   6.7734   59.046   36.822   59.046   36.822 0.000000 0.000000 
1 1 1    0   46    2 o  258.579   20.451   53.296   7.9778   53.296   7.9778   53.296   7.9778  258.579   20.451  258.579   20.451 0.000000 0.000000 
1 1 1    0   46    3 o  200.752   26.364   33.502   7.7137   33.502   7.7137   33.502   7.7137  200.752   26.364  200.752   26.364 0.000000 0.000000 
1 1 1    0   46    4 o  351.039   17.073   96.525   9.1239   96.525   9.1239   96.525   9.1239  351.039   17.073  351.039   17.073 0.000000 0.000000 
1 1 1    0   46    5 o  328.904   26.018   87.462   12.910   87.462   12.910   87.462   12.910  328.904   26.018  328.904   26.018 0.000000 0.000000 
1 1 1    0   46    6 o   71.962   44.674   4.4140   9.8566   4.4140   9.8566   4.4140   9.8566   71.962   44.674   71.962   44.674 0.000000 0.000000 
1 1 1    0   46    7 o  178.255   43.343   30.239   10.247   30.239   10.247   30.239   10.247  178.255   43.343  178.255   43.343 0.000000 0.000000 
1 1 1    0   46    8 o   67.864   43.217   2.7152   9.8836   2.7152   9.8836   2.7152   9.8836   67.864   43.217   67.864   43.217 0.000000 0.000000 
1 1 1    0   46    9 o   68.007   43.582   2.4122   10.249   2.4122   10.249   2.4122   10.249   68.007   43.582   68.007   43.582 0.000000 0.000000 
1 1 1    0   46   10 o  242.505   30.771   49.533   10.921   49.533   10.921   49.533   10.921  242.505   30.771  242.505   30.771 0.000000 0.000000 
1 1 1    0   46   11 o  116.923   52.960   17.308   10.219   17.308   10.219   17.308   10.219  116.923   52.960  116.923   52.960 0.000000 0.000000 
1 1 1    0   46   12 o  372.853   25.273  112.092   14.271  112.092   14.271  112.092   14.271  372.853   25.273  372.853   25.273 0.000000 0.000000 
1 1 1    0   46   13 o  108.135   54.519   15.774   11.158   15.774   11.158   15.774   11.158  108.135   54.519  108.135   54.519 0.000000 0.000000 
1 1 1    0   46   14 o   52.773   36.916  -8.7132   11.080  -8.7132   11.080  -8.7132   11.080   52.773   36.916   52.773   36.916 0.000000 0.000000 
1 1 1    0   46   15 o  269.319   31.977   61.354   12.692   61.354   12.692   61.354   12.692  269.319   31.977  269.319   31.977 0.000000 0.000000 
1 1 1    0   47    1 o  403.407   15.794  127.086   9.7184  127.086   9.7184  127.086   9.7184  403.407   15.794  403.407   15.794 0.000000 0.000000 
1 1 1    0   47    2 o  120.991   45.100   16.320   7.7754   16.320   7.7754   16.320   7.7754  120.991   45.100  120.991   45.100 0.000000 0.000000 
1 1 1    0   47    3 o  170.962   32.033   25.772   7.5209   25.772   7.5209   25.772   7.5209  170.962   32.033  170.962   32.033 0.000000 0.000000 
1 1 1    0   47    4 o  187.598   30.574   30.364   8.0792   30.364   8.0792   30.364   8.0792  187.598   30.574  187.598   30.574 0.000000 0.000000 
1 1 1    0   47    5 o  180.547   44.880   31.557   10.733   31.557   10.733   31.557   10.733  180.547   44.880  180.547   44.880 0.000000 0.000000 
1 1 1    0   47    6 o  107.962   54.100   15.661   10.948   15.661   10.948   15.661   10.948  107.962   54.100  107.962   54.100 0.000000 0.000000 
1 1 1    1    0    5 o  455.887   5.1218  159.127   3.5729  159.127   3.5729  159.127   3.5729  455.887   5.1218  455.887   5.1218 0.000000 0.000000 
1 1 1    1    0    6 o  482.754   4.5897  178.415   3.3907  178.415   3.3907  178.415   3.3907  482.754   4.5897  482.754   4.5897 0.000000 0.000000 
1 1 1    1    0    7 f  1197.65   8.0480  1098.04   14.752  1098.04   14.752  1098.04   14.752  1197.65   8.0480  1197.65   8.0480 0.000000 0.000000 
1 1 1    1    0    8 o  1617.98   10.406  2004.24   25.767  2004.24   25.767  2004.24   25.767  1617.98   10.406  1617.98   10.406 0.000000 0.000000 
1 1 1    1    0    9 o  873.820   7.4271  584.564   9.9321  584.564   9.9321  584.564   9.9321  873.820   7.4271  873.820   7.4271 0.000000 0.000000 
1 1 1    1    0   10 o  692.540   7.9901  367.254   8.4671  367.254   8.4671  367.254   8.4671  692.540   7.9901  692.540   7.9901 0.000000 0.000000 
1 1 1    1    0   11 o  1988.70   12.590  3028.24   38.319  3028.24   38.319  3028.24   38.319  1988.70   12.590  1988.70   12.590 0.000000 0.000000 
1 1 1    1    0   12 o  588.650   5.3637  265.272   4.8318  265.272   4.8318  265.272   4.8318  588.650   5.3637  588.650   5.3637 0.000000 0.000000 
1 1 1    1    0   13 o  159.190   6.2469   19.485   1.5168   19.485   1.5168   19.485   1.5168  159.190   6.2469  159.190   6.2469 0.000000 0.000000 
1 1 1    1    0   14 o  1413.44   9.4055  1529.50   20.346  1529.50   20.346  1529.50   20.346  1413.44   9.4055  1413.44   9.4055 0.000000 0.000000 
1 1 1    1    0   15 o  309.705   6.0585   73.498   2.8695   73.498   2.8695   73.498   2.8695  309.705   6.0585  309.705   6.0585 0.000000 0.000000 
1 1 1    1    0   16 o  1039.74   8.6552  827.700   13.772  827.700   13.772  827.700   13.772  1039.74   8.6552  1039.74   8.6552 0.000000 0.000000 
1 1 1    1    0   17 o  277.351   5.6420   58.950   2.3929   58.950   2.3929   58.950   2.3929  277.351   5.6420  277.351   5.6420 0.000000 0.000000 
1 1 1    1    0   18 o  425.384   5.4580  138.569   3.5524  138.569   3.5524  138.569   3.5524  425.384   5.4580  425.384   5.4580 0.000000 0.000000 
1 1 1    1    0   19 o  264.147   6.1264   53.494   2.4740   53.494   2.4740   53.494   2.4740  264.147   6.1264  264.147   6.1264 0.000000 0.000000 
1 1 1    1    0   20 o  106.820   11.768   9.0515   1.8645   9.0515   1.8645   9.0515   1.8645  106.820   11.768  106.820   11.768 0.000000 0.000000 
1 1 1    1    0   21 o  213.090   7.2887   34.882   2.3710   34.882   2.3710   34.882   2.3710  213.090   7.2887  213.090   7.2887 0.000000 0.000000 
1 1 1    1    0   22 o  494.433   6.8173  187.240   5.1571  187.240   5.1571  187.240   5.1571  494.433   6.8173  494.433   6.8173 0.000000 0.000000 
1 1 1    1    0   23 o  624.980   7.1553  299.119   6.8428  299.119   6.8428  299.119   6.8428  624.980   7.1553  624.980   7.1553 0.000000 0.000000 
1 1 1    1    0   24 o  586.802   6.2486  263.658   5.6109  263.658   5.6109  263.658   5.6109  586.802   6.2486  586.802   6.2486 0.000000 0.000000 
1 1 1    1    0   25 o  215.690   8.3939   35.775   2.7617   35.775   2.7617   35.775   2.7617  215.690   8.3939  215.690   8.3939 0.000000 0.000000 
1 1 1    1    0   26 o  1456.96   9.9684  1625.32   22.228  1625.32   22.228  1625.32   22.228  1456.96   9.9684  1456.96   9.9684 0.000000 0.000000 
1 1 1    1    0   27 o  1560.73   10.542  1865.06   25.182  1865.06   25.182  1865.06   25.182  1560.73   10.542  1560.73   10.542 0.000000 0.000000 
1 1 1    1    0   28 o   75.632   29.140   5.9750   3.1969   5.9750   3.1969   5.9750   3.1969   75.632   29.140   75.632   29.140 0.000000 0.000000 
1 1 1    1    0   29 o  839.770   8.4481  539.975   10.857  539.975   10.857  539.975   10.857  839.770   8.4481  839.770   8.4481 0.000000 0.000000 
1 1 1    1    0   30 o  379.773   7.5905  110.529   4.4083  110.529   4.4083  110.529   4.4083  379.773   7.5905  379.773   7.5905 0.000000 0.000000 
1 1 1    1    0   31 o  862.924   7.6170  570.106   10.059  570.106   10.059  570.106   10.059  862.924   7.6170  862.924   7.6170 0.000000 0.000000 
1 1 1    1    0   32 o  1095.22   8.5297  918.370   14.297  918.370   14.297  918.370   14.297  1095.22   8.5297  1095.22   8.5297 0.000000 0.000000 
1 1 1    1    0   33 o  1173.03   8.9484  1053.53   16.065  1053.53   16.065  1053.53   16.065  1173.03   8.9484  1173.03   8.9484 0.000000 0.000000 
1 1 1    1    0   34 o  415.422   9.8801  132.343   6.2743  132.343   6.2743  132.343   6.2743  415.422   9.8801  415.422   9.8801 0.000000 0.000000 
1 1 1    1    0   35 o  351.652   11.453   94.986   6.1500   94.986   6.1500   94.986   6.1500  351.652   11.453  351.652   11.453 0.000000 0.000000 
1 1 1    1    0   36 o  351.641   10.639   94.936   5.7143   94.936   5.7143   94.936   5.7143  351.641   10.639  351.641   10.639 0.000000 0.000000 
1 1 1    1    0   37 o  167.390   20.830   22.459   5.1140   22.459   5.1140   22.459   5.1140  167.390   20.830  167.390   20.830 0.000000 0.000000 
1 1 1    1    0   38 f  175.417   20.277   24.524   5.2551   24.524   5.2551   24.524   5.2551  175.417   20.277  175.417   20.277 0.000000 0.000000 
1 1 1    1    0   39 o  460.374   9.7365  162.507   6.8540  162.507   6.8540  162.507   6.8540  460.374   9.7365  460.374   9.7365 0.000000 0.000000 
1 1 1    1    0   40 o  143.107   33.162   18.062   6.3194   18.062   6.3194   18.062   6.3194  143.107   33.162  143.107   33.162 0.000000 0.000000 
1 1 1    1    0   41 o  185.516   23.830   27.718   6.4603   27.718   6.4603   27.718   6.4603  185.516   23.830  185.516   23.830 0.000000 0.000000 
1 1 1    1    0   42 o  292.820   13.104   66.112   5.8464   66.112   5.8464   66.112   5.8464  292.820   13.104  292.820   13.104 0.000000 0.000000 
1 1 1    1    0   43 o  599.030   8.9353  275.030   8.1886  275.030   8.1886  275.030   8.1886  599.030   8.9353  599.030   8.9353 0.000000 0.000000 
1 1 1    1    0   44 o   40.607   27.616  -2.8820   5.2244  -2.8820   5.2244  -2.8820   5.2244   40.607   27.616   40.607   27.616 0.000000 0.000000 
1 1 1    1    0   45 o  404.759   10.571  125.827   6.5393  125.827   6.5393  125.827   6.5393  404.759   10.571  404.759   10.571 0.000000 0.000000 
1 1 1    1    0   46 f  457.475   11.073  160.749   7.7434  160.749   7.7434  160.749   7.7434  457.475   11.073  457.475   11.073 0.000000 0.000000 
1 1 1    1    0   47 o  220.172   18.271   38.066   6.0598   38.066   6.0598   38.066   6.0598  220.172   18.271  220.172   18.271 0.000000 0.000000 
1 1 1    1    0   48 o  551.390   10.891  233.484   9.1836  233.484   9.1836  233.484   9.1836  551.390   10.891  551.390   10.891 0.000000 0.000000 
1 1 1    1    0   49 o   60.450   36.194   3.0992   5.9742   3.0992   5.9742   3.0992   5.9742   60.450   36.194   60.450   36.194 0.000000 0.000000 
1 1 1    1    0   50 o  268.375   16.596   56.116   6.7577   56.116   6.7577   56.116   6.7577  268.375   16.596  268.375   16.596 0.000000 0.000000 
1 1 1    1    0   51 o   46.015   30.823  -2.0002   6.0488  -2.0002   6.0488  -2.0002   6.0488   46.015   30.823   46.015   30.823 0.000000 0.000000 
1 1 1    1    0   52 o  462.821   12.292  165.035   8.6936  165.035   8.6936  165.035   8.6936  462.821   12.292  462.821   12.292 0.000000 0.000000 
1 1 1    1    0   53 o  430.595   10.484  142.668   6.9008  142.668   6.9008  142.668   6.9008  430.595   10.484  430.595   10.484 0.000000 0.000000 
1 1 1    1    0   54 o  335.370   12.483   86.912   6.3877   86.912   6.3877   86.912   6.3877  335.370   12.483  335.370   12.483 0.000000 0.000000 
1 1 1    1    0   55 o  167.406   23.327   23.066   5.6453   23.066   5.6453   23.066   5.6453  167.406   23.327  167.406   23.327 0.000000 0.000000 
1 1 1    1    0   56 o  477.227   10.456  175.345   7.6294  175.345   7.6294  175.345   7.6294  477.227   10.456  477.227   10.456 0.000000 0.000000 
1 1 1    1    0   57 o  179.230   25.115   26.621   6.5022   26.621   6.5022   26.621   6.5022  179.230   25.115  179.230   25.115 0.000000 0.000000 
1 1 1    1    0   58 f  247.967   17.877   48.507   6.7040   48.507   6.7040   48.507   6.7040  247.967   17.877  247.967   17.877 0.000000 0.000000 
1 1 1    1    0   59 o  313.938   15.512   76.933   7.4123   76.933   7.4123   76.933   7.4123  313.938   15.512  313.938   15.512 0.000000 0.000000 
1 1 1    1    0   60 o  166.069   27.202   23.510   6.3571   23.510   6.3571   23.510   6.3571  166.069   27.202  166.069   27.202 0.000000 0.000000 
1 1 1    1    0   61 o  384.003   15.632  115.219   9.1536  115.219   9.1536  115.219   9.1536  384.003   15.632  384.003   15.632 0.000000 0.000000 
1 1 1    1    0   62 o   44.530   30.160  -2.2574   6.1021  -2.2574   6.1021  -2.2574   6.1021   44.530   30.160   44.530   30.160 0.000000 0.000000 
1 1 1    1    0   63 o  125.482   45.136   17.635   7.9354   17.635   7.9354   17.635   7.9354  125.482   45.136  125.482   45.136 0.000000 0.000000 
1 1 1    1    0   64 o   57.824   33.463   3.8350   4.8146   3.8350   4.8146   3.8350   4.8146   57.824   33.463   57.824   33.463 0.000000 0.000000 
1 1 1    1    0   65 o   42.947   28.366  -0.3128   4.8287  -0.3128   4.8287  -0.3128   4.8287   42.947   28.366   42.947   28.366 0.000000 0.000000 
1 1 1    1    0   66 o   44.767   28.923   0.6919   4.6337   0.6919   4.6337   0.6919   4.6337   44.767   28.923   44.767   28.923 0.000000 0.000000 
1 1 1    1    1    4 f  385.661   3.1248  113.834   1.8446  114.675   2.4515  112.736   2.8006  387.077   4.1377  383.785   4.7675 3.292084 6.312625 
1 1 1    1    1    5 o  1467.46   6.7152  1648.39   15.083  1655.67   21.455  1641.27   21.209  1470.54   9.5318  1464.14   9.4640 6.404907 13.43212 
1 1 1    1    1    6 o  724.410   3.9608  401.642   4.3918  398.455   6.1680  404.920   6.2547  721.504   5.5852  727.333   5.6183 -5.829590 7.922107 
1 1 1    1    1    7 o  269.921   2.9836   55.761   1.2327   54.404   1.7347   57.145   1.7520  266.612   4.2507  273.245   4.1890 -6.633362 5.967971 
1 1 1    1    1    8 o  464.829   3.3055  165.367   2.3518  167.727   3.3545  163.085   3.2982  468.123   4.6816  461.600   4.6681 6.523712 6.611262 
1 1 1    1    1    9 o  928.966   5.4725  660.540   7.7814  672.611   11.204  649.292   10.816  937.349   7.8090  920.961   7.6725 16.38788 10.94753 
1 1 1    1    1   10 o  859.058   5.7268  564.872   7.5302  558.864   9.6331  574.310   12.074  854.435   7.3658  866.106   9.1079 -11.67065 11.71364 
1 1 1    1    1   11 f  411.740   3.3774  129.750   2.1285  127.672   2.9916  131.882   3.0292  408.418   4.7855  415.097   4.7676 -6.679108 6.755082 
1 1 1    1    1   12 o  1179.49   5.7179  1064.87   10.323  1076.63   14.775  1053.65   14.429  1185.90   8.1397  1173.18   8.0351 12.71655 11.43758 
1 1 1    1    1   13 o  359.484   3.4887   98.907   1.9196   99.204   2.7106   98.608   2.7188  360.013   4.9191  358.930   4.9488 1.083191 6.977656 
1 1 1    1    1   14 o  819.824   4.5205  514.430   5.6725  517.491   8.0688  511.439   7.9762  822.217   6.4114  817.396   6.3752 4.821350 9.041527 
1 1 1    1    1   15 o  129.207   6.2803   12.779   1.2420   12.184   1.7882   13.334   1.7265  125.799   9.3538  131.687   8.6128 -5.888214 12.71506 
1 1 1    1    1   16 o  719.995   4.9488  396.792   5.4538  396.618   7.7016  396.966   7.7241  719.786   6.9905  720.100   7.0079 -0.3145752 9.898374 
1 1 1    1    1   17 o  925.259   4.9362  655.294   6.9908  660.136   9.9544  650.582   9.8199  928.595   7.0035  921.852   6.9595 6.742493 9.873386 
1 1 1    1    1   18 o  447.662   3.8629  153.387   2.6469  155.293   3.7715  151.537   3.7156  450.410   5.4706  444.929   5.4559 5.481110 7.726242 
1 1 1    1    1   19 f  1260.55   6.1659  1216.48   11.897  1218.53   16.862  1214.45   16.787  1261.41   8.7336  1259.30   8.7091 2.110107 12.33391 
1 1 1    1    1   20 o  191.390   5.2848   28.041   1.5482   27.515   2.1717   28.584   2.2076  189.563   7.4848  193.210   7.4648 -3.646835 10.57094 
1 1 1    1    1   21 o  165.684   5.9852   21.016   1.5178   21.087   2.1272   20.943   2.1664  165.719   8.4139  165.141   8.6004 0.5787201 12.03168 
1 1 1    1    1   22 o  123.760   8.8860   11.791   1.6721   9.3658   2.3343   14.347   2.3963  109.603   14.251  136.341   11.593 -26.73811 18.37107 
1 1 1    1    1   23 o  536.977   4.9504  220.723   4.0688  222.291   5.8190  219.223   5.6914  538.818   7.0557  535.091   6.9490 3.726868 9.903083 
1 1 1    1    1   24 o  627.836   4.4847  301.721   4.3097  303.597   6.1033  299.855   6.0864  629.733   6.3320  625.839   6.3537 3.894165 8.970120 
1 1 1    1    1   25 o  566.441   4.4553  245.590   3.8628  243.453   5.4204  247.796   5.5062  563.930   6.2796  568.936   6.3229 -5.006470 8.911387 
1 1 1    1    1   26 o  1059.09   5.6568  858.618   9.1702  854.025   12.883  863.335   13.056  1056.15   7.9692  1061.89   8.0328 -5.737183 11.31519 
1 1 1    1    1   27 o  366.585   4.8580  102.860   2.7258  103.413   3.8472  102.303   3.8627  367.544   6.8386  365.564   6.9033 1.980133 9.717069 
1 1 1    1    1   28 o  628.675   6.6647  302.549   6.4133  298.866   8.9695  306.402   9.1733  624.763   9.3796  632.588   9.4741 -7.824524 13.33173 
1 1 1    1    1   29 o  640.815   5.1757  314.315   5.0766  311.594   6.6672  318.071   7.8312  638.001   6.8274  644.571   7.9376 -6.569763 10.46988 
1 1 1    1    1   30 f  824.470   5.2316  520.298   6.6020  517.060   9.2774  523.620   9.3971  821.842   7.3751  827.037   7.4233 -5.195129 10.46412 
1 1 1    1    1   31 o  278.684   6.7522   59.453   2.8802   53.244   4.0104   66.067   4.1392  263.692   9.9361  293.745   9.2062 -30.05283 13.54550 
1 1 1    1    1   32 o  584.376   5.2418  261.394   4.6886  258.563   6.5872  264.301   6.6750  581.155   7.4053  587.568   7.4220 -6.413269 10.48448 
1 1 1    1    1   33 o  177.381   10.755   24.186   2.9064   26.030   4.1294   22.377   4.0912  183.699   14.812  170.115   15.897 13.58437 21.72808 
1 1 1    1    1   34 o  407.929   7.1808  127.399   4.4836  126.366   6.2946  128.463   6.3879  406.200   10.124  409.553   10.190 -3.353363 14.36441 
1 1 1    1    1   35 o  632.138   7.0932  305.935   6.8631  297.967   8.8879  317.705   10.801  623.765   9.3091  644.013   10.958 -20.24756 14.37808 
1 1 1    1    1   36 o  511.510   6.1343  200.301   4.8028  196.189   6.7540  204.507   6.8309  506.152   8.7179  516.773   8.6359 -10.62076 12.27113 
1 1 1    1    1   37 o  569.898   6.1390  248.646   5.3551  250.460   7.6027  246.860   7.5441  571.875   8.6855  567.750   8.6812 4.125000 12.28009 
1 1 1    1    1   38 o  218.244   11.558   36.603   3.8474   36.598   5.4298   36.607   5.4523  217.776   16.410  217.794   16.477 -0.1828003E-01 23.25475 
1 1 1    1    1   39 o  382.454   7.7057  112.018   4.5109  114.765   6.4347  109.364   6.3253  386.989   10.863  377.768   10.939 9.220398 15.41685 
1 1 1    1    1   40 o   92.824   30.137   6.4574   4.8987   1.0742   7.8315   9.9174   6.2786   85.369   35.732  112.447   33.768 -27.07767 49.16375 
1 1 1    1    1   41 o  461.601   7.6106  163.212   5.3772  162.611   6.9948  164.081   8.4077  460.609   9.9213  462.538   11.876 -1.928772 15.47463 
1 1 1    1    1   42 o  451.588   7.1355  156.212   4.9321  153.385   6.9322  159.110   7.0187  447.279   10.126  455.554   10.066 -8.275482 14.27760 
1 1 1    1    1   43 o  540.829   6.5135  224.046   5.3920  223.193   7.5759  224.922   7.6758  539.568   9.1732  541.645   9.2585 -2.076965 13.03330 
1 1 1    1    1   44 o  625.389   6.2742  299.602   6.0059  293.215   8.4899  306.000   8.4972  618.387   8.9696  631.748   8.7875 -13.36176 12.55682 
1 1 1    1    1   45 o  272.668   9.5654   57.041   3.9922   54.732   5.6538   59.336   5.6377  266.368   13.916  277.784   13.259 -11.41562 19.22129 
1 1 1    1    1   46 o  108.780   24.856   9.5846   4.0481   6.6060   5.6027   12.838   5.8555   94.704   32.267  125.291   30.760 -30.58699 44.57940 
1 1 1    1    1   47 o  403.431   9.2991  124.931   5.7422  126.685   7.5606  122.541   8.8271  405.824   12.172  398.714   14.464 7.109802 18.90387 
1 1 1    1    1   48 o  329.282   9.5602   83.274   4.8184   78.336   6.5065   89.272   7.1702  318.837   13.333  340.288   13.766 -21.45142 19.16413 
1 1 1    1    1   49 o  461.495   6.9395  163.336   4.9019  166.079   6.9353  160.598   6.9294  464.882   9.7466  457.116   9.9037 7.765472 13.89531 
1 1 1    1    1   50 o  113.138   23.255   10.401   3.8925   12.111   5.9685   9.1348   5.1346  120.660   31.850  105.524   30.236 15.13567 43.91656 
1 1 1    1    1   51 o  245.357   14.477   46.757   5.4128   46.537   8.7971   46.891   6.8665  241.698   24.100  244.595   18.477 -2.896927 30.36838 
1 1 1    1    1   52 o  234.297   13.297   42.599   4.7488   40.185   6.6159   45.165   6.8204  225.805   19.328  239.681   18.740 -13.87601 26.92171 
1 1 1    1    1   53 o  188.575   13.254   27.664   3.8014   32.820   5.4581   22.806   5.2975  204.272   17.629  169.010   20.925 35.26189 27.36182 
1 1 1    1    1   54 o  303.763   9.3513   71.060   4.3479   64.079   6.1365   78.098   6.1612  287.358   13.952  317.622   12.673 -30.26389 18.84832 
1 1 1    1    1   55 o   93.999   25.697   7.3417   3.8030   9.9462   5.3715   4.7240   5.3851  108.446   30.876   83.700   31.265 24.74630 43.94094 
1 1 1    1    1   56 o   50.259   22.892  -2.1253   3.8795   9.6338   5.5890 -13.0593   5.3894  106.574   31.827   42.267   21.043 64.30664 38.15481 
1 1 1    1    1   57 o  327.702   11.073   83.103   5.5543   91.067   8.6589   77.535   7.2402  340.706   16.604  315.080   15.013 25.62595 22.38470 
1 1 1    1    1   58 o   63.455   26.885   0.7295   4.5211  -0.8716   6.6379   2.1151   6.1749   70.496   31.184   76.591   31.865 -6.095291 44.58501 
1 1 1    1    1   59 o  193.028   15.433   29.410   4.5215   24.346   6.3154   34.736   6.4764  171.423   24.789  207.487   20.668 -36.06490 32.27458 
1 1 1    1    1   60 o  314.308   11.348   76.753   5.4594   78.644   8.3950   75.367   7.1866  314.495   17.509  309.645   15.163 4.849609 23.16216 
1 1 1    1    1   61 o  132.516   22.962   14.698   4.4888   7.7065   6.4898   21.110   6.2153   96.120   34.580  157.192   26.793 -61.07247 43.74544 
1 1 1    1    1   62 o   70.359   27.318   3.1858   4.2129   1.4662   5.9585   4.9048   5.9575   71.786   30.654   83.277   32.443 -11.49014 44.63427 
1 1 1    1    1   63 o   59.940   26.278  -0.0686   4.6160  -2.4771   5.8177   4.0244   7.5840   60.462   27.726   84.473   35.243 -24.01181 44.84203 
1 1 1    1    1   64 o  100.222   25.940   8.9671   4.0102   9.6937   4.9411   7.5649   6.8642  102.472   29.748   92.923   35.173 9.548782 46.06640 
1 1 1    1    1   65 o   44.670   20.758  -2.2959   3.4204  -6.9883   4.7639   2.6968   4.9139   44.686   21.751   69.308   28.596 -24.62130 35.92768 
1 1 1    1    1   66 o   89.789   23.819   7.2628   3.3274   0.4268   4.5885   14.844   4.8322   59.646   26.173  128.067   25.547 -68.42058 36.57443 
1 1 1    1    2    4 o  198.746   3.1496   30.231   0.9581   30.639   1.3626   29.832   1.3476  200.078   4.4493  197.426   4.4594 2.651413 6.299420 
1 1 1    1    2    5 o  132.582   2.9994   13.453   0.6087   13.471   0.8610   13.435   0.8606  132.668   4.2399  132.490   4.2437 0.1784058 5.998849 
1 1 1    1    2    6 o  652.694   3.7456  326.052   3.7419  323.941   5.2658  328.204   5.3183  650.557   5.2883  654.824   5.3062 -4.266113 7.491409 
1 1 1    1    2    7 o  622.833   3.6869  296.900   3.5148  296.492   4.9652  297.311   4.9763  622.385   5.2120  623.244   5.2165 -0.8590088 7.374034 
1 1 1    1    2    8 o  527.718   3.7229  213.143   3.0071  219.218   4.6889  208.898   3.9192  535.163   5.7242  522.424   4.9012 12.73853 7.535826 
1 1 1    1    2    9 o  968.408   6.1786  717.847   9.1583  723.130   11.911  710.210   14.323  971.906   8.0070  963.118   9.7160 8.788208 12.59020 
1 1 1    1    2   10 o  821.666   5.0938  516.752   6.4063  512.339   9.0037  521.278   9.1171  818.102   7.1903  825.207   7.2181 -7.105103 10.18826 
1 1 1    1    2   11 o  574.702   3.7189  252.786   3.2713  252.512   4.6232  253.060   4.6295  574.372   5.2587  574.996   5.2602 -0.6236572 7.437947 
1 1 1    1    2   12 o  1124.84   5.5244  968.459   9.5115  954.675   13.242  983.149   13.671  1116.73   7.7471  1133.26   7.8812 -16.52600 11.05126 
1 1 1    1    2   13 o  1247.63   5.9989  1191.47   11.456  1190.22   16.178  1192.74   16.224  1246.86   8.4770  1248.18   8.4919 -1.319702 11.99887 
1 1 1    1    2   14 o  1666.48   7.6424  2126.04   19.494  2128.54   27.608  2123.56   27.529  1667.21   10.819  1665.26   10.801 1.952759 15.28709 
1 1 1    1    2   15 o  691.559   5.2611  366.070   5.5690  364.746   8.7938  366.957   7.1958  690.227   8.3237  692.361   6.7901 -2.133789 10.74191 
1 1 1    1    2   16 o  546.926   4.4816  228.955   3.7517  227.492   5.2668  230.462   5.3455  545.143   6.3120  548.690   6.3649 -3.546570 8.964008 
1 1 1    1    2   17 o  441.687   3.7986  149.318   2.5681  148.001   3.6215  150.650   3.6422  439.713   5.3809  443.632   5.3638 -3.918762 7.597639 
1 1 1    1    2   18 o  239.576   4.3635   43.933   1.6001   45.457   2.2911   42.481   2.2357  243.678   6.1427  235.568   6.2005 8.110580 8.728065 
1 1 1    1    2   19 o  229.026   4.6618   40.151   1.6342   40.773   2.3246   39.542   2.2979  230.773   6.5810  227.262   6.6058 3.511383 9.324499 
1 1 1    1    2   20 o  1132.27   5.7298  981.453   9.9301  990.972   14.200  972.343   13.892  1137.56   8.1554  1126.83   8.0543 10.73413 11.46216 
1 1 1    1    2   21 o  906.643   5.0117  629.244   6.9549  640.860   10.003  618.374   9.6763  914.857   7.1435  898.671   7.0346 16.18616 10.02575 
1 1 1    1    2   22 o  519.033   5.2558  206.227   4.1754  205.078   5.3890  207.952   6.6046  517.540   6.8029  521.098   8.2806 -3.557434 10.71669 
1 1 1    1    2   23 o  412.981   4.9671  130.556   3.1398  134.148   4.5236  127.216   4.3615  418.578   7.0605  407.621   6.9906 10.95673 9.935708 
1 1 1    1    2   24 o  986.063   5.3773  744.308   8.1159  737.056   11.375  751.827   11.583  981.133   7.5747  990.911   7.6367 -9.778259 10.75617 
1 1 1    1    2   25 o  208.509   6.1254   33.282   1.9549   32.158   2.7956   34.358   2.7348  204.926   8.9126  211.826   8.4348 -6.900314 12.27113 
1 1 1    1    2   26 o  745.290   4.8015  425.162   5.4774  429.433   7.8082  421.023   7.6857  748.968   6.8111  741.600   6.7708 7.368774 9.603961 
1 1 1    1    2   27 o  304.679   5.5857   71.056   2.6049   69.196   3.4705   73.457   3.9421  300.642   7.5418  309.749   8.3147 -9.106201 11.22555 
1 1 1    1    2   28 o  882.023   7.3654  595.560   9.9437  577.859   13.714  615.185   14.439  868.696   10.314  896.302   10.525 -27.60632 14.73596 
1 1 1    1    2   29 o  639.070   5.2231  312.607   5.1091  313.360   6.7365  311.586   7.8389  639.806   6.8788  637.964   8.0277 1.842224 10.57175 
1 1 1    1    2   30 o  1165.40   6.1690  1039.62   11.004  1033.05   15.457  1046.38   15.670  1161.59   8.6935  1169.06   8.7572 -7.465454 12.33960 
1 1 1    1    2   31 o  252.053   7.1771   48.635   2.7689   50.321   4.0259   47.121   3.8144  256.347   10.260  248.065   10.046 8.281891 14.35940 
1 1 1    1    2   32 f  1379.36   6.9673  1456.54   14.710  1456.55   20.827  1456.52   20.779  1379.16   9.8659  1379.15   9.8434 0.1074219E-01 13.93660 
1 1 1    1    2   33 o  1092.81   6.0947  914.190   10.194  913.114   14.413  915.268   14.421  1092.04   8.6229  1093.32   8.6175 -1.287720 12.19079 
1 1 1    1    2   34 o  312.162   8.4127   74.613   4.0196   72.117   5.5912   77.283   5.7829  306.819   11.906  317.619   11.895 -10.79922 16.82965 
1 1 1    1    2   35 o  870.349   6.6205  579.926   8.8198  595.992   12.734  565.110   12.228  882.171   9.4303  859.020   9.2999 23.15100 13.24459 
1 1 1    1    2   36 o  173.753   12.996   23.266   3.4312   18.624   4.8458   27.934   4.8590  154.299   21.069  190.082   16.876 -35.78287 26.99441 
1 1 1    1    2   37 o  374.333   7.3750  107.293   4.2256  106.879   6.0111  107.697   5.9414  373.515   10.514  374.947   10.353 -1.432343 14.75544 
1 1 1    1    2   38 o  411.616   7.0859  129.731   4.4643  124.878   6.2860  134.671   6.3414  403.735   10.172  419.280   9.8813 -15.54440 14.18134 
1 1 1    1    2   39 o  594.767   6.2367  270.847   5.6777  273.762   8.1075  268.041   7.9538  597.825   8.8601  591.550   8.7844 6.274902 12.47668 
1 1 1    1    2   40 o  188.311   17.265   27.471   4.9210   26.960   8.2493   27.753   6.1314  184.259   30.303  188.644   21.625 -4.385345 37.22810 
1 1 1    1    2   41 o  344.575   8.9499   90.978   4.7203   91.221   6.1348   90.626   7.3903  344.890   11.621  343.602   14.052 1.288483 18.23487 
1 1 1    1    2   42 o  353.833   8.0941   95.928   4.3836   94.570   6.2015   97.284   6.1973  351.108   11.539  356.122   11.369 -5.014771 16.19942 
1 1 1    1    2   43 o  471.238   6.8452  170.115   4.9374  173.952   7.1162  166.554   6.8561  476.284   9.7614  466.060   9.6110 10.22354 13.69876 
1 1 1    1    2   44 o  168.032   14.418   21.873   3.6724   21.220   5.1689   22.539   5.2186  164.354   21.029  169.563   20.525 -5.208847 29.38554 
1 1 1    1    2   45 o  120.284   22.123   11.563   3.9230   11.039   5.0865   12.331   6.1632  116.533   28.705  122.970   32.320 -6.437111 43.22681 
1 1 1    1    2   46 f  275.986   11.796   58.543   4.9830   62.888   6.2094   50.683   8.3516  285.770   14.196  254.633   21.633 31.13696 25.87484 
1 1 1    1    2   47 o   69.307   26.355   2.7056   3.8650   9.1744   5.5763  -3.2754   5.3620  106.772   31.769   58.862   26.851 47.91011 41.59626 
1 1 1    1    2   48 o   99.133   23.386   7.9808   3.4910   1.5107   4.9232   14.524   4.9510   70.154   28.746  134.104   25.041 -63.94990 38.12293 
1 1 1    1    2   49 o  172.095   14.103   23.012   3.6822   21.435   5.1913   24.608   5.2236  164.497   21.105  176.803   19.634 -12.30525 28.82548 
1 1 1    1    2   50 o   82.625   25.346   5.4159   3.5111   3.2272   5.0044   7.5376   4.9273   76.944   29.802   96.971   30.072 -20.02702 42.33805 
1 1 1    1    2   51 o  395.356   9.1193  120.171   5.5185  128.154   8.2136  113.602   7.4506  407.268   13.176  383.580   12.690 23.68842 18.29336 
1 1 1    1    2   52 o  232.435   13.128   41.914   4.6513   41.044   6.4312   42.869   6.7353  228.468   18.551  233.367   19.022 -4.898712 26.56971 
1 1 1    1    2   53 o  217.900   12.364   36.822   4.1067   38.836   6.3912   35.406   5.3596  221.853   19.004  212.531   16.608 9.321915 25.23854 
1 1 1    1    2   54 o  449.085   7.4706  154.967   5.1351  155.842   7.2525  154.088   7.2719  449.458   10.542  446.893   10.631 2.565460 14.97184 
1 1 1    1    2   55 o  192.831   13.792   29.018   4.0437   30.864   5.6263   27.046   5.8158  197.286   18.862  183.777   21.055 13.50798 28.26799 
1 1 1    1    2   56 o   82.510   27.542   5.3518   4.0810  -2.0297   5.9589   11.873   5.6007   64.382   28.940  117.793   30.738 -53.41133 42.21787 
1 1 1    1    2   57 o   94.358   29.278   7.4159   4.6697   3.3048   6.9074   10.876   6.3373   83.706   34.145  112.211   33.977 -28.50448 48.16971 
1 1 1    1    2   58 o   82.709   28.603   5.3230   4.4075   5.8331   6.3694   4.8543   6.1053   90.287   33.948   85.762   33.001 4.524651 47.34479 
1 1 1    1    2   59 o  121.037   25.583   12.377   4.5912   4.7039   7.4053   17.168   5.8517   89.042   35.700  141.988   27.920 -52.94503 45.32134 
1 1 1    1    2   60 f  104.340   27.859   9.4158   4.5328   10.032   7.2830   9.0262   5.7911  107.173   36.785  101.934   32.734 5.239052 49.24107 
1 1 1    1    2   61 o  125.778   20.509   13.053   3.8124   11.452   5.3690   14.680   5.4143  113.510   30.326  129.868   28.057 -16.35789 41.31417 
1 1 1    1    2   62 o  148.485   22.038   18.391   4.8567   19.448   6.5429   17.094   7.2478  147.960   29.919  135.275   34.804 12.68500 45.89586 
1 1 1    1    2   63 o   96.428   27.254   8.2449   4.2011   13.649   5.1189  -2.9033   7.3526  124.038   27.666   67.207   30.948 56.83050 41.51164 
1 1 1    1    2   64 o   74.191   25.855   4.5401   3.6047   8.6706   4.9862   0.0181   5.2172   97.010   30.279   62.846   27.731 34.16329 41.05899 
1 1 1    1    2   65 o   79.881   26.323   5.6354   3.7323   3.0708   4.8484   9.3655   5.8473   70.421   28.653   98.413   32.967 -27.99168 43.67805 
1 1 1    1    2   66 o  148.548   15.442   18.019   3.4597   23.218   4.8577   12.667   4.9286  165.876   19.505  116.155   28.041 49.72134 34.15736 
1 1 1    1    3    1 o  1042.54   10.060  832.190   16.053  801.867   21.785  868.219   23.747  1023.15   13.911  1064.59   14.573 -41.44397 20.14646 
1 1 1    1    3    2 o  1198.06   7.9709  1098.82   14.617  1124.29   21.211  1075.79   20.171  1211.68   11.437  1185.28   11.118 26.40283 15.95048 
1 1 1    1    3    3 o  503.246   4.5712  193.840   3.5211  196.341   5.0249  191.426   4.9355  506.459   6.4821  500.080   6.4480 6.378754 9.142976 
1 1 1    1    3    4 o  982.916   6.8522  739.546   10.309  714.632   14.049  768.615   15.175  966.122   9.5002  1001.93   9.8949 -35.80847 13.71726 
1 1 1    1    3    5 o  960.763   6.7667  706.583   9.9509  715.280   14.252  698.312   13.900  966.554   9.6337  955.026   9.5086 11.52832 13.53593 
1 1 1    1    3    6 o  705.435   4.9666  380.893   5.3627  379.713   6.8937  382.700   8.5343  704.316   6.3946  707.046   7.8859 -2.730530 10.15274 
1 1 1    1    3    7 o  880.771   4.5377  593.754   6.1174  601.768   8.7671  586.149   8.5400  886.652   6.4600  875.072   6.3759 11.58020 9.076557 
1 1 1    1    3    8 o  948.488   5.5420  688.596   8.0457  713.816   11.792  666.627   11.006  965.629   7.9782  933.174   7.7051 32.45453 11.09144 
1 1 1    1    3    9 o  520.018   4.9473  206.978   3.9379  208.360   5.6045  205.631   5.5341  521.721   7.0182  518.294   6.9760 3.427673 9.895430 
1 1 1    1    3   10 o  1093.54   5.7489  915.321   9.6225  904.333   14.523  923.921   12.847  1086.85   8.7299  1098.60   7.6402 -11.75232 11.60105 
1 1 1    1    3   11 o  104.425   5.1067   8.3464   0.8162   7.4926   1.1376   9.2524   1.1718   98.640   7.5930  109.717   7.0146 -11.07693 10.33724 
1 1 1    1    3   12 o  660.578   3.9983  333.980   4.0427  334.094   5.7198  333.867   5.7148  660.666   5.6562  660.442   5.6532 0.2242432 7.996993 
1 1 1    1    3   13 o  378.424   3.5218  109.604   2.0399  110.426   2.8942  108.791   2.8756  379.831   4.9781  377.008   4.9833 2.823029 7.043732 
1 1 1    1    3   14 f  515.963   3.7629  203.755   2.9717  203.641   4.1903  203.871   4.2150  515.799   5.3076  516.090   5.3359 -0.2911377 7.526093 
1 1 1    1    3   15 o  939.267   6.2373  675.326   8.9671  672.604   14.136  677.160   11.600  937.217   9.8543  940.471   8.0580 -3.254639 12.72937 
1 1 1    1    3   16 o  783.391   4.8037  469.742   5.7601  474.917   7.6810  463.092   8.7072  787.651   6.3711  777.752   7.3142 9.899109 9.699897 
1 1 1    1    3   17 o  662.553   4.2004  335.997   4.2598  343.775   6.1303  328.735   5.9234  670.136   5.9765  655.315   5.9055 14.82050 8.401991 
1 1 1    1    3   18 o  387.298   3.9242  114.811   2.3263  115.343   3.3053  114.288   3.2748  388.171   5.5630  386.392   5.5372 1.778717 7.849058 
1 1 1    1    3   19 f  492.019   4.0292  185.296   3.0344  187.542   4.3106  183.090   4.2722  494.956   5.6898  489.046   5.7073 5.910278 8.059015 
1 1 1    1    3   20 o  431.903   4.0410  142.784   2.6714  143.686   3.7786  141.883   3.7773  433.232   5.6983  430.504   5.7324 2.727264 8.082713 
1 1 1    1    3   21 o  586.094   4.2453  262.936   3.8084  262.322   5.3770  263.555   5.3949  585.358   6.0014  586.732   6.0072 -1.374146 8.491371 
1 1 1    1    3   22 o  693.810   5.6558  368.513   6.0063  367.381   7.7085  370.262   9.5826  692.675   7.2706  695.293   9.0042 -2.618225 11.57310 
1 1 1    1    3   23 o  851.769   5.2893  555.380   6.8958  550.625   10.475  559.016   9.1609  847.976   8.0705  854.474   7.0044 -6.497131 10.68619 
1 1 1    1    3   24 o  892.427   5.0948  609.642   6.9594  610.006   9.8565  609.280   9.8276  892.600   7.2143  892.070   7.1975 0.5301514 10.19068 
1 1 1    1    3   25 o  830.106   4.9780  527.451   6.3250  528.625   8.9448  526.278   8.9451  830.957   7.0327  829.109   7.0486 1.847473 9.956955 
1 1 1    1    3   26 o  246.851   5.6397   46.644   2.1309   47.885   3.0131   45.402   3.0139  250.089   7.8714  243.517   8.0860 6.572159 11.28462 
1 1 1    1    3   27 o  1275.04   7.4117  1244.58   14.465  1232.06   20.270  1257.57   20.648  1268.41   10.441  1281.48   10.527 -13.06274 14.82627 
1 1 1    1    3   28 f  1116.19   6.8410  953.732   11.688  969.825   20.528  946.013   14.217  1125.29   11.918  1111.60   8.3557 13.68823 14.55559 
1 1 1    1    3   29 o  654.088   5.2671  327.472   5.2732  328.924   6.9899  325.555   8.0335  655.500   6.9667  652.107   8.0485 3.393372 10.64491 
1 1 1    1    3   30 o  262.872   6.6022   52.897   2.6565   49.713   3.7088   56.252   3.8068  254.805   9.5095  271.051   9.1756 -16.24588 13.21447 
1 1 1    1    3   31 o  628.182   5.1399  302.048   4.9421  301.672   6.9952  302.423   6.9833  627.744   7.2803  628.526   7.2588 -0.7814941 10.28069 
1 1 1    1    3   32 o  1078.18   6.0379  889.859   9.9643  886.138   14.019  893.657   14.165  1075.81   8.5137  1080.36   8.5662 -4.551758 12.07734 
1 1 1    1    3   33 o  357.369   6.4491   97.767   3.5277  103.319   5.0269   92.380   4.9517  367.329   8.9408  347.332   9.3140 19.99719 12.91078 
1 1 1    1    3   34 o  597.810   6.4200  273.585   5.8744  275.704   8.1833  271.333   8.4379  600.038   8.9100  595.249   9.2612 4.789063 12.85141 
1 1 1    1    3   35 o  222.910   11.407   38.165   3.8788   35.998   5.5272   40.269   5.4447  215.991   16.852  228.635   15.652 -12.64417 22.99963 
1 1 1    1    3   36 o  185.187   12.289   26.395   3.4635   31.624   4.9850   21.514   4.8158  202.406   16.227  166.300   19.277 36.10605 25.19716 
1 1 1    1    3   37 o  875.048   5.9615  586.200   7.9847  579.111   11.173  593.599   11.415  869.602   8.3944  880.406   8.4705 -10.80469 11.92540 
1 1 1    1    3   38 o  633.707   6.0237  307.452   5.8428  308.996   8.2648  305.909   8.2610  635.180   8.5009  631.997   8.5398 3.182739 12.04966 
1 1 1    1    3   39 o  901.383   6.5314  622.115   9.0112  621.054   11.962  623.508   13.702  900.445   8.6790  902.102   9.9236 -1.657227 13.18341 
1 1 1    1    3   40 o  146.638   19.930   16.842   4.3573   27.128   7.6836   11.966   5.2903  185.309   27.959  121.964   28.799 63.34472 40.13859 
1 1 1    1    3   41 o  209.437   13.209   33.793   4.2127   30.214   5.4537   39.088   6.6333  197.355   18.261  224.502   19.497 -27.14711 26.71346 
1 1 1    1    3   42 o  131.393   19.153   13.574   3.7387   11.715   5.1447   15.655   5.4426  120.477   28.368  139.924   26.380 -19.44668 38.73798 
1 1 1    1    3   43 o  199.546   12.610   30.696   3.8316   23.858   5.3855   37.706   5.4524  174.619   20.542  220.764   16.250 -46.14461 26.19260 
1 1 1    1    3   44 o  220.109   12.341   37.330   4.1411   37.778   5.3710   36.673   6.5026  220.929   15.991  217.003   19.795 3.926132 25.44721 
1 1 1    1    3   45 o   63.188   25.630   1.3244   3.8653   2.2330   5.0232   0.0055   6.0523   73.774   29.465   72.159   30.855 1.615326 42.66417 
1 1 1    1    3   46 o  295.713   10.706   67.163   4.8457   76.213   6.3620   54.659   7.4782  314.714   13.207  265.201   18.539 49.51331 22.76251 
1 1 1    1    3   47 o   68.179   26.159   2.5148   3.8288  -3.7723   5.6478   7.8619   5.2084   59.621   27.332   99.679   30.919 -40.05827 41.26812 
1 1 1    1    3   48 o  270.082   9.6133   56.028   3.9741   54.639   5.6366   57.402   5.6040  265.831   13.901  272.903   13.416 -7.071808 19.31919 
1 1 1    1    3   49 o  358.010   8.0133   98.369   4.3911   93.568   6.1233  103.453   6.3005  348.647   11.474  366.645   11.227 -17.99832 16.05321 
1 1 1    1    3   50 o   77.100   25.653   4.4912   3.5415   6.7952   5.0052   2.1812   5.0116   93.297   30.471   72.827   29.309 20.47029 42.27854 
1 1 1    1    3   51 o  250.394   12.342   48.390   4.7301   52.042   7.0117   45.340   6.4076  257.901   17.873  240.749   17.508 17.15193 25.01955 
1 1 1    1    3   52 o  100.389   27.200   8.3383   4.2834   8.3144   5.8520   8.3659   6.2866  101.577   32.936  102.517   34.182 -0.9399872 47.46755 
1 1 1    1    3   53 o  176.820   14.862   24.445   3.9852   24.157   6.0469   24.667   5.2987  173.118   23.422  176.143   20.008 -3.024353 30.80414 
1 1 1    1    3   54 o  227.806   13.214   40.349   4.5877   41.182   7.8664   39.920   5.6476  226.636   22.995  225.614   16.468 1.021912 28.28368 
1 1 1    1    3   55 o  346.538   9.1082   92.502   4.8312  100.140   7.3622   86.726   6.4025  359.218   13.390  334.592   12.502 24.62589 18.31892 
1 1 1    1    3   56 o  135.064   19.455   14.671   3.9060   22.986   5.7437   7.5169   5.3276  168.288   22.892   95.933   31.442 72.35446 38.89292 
1 1 1    1    3   57 o  179.779   18.385   25.741   4.9878   31.661   8.4491   22.573   6.1795  194.219   29.336  165.441   25.199 28.77829 38.67270 
1 1 1    1    3   58 o  253.018   14.095   50.103   5.4370   54.437   9.9763   48.272   6.4846  257.416   25.662  246.978   17.262 10.43819 30.92771 
1 1 1    1    3   59 o  107.473   24.926   9.7664   4.0208   13.548   5.8016   6.2711   5.5776  124.628   30.631   89.612   32.077 35.01534 44.35276 
1 1 1    1    3   60 o   47.246   22.059  -3.2652   3.9363  -7.4723   5.5702   0.9318   5.5634   50.404   24.287   69.256   29.598 -18.85287 38.28723 
1 1 1    1    3   61 o   82.452   26.193   5.6986   3.7157   8.1011   5.2653   3.3151   5.2444   96.513   31.236   75.453   30.116 21.05956 43.38930 
1 1 1    1    3   62 o   69.449   28.310   2.4155   4.7443  -0.4538   7.9738   3.9879   5.9028   75.449   33.727   79.711   31.903 -4.262550 46.42549 
1 1 1    1    3   63 o  246.850   12.328   47.808   4.6579   46.698   5.6358   50.202   8.2738  241.945   15.297  245.479   22.262 -3.533218 27.01137 
1 1 1    1    3   64 o   61.705   25.289   1.8346   3.8117   2.0200   5.1053   1.6012   5.7296   68.443   28.760   69.766   29.932 -1.323090 41.50962 
1 1 1    1    3   65 o   84.209   25.377   6.3592   3.5415   0.5856   4.9279   12.526   5.0929   62.334   27.244  115.799   28.842 -53.46545 39.67467 
1 1 1    1    3   66 f  123.121   20.111   12.971   3.6590   14.839   4.9099   10.637   5.4875  127.603   26.021  103.708   31.665 23.89547 40.98465 
1 1 1    1    4    1 o  167.117   5.5754   21.377   1.4262   19.633   1.9901   23.218   2.0448  159.933   8.1565  174.156   7.6709 -14.22289 11.19698 
1 1 1    1    4    2 o  302.393   4.0146   69.987   1.8581   70.825   2.6382   69.161   2.6175  304.188   5.6663  300.594   5.6891 3.593994 8.029464 
1 1 1    1    4    3 o  487.615   4.5758  181.985   3.4152  181.814   4.8309  182.156   4.8288  487.363   6.4760  487.821   6.4670 -0.4576111 9.152077 
1 1 1    1    4    4 o  972.768   6.8216  724.353   10.157  720.975   14.299  727.794   14.430  970.395   9.6270  974.971   9.6697 -4.576233 13.64486 
1 1 1    1    4    5 o  511.055   4.7423  199.903   3.7096  206.022   5.3497  194.237   5.1485  518.790   6.7371  503.734   6.6774 15.05588 9.485554 
1 1 1    1    4    6 o  663.942   5.4030  337.410   5.4908  338.297   7.7902  336.534   7.7403  664.770   7.6561  663.036   7.6270 1.733826 10.80678 
1 1 1    1    4    7 o  480.071   6.7421  176.417   4.9542  176.417   4.9542   0.0000   0.0000  480.071   6.7421  ?   ?  0.000000 6.742119 
1 1 1    1    4    8 o  431.119   9.5269  142.303   6.2867   0.0000   0.0000  142.303   6.2867  ?   ?   431.119   9.5269 0.000000 9.526948 
1 1 1    1    4    9 o  880.961   5.3175  594.031   7.1702  584.352   12.272  599.048   8.8352  873.643   9.1770  884.644   6.5250 -11.00134 11.26025 
1 1 1    1    4   10 o  1464.59   6.7921  1641.97   15.226  1627.52   21.306  1657.05   21.767  1457.98   9.5474  1471.15   9.6666 -13.16138 13.58666 
1 1 1    1    4   11 o  1124.06   5.5143  967.119   9.4875  963.562   13.368  970.729   13.467  1121.91   7.7849  1126.08   7.8131 -4.163452 11.02945 
1 1 1    1    4   12 o  841.194   4.5456  541.596   5.8527  533.250   8.1591  550.442   8.4003  834.648   6.3866  847.993   6.4719 -13.34546 9.092501 
1 1 1    1    4   13 o  216.284   3.8389   35.803   1.2709   36.662   1.8104   34.969   1.7844  218.855   5.4045  213.741   5.4542 5.114655 7.678388 
1 1 1    1    4   14 o  539.701   4.7871  222.947   3.9546  229.888   6.4420  218.749   5.0095  547.985   7.6804  534.576   6.1224 13.40924 9.821976 
1 1 1    1    4   15 o  650.250   5.1948  323.646   5.1704  311.930   7.9194  332.349   6.8259  638.299   8.1059  658.899   6.7682 -20.60022 10.55998 
1 1 1    1    4   16 o  642.417   4.4155  315.885   4.3418  321.097   5.7973  309.228   6.5522  647.664   5.8480  635.558   6.7354 12.10663 8.919852 
1 1 1    1    4   17 o  476.792   3.8847  173.999   2.8350  175.909   4.0429  172.151   3.9766  479.376   5.5100  474.228   5.4784 5.148163 7.769984 
1 1 1    1    4   18 o  303.956   4.0882   70.716   1.9020   73.169   2.7014   68.306   2.6784  309.160   5.7086  298.708   5.8581 10.45239 8.179625 
1 1 1    1    4   19 o  245.323   4.5360   46.068   1.7033   45.732   2.3898   46.414   2.4283  244.405   6.3882  246.220   6.4432 -1.815125 9.073252 
1 1 1    1    4   20 o  601.375   4.2292  276.826   3.8929  275.924   5.5001  277.731   5.5107  600.343   5.9855  602.306   5.9775 -1.962708 8.459105 
1 1 1    1    4   21 o  831.804   5.5421  529.675   7.0561  534.510   10.008  524.895   9.9505  835.469   7.8258  827.919   7.8521 7.549744 11.08596 
1 1 1    1    4   22 o  537.680   4.9064  221.301   4.0379  220.052   4.9271  223.858   7.0466  536.129   6.0042  540.654   8.5151 -4.524597 10.41909 
1 1 1    1    4   23 o  1188.21   6.4412  1080.89   11.715  1083.16   17.987  1079.22   15.438  1189.17   9.8822  1187.14   8.4959 2.030762 13.03215 
1 1 1    1    4   24 o  649.032   4.5214  322.434   4.4917  317.350   6.3011  327.686   6.4045  643.845   6.3939  654.246   6.3955 -10.40125 9.043509 
1 1 1    1    4   25 o  905.723   5.1742  627.928   7.1732  630.541   10.192  625.363   10.097  907.522   7.3374  903.790   7.2990 3.732483 10.34955 
1 1 1    1    4   26 o  983.091   5.4358  739.784   8.1794  731.200   11.443  748.750   11.696  977.285   7.6500  988.941   7.7266 -11.65582 10.87301 
1 1 1    1    4   27 o  324.495   5.9695   80.601   2.9650   79.863   4.3673   81.233   4.0381  322.967   8.8347  325.737   8.0992 -2.770050 11.98536 
1 1 1    1    4   28 o  1731.83   10.296  2296.64   27.293  2307.75   43.331  2289.33   35.139  1735.29   16.314  1728.76   13.280 6.529663 21.03544 
1 1 1    1    4   29 o  399.935   5.1469  122.427   3.1507  119.349   4.4314  125.574   4.4805  394.848   7.3323  405.014   7.2275 -10.16672 10.29559 
1 1 1    1    4   30 o  581.738   5.0102  259.032   4.4612  256.602   6.2968  261.480   6.3213  578.964   7.1056  584.442   7.0664 -5.478455 10.02115 
1 1 1    1    4   31 f  2135.66   9.7890  3492.55   31.999  3469.03   44.877  3516.88   45.640  2127.89   13.779  2142.49   13.917 -14.60278 19.58434 
1 1 1    1    4   32 o  212.836   8.6999   34.684   2.8342   33.374   4.0051   35.999   4.0112  208.342   12.619  216.442   12.157 -8.099808 17.52219 
1 1 1    1    4   33 o  373.091   6.1835  106.557   3.5312  111.890   5.0550  101.474   4.9349  382.268   8.6394  364.035   8.8565 18.23315 12.37246 
1 1 1    1    4   34 o   75.777   25.303   4.1545   3.4445   6.4462   4.4343   0.6682   5.4693   91.814   28.537   71.435   29.877 20.37859 41.31595 
1 1 1    1    4   35 o  729.025   6.1009  406.866   6.8078  422.406   10.626  396.045   8.8667  742.671   9.3473  719.187   8.0547 23.48401 12.33899 
1 1 1    1    4   36 o  841.965   5.8490  542.693   7.5377  541.343   10.649  544.049   10.671  840.794   8.2746  842.892   8.2711 -2.098694 11.69962 
1 1 1    1    4   37 o  564.919   6.0793  244.322   5.2567  241.686   7.3793  247.037   7.4900  561.767   8.5820  567.951   8.6159 -6.183289 12.16081 
1 1 1    1    4   38 o  1139.21   6.5613  993.670   11.441  997.682   16.198  989.675   16.162  1141.26   9.2729  1136.66   9.2894 4.591064 13.12558 
1 1 1    1    4   39 o  266.567   10.097   54.447   4.1197   45.600   5.5330   65.452   6.1713  243.324   14.928  292.118   13.802 -48.79411 20.33125 
1 1 1    1    4   40 o  793.227   7.0076  481.865   8.5082  497.918   14.986  474.229   10.335  805.792   12.151  786.786   8.5822 19.00635 14.87588 
1 1 1    1    4   41 o  256.273   10.889   50.358   4.2715   49.536   5.4786   51.632   6.8215  253.615   14.170  258.549   17.338 -4.933899 22.39134 
1 1 1    1    4   42 o  155.672   17.197   18.872   4.0291   20.075   5.1394   16.953   6.4902  159.868   21.552  145.010   30.221 14.85738 37.11876 
1 1 1    1    4   43 o  293.881   9.7381   66.232   4.3804   70.939   5.6734   59.285   6.8928  303.968   12.194  277.058   16.326 26.91000 20.37725 
1 1 1    1    4   44 o  367.517   7.7473  103.523   4.3581  101.244   6.1160  105.875   6.2117  363.175   11.002  371.396   10.927 -8.221130 15.50648 
1 1 1    1    4   45 o  292.148   8.8324   65.463   3.9496   69.121   5.6065   61.860   5.5649  299.898   12.214  283.650   12.817 16.24832 17.70480 
1 1 1    1    4   46 o  379.181   9.0069  110.318   5.2275  112.120   6.7629  107.643   8.2393  381.948   11.568  373.810   14.400 8.137115 18.47129 
1 1 1    1    4   47 o  208.218   12.024   33.460   3.8158   29.291   5.8475   36.553   5.0357  193.260   20.060  217.125   15.249 -23.86586 25.19808 
1 1 1    1    4   48 o  212.228   11.329   34.744   3.6670   30.364   5.1246   39.341   5.2494  197.314   17.138  225.165   15.323 -27.85106 22.98915 
1 1 1    1    4   49 o  255.896   9.7547   50.329   3.8207   50.921   5.4116   49.739   5.3951  256.486   13.836  253.456   13.961 3.029785 19.65520 
1 1 1    1    4   50 o  309.484   8.6462   73.578   4.0958   69.740   5.7370   77.568   5.8493  300.696   12.465  317.204   12.047 -16.50818 17.33522 
1 1 1    1    4   51 o  376.346   10.017  109.010   5.7704  108.765   9.7496  109.142   7.1589  373.935   17.034  376.000   12.439 -2.065063 21.09241 
1 1 1    1    4   52 o  293.454   10.123   66.329   4.5468   67.204   5.8213   64.962   7.2810  294.794   12.901  288.420   16.562 6.373718 20.99419 
1 1 1    1    4   53 o  251.918   11.001   48.966   4.2420   50.569   6.6172   47.847   5.5271  254.010   17.120  247.840   14.635 6.170471 22.52236 
1 1 1    1    4   54 o   57.769   24.566   0.3052   3.7979  -3.3995   5.7561   3.1613   5.0541   60.244   27.609   76.092   29.816 -15.84821 40.63541 
1 1 1    1    4   55 o  337.373   9.2784   87.700   4.7913   90.996   7.3965   85.316   6.2893  342.139   14.124  331.885   12.381 10.25409 18.78196 
1 1 1    1    4   56 o  217.556   13.719   36.942   4.5451   39.891   7.9017   35.484   5.5564  222.024   23.614  211.998   17.274 10.02567 29.25751 
1 1 1    1    4   57 o  246.675   23.857   49.395   8.8950   49.395   8.8950   0.0000   0.0000  246.675   23.857  ?   ?  0.000000 23.85672 
1 1 1    1    4   58 o  353.213   9.4466   96.330   5.1072  101.490   7.8574   92.555   6.7204  360.535   14.239  344.985   12.727 15.54974 19.09743 
1 1 1    1    4   59 o   52.837   23.577  -1.1288   3.8780   0.3443   5.5326  -2.5517   5.4374   67.642   29.219   59.387   27.070 8.254303 39.83191 
1 1 1    1    4   60 o   84.787   26.500   6.0159   3.8179  -0.4852   5.4608   12.232   5.3398   64.535   28.429  118.170   29.588 -53.63576 41.03269 
1 1 1    1    4   61 o   76.165   25.958   4.6503   3.6261   11.293   5.2186  -1.5509   5.0421  112.801   29.785   58.875   26.528 53.92613 39.88590 
1 1 1    1    4   62 o   64.981   26.860   1.7528   4.3468   2.6576   7.7325   1.3348   5.2558   81.875   34.940   68.041   28.915 13.83414 45.35293 
1 1 1    1    4   63 o   50.771   23.049  -1.5618   3.8912  -8.3666   5.0106   8.7788   6.1767   44.790   21.910   98.365   33.870 -53.57486 40.33869 
1 1 1    1    4   64 o  123.474   20.086   12.824   3.6656   12.415   5.1481   13.244   5.2206  116.148   29.036  120.241   28.754 -4.093658 40.86464 
1 1 1    1    4   65 o   82.181   26.129   6.0477   3.6969   7.2755   4.7408   4.1427   5.9053   88.745   29.684   77.428   31.576 11.31669 43.33831 
1 1 1    1    4   66 o  139.909   19.661   16.620   4.0942   16.197   4.8897   17.612   7.4889  134.481   24.663  129.201   36.344 5.280502 43.92197 
1 1 1    1    5    1 o  741.961   8.0260  421.434   9.1149  432.462   13.200  411.380   12.602  751.492   11.475  732.955   11.233 18.53680 16.05802 
1 1 1    1    5    2 o  776.882   5.8624  461.975   6.9710  466.862   9.9503  457.264   9.7693  780.919   8.3246  772.852   8.2584 8.066711 11.72601 
1 1 1    1    5    3 o  969.358   6.8267  719.284   10.129  719.401   14.329  719.167   14.320  969.334   9.6579  969.177   9.6530 0.1578369 13.65488 
1 1 1    1    5    4 o  216.572   4.2641   35.899   1.4135   35.469   1.9994   36.329   1.9986  215.262   6.0683  217.857   5.9936 -2.594604 8.529261 
1 1 1    1    5    5 o  984.394   6.9332  741.775   10.447  739.102   14.716  744.491   14.832  982.511   9.7855  986.085   9.8268 -3.573730 13.86802 
1 1 1    1    5    6 o  331.109   6.2310   83.919   3.1579   82.380   4.4074   85.542   4.5268  328.030   8.7781  334.266   8.8477 -6.235809 12.46342 
1 1 1    1    5    7 o  832.757   8.8266  530.922   11.251  520.555   15.586  542.202   16.257  824.447   12.351  841.401   12.623 -16.95422 17.66046 
1 1 1    1    5    8 o  345.008   4.6028   91.105   2.4307   92.551   3.4633   89.700   3.4122  347.720   6.5072  342.323   6.5122 5.397369 9.206146 
1 1 1    1    5    9 o  247.664   4.8932   46.948   1.8549   48.536   2.6404   45.400   2.6064  251.806   6.8507  243.533   6.9923 8.273575 9.789021 
1 1 1    1    5   10 o  661.548   4.5628  334.968   4.6203  329.655   6.4334  340.627   6.6396  656.250   6.4047  667.080   6.5027 -10.83002 9.127160 
1 1 1    1    5   11 f  288.771   4.0118   63.823   1.7732   62.544   2.4782   65.166   2.5383  285.851   5.6640  291.781   5.6835 -5.929535 8.023959 
1 1 1    1    5   12 o  573.282   4.0404  251.543   3.5454  254.759   4.7390  247.454   5.3430  576.918   5.3666  568.573   6.1394 8.344788 8.154334 
1 1 1    1    5   13 o  1134.43   5.9818  985.084   10.387  978.661   13.675  993.841   15.968  1130.64   7.9021  1139.31   9.1568 -8.670044 12.09499 
1 1 1    1    5   14 o  640.127   5.0780  313.644   4.9754  306.552   7.7989  318.510   6.4609  632.779   8.0521  645.044   6.5439 -12.26422 10.37588 
1 1 1    1    5   15 o  430.973   4.0013  142.162   2.6395  144.540   3.4953  139.007   4.0264  434.546   5.2551  426.135   6.1730 8.411377 8.106966 
1 1 1    1    5   16 o  101.374   6.9534   7.9046   1.0724   8.5476   1.5446   7.3062   1.4901  105.201   9.7013   97.142   10.173 8.059250 14.05710 
1 1 1    1    5   17 o  481.768   3.8924  177.651   2.8703  179.371   4.0905  175.983   4.0286  484.066   5.5208  479.473   5.4894 4.593048 7.785437 
1 1 1    1    5   18 o  228.566   4.5453   39.989   1.5902   40.427   2.2557   39.556   2.2420  229.793   6.4133  227.304   6.4441 2.488693 9.091619 
1 1 1    1    5   19 o  516.658   4.0599  204.321   3.2106  202.260   4.5326  206.396   4.5485  514.006   5.7611  519.236   5.7231 -5.229858 8.120620 
1 1 1    1    5   20 o  607.482   4.2420  282.477   3.9443  283.009   5.5861  281.947   5.5702  608.001   6.0026  606.859   5.9967 1.141846 8.484736 
1 1 1    1    5   21 o  269.187   6.1255   55.476   2.5238   55.308   3.4326   55.673   3.7236  268.738   8.3450  269.610   9.0232 -0.8716125 12.29055 
1 1 1    1    5   22 o  829.981   5.2084  527.329   6.6167  534.348   10.272  522.350   8.6504  835.346   8.0337  825.980   6.8422 9.366089 10.55259 
1 1 1    1    5   23 o  544.622   4.6783  227.043   3.8999  219.613   5.9195  232.742   5.1840  535.569   7.2211  551.378   6.1425 -15.80945 9.480229 
1 1 1    1    5   24 o  459.792   4.4151  161.817   3.1072  162.766   4.4155  160.885   4.3734  461.106   6.2562  458.434   6.2326 2.671570 8.830930 
1 1 1    1    5   25 o  780.820   4.8608  466.668   5.8094  460.369   8.1336  473.228   8.3003  775.474   6.8525  786.228   6.8972 -10.75421 9.722580 
1 1 1    1    5   26 o  503.476   5.2567  194.029   4.0510  202.504   5.0372  178.513   6.8160  514.334   6.3985  482.845   9.2226 31.48874 11.22482 
1 1 1    1    5   27 o  798.849   6.2585  488.497   7.6526  483.975   12.036  491.564   9.9144  795.018   9.8912  801.297   8.0836 -6.279358 12.77415 
1 1 1    1    5   28 o  410.059   5.3637  128.706   3.3665  131.486   4.3973  124.768   5.2328  414.444   6.9319  403.692   8.4687 10.75229 10.94395 
1 1 1    1    5   29 o  934.157   5.4597  667.955   7.8065  676.637   11.176  659.681   10.909  940.134   7.7663  928.282   7.6780 11.85107 10.92093 
1 1 1    1    5   30 o  869.127   5.4039  578.196   7.1888  571.310   10.057  585.388   10.279  863.869   7.6062  874.445   7.6801 -10.57611 10.80913 
1 1 1    1    5   31 o  160.877   10.340   19.902   2.5326   15.109   3.5734   24.739   3.5900  139.346   17.114  179.218   13.179 -39.87173 21.60045 
1 1 1    1    5   32 o  432.318   5.7510  143.066   3.8055  141.693   5.4011  144.420   5.3628  430.192   8.2025  434.316   8.0670 -4.123627 11.50473 
1 1 1    1    5   33 o  648.965   5.7018  322.387   5.6637  326.362   8.5717  319.307   7.5455  652.862   8.5778  645.800   7.6335 7.061768 11.48254 
1 1 1    1    5   34 o  100.386   22.550   8.0479   3.3802   8.9205   4.1285   6.2732   5.8876  105.614   25.767   95.215   33.052 10.39951 41.90887 
1 1 1    1    5   35 o  511.566   6.4880  200.350   5.0802  193.801   7.7794  205.219   6.7080  503.015   10.104  517.683   8.4657 -14.66846 13.18178 
1 1 1    1    5   36 o  572.038   5.9894  250.510   5.2442  255.989   7.4683  245.181   7.3655  578.171   8.4391  565.831   8.5045 12.33990 11.98098 
1 1 1    1    5   37 o  300.038   8.4422   68.943   3.8771   74.753   5.5471   63.394   5.4210  312.331   11.603  287.601   12.315 24.72992 16.92004 
1 1 1    1    5   38 o  228.043   10.722   39.848   3.7424   47.593   5.3244   32.285   5.2613  248.720   14.043  204.380   16.972 44.34012 22.02867 
1 1 1    1    5   39 o  362.801   8.5018  100.822   4.7212   98.626   6.6696  103.028   6.6839  358.664   12.149  366.595   11.912 -7.930267 17.01436 
1 1 1    1    5   40 o  819.552   7.7223  514.466   9.6871  511.411   15.106  516.600   12.624  816.620   12.086  821.012   10.046 -4.392334 15.71581 
1 1 1    1    5   41 o  655.133   6.6533  328.712   6.6717  328.782   8.7553  328.614   10.303  655.031   8.7325  654.705   10.281 0.3260498 13.48917 
1 1 1    1    5   42 o  575.729   6.8571  253.902   6.0427  253.575   7.8433  254.380   9.4782  575.180   8.9089  575.893   10.753 -0.7131348 13.96380 
1 1 1    1    5   43 f  481.453   6.7025  177.574   4.9393  180.307   6.9871  174.843   6.9833  484.911   9.4137  477.493   9.5549 7.417847 13.41319 
1 1 1    1    5   44 o  279.288   9.2000   59.824   3.9329   62.584   5.6374   57.206   5.4894  285.364   12.907  272.807   13.146 12.55685 18.42293 
1 1 1    1    5   45 o  374.949   7.9133  107.787   4.5415   98.095   6.6948  116.049   6.1812  357.246   12.243  388.801   10.387 -31.55524 16.05563 
1 1 1    1    5   46 o  299.957   9.8758   69.075   4.5342   68.182   5.7593   70.531   7.3537  297.714   12.639  301.924   15.969 -4.210236 20.36550 
1 1 1    1    5   47 o  333.682   8.6310   85.443   4.4082   86.817   7.0125   84.545   5.6682  335.676   13.648  331.623   11.167 4.053436 17.63450 
1 1 1    1    5   48 f  613.019   6.2518  288.057   5.8661  301.052   8.4346  275.883   8.1638  626.206   8.7999  599.437   8.8977 26.76825 12.51428 
1 1 1    1    5   49 o  502.688   6.6472  193.781   5.1146  194.147   7.2797  193.425   7.1873  502.643   9.4621  501.730   9.3589 0.9131775 13.30865 
1 1 1    1    5   50 o   47.949   21.913  -2.2753   3.5924  -2.6829   4.7236  -1.7161   5.5326   55.544   25.285   63.487   28.257 -7.942951 37.91819 
1 1 1    1    5   51 o  160.043   19.546   20.308   4.6886   48.244   14.023   16.792   4.9749  238.050   39.897  144.226   23.332 93.82425 46.21918 
1 1 1    1    5   52 o  226.746   13.680   39.954   4.7256   41.970   6.5038   37.700   6.8780  230.975   18.553  218.042   20.863 12.93257 27.91941 
1 1 1    1    5   53 o  347.493   8.1925   92.835   4.3575   85.898   6.1580   99.792   6.1667  333.371   12.068  359.566   11.205 -26.19547 16.46789 
1 1 1    1    5   54 o   51.955   23.407  -1.7066   3.9243  -3.1161   6.5691  -0.9244   4.8935   65.700   29.873   61.048   26.902 4.652218 40.20053 
1 1 1    1    5   55 o  270.829   11.320   56.708   4.6926   52.517   7.7451   59.139   5.8985  257.266   19.821  275.486   14.035 -18.21964 24.28724 
1 1 1    1    5   56 f  287.368   10.378   63.786   4.5650   64.212   6.9560   63.463   6.0502  286.129   15.946  285.621   13.839 0.5083923 21.11405 
1 1 1    1    5   57 o  285.968   12.591   63.511   5.5114   62.294   7.8815   64.675   7.7098  280.326   18.472  286.056   17.695 -5.730591 25.58028 
1 1 1    1    5   58 o   93.735   27.453   7.4115   4.1916   6.9874   6.2713   7.7540   5.6351   94.509   33.994   96.737   32.363 -2.227875 46.93584 
1 1 1    1    5   59 f  222.524   12.859   38.708   4.3612   41.427   6.2686   36.158   6.0715  227.927   18.118  212.493   18.863 15.43381 26.15485 
1 1 1    1    5   60 o  136.112   19.679   15.108   3.9808   12.630   5.6517   17.548   5.6080  119.538   30.722  143.615   26.487 -24.07763 40.56356 
1 1 1    1    5   61 o  108.458   25.106   10.118   4.0854   7.6340   5.4330   13.349   6.1975   94.213   31.776  121.202   32.667 -26.98950 45.57236 
1 1 1    1    5   62 o  254.113   12.870   50.789   4.9893   55.416   9.0185   48.748   5.9894  258.011   23.080  247.189   15.915 10.82205 28.03514 
1 1 1    1    5   63 o  170.041   16.274   23.305   4.1838   23.768   5.3997   22.608   6.6180  168.768   21.383  160.014   28.043 8.753296 35.26505 
1 1 1    1    5   64 o   47.024   21.582  -1.8342   3.5355 -10.2480   4.7996   8.1472   5.2276   40.606   20.156   93.926   31.163 -53.31988 37.11359 
1 1 1    1    5   65 o  111.946   23.211   11.035   3.8467   13.952   4.9151   6.4236   6.1796  123.769   26.727   85.993   33.170 37.77650 42.59777 
1 1 1    1    5   66 o  131.250   19.044   14.575   3.7142   13.331   4.9267   16.213   5.6533  119.497   27.506  130.883   28.984 -11.38511 39.95812 
1 1 1    1    6    1 o  218.064   8.4391   36.404   2.8168   0.0000   0.0000   36.404   2.8168  ?   ?   218.064   8.4391 0.000000 8.439097 
1 1 1    1    6    2 o  591.498   5.8783  267.803   5.3220  268.889   6.5485  265.689   9.1338  592.673   7.2187  589.069   10.130 3.604431 12.43902 
1 1 1    1    6    3 o  1254.16   9.6680  1204.29   18.559  1207.95   22.825  1197.15   31.883  1255.93   11.873  1249.92   16.665 6.014038 20.46212 
1 1 1    1    6    4 o  967.299   13.732  716.692   20.331   0.0000   0.0000  716.692   20.331  ?   ?   967.299   13.732 0.000000 13.73179 
1 1 1    1    6    5 o  436.766   6.5496  146.023   4.3786  150.303   6.2984  142.021   6.0912  443.077   9.2871  430.697   9.2398 12.37964 13.10057 
1 1 1    1    6    6 o  223.625   5.3103   38.277   1.8177   35.115   3.1087   39.919   2.2406  214.159   9.4835  228.366   6.4100 -14.20750 11.44660 
1 1 1    1    6    7 o  209.645   4.7829   33.640   1.5348   33.292   2.1716   33.987   2.1694  208.547   6.8031  210.714   6.7263 -2.166855 9.566857 
1 1 1    1    6    8 o  975.319   6.9890  728.164   10.434  730.516   14.805  725.844   14.706  976.783   9.9021  973.656   9.8680 3.127197 13.97961 
1 1 1    1    6    9 o  635.024   5.4966  308.660   5.3426  310.357   7.5897  306.992   7.5219  636.724   7.7876  633.263   7.7602 3.460388 10.99396 
1 1 1    1    6   10 o  1158.47   7.9892  1027.40   14.166  1027.08   20.024  1027.73   20.044  1158.11   11.296  1158.48   11.304 -0.3651123 15.98073 
1 1 1    1    6   11 o  509.754   4.6420  198.888   3.6219  197.836   4.6283  200.549   5.8173  508.387   5.9479  511.836   7.4254 -3.449432 9.513875 
1 1 1    1    6   12 o  177.312   4.8076   24.064   1.3048   20.797   1.7742   27.912   1.9255  164.824   7.0327  190.954   6.5879 -26.13043 9.636389 
1 1 1    1    6   13 o  808.073   8.9823  499.962   11.110  499.962   11.110   0.0000   0.0000  808.073   8.9823  ?   ?  0.000000 8.982269 
1 1 1    1    6   14 o  843.083   5.3530  544.072   6.9078  544.123   9.7706  544.020   9.7676  843.050   7.5717  842.969   7.5702 0.8038330E-01 10.70695 
1 1 1    1    6   15 o  1083.26   5.8458  898.257   9.6927  896.650   12.796  900.421   14.846  1082.19   7.7252  1084.39   8.9445 -2.199463 11.81878 
1 1 1    1    6   16 o  824.083   4.6317  519.817   5.8422  508.097   8.0899  532.592   8.4459  814.677   6.4877  834.078   6.6156 -19.40149 9.265867 
1 1 1    1    6   17 o  898.434   4.9036  617.875   6.7433  619.378   9.5515  616.381   9.5214  899.435   6.9379  897.256   6.9329 2.178406 9.808186 
1 1 1    1    6   18 o  355.174   3.9960   96.557   2.1724   95.145   3.0628   97.987   3.0817  352.541   5.6760  357.768   5.6275 -5.226532 7.992860 
1 1 1    1    6   19 o  809.049   4.6887  501.051   5.8063  508.137   8.3227  494.332   8.1044  814.662   6.6745  803.523   6.5895 11.13824 9.379230 
1 1 1    1    6   20 o  226.545   5.1227   39.288   1.7763   38.056   2.5915   40.379   2.4396  222.932   7.5948  229.646   6.9405 -6.714066 10.28839 
1 1 1    1    6   21 o  759.368   5.3285  441.427   6.1933  439.682   7.5642  444.976   10.787  757.815   6.5213  762.210   9.2464 -4.394897 11.31468 
1 1 1    1    6   22 o  228.195   5.5565   39.863   1.9408   38.796   3.0342   40.601   2.5249  225.076   8.8073  230.279   7.1633 -5.203201 11.35257 
1 1 1    1    6   23 o  368.484   4.4865  103.931   2.5304  100.414   3.5653  107.500   3.5920  362.167   6.4317  374.730   6.2624 -12.56345 8.976873 
1 1 1    1    6   24 o  650.603   4.5764  323.992   4.5573  319.579   6.3799  328.590   6.5120  646.111   6.4512  655.155   6.4939 -9.044006 9.153566 
1 1 1    1    6   25 o  688.111   4.6654  362.423   4.9138  371.479   7.0693  353.957   6.8350  696.608   6.6301  679.982   6.5671 16.62622 9.331908 
1 1 1    1    6   26 o  940.329   5.6785  676.827   8.1731  672.274   10.798  682.934   12.506  937.096   7.5281  944.449   8.6513 -7.352295 11.46809 
1 1 1    1    6   27 o  408.055   5.5203  127.452   3.4479  129.169   6.0040  126.607   4.2115  410.729   9.5502  406.684   6.7657 4.045197 11.70391 
1 1 1    1    6   28 o  490.484   5.2116  184.141   3.9126  188.628   5.2020  178.296   5.9372  496.399   6.8465  482.590   8.0377 13.80872 10.55837 
1 1 1    1    6   29 o  599.204   4.9012  274.817   4.4951  270.087   6.3326  279.622   6.3818  593.985   6.9653  604.381   6.8987 -10.39575 9.803405 
1 1 1    1    6   30 o  570.922   5.0371  249.491   4.4017  248.913   6.2333  250.065   6.2168  570.220   7.1417  571.539   7.1064 -1.318481 10.07496 
1 1 1    1    6   31 o  293.376   6.6669   65.888   2.9938   67.526   4.3165   64.369   4.1557  296.960   9.4966  289.939   9.3642 7.021423 13.33692 
1 1 1    1    6   32 o  1117.79   6.1625  956.454   10.544  951.403   14.821  961.630   15.003  1114.70   8.6863  1120.67   8.7463 -5.971191 12.32683 
1 1 1    1    6   33 f  627.443   6.1641  301.372   5.9199  313.929   9.6959  293.909   7.4748  640.248   9.8940  619.574   7.8820 20.67426 12.64977 
1 1 1    1    6   34 o  652.216   6.3541  325.652   6.3433  323.374   7.6877  330.513   11.228  649.883   7.7285  656.857   11.167 -6.974670 13.58082 
1 1 1    1    6   35 o  327.954   7.9678   82.355   3.9996   87.739   6.2676   78.656   5.1949  338.389   12.101  320.441   10.592 17.94833 16.08131 
1 1 1    1    6   36 f  329.442   7.6380   83.104   3.8515   74.950   5.3519   91.865   5.5470  312.768   11.179  346.292   10.465 -33.52386 15.31335 
1 1 1    1    6   37 o  375.177   7.3000  107.780   4.1921  109.110   5.9207  106.442   5.9363  377.390   10.250  372.741   10.405 4.649170 14.60552 
1 1 1    1    6   38 o  477.578   6.6076  174.637   4.8301  184.327   6.9745  165.705   6.6957  490.534   9.2891  465.091   9.4056 25.44336 13.21942 
1 1 1    1    6   39 o  302.798   12.413   70.305   5.7532   61.197   7.8231   81.033   8.4903  281.607   18.248  324.346   17.163 -42.73972 25.05093 
1 1 1    1    6   40 o  469.027   7.2617  168.488   5.2132  158.921   6.7396  182.741   8.2256  455.380   9.6692  488.219   11.007 -32.83865 14.65119 
1 1 1    1    6   41 o  323.050   8.1491   79.960   4.0295   87.428   5.7559   72.781   5.6429  337.634   11.138  308.006   11.969 29.62836 16.34980 
1 1 1    1    6   42 o  830.327   6.0727  528.026   7.7180  534.837   11.010  521.445   10.822  835.358   8.6110  824.839   8.5717 10.51898 12.15005 
1 1 1    1    6   43 o  530.680   6.3638  215.727   5.1692  220.418   7.3007  211.012   7.3200  536.182   8.8958  524.594   9.1163 11.58832 12.73739 
1 1 1    1    6   44 o  272.193   9.1070   56.824   3.7942   56.294   5.3071   57.379   5.4265  270.634   12.812  273.215   12.976 -2.581299 18.23513 
1 1 1    1    6   45 o  326.236   8.4074   81.622   4.1982   82.467   6.2205   80.916   5.6892  327.517   12.409  324.532   11.453 2.984955 16.88641 
1 1 1    1    6   46 o  207.425   12.542   33.218   3.9631   28.417   4.9419   41.871   6.6340  191.034   17.081  231.803   18.861 -40.76907 25.44640 
1 1 1    1    6   47 o  397.799   7.8284  121.382   4.7666  122.775   7.4106  120.400   6.2252  399.442   12.121  395.861   10.274 3.581024 15.88931 
1 1 1    1    6   48 o  231.306   10.332   41.129   3.6580   39.923   5.1715   42.336   5.1748  226.857   14.978  233.731   14.537 -6.874298 20.87216 
1 1 1    1    6   49 o  434.581   7.3644  144.904   4.8987  145.929   6.7199  143.742   7.1561  435.636   10.078  432.203   10.817 3.433350 14.78446 
1 1 1    1    6   50 o  123.775   21.500   12.328   3.9255   14.606   5.7708   10.367   5.3554  132.841   29.179  111.824   30.462 21.01752 42.18270 
1 1 1    1    6   51 o   74.318   28.275   3.2887   4.4502 -20.4326   14.269   5.8446   4.6838   78.638   38.130   87.421   29.504 -8.782959 48.21177 
1 1 1    1    6   52 o   98.324   25.152   7.9855   3.8006   8.3988   4.8130   7.3010   6.1944  100.792   29.389   97.590   33.900 3.201103 44.86574 
1 1 1    1    6   53 o  109.235   23.790   9.8254   3.8649   12.842   6.6398   8.2794   4.7532  122.684   34.119   99.932   29.225 22.75211 44.92466 
1 1 1    1    6   54 f  374.748   8.8017  108.100   5.0487  106.097   8.1410  109.352   6.4357  369.483   14.395  376.250   11.175 -6.766418 18.22356 
1 1 1    1    6   55 o   73.517   25.693   3.9843   3.5606   6.8775   5.1965   1.4238   4.8885   92.786   31.078   68.457   28.406 24.32949 42.10366 
1 1 1    1    6   56 o  328.319   9.0560   83.087   4.5509   88.791   6.6965   78.191   6.2037  338.152   12.938  317.387   12.770 20.76566 18.17871 
1 1 1    1    6   57 o  182.794   16.428   26.415   4.5472   24.378   6.0239   29.113   6.9329  172.769   23.380  188.419   24.629 -15.64961 33.95870 
1 1 1    1    6   58 o  157.186   19.400   19.890   4.5686   19.228   7.9025   20.222   5.5991  146.790   35.550  156.484   24.154 -9.694229 42.97900 
1 1 1    1    6   59 o   79.074   26.845   4.9560   3.8778   3.6573   5.4741   6.2642   5.4942   78.433   30.937   89.217   31.847 -10.78421 44.39953 
1 1 1    1    6   60 o  144.355   17.905   16.804   3.8713   13.490   5.3839   20.353   5.5706  124.331   28.848  156.101   24.090 -31.77016 37.58377 
1 1 1    1    6   61 o   82.648   26.827   5.7316   3.8818   5.8128   5.1910   5.6285   5.8468   85.370   30.897   86.116   32.494 -0.7462234 44.83872 
1 1 1    1    6   62 o  164.364   18.834   22.042   4.6528   18.738   8.4172   23.496   5.5834  138.668   38.362  167.759   22.297 -29.09119 44.37126 
1 1 1    1    6   63 o  212.132   14.293   35.804   4.6139   39.138   5.5077   27.959   8.4486  220.497   16.437  173.873   32.952 46.62428 36.82396 
1 1 1    1    6   64 o   59.808   25.110   1.3168   3.8863  -5.4366   5.0084   11.537   6.1610   49.031   23.470  108.862   33.605 -59.83091 40.98943 
1 1 1    1    6   65 o   67.924   25.332   3.5733   3.5325   6.5208   4.9587   0.5359   5.0337   84.901   30.260   62.483   27.416 22.41784 40.83291 
1 1 1    1    7    1 o  955.356   13.637  699.093   19.941   0.0000   0.0000  699.093   19.941  ?   ?   955.356   13.637 0.000000 13.63667 
1 1 1    1    7    2 o  860.327   8.9973  566.665   11.848  551.237   16.333  583.801   17.213  848.387   12.578  873.071   12.881 -24.68414 18.00300 
1 1 1    1    7    3 o  794.974   6.9964  483.774   8.5133  485.073   14.782  483.129   10.414  795.865   12.135  794.401   8.5644 1.464050 14.85252 
1 1 1    1    7    4 o  481.391   4.8253  177.371   3.5555  179.582   5.1011  175.281   4.9583  484.357   6.8807  478.523   6.7695 5.833374 9.652488 
1 1 1    1    7    5 o  1221.31   8.2449  1141.89   15.413  1160.92   22.207  1124.20   21.409  1231.24   11.783  1211.63   11.544 19.61243 16.49581 
1 1 1    1    7    6 o  811.596   6.1817  504.191   7.6793  503.007   10.836  505.385   10.884  810.573   8.7340  812.486   8.7521 -1.913391 12.36458 
1 1 1    1    7    7 o  1409.81   9.3018  1521.71   20.072  1532.51   28.620  1511.25   28.159  1414.52   13.219  1404.69   13.097 9.836060 18.60803 
1 1 1    1    7    8 f  340.009   4.7332   88.484   2.4633   84.201   3.4228   93.085   3.5477  331.660   6.7425  348.719   6.6467 -17.05945 9.467805 
1 1 1    1    7    9 o  618.442   5.4557  292.752   5.1644  292.041   7.2875  293.469   7.3198  617.647   7.7085  619.155   7.7238 -1.507874 10.91225 
1 1 1    1    7   10 o  1154.44   7.9931  1020.29   14.124  1022.57   20.018  1018.04   19.931  1155.55   11.318  1152.98   11.293 2.560791 15.98877 
1 1 1    1    7   11 o  867.573   7.6260  576.214   10.127  594.248   17.964  567.814   12.261  880.768   13.325  861.162   9.3016 19.60651 16.25072 
1 1 1    1    7   12 o  342.452   7.1743   89.777   3.7605   88.158   5.3255   91.387   5.3109  339.300   10.254  345.461   10.044 -6.160522 14.35381 
1 1 1    1    7   13 o  704.424   5.3333  379.824   5.7504  384.090   7.4656  373.600   9.0167  708.328   6.8859  698.539   8.4331 9.789551 10.88730 
1 1 1    1    7   14 o  747.980   5.0408  428.245   5.7711  426.493   8.1339  430.021   8.1895  746.386   7.1198  749.466   7.1390 -3.079590 10.08247 
1 1 1    1    7   15 o  912.577   5.6656  637.501   7.9138  639.867   11.220  635.158   11.163  914.162   8.0189  910.793   8.0077 3.369568 11.33248 
1 1 1    1    7   16 o  730.459   5.0759  408.435   5.6752  405.588   7.9644  411.372   8.0890  727.833   7.1491  733.002   7.2097 -5.168518 10.15330 
1 1 1    1    7   17 o  294.497   4.3490   66.386   1.9604   69.829   3.0896   64.065   2.5364  302.003   6.6837  289.286   5.7282 12.71667 8.802547 
1 1 1    1    7   18 o  1111.25   5.6362  945.351   9.5867  941.951   13.505  948.803   13.611  1109.08   7.9555  1113.11   7.9887 -4.023560 11.27422 
1 1 1    1    7   19 o  589.266   4.4407  265.794   4.0053  266.383   6.0780  265.342   5.3251  589.846   6.7321  588.722   5.9095 1.124023 8.957844 
1 1 1    1    7   20 o  728.767   5.6657  406.582   6.3199  405.624   8.1085  408.066   10.088  727.836   7.2784  729.927   9.0289 -2.090149 11.59725 
1 1 1    1    7   21 o  117.884   8.6930   10.700   1.5575   12.132   2.3651   9.6038   2.0696  125.200   12.509  111.263   12.361 13.93693 17.58624 
1 1 1    1    7   22 o  676.474   4.8407  350.288   5.0122  354.993   7.8021  346.981   6.5402  680.912   7.4860  673.227   6.3469 7.684692 9.814472 
1 1 1    1    7   23 o  1057.17   5.6031  855.514   9.0665  861.037   12.919  850.154   12.727  1060.45   7.9591  1053.73   7.8910 6.719482 11.20785 
1 1 1    1    7   24 o  189.366   6.1219   27.450   1.7744   28.767   2.5057   26.126   2.5132  193.831   8.4457  184.717   8.8889 9.114029 12.26139 
1 1 1    1    7   25 o  375.806   4.6532  108.099   2.6766  109.229   3.7972  106.984   3.7735  377.741   6.5675  373.838   6.5946 3.902405 9.307017 
1 1 1    1    7   26 o  1300.73   8.1854  1295.30   16.297  1287.78   25.648  1300.39   21.104  1296.60   12.923  1303.12   10.581 -6.523804 16.70233 
1 1 1    1    7   27 o  451.475   5.1926  156.015   3.5883  161.974   5.6711  152.037   4.6339  459.970   8.0550  445.659   6.7932 14.31143 10.53712 
1 1 1    1    7   28 o  1174.24   6.5985  1055.48   11.860  1044.40   15.480  1071.21   18.453  1167.97   8.6590  1182.78   10.193 -14.80823 13.37430 
1 1 1    1    7   29 o  497.322   4.9633  189.310   3.7781  185.835   5.2931  192.918   5.3944  492.704   7.0187  502.007   7.0205 -9.302399 9.927186 
1 1 1    1    7   30 o  300.084   6.3218   68.932   2.9037   66.625   4.1056   71.242   4.1073  294.982   9.0931  305.037   8.7971 -10.05536 12.65197 
1 1 1    1    7   31 o  718.320   5.2556  394.956   5.7785  399.927   8.2970  390.273   8.0525  722.763   7.4999  713.990   7.3683 8.773193 10.51379 
1 1 1    1    7   32 o  511.222   5.4510  200.052   4.2654  194.756   5.9804  205.536   6.0852  504.358   7.7468  518.131   7.6730 -13.77277 10.90362 
1 1 1    1    7   33 o  258.811   9.6937   51.298   3.8401   54.009   4.8384   46.682   6.3124  265.518   11.905  246.152   16.855 19.36612 20.63593 
1 1 1    1    7   34 o  300.869   9.2278   69.324   4.2496   68.401   5.9138   70.309   6.1106  298.765   12.932  302.897   13.180 -4.131897 18.46508 
1 1 1    1    7   35 o  628.317   6.1975  302.230   5.9603  315.930   9.4728  293.251   7.6685  642.253   9.6361  618.843   8.0959 23.40979 12.58558 
1 1 1    1    7   36 f  873.956   5.8900  584.732   7.8790  595.223   11.268  574.695   11.021  881.619   8.3502  866.286   8.3119 15.33276 11.78190 
1 1 1    1    7   37 o  541.975   6.1564  224.887   5.1071  228.344   7.1245  221.233   7.3248  546.028   8.5245  537.441   8.9043 8.587646 12.32692 
1 1 1    1    7   38 o  1233.83   7.8570  1165.89   14.838  1162.47   18.181  1172.71   25.679  1231.80   9.6428  1236.58   13.567 -4.774536 16.64481 
1 1 1    1    7   39 o  668.320   7.7825  342.101   7.9612  346.964   12.448  338.735   10.356  672.677   12.090  664.837   10.177 7.839966 15.80287 
1 1 1    1    7   40 o  234.662   11.400   42.227   4.0947   41.767   5.1285   43.035   6.8004  232.796   14.464  235.728   19.009 -2.932419 23.88660 
1 1 1    1    7   41 o  403.254   7.1364  124.564   4.4048  125.539   6.2396  123.595   6.2191  404.647   10.074  401.499   10.120 3.148193 14.27937 
1 1 1    1    7   42 f  387.640   7.1924  115.122   4.2675  119.026   6.1041  111.391   5.9685  393.952   10.123  381.098   10.232 12.85370 14.39338 
1 1 1    1    7   43 f  315.034   8.0316   76.071   3.8728   77.458   5.5246   74.730   5.4306  317.652   11.363  312.008   11.371 5.644440 16.07548 
1 1 1    1    7   44 o  574.445   6.1824  252.805   5.4360  248.670   7.6497  257.022   7.7261  569.431   8.7767  578.923   8.7190 -9.492065 12.37145 
1 1 1    1    7   45 o  631.297   6.6885  305.419   6.4630  311.160   9.2080  299.845   9.0735  636.773   9.4474  625.080   9.4835 11.69226 13.38618 
1 1 1    1    7   46 o  118.842   19.522   11.225   3.4278   8.5734   4.4292   15.184   5.4127  102.752   27.583  136.971   26.777 -34.21876 38.44286 
1 1 1    1    7   47 o  486.527   7.0871  181.504   5.2777  187.015   8.3860  177.890   6.7913  493.169   11.109  481.339   9.2179 11.82980 14.43564 
1 1 1    1    7   48 o  458.210   7.2254  161.041   5.0675  164.381   8.0244  158.826   6.5357  462.184   11.343  454.699   9.3907 7.485229 14.72575 
1 1 1    1    7   49 o  136.622   17.337   14.712   3.5438   10.644   5.5003   17.598   4.6338  113.458   30.857  148.722   20.935 -35.26412 37.28833 
1 1 1    1    7   50 o  198.209   12.630   30.443   3.8117   34.832   5.4389   26.208   5.3435  211.062   16.979  182.242   19.457 28.82088 25.82373 
1 1 1    1    7   51 o   79.881   26.106   4.9445   3.6738   5.7396   6.6004   4.5876   4.4222   92.648   34.612   80.295   28.581 12.35334 44.88725 
1 1 1    1    7   52 o  177.924   18.174   24.988   4.8799   23.531   7.0588   26.322   6.7537  169.064   28.277  180.258   25.164 -11.19406 37.85255 
1 1 1    1    7   53 o  152.308   15.185   18.210   3.4929   17.950   5.0105   18.455   4.8720  148.977   22.690  151.454   21.631 -2.476440 31.34812 
1 1 1    1    7   54 o   75.445   25.400   4.3495   3.4712   7.1940   4.9225   1.5360   4.8956   94.112   30.175   69.035   28.518 25.07748 41.51842 
1 1 1    1    7   55 f  294.011   9.3910   66.633   4.2262   65.217   5.9676   68.058   5.9858  289.780   13.454  296.102   13.207 -6.322479 18.85347 
1 1 1    1    7   56 o  121.153   20.578   11.939   3.6794   13.384   5.3186   10.614   5.0955  125.643   28.332  111.530   29.423 14.11232 40.84645 
1 1 1    1    7   57 o  271.974   11.108   57.277   4.6242   54.542   5.8233   61.946   7.6080  263.961   14.468  279.754   17.861 -15.79318 22.98550 
1 1 1    1    7   58 o  215.658   13.153   36.355   4.3210   40.692   6.6263   33.147   5.6995  225.523   19.384  203.811   18.471 21.71245 26.77524 
1 1 1    1    7   59 f  137.000   19.667   15.256   4.0059   14.481   5.8046   15.961   5.5353  128.887   29.988  136.727   27.404 -7.840088 40.62325 
1 1 1    1    7   60 o  136.390   19.439   15.171   3.9433   8.8823   5.9601   20.067   5.2589  100.889   33.265  155.578   22.757 -54.68893 40.30470 
1 1 1    1    7   61 o  140.144   19.078   16.054   3.9861   16.771   5.5792   15.307   5.6970  139.046   27.189  131.635   29.053 7.411362 39.79118 
1 1 1    1    7   62 o  137.611   22.064   15.893   4.4903   7.9021   6.8263   21.989   5.9617   95.931   35.322  160.392   25.108 -64.46070 43.33616 
1 1 1    1    7   63 f   47.434   22.112  -2.8720   3.9309  -0.3350   4.9611  -7.1514   6.4434   60.758   26.914   54.912   26.373 5.846100 37.68188 
1 1 1    1    7   64 o  211.941   12.112   35.524   3.9127   36.041   5.4126   34.959   5.6628  210.281   16.961  206.201   18.126 4.080002 24.82384 
1 1 1    1    7   65 o  249.826   10.432   48.972   3.9891   49.534   5.5555   48.375   5.7315  247.889   14.708  244.370   15.402 3.519028 21.29641 
1 1 1    1    8    1 o  157.719   10.112   19.124   2.4283   0.0000   0.0000   19.124   2.4283  ?   ?   157.719   10.112 0.000000 10.11206 
1 1 1    1    8    2 o  364.477   5.3075  101.680   2.9610  102.034   3.6376  100.986   5.0974  365.099   6.5093  363.186   9.1697 1.912476 11.24513 
1 1 1    1    8    3 o  374.965   4.6382  107.612   2.6620  105.498   3.7427  109.777   3.7869  371.244   6.5865  378.699   6.5331 -7.454498 9.277056 
1 1 1    1    8    4 o  105.400   6.8346   8.5396   1.0967   9.0285   1.5722   8.0762   1.5305  108.167   9.5956  102.226   9.9056 5.941574 13.79124 
1 1 1    1    8    5 o  400.218   4.7228  122.596   2.8931  126.067   4.1524  119.321   4.0331  405.824   6.6849  394.817   6.6737 11.00693 9.446005 
1 1 1    1    8    6 o  1016.02   7.2132  790.221   11.218  794.179   15.943  786.340   15.786  1018.44   10.228  1013.40   10.177 5.036011 14.42831 
1 1 1    1    8    7 o  1380.68   9.1663  1459.48   19.371  1465.76   27.531  1453.32   27.261  1383.37   13.002  1377.49   12.929 5.878906 18.33646 
1 1 1    1    8    8 o  505.488   5.1173  195.577   3.9594  191.186   5.5225  200.220   5.6795  499.750   7.2196  511.420   7.2555 -11.66995 10.23548 
1 1 1    1    8    9 o  476.156   5.0662  173.538   3.6923  177.819   5.2973  169.492   5.1494  481.962   7.1807  470.543   7.1496 11.41925 10.13313 
1 1 1    1    8   10 o  508.336   7.3016  197.818   5.6812  200.561   8.1270  195.196   7.9450  511.774   10.375  504.886   10.281 6.888245 14.60597 
1 1 1    1    8   11 o  514.573   7.4388  202.708   5.8589  206.773   8.4057  198.867   8.1709  519.624   10.569  509.596   10.475 10.02762 14.88051 
1 1 1    1    8   12 o  216.889   5.9141   36.009   1.9634   37.480   2.8190   34.623   2.7360  221.253   8.3242  212.651   8.4059 8.602661 11.83006 
1 1 1    1    8   13 o  849.049   6.6083  551.863   8.5881  560.568   12.323  543.643   11.975  855.592   9.4101  842.583   9.2851 13.00897 13.21979 
1 1 1    1    8   14 o  1293.27   8.8410  1280.75   17.501  1260.17   24.296  1302.94   25.230  1282.49   12.377  1304.04   12.640 -21.55029 17.69095 
1 1 1    1    8   15 o  336.088   4.4370   86.460   2.2825   84.817   3.1856   88.193   3.2719  332.853   6.2528  339.413   6.2981 -6.559937 8.874873 
1 1 1    1    8   16 o  186.915   5.5987   26.745   1.6018   30.866   2.3280   23.041   2.2073  200.774   7.5755  173.460   8.3135 27.31378 11.24734 
1 1 1    1    8   17 o  714.690   5.0904  391.003   5.5685  388.086   7.8188  394.005   7.9325  711.935   7.1751  717.341   7.2246 -5.405762 10.18225 
1 1 1    1    8   18 o  810.472   5.9837  502.881   7.4230  485.942   11.460  515.127   9.7434  796.504   9.3996  820.185   7.7612 -23.68115 12.18969 
1 1 1    1    8   19 o  430.760   6.7614  142.068   4.4580  138.265   5.2360  152.091   8.4996  424.916   8.0506  445.467   12.466 -20.55042 14.83929 
1 1 1    1    8   20 f  147.276   6.6587   16.606   1.5010   18.026   1.9705   14.644   2.3169  153.191   8.4361  137.806   11.078 15.38432 13.92443 
1 1 1    1    8   21 o  289.662   6.3987   64.235   2.8370   48.617   4.2958   76.315   3.7780  251.913   11.141  315.700   7.8185 -63.78650 13.61068 
1 1 1    1    8   22 o  690.855   4.8905  365.335   5.1714  378.144   6.9972  349.917   7.6769  702.813   6.5045  676.041   7.4190 26.77155 9.866583 
1 1 1    1    8   23 o  834.229   4.9303  532.698   6.2955  529.309   8.8657  536.146   8.9412  831.503   6.9659  836.855   6.9803 -5.352173 9.861495 
1 1 1    1    8   24 o  434.283   4.8020  144.360   3.1920  141.949   4.9325  146.097   4.1869  430.599   7.4839  436.867   6.2614 -6.268646 9.757778 
1 1 1    1    8   25 o  704.407   5.3297  379.800   5.7464  376.542   8.1043  383.094   8.1492  701.324   7.5496  707.400   7.5263 -6.076172 10.66030 
1 1 1    1    8   26 o  701.177   5.5495  376.327   5.9559  353.428   10.126  388.439   7.3645  679.396   9.7376  712.344   6.7543 -32.94751 11.85085 
1 1 1    1    8   27 o  606.628   5.4852  281.677   5.0931  293.189   7.1963  270.125   7.2093  618.856   7.5972  594.008   7.9292 24.84821 10.98131 
1 1 1    1    8   28 o  1317.41   6.6450  1328.56   13.399  1318.76   18.827  1338.61   19.075  1312.39   9.3721  1322.23   9.4253 -9.833374 13.29185 
1 1 1    1    8   29 o  446.841   5.1327  152.830   3.5105  153.884   4.9797  151.789   4.9497  448.347   7.2564  445.285   7.2623 3.061737 10.26624 
1 1 1    1    8   30 o  300.171   6.3027   68.973   2.8958   68.962   4.1469   68.983   4.0455  300.111   9.0275  300.160   8.8054 -0.4858398E-01 12.61076 
1 1 1    1    8   31 o  629.562   5.2270  303.383   5.0368  304.178   7.1154  302.584   7.1309  630.333   7.3750  628.678   7.4105 1.654785 10.45496 
1 1 1    1    8   32 o  546.500   6.0308  228.628   5.0447  223.639   6.9842  234.069   7.2945  540.441   8.4430  552.895   8.6195 -12.45355 12.06568 
1 1 1    1    8   33 o  375.849   8.6850  108.170   4.9963  108.170   4.9963   0.0000   0.0000  375.849   8.6850  ?   ?  0.000000 8.684977 
1 1 1    1    8   34 o  502.174   6.2872  193.057   4.8326  192.688   7.5891  193.308   6.2677  501.578   9.8851  502.447   8.1498 -0.8688965 12.81153 
1 1 1    1    8   35 o  217.766   10.626   36.328   3.5417   36.833   4.4752   35.481   5.7940  218.800   13.428  214.288   17.827 4.512711 22.31802 
1 1 1    1    8   36 o  529.800   6.5515  214.902   5.3128  217.363   6.8556  211.201   8.4061  532.755   8.4071  525.053   10.460 7.702576 13.41959 
1 1 1    1    8   37 o  113.256   21.447   10.187   3.5818   12.924   4.5413   5.6822   5.8266  127.490   24.156   92.277   32.811 35.21280 40.74437 
1 1 1    1    8   38 o  942.082   6.8835  679.616   9.9258  687.687   14.119  671.729   13.957  947.392   9.7365  936.334   9.7383 11.05756 13.77081 
1 1 1    1    8   39 o  637.565   6.5887  311.279   6.4297  303.271   10.125  316.690   8.3234  629.019   10.516  642.958   8.4577 -13.93896 13.49535 
1 1 1    1    8   40 o  468.372   7.2717  168.032   5.2131  170.530   6.7172  164.249   8.2665  471.712   9.3034  462.759   11.671 8.953156 14.92510 
1 1 1    1    8   41 o  667.061   6.0430  340.775   6.1700  349.420   8.8258  332.512   8.6290  675.240   8.5394  658.698   8.5587 16.54205 12.09017 
1 1 1    1    8   42 o  285.281   8.4686   62.382   3.6979   58.358   5.1901   66.530   5.2700  275.690   12.299  294.408   11.695 -18.71759 16.97193 
1 1 1    1    8   43 o  241.548   9.5062   44.752   3.5146   47.590   5.0113   42.005   4.9306  248.483   13.224  233.320   13.869 15.16296 19.16256 
1 1 1    1    8   44 o  279.203   8.7890   59.789   3.7560   65.435   5.6373   55.281   5.0370  291.755   12.624  268.197   12.270 23.55728 17.60416 
1 1 1    1    8   45 o  319.296   9.1271   78.228   4.4606   76.363   5.6261   81.383   7.3193  315.209   11.661  324.995   14.714 -9.786194 18.77444 
1 1 1    1    8   46 f  358.736   7.9991   98.711   4.3923  101.150   7.0562   97.169   5.6121  362.519   12.717  355.658   10.309 6.861145 16.37037 
1 1 1    1    8   47 o  256.371   9.8876   50.495   3.8800   52.000   6.2997   49.575   4.9249  258.887   15.976  253.711   12.682 5.176239 20.39773 
1 1 1    1    8   48 o  432.000   7.4476  143.175   4.9246  141.737   7.8247  144.119   6.3371  429.010   11.916  433.080   9.5598 -4.069916 15.27680 
1 1 1    1    8   49 o  247.172   9.5144   46.966   3.5996   50.706   5.2846   43.729   4.9164  255.893   13.540  237.577   13.576 18.31587 19.17442 
1 1 1    1    8   50 o   50.493   22.842  -1.9148   3.7815   4.2551   6.7493  -4.7379   4.5654   88.030   34.466   49.511   23.319 38.51961 41.61360 
1 1 1    1    8   51 o  540.828   7.1160  224.547   5.8907  251.083   9.8929  209.971   7.3322  570.536   11.328  522.445   9.1690 48.09064 14.57412 
1 1 1    1    8   52 o  394.019   8.1890  119.342   4.9388  124.459   6.3785  111.684   7.8040  401.841   10.370  379.753   13.426 22.08771 16.96479 
1 1 1    1    8   53 o  197.717   11.929   30.328   3.5932   28.641   5.0882   32.007   5.0750  190.583   17.643  201.894   16.569 -11.31134 24.20289 
1 1 1    1    8   54 o  169.668   14.318   22.530   3.6836   19.683   5.4243   24.966   5.0182  155.580   23.512  177.318   18.775 -21.73773 30.08819 
1 1 1    1    8   55 o  126.255   19.354   12.839   3.6209   16.406   5.3010   9.7186   4.9576  140.792   25.539  107.099   29.365 33.69318 38.91681 
1 1 1    1    8   56 o   79.123   25.868   4.9731   3.6070   2.5441   5.0678   7.4671   5.1350   73.217   29.470   95.177   30.851 -21.96038 42.66477 
1 1 1    1    8   57 o  166.905   15.966   22.029   4.0291   21.551   5.2918   22.689   6.2148  162.873   21.772  165.568   25.329 -2.695190 33.39989 
1 1 1    1    8   58 o   72.945   27.156   3.6344   4.0561   4.9606   6.3149   2.7029   5.2921   86.518   33.487   74.344   30.048 12.17424 44.99148 
1 1 1    1    8   59 o  247.837   11.218   47.697   4.2556   51.258   6.0485   44.205   5.9885  254.785   15.585  236.010   16.685 18.77531 22.83131 
1 1 1    1    8   60 o  226.017   12.998   40.077   4.4776   40.534   6.1390   39.558   6.5450  224.823   17.990  221.192   19.532 3.631226 26.55498 
1 1 1    1    8   61 o  124.128   22.049   12.924   4.0358   16.038   5.5858   9.5224   5.8373  135.397   27.882  102.842   32.847 32.55484 43.08537 
1 1 1    1    8   62 o   95.542   27.072   8.0589   4.1397   9.9283   6.8749   6.9955   5.1851  103.796   35.733   89.987   31.030 13.80982 47.32545 
1 1 1    1    8   63 o   76.986   25.782   5.0169   3.5762   6.1644   4.8624   3.6648   5.2782   84.734   29.990   75.167   30.139 9.566811 42.51771 
1 1 1    1    8   64 o   48.902   22.182  -1.2794   3.5949   4.5927   5.1216  -6.9816   5.0470   77.381   30.099   46.555   22.597 30.82654 37.63778 
1 1 1    1    8   65 o  100.497   23.795   9.0448   3.6036   11.487   5.0447   6.5005   5.1494  109.690   29.434   84.643   30.752 25.04646 42.56780 
1 1 1    1    9    2 f  864.257   9.2546  571.868   12.243  530.531   16.218  626.623   18.666  832.289   12.731  904.487   13.483 -72.19812 18.54334 
1 1 1    1    9    3 o  1897.21   13.939  2757.17   40.478  2770.12   49.875  2732.18   69.285  1901.22   17.139  1886.93   23.989 14.29419 29.48265 
1 1 1    1    9    4 o  344.683   4.7266   90.934   2.4937   91.091   3.5364   90.778   3.5168  344.963   6.6976  344.369   6.6720 0.5936584 9.453759 
1 1 1    1    9    5 o  288.409   4.8445   63.666   2.1386   63.567   3.0019   63.768   3.0475  288.170   6.8057  288.623   6.8983 -0.4529419 9.690438 
1 1 1    1    9    6 o  529.109   5.1763  214.283   4.1921  220.297   6.0413  208.697   5.8219  536.447   7.3575  522.133   7.2848 14.31403 10.35379 
1 1 1    1    9    7 o  784.236   6.1722  470.780   7.4089  462.975   10.329  479.051   10.633  777.635   8.6779  791.017   8.7823 -13.38171 12.34642 
1 1 1    1    9    8 o  442.051   5.8027  149.576   3.9262  160.279   7.0460  144.756   4.7283  457.512   10.062  434.850   7.1039 22.66183 12.31679 
1 1 1    1    9    9 o  765.171   8.6291  448.266   10.106  447.050   14.248  449.497   14.338  763.976   12.184  766.062   12.228 -2.085693 17.26192 
1 1 1    1    9   10 o  794.569   6.2892  483.285   7.6489  494.532   11.023  472.841   10.623  803.664   8.9607  785.847   8.8313 17.81738 12.58121 
1 1 1    1    9   11 o  507.743   5.3207  197.335   4.1351  195.164   5.8077  199.567   5.8889  504.898   7.5150  510.560   7.5355 -5.662628 10.64236 
1 1 1    1    9   12 o  157.469   6.9971   18.984   1.6865   20.401   2.4124   17.629   2.3587  162.927   9.7176  151.371   10.241 11.55673 14.11738 
1 1 1    1    9   13 f  204.915   6.3271   32.145   1.9845   35.872   2.8369   28.573   2.7770  216.442   8.5632  193.161   9.3926 23.28130 12.71020 
1 1 1    1    9   14 o   83.714   13.100   5.4997   1.6235   4.9344   2.3240   6.0386   2.2690   78.627   19.424   87.159   17.614 -8.531197 26.22105 
1 1 1    1    9   15 o  307.433   5.8614   72.356   2.7582   74.501   3.9426   70.299   3.8600  311.910   8.2581  302.986   8.3234 8.924042 11.72496 
1 1 1    1    9   16 o  230.854   5.7291   40.799   2.0244   41.316   2.5490   39.914   3.3314  232.294   7.1690  228.276   9.5344 4.017685 11.92895 
1 1 1    1    9   17 o  971.068   5.9738  721.917   8.8791  720.417   12.525  723.433   12.589  969.894   8.4370  971.920   8.4623 -2.026245 11.94965 
1 1 1    1    9   18 o  500.802   5.7208  192.002   4.3852  196.916   6.2462  187.225   6.1581  507.094   8.0474  494.456   8.1367 12.63831 11.44406 
1 1 1    1    9   19 o  1108.47   7.2148  940.786   12.241  934.354   15.639  950.958   19.667  1104.51   9.2509  1114.04   11.534 -9.531372 14.78555 
1 1 1    1    9   20 o  413.771   5.5204  131.060   3.4962  128.171   5.6409  132.862   4.4551  409.098   9.0085  416.573   6.9871 -7.475311 11.40056 
1 1 1    1    9   21 o  672.836   5.2246  346.537   5.3806  338.532   7.4799  355.120   7.7457  664.952   7.3491  681.045   7.4304 -16.09326 10.45088 
1 1 1    1    9   22 o  680.958   5.3054  354.948   5.5298  356.000   7.8377  353.905   7.8032  681.901   7.5092  679.891   7.4983 2.009460 10.61193 
1 1 1    1    9   23 o  529.269   5.0865  214.418   4.1207  211.004   5.8742  217.726   5.7819  524.994   7.3101  533.296   7.0833 -8.302246 10.17895 
1 1 1    1    9   24 o  755.969   5.0974  437.432   5.8982  430.622   7.8079  446.483   9.0015  750.018   6.8013  763.678   7.7008 -13.65967 10.27426 
1 1 1    1    9   25 o  242.527   6.2037   45.024   2.3029   41.723   3.8894   46.807   2.8577  233.418   10.886  247.268   7.5506 -13.85059 13.24838 
1 1 1    1    9   26 o  1522.91   7.8573  1775.53   18.315  1760.11   23.970  1797.16   28.392  1516.11   10.329  1531.83   12.109 -15.71924 15.91608 
1 1 1    1    9   27 o  534.900   5.1432  219.000   4.2109  215.362   5.4443  224.417   6.6432  530.413   6.7059  541.422   8.0163 -11.00903 10.45134 
1 1 1    1    9   28 o   39.432   17.095  -0.3080   1.9076   0.1878   2.6362  -0.8530   2.7640   49.069   20.645   45.814   20.202 3.255028 28.88486 
1 1 1    1    9   29 o  339.883   5.6420   88.426   2.9352   82.438   4.0492   95.056   4.2609  328.143   8.0618  352.365   7.9001 -24.22153 11.28737 
1 1 1    1    9   30 o  791.316   5.2978  479.307   6.4167  486.993   9.1611  471.904   8.9906  797.567   7.5043  785.115   7.4814 12.45245 10.59653 
1 1 1    1    9   31 o  689.904   5.5683  364.339   5.8800  359.571   8.8350  368.131   7.8782  685.285   8.4230  693.430   7.4226 -8.145264 11.22684 
1 1 1    1    9   32 o  344.623   7.0517   90.925   3.7197   89.140   5.1971   92.799   5.3262  341.164   9.9523  348.096   9.9966 -6.931763 14.10605 
1 1 1    1    9   33 o  781.641   6.0150  467.708   7.1964  474.148   9.4856  458.975   11.046  786.927   7.8752  774.160   9.3220 12.76660 12.20319 
1 1 1    1    9   34 o  260.463   10.144   51.964   4.0442   46.293   5.6330   57.996   5.8098  245.253   15.079  274.717   13.861 -29.46384 20.48197 
1 1 1    1    9   35 o  616.146   6.2480  290.643   5.8924  290.384   7.6418  291.024   9.2540  615.797   8.1075  616.391   9.8085 -0.5942993 12.72552 
1 1 1    1    9   36 o  322.912   7.5554   79.846   3.7343   84.090   5.2325   75.440   5.3311  331.302   10.319  313.774   11.100 17.52835 15.15543 
1 1 1    1    9   37 o  424.715   6.7660  138.120   4.3984  142.263   6.0385  133.436   6.4196  430.948   9.1545  417.325   10.050 13.62384 13.59433 
1 1 1    1    9   38 o  121.009   24.821   11.702   4.4432   10.659   6.9579   12.420   5.7737  116.833   35.652  124.226   30.572 -7.392891 46.96546 
1 1 1    1    9   39 o  425.501   7.4847  138.675   4.8747  138.375   6.2278  139.149   7.8325  424.929   9.5752  425.952   12.014 -1.023071 15.36265 
1 1 1    1    9   40 o  430.258   7.3648  141.808   4.8502  140.395   6.1834  144.066   7.8196  427.982   9.4391  433.357   11.789 -5.374268 15.10206 
1 1 1    1    9   41 o  432.490   6.6190  143.274   4.3817  146.846   6.2015  139.713   6.1918  437.667   9.2572  426.888   9.4762 10.77887 13.24744 
1 1 1    1    9   42 o  371.076   7.0224  105.500   3.9886  101.796   5.5756  109.381   5.7081  364.296   9.9993  377.636   9.8752 -13.33972 14.05365 
1 1 1    1    9   43 o  211.709   10.477   34.399   3.3950   33.080   4.8911   35.626   4.7161  206.682   15.575  214.702   14.435 -8.020233 21.23571 
1 1 1    1    9   44 o  629.706   6.6289  303.859   6.3892  302.924   8.9753  304.820   9.0975  628.342   9.3322  630.287   9.4300 -1.945801 13.26704 
1 1 1    1    9   45 o  223.135   11.915   38.388   4.0547   26.942   5.4805   52.230   6.0268  185.477   19.602  259.825   15.221 -74.34805 24.81714 
1 1 1    1    9   46 f  148.812   14.869   17.250   3.3415   13.678   5.2205   19.730   4.3492  129.660   27.174  158.595   18.249 -28.93503 32.73306 
1 1 1    1    9   47 o  457.551   6.6432  160.510   4.6525  149.033   6.5440  172.240   6.6158  440.441   9.7070  473.597   9.1265 -33.15649 13.32364 
1 1 1    1    9   48 o  197.322   12.436   30.125   3.7368   29.507   6.2856   30.462   4.6472  193.179   21.629  197.847   15.469 -4.668411 26.59139 
1 1 1    1    9   49 o  258.188   10.663   51.313   4.2140   48.230   6.7141   53.317   5.4130  248.436   17.774  262.383   13.524 -13.94731 22.33419 
1 1 1    1    9   50 o  481.242   7.6897  177.841   5.6643  182.089   10.126  175.907   6.8334  485.206   13.635  478.236   9.3352 6.969727 16.52425 
1 1 1    1    9   51 o  157.772   15.209   19.497   3.6273   22.314   4.5232   14.421   6.0716  168.194   17.842  130.997   30.800 37.19690 35.59431 
1 1 1    1    9   52 o   69.863   23.940   3.6076   3.0843   3.3661   4.3489   3.8520   4.3749   73.955   27.996   76.330   28.245 -2.374512 39.76897 
1 1 1    1    9   53 f  216.093   10.711   36.037   3.5428   34.853   5.0085   37.222   5.0120  210.985   15.620  218.233   15.097 -7.248428 21.72375 
1 1 1    1    9   54 o  206.628   11.609   33.122   3.6566   38.373   5.1877   27.936   5.1550  221.359   15.407  187.835   18.156 33.52371 23.81255 
1 1 1    1    9   55 o  256.894   10.307   50.961   4.0527   56.759   5.9454   45.929   5.5389  269.586   14.461  242.235   15.013 27.35089 20.84483 
1 1 1    1    9   56 o  164.382   14.698   21.246   3.6592   27.169   5.0373   14.629   5.3244  184.884   18.030  131.751   27.300 53.13300 32.71621 
1 1 1    1    9   57 o  134.065   19.568   14.536   3.8970   11.575   4.9784   19.220   6.2624  116.345   28.241  150.734   28.179 -34.38842 39.89497 
1 1 1    1    9   58 o   85.413   26.750   6.0491   3.8880  -0.0866   5.7071   11.363   5.3110   67.358   29.382  114.324   29.981 -46.96629 41.97837 
1 1 1    1    9   59 o  111.326   23.684   10.446   3.9117   4.8580   5.0947   18.471   6.1055   81.713   30.432  146.635   28.227 -64.92157 41.50762 
1 1 1    1    9   60 f   90.721   25.766   7.0677   3.7454   5.3557   5.0607   9.1413   5.5695   83.269   30.450  101.646   32.045 -18.37792 44.20473 
1 1 1    1    9   61 o  139.841   21.314   16.260   4.4179   17.863   8.2846   15.623   5.2225  135.953   38.219  134.348   26.338 1.605713 46.41548 
1 1 1    1    9   62 o  151.243   19.803   18.886   4.4742   15.465   5.5950   24.953   7.4517  131.626   28.589  166.800   30.303 -35.17412 41.66086 
1 1 1    1    9   63 o  148.632   17.830   18.137   3.9753   22.264   5.7218   14.286   5.5272  160.777   23.985  124.678   29.435 36.09872 37.96952 
1 1 1    1    9   64 o  144.701   19.094   17.512   4.1257   9.7305   6.3666   23.146   5.4170   99.684   34.383  164.420   22.083 -64.73650 40.86370 
1 1 1    1    9   65 o  110.525   21.889   10.682   3.5721   17.631   5.0713   3.8387   5.0324  140.799   24.417   73.238   29.406 67.56091 38.22169 
1 1 1    1   10    2 o  267.859   9.6404   54.935   3.9525   0.0000   0.0000   54.935   3.9525  ?   ?   267.859   9.6404 0.000000 9.640383 
1 1 1    1   10    3 o  957.728   8.0667  702.209   11.825  715.929   14.782  677.823   19.707  966.955   9.9875  940.662   13.687 26.29303 16.94396 
1 1 1    1   10    4 o  363.040   4.8664  100.879   2.7041   97.659   3.7965  104.195   3.8526  357.177   6.9443  368.936   6.8223 -11.75977 9.734821 
1 1 1    1   10    5 o  1464.42   11.150  1642.30   24.993  1614.09   42.414  1657.31   30.934  1450.87   19.099  1470.85   13.740 -19.97595 23.52797 
1 1 1    1   10    6 o  1213.22   11.749  1127.31   21.818  1146.33   31.439  1109.63   30.304  1222.94   16.795  1203.24   16.454 19.70154 23.51246 
1 1 1    1   10    7 o  1377.65   13.023  1453.88   27.460  1487.97   39.844  1423.03   37.898  1393.01   18.687  1362.34   18.174 30.66455 26.06751 
1 1 1    1   10    8 o  554.435   6.2001  235.309   5.2616  234.355   6.4172  237.266   9.1911  553.278   7.5776  556.608   10.788 -3.329773 13.18345 
1 1 1    1   10    9 o  472.150   5.1904  170.637   3.7510  170.223   5.2778  171.058   5.3322  471.539   7.3124  472.693   7.3698 -1.153992 10.38197 
1 1 1    1   10   10 o  472.461   5.2616  170.864   3.8050  167.808   5.2896  174.141   5.4774  468.174   7.3815  476.925   7.5033 -8.750397 10.52550 
1 1 1    1   10   11 o  394.901   5.2165  119.371   3.1531  121.805   4.4759  116.973   4.4425  398.869   7.3314  390.876   7.4253 7.993835 10.43477 
1 1 1    1   10   12 o  709.398   6.0712  385.250   6.5923  376.883   9.1311  394.360   9.5273  701.556   8.5034  717.630   8.6736 -16.07391 12.14653 
1 1 1    1   10   13 o  730.953   6.1937  409.035   6.9296  406.626   9.7624  411.482   9.8379  728.679   8.7529  733.015   8.7684 -4.336731 12.38945 
1 1 1    1   10   14 o  311.280   5.7745   74.177   2.7513   69.944   3.7904   78.891   3.9998  302.222   8.1939  320.972   8.1415 -18.75009 11.55089 
1 1 1    1   10   15 o  735.591   6.3022  414.260   7.0957  407.567   9.9011  421.328   10.174  729.492   8.8674  741.700   8.9619 -12.20764 12.60740 
1 1 1    1   10   16 o  999.002   10.592  764.601   16.196  764.601   16.196   0.0000   0.0000  999.002   10.592  ?   ?  0.000000 10.59211 
1 1 1    1   10   17 o  655.559   8.8151  329.138   8.8453  333.829   12.553  324.512   12.466  659.979   12.427  650.697   12.516 9.282104 17.63713 
1 1 1    1   10   18 o  986.687   6.6920  745.372   10.107  757.020   13.195  728.841   15.720  994.231   8.6708  975.394   10.529 18.83649 13.63980 
1 1 1    1   10   19 o  239.314   6.4407   43.846   2.3592   42.386   3.9825   44.635   2.9283  235.216   11.062  241.438   7.9240 -6.221893 13.60709 
1 1 1    1   10   20 o  240.961   6.5684   44.451   2.4226   41.509   4.0232   46.124   3.0344  232.775   11.292  245.434   8.0772 -12.65897 13.88327 
1 1 1    1   10   21 o  1167.18   6.8838  1042.93   12.298  1038.27   17.295  1047.69   17.490  1164.38   9.7041  1169.64   9.7696 -5.266357 13.77009 
1 1 1    1   10   22 o  428.234   5.0913  140.369   3.3372  134.690   4.6597  146.350   4.7817  419.446   7.2579  437.227   7.1451 -17.78049 10.18476 
1 1 1    1   10   23 o  499.272   5.5390  190.805   4.2329  182.397   5.4381  203.730   6.7425  488.116   7.2787  515.844   8.5395 -27.72729 11.22062 
1 1 1    1   10   24 o  777.599   6.7702  462.868   8.0579  460.772   11.385  464.972   11.407  775.742   9.5880  779.270   9.5633 -3.528625 13.54200 
1 1 1    1   10   25 o  646.606   5.4932  320.027   5.4366  324.802   7.7790  315.467   7.6013  651.362   7.8024  641.934   7.7362 9.427246 10.98755 
1 1 1    1   10   26 o  952.490   6.3394  694.463   9.2422  694.073   13.067  694.854   13.074  952.126   8.9663  952.661   8.9660 -0.5356445 12.68004 
1 1 1    1   10   27 o  346.878   5.2159   92.099   2.7694   86.303   3.8483   98.324   3.9884  335.761   7.4880  358.386   7.2707 -22.62460 10.43714 
1 1 1    1   10   28 o  1083.27   5.9125  898.247   9.8034  905.831   13.956  890.861   13.774  1087.73   8.3826  1078.70   8.3421 9.023804 11.82622 
1 1 1    1   10   29 o  141.956   10.252   15.512   2.2125   14.821   3.1498   16.185   3.1085  138.245   15.133  144.645   14.224 -6.399826 20.76857 
1 1 1    1   10   30 o  1622.32   7.8213  2015.04   19.422  2002.66   27.258  2027.81   27.680  1617.03   11.013  1627.14   11.114 -10.11096 15.64635 
1 1 1    1   10   31 o  831.656   6.2412  529.471   7.9448  528.873   11.119  530.094   11.356  831.080   8.7406  832.030   8.9172 -0.9503174 12.48658 
1 1 1    1   10   32 o  291.244   7.5235   64.943   3.3538   66.411   4.2894   62.634   5.3799  294.481   9.5163  285.919   12.293 8.561218 15.54603 
1 1 1    1   10   33 o  794.794   6.6525  483.617   8.0930  472.610   11.274  495.318   11.624  785.562   9.3766  804.208   9.4433 -18.64630 13.30776 
1 1 1    1   10   34 o  813.549   6.1359  506.697   7.6407  494.237   9.8165  525.846   12.170  803.395   7.9829  828.586   9.5959 -25.19092 12.48226 
1 1 1    1   10   35 o  390.575   6.5551  116.795   3.9188  112.137   5.4048  121.958   5.6903  382.632   9.2284  399.033   9.3167 -16.40079 13.11349 
1 1 1    1   10   36 o  227.884   9.6653   39.782   3.3713   43.669   4.6709   35.556   4.8709  238.322   12.852  214.782   14.909 23.54021 19.68372 
1 1 1    1   10   37 o  276.331   8.7893   58.491   3.7175   59.045   5.2173   57.920   5.2984  277.515   12.283  274.847   12.594 2.668060 17.59212 
1 1 1    1   10   38 o  373.608   7.6979  106.911   4.4021  118.060   7.3026  100.547   5.5172  392.371   12.159  362.220   9.9512 30.15073 15.71224 
1 1 1    1   10   39 o  314.458   8.6794   75.767   4.1775   73.909   5.4045   78.525   6.5846  310.447   11.374  319.865   13.449 -9.418365 17.61363 
1 1 1    1   10   40 o  443.111   6.5106  150.383   4.4157  149.182   6.2396  151.589   6.2499  441.165   9.2403  444.714   9.1818 -3.548981 13.02645 
1 1 1    1   10   41 o  333.011   7.5426   84.972   3.8446   91.095   5.4991   79.117   5.3772  344.615   10.425  321.124   10.940 23.49158 15.11177 
1 1 1    1   10   42 o  313.102   7.6895   75.132   3.6851   70.887   5.1941   79.435   5.2293  303.890   11.167  321.738   10.619 -17.84808 15.40939 
1 1 1    1   10   43 f  293.142   8.3227   65.889   3.7343   62.955   5.5107   68.380   5.0781  286.197   12.580  298.413   11.118 -12.21524 16.78839 
1 1 1    1   10   44 o  177.140   12.915   24.263   3.4777   17.240   5.3130   29.527   4.6001  146.891   24.493  195.104   15.533 -48.21367 29.00283 
1 1 1    1   10   45 o  252.234   10.597   48.876   4.0913   46.065   5.7015   51.860   5.8744  243.894   15.351  258.923   14.885 -15.02916 21.38285 
1 1 1    1   10   46 o  543.995   6.8010  226.879   5.6628  214.784   8.9546  234.939   7.3102  528.533   11.069  553.278   8.6321 -24.74536 14.03689 
1 1 1    1   10   47 o   81.894   24.378   5.3385   3.2829   4.9709   5.5446   5.5368   4.0737   86.759   31.850   84.765   27.479 1.994110 42.06591 
1 1 1    1   10   48 o  273.672   8.6040   57.521   3.6041   50.552   5.0835   64.564   5.1106  255.655   13.034  289.540   11.532 -33.88455 17.40314 
1 1 1    1   10   49 o  409.440   7.3099  128.661   4.5811  128.574   6.5067  128.747   6.4510  408.711   10.401  409.008   10.304 -0.2969055 14.64114 
1 1 1    1   10   50 o  139.223   17.507   15.326   3.6482   13.982   6.3945   15.974   4.4421  128.802   32.450  141.172   21.213 -12.36978 38.76850 
1 1 1    1   10   51 o   46.082   21.154  -2.3072   3.3991  -2.0092   4.2452  -2.8395   5.6738   53.648   24.241   61.242   27.814 -7.594021 36.89513 
1 1 1    1   10   52 o  433.338   6.9281  144.187   4.5952  159.195   6.7125  130.951   6.3040  454.630   9.6462  412.237   9.9909 42.39307 13.88761 
1 1 1    1   10   53 f  165.311   12.996   21.302   3.2619   25.131   4.6613   17.627   4.5662  178.465   17.280  148.137   20.704 30.32878 26.96810 
1 1 1    1   10   54 o   38.863   18.556  -3.9695   3.0887  -0.8955   4.3124  -7.2075   4.4260   57.131   25.211   43.510   21.129 13.62100 32.89389 
1 1 1    1   10   55 o   82.866   24.906   5.6241   3.4144   2.9212   4.5754   9.0210   5.1293   72.486   28.378  103.237   30.407 -30.75094 41.59269 
1 1 1    1   10   56 o   51.376   22.550  -0.5726   3.4082  -3.4090   4.3458   3.9595   5.4933   50.315   23.387   80.377   31.198 -30.06210 38.99057 
1 1 1    1   10   57 o   94.500   26.839   7.5440   4.0638   8.1424   5.6913   6.9215   5.8046   98.625   32.506   93.272   32.793 5.352409 46.17362 
1 1 1    1   10   58 o  196.959   13.449   30.415   4.0302   29.612   5.2071   31.615   6.3648  192.591   17.867  197.320   21.418 -4.728333 27.89207 
1 1 1    1   10   59 o  157.038   15.507   19.603   3.6787   26.944   5.1826   12.148   5.2224  182.864   18.783  117.833   29.123 65.03074 34.65462 
1 1 1    1   10   60 o   59.784   24.969   1.1109   3.8122   4.7616   5.3911  -2.5403   5.3914   81.474   31.092   58.465   26.766 23.00932 41.02612 
1 1 1    1   10   61 o   89.854   27.326   7.0289   4.0926  -0.1086   7.0158   10.710   5.0387   72.128   31.976  109.283   29.455 -37.15467 43.47460 
1 1 1    1   10   62 o   50.697   23.455  -2.6334   4.2962   2.8777   4.8807 -21.5959   9.0533   71.182   28.826   52.453   26.289 18.72853 39.01355 
1 1 1    1   10   63 o  100.684   24.658   8.9903   3.7698   3.5642   5.6187   13.433   5.0840   75.451   30.789  121.523   27.919 -46.07234 41.56200 
1 1 1    1   10   64 o   78.477   26.275   5.4198   3.7143   8.9077   5.4916   2.4789   5.0427   96.280   31.940   68.840   28.731 27.44022 42.96081 
1 1 1    1   11    2 o  269.311   10.016   55.538   4.1287   0.0000   0.0000   55.538   4.1287  ?   ?   269.311   10.016 0.000000 10.01593 
1 1 1    1   11    3 o  1275.91   17.303  1247.98   33.792  1247.98   33.792   0.0000   0.0000  1275.91   17.303  ?   ?  0.000000 17.30312 
1 1 1    1   11    4 o  846.156   7.5302  548.127   9.7528  572.018   12.376  508.979   15.842  864.324   9.3547  815.135   12.697 49.18848 15.77137 
1 1 1    1   11    5 o  719.167   6.8731  395.931   7.5657  393.125   9.2032  401.781   13.288  716.565   8.3910  724.254   11.986 -7.689575 14.63155 
1 1 1    1   11    6 f  818.104   6.3868  512.347   7.9976  510.487   11.278  514.229   11.343  816.516   9.0243  819.502   9.0425 -2.986145 12.77516 
1 1 1    1   11    7 o  963.416   7.0854  710.569   10.448  705.016   14.666  716.291   14.889  959.493   9.9864  967.130   10.058 -7.637756 14.17343 
1 1 1    1   11    8 o  150.995   6.7415   17.454   1.5581   17.380   2.1976   17.529   2.2093  150.345   9.5999  150.990   9.6096 -0.6446838 13.58318 
1 1 1    1   11    9 o  797.135   6.3667  486.439   7.7682  476.840   10.779  496.811   11.205  789.121   8.9242  805.468   9.0885 -16.34741 12.73743 
1 1 1    1   11   10 o  789.664   6.3653  477.373   7.6936  474.804   10.826  479.994   10.935  787.416   8.9828  791.706   9.0240 -4.289490 12.73273 
1 1 1    1   11   11 o  1133.19   8.0061  983.266   13.886  976.207   19.467  990.580   19.814  1128.82   11.267  1137.08   11.385 -8.266846 16.01733 
1 1 1    1   11   12 f   98.212   10.771   7.4780   1.5927   7.4320   2.2514   7.5242   2.2534   97.221   15.661   97.848   15.567 -0.6275558 22.08184 
1 1 1    1   11   13 o  748.524   6.3047  428.952   7.2234  428.781   10.181  429.124   10.250  748.243   8.8893  748.538   8.9467 -0.2953491 12.61195 
1 1 1    1   11   14 o  1115.77   7.9886  953.346   13.643  951.870   19.255  954.834   19.334  1114.57   11.287  1116.30   11.315 -1.730347 15.98197 
1 1 1    1   11   15 o  668.262   8.7463  342.014   8.9462  349.264   12.827  335.147   12.484  675.062   12.414  661.284   12.334 13.77771 17.49922 
1 1 1    1   11   16 o  724.379   9.0427  401.881   10.026  402.628   14.121  401.122   14.238  724.784   12.729  723.416   12.858 1.367676 18.09319 
1 1 1    1   11   17 o  548.914   6.0146  230.667   5.0534  235.652   7.1938  225.812   7.1002  554.726   8.4725  543.018   8.5425 11.70825 12.03153 
1 1 1    1   11   18 o  186.231   8.5255   26.559   2.4302   24.896   3.4193   28.255   3.4546  179.814   12.501  191.670   11.833 -11.85579 17.21347 
1 1 1    1   11   19 o  498.218   6.1930  190.023   4.7227  190.471   6.6537  189.567   6.7043  498.735   8.7162  497.547   8.8034 1.187622 12.38833 
1 1 1    1   11   20 o  514.409   4.9653  202.549   3.9095  199.075   5.4780  206.155   5.5813  509.935   7.0184  518.924   7.0269 -8.988464 9.931505 
1 1 1    1   11   21 o  379.534   5.1056  110.259   2.9660  110.976   4.2163  109.556   4.1730  380.736   7.2350  378.293   7.2070 2.443817 10.21205 
1 1 1    1   11   22 o  382.278   9.6126  111.899   5.6246  111.899   5.6246   0.0000   0.0000  382.278   9.6126  ?   ?  0.000000 9.612585 
1 1 1    1   11   23 o  645.563   6.3277  319.014   6.2525  327.133   9.0358  311.556   8.6608  653.654   9.0313  637.906   8.8702 15.74780 12.65876 
1 1 1    1   11   24 f  448.944   5.3766  154.272   3.6946  157.358   5.3132  151.383   5.1410  453.377   7.6565  444.689   7.5530 8.688171 10.75496 
1 1 1    1   11   25 o  553.227   5.4199  234.267   4.5895  230.960   6.4653  237.626   6.5161  549.268   7.6901  557.138   7.6411 -7.870483 10.84084 
1 1 1    1   11   26 o  826.498   6.0035  522.883   7.5949  510.674   10.503  536.266   10.996  816.719   8.4015  836.927   8.5836 -20.20782 12.01096 
1 1 1    1   11   27 o  534.230   5.7455  218.461   4.6981  214.538   6.5628  222.585   6.7286  529.365   8.0997  539.200   8.1528 -9.835510 11.49226 
1 1 1    1   11   28 o  296.674   7.2619   67.380   3.2976   67.027   4.7169   67.717   4.6120  295.848   10.416  297.373   10.132 -1.525055 14.53157 
1 1 1    1   11   29 o  795.795   5.6709  484.761   6.9075  479.314   10.609  488.770   9.1008  791.202   8.7603  799.021   7.4413 -7.819031 11.49417 
1 1 1    1   11   30 o  767.766   7.0350  451.274   8.2673  448.103   11.572  454.579   11.815  764.942   9.8833  770.443   10.019 -5.501343 14.07365 
1 1 1    1   11   31 o  921.038   8.0906  649.527   11.406  655.365   12.958  629.447   24.032  925.108   9.1514  905.932   17.331 19.17554 19.59874 
1 1 1    1   11   32 o  828.203   6.5611  525.117   8.3173  513.829   9.7565  555.139   15.911  819.198   7.7810  851.202   12.212 -32.00446 14.48043 
1 1 1    1   11   33 o  425.462   6.6232  138.586   4.3132  140.117   6.6821  137.492   5.6472  427.699   10.207  423.724   8.7073 3.974976 13.41655 
1 1 1    1   11   34 o  407.010   6.2007  126.824   3.8629  127.993   5.4163  125.613   5.5110  408.815   8.6558  404.989   8.8903 3.825897 12.40806 
1 1 1    1   11   35 o  861.493   5.8517  568.186   7.7161  563.300   10.812  573.257   11.016  857.639   8.2362  865.180   8.3182 -7.541321 11.70588 
1 1 1    1   11   36 o  268.460   8.4709   55.200   3.4808   61.894   4.9342   48.569   4.9111  284.183   11.343  251.365   12.807 32.81790 17.10818 
1 1 1    1   11   37 o  449.903   7.2074  155.011   4.9633  155.721   8.5731  154.653   6.0871  450.641   12.429  449.309   8.8511 1.332306 15.25849 
1 1 1    1   11   38 o  397.933   7.4296  121.286   4.5253  119.751   7.2514  122.265   5.7914  395.152   11.989  399.435   9.4725 -4.283112 15.27968 
1 1 1    1   11   39 o  476.455   6.9489  173.875   5.0677  172.703   6.4983  175.695   8.0956  474.719   8.9433  478.644   11.050 -3.925018 14.21576 
1 1 1    1   11   40 o  245.977   8.8063   46.375   3.3156   44.496   4.6704   48.284   4.7076  240.411   12.738  250.811   12.263 -10.39983 17.68102 
1 1 1    1   11   41 o  493.450   6.2313  186.509   4.7064  184.595   6.5830  188.511   6.7314  490.704   8.7646  495.871   8.8688 -5.167145 12.46889 
1 1 1    1   11   42 o  244.086   9.9370   45.710   3.7125   46.496   5.9840   45.218   4.7337  245.174   16.034  242.234   12.813 2.940414 20.52451 
1 1 1    1   11   43 o  393.855   8.0424  118.936   4.8483  125.773   8.1061  115.128   6.0497  404.401   13.096  387.281   10.206 17.11996 16.60287 
1 1 1    1   11   44 o  196.083   11.602   29.653   3.4665   30.023   4.4861   29.106   5.4612  196.800   15.006  193.068   18.715 3.732254 23.98815 
1 1 1    1   11   45 o  221.372   12.206   37.816   4.1199   52.097   10.321   35.109   4.4934  256.404   26.689  213.018   13.857 43.38699 30.07139 
1 1 1    1   11   46 o  271.607   9.2776   56.650   3.8569   59.747   6.6589   55.087   4.7314  277.613   15.736  267.582   11.552 10.03134 19.52089 
1 1 1    1   11   47 o  278.020   8.1710   59.330   3.4771   62.059   5.0303   56.834   4.8118  283.920   11.575  271.706   11.570 12.21396 16.36619 
1 1 1    1   11   48 o  148.541   13.375   17.170   3.0083   21.652   4.2294   12.580   4.2796  166.221   16.857  124.677   23.282 41.54391 28.74386 
1 1 1    1   11   49 o  183.933   11.508   26.181   3.2236   26.424   4.7104   25.967   4.4211  183.618   16.951  182.242   16.012 1.376617 23.31772 
1 1 1    1   11   50 o  274.214   9.6368   57.873   4.0448   52.328   6.7057   61.045   5.0712  258.671   17.032  281.236   11.781 -22.56451 20.70909 
1 1 1    1   11   51 o  177.580   13.709   24.570   3.6975   25.483   4.5903   22.884   6.2395  180.066   16.851  167.904   25.044 12.16245 30.18538 
1 1 1    1   11   52 o  213.266   10.526   35.082   3.4361   37.462   4.8932   32.766   4.8261  219.113   14.675  204.617   15.525 14.49602 21.36310 
1 1 1    1   11   53 o  147.065   14.491   16.971   3.2196   16.489   4.6235   17.424   4.4860  142.757   21.855  147.298   20.449 -4.541656 29.92982 
1 1 1    1   11   54 o   83.880   23.451   5.7959   3.1281   12.701   4.4977  -0.6731   4.3535  123.871   24.590   58.076   25.489 65.79524 35.41656 
1 1 1    1   11   55 o  148.388   17.427   17.521   3.8828   14.525   4.8384   22.939   6.5077  132.360   24.793  166.381   26.438 -34.02106 36.24470 
1 1 1    1   11   56 o   59.446   24.384   1.2339   3.5474   4.4690   4.6458  -3.2898   5.4937   79.362   29.152   58.335   26.822 21.02661 39.61339 
1 1 1    1   11   57 o   64.069   25.282   2.1545   3.6574  -0.5444   5.3739   4.4832   4.9918   64.342   28.277   80.332   30.083 -15.99022 41.28648 
1 1 1    1   11   58 o   71.856   24.900   3.9504   3.3409   3.4736   4.7312   4.4247   4.7184   74.687   28.963   78.796   29.298 -4.109230 41.19808 
1 1 1    1   11   59 o   71.638   25.714   3.8223   3.5867   2.8722   4.8898   4.9288   5.2769   72.503   29.031   82.261   30.905 -9.757095 42.40175 
1 1 1    1   11   60 o   59.835   24.603   1.4165   3.6222   5.0379   5.4184  -1.5096   4.8706   82.521   31.247   57.787   26.052 24.73419 40.68254 
1 1 1    1   11   61 o   50.368   23.158  -2.2977   4.0956  -7.8523   6.8371   0.8109   5.1148   56.451   27.127   65.542   28.204 -9.091225 39.13222 
1 1 1    1   11   62 o   91.768   27.423   7.5128   4.1483   4.9639   5.2540   11.732   6.7599   80.401   30.691  110.302   35.360 -29.90159 46.82197 
1 1 1    1   11   63 o   63.296   24.826   2.5774   3.5064   3.6655   5.0443   1.5602   4.8774   73.716   29.496   65.514   27.848 8.201782 40.56559 
1 1 1    1   11   64 o   59.240   24.298   1.7681   3.5220  -0.5890   5.0555   3.9908   4.9093   59.415   26.686   73.820   29.240 -14.40469 39.58720 
1 1 1    1   12    2 o  760.617   12.343  443.192   14.370   0.0000   0.0000  443.192   14.370  ?   ?   760.617   12.343 0.000000 12.34299 
1 1 1    1   12    3 o  395.447   7.1833  119.718   4.3479  119.057   6.1614  120.374   6.1364  394.286   10.209  396.464   10.112 -2.178345 14.36964 
1 1 1    1   12    4 o  1219.47   9.6871  1138.80   18.081  1149.83   22.382  1118.10   30.678  1225.16   11.936  1207.61   16.597 17.55176 20.44319 
1 1 1    1   12    5 o  375.463   5.1238  107.908   2.9446  108.656   4.1365  107.139   4.1926  376.730   7.1735  374.089   7.3222 2.641724 10.25058 
1 1 1    1   12    6 o  353.853   5.1754   95.845   2.8031   94.324   3.9545   97.380   3.9740  351.000   7.3606  356.644   7.2799 -5.643860 10.35251 
1 1 1    1   12    7 o  920.935   6.9254  649.309   9.7621  655.183   13.929  643.639   13.686  924.924   9.8388  916.745   9.7532 8.178833 13.85378 
1 1 1    1   12    8 o  785.984   6.3449  472.939   7.6333  464.197   10.612  482.310   10.988  778.567   8.9050  793.605   9.0456 -15.03741 12.69341 
1 1 1    1   12    9 o  844.703   6.6228  546.270   8.5627  543.059   12.058  549.536   12.161  842.062   9.3556  847.067   9.3799 -5.004822 13.24800 
1 1 1    1   12   10 o  680.007   5.9752  353.998   6.2192  348.841   8.6999  359.388   8.8938  674.932   8.4214  685.057   8.4819 -10.12482 11.95251 
1 1 1    1   12   11 o  836.074   6.6358  535.181   8.4920  538.954   12.097  531.516   11.924  838.848   9.4217  833.044   9.3514 5.804077 13.27469 
1 1 1    1   12   12 o  566.218   5.7026  245.436   4.9422  245.117   6.9664  245.758   7.0126  565.766   8.0446  566.503   8.0874 -0.7368774 11.40703 
1 1 1    1   12   13 o  1004.93   7.4547  773.289   11.467  785.161   16.421  761.992   16.019  1012.35   10.597  997.313   10.494 15.03857 14.91405 
1 1 1    1   12   14 o  442.044   8.1598  149.636   5.5209  151.527   7.7301  147.668   7.8878  444.699   11.357  438.983   11.739 5.716675 16.33350 
1 1 1    1   12   15 o  610.505   6.9375  285.369   6.4828  294.865   11.526  280.976   7.8404  620.300   12.140  605.722   8.4566 14.57770 14.79489 
1 1 1    1   12   16 o  1098.87   8.0078  924.640   13.469  924.793   19.044  924.487   19.052  1098.66   11.324  1098.48   11.331 0.1823730 16.02001 
1 1 1    1   12   17 o  900.285   7.1503  620.552   9.8531  623.344   13.974  617.792   13.895  902.122   10.120  898.097   10.108 4.025513 14.30346 
1 1 1    1   12   18 o  153.345   9.8857   18.084   2.3080   15.972   3.2632   20.198   3.2647  143.558   15.076  161.805   13.300 -18.24713 20.10382 
1 1 1    1   12   19 o  435.577   6.3055  145.240   4.2039  144.382   5.9420  146.099   5.9485  434.230   8.9401  436.806   8.8971 -2.575470 12.61286 
1 1 1    1   12   20 o  248.879   7.7895   47.422   2.9673   46.579   4.2255   48.242   4.1680  246.609   11.194  250.978   10.850 -4.368988 15.58947 
1 1 1    1   12   21 o  745.120   6.7144  425.013   7.6577  460.362   11.261  394.606   10.444  775.390   9.4883  717.880   9.5052 57.50989 13.43043 
1 1 1    1   12   22 o  258.538   6.6749   51.167   2.6414   49.787   3.6827   52.629   3.7907  254.998   9.4355  262.174   9.4462 -7.175461 13.35137 
1 1 1    1   12   23 o  730.395   5.5207  408.341   6.1720  402.150   8.6295  414.824   8.8309  724.782   7.7788  736.114   7.8377 -11.33142 11.04260 
1 1 1    1   12   24 o  182.207   7.8594   25.416   2.1919   24.168   3.1207   26.631   3.0793  177.268   11.565  186.169   10.853 -8.900665 15.86014 
1 1 1    1   12   25 o  1479.61   8.3136  1676.06   18.828  1693.41   26.916  1659.45   26.347  1486.98   11.826  1472.01   11.694 14.97388 16.63118 
1 1 1    1   12   26 o  1107.93   6.8813  939.669   11.670  950.447   16.695  929.371   16.318  1114.12   9.7900  1101.71   9.6767 12.41541 13.76525 
1 1 1    1   12   27 o  1043.76   6.7355  833.979   10.761  825.992   15.087  842.248   15.352  1038.62   9.4905  1048.79   9.5631 -10.16626 13.47302 
1 1 1    1   12   28 o  1254.35   7.5320  1204.55   14.461  1191.52   20.170  1218.32   20.744  1247.34   10.565  1261.28   10.745 -13.93640 15.06866 
1 1 1    1   12   29 o  723.770   7.7351  401.060   8.5691  421.498   11.894  379.006   12.356  741.863   10.475  703.425   11.476 38.43787 15.53761 
1 1 1    1   12   30 o  104.186   22.410   8.6561   3.4676   9.4603   4.8582   7.8209   4.9509  108.926   28.727  100.252   29.959 8.674484 41.50631 
1 1 1    1   12   31 o  583.162   7.2790  260.370   6.4972  262.533   8.1107  256.495   10.854  585.516   9.0501  578.597   12.256 6.918884 15.23554 
1 1 1    1   12   32 o  540.204   7.7003  223.441   6.3670  240.536   11.106  215.073   7.7707  560.243   12.952  529.922   9.5803 30.32098 16.10989 
1 1 1    1   12   33 o  584.611   6.1398  261.647   5.4940  252.680   8.4718  268.155   7.2175  574.368   9.6365  591.770   7.9682 -17.40271 12.50419 
1 1 1    1   12   34 o  751.337   5.6959  432.159   6.5504  431.786   9.2645  432.531   9.2628  750.898   8.0606  751.546   8.0522 -0.6481323 11.39353 
1 1 1    1   12   35 o  147.254   13.161   16.757   2.9350   17.110   4.0300   16.359   4.2831  148.167   18.149  144.565   19.883 3.601730 26.92052 
1 1 1    1   12   36 o  146.782   13.873   16.673   3.0798   20.388   4.4282   13.192   4.2863  161.895   18.185  129.060   22.517 32.83430 28.94300 
1 1 1    1   12   37 o  360.257   7.6434   99.406   4.2147   97.552   6.8177  100.552   5.3621  356.644   12.489  362.242   9.6709 -5.597839 15.79570 
1 1 1    1   12   38 o  228.169   10.380   39.911   3.6250   45.456   4.6481   31.303   5.7915  243.087   12.535  200.775   19.075 42.31149 22.82488 
1 1 1    1   12   39 o  737.805   5.8502  416.864   6.6067  410.213   9.2818  423.694   9.4059  731.666   8.2880  743.594   8.2640 -11.92865 11.70410 
1 1 1    1   12   40 o  257.071   9.2045   50.666   3.6218   48.750   5.7622   51.917   4.6566  251.349   15.047  260.085   11.697 -8.735657 19.05868 
1 1 1    1   12   41 o  460.347   6.7785  162.362   4.7763  169.312   7.7009  158.017   6.0889  469.714   10.711  453.980   8.7626 15.73370 13.83880 
1 1 1    1   12   42 o  423.474   6.6273  137.406   4.2957  129.003   6.1783  145.269   5.9767  410.030   9.8443  435.210   8.9721 -25.17935 13.31955 
1 1 1    1   12   43 o  365.369   9.1802  102.424   5.1340   71.531   10.641  111.797   5.8614  302.455   23.161  381.628   10.034 -79.17334 25.24116 
1 1 1    1   12   44 o  337.204   8.9391   87.254   4.6138   78.821   6.6027   95.301   6.4497  319.951   13.482  352.040   11.970 -32.08859 18.02903 
1 1 1    1   12   45 o  191.599   11.255   28.324   3.2864   29.959   5.2262   27.255   4.2265  195.956   17.613  187.367   14.859 8.588989 23.04350 
1 1 1    1   12   46 o  243.860   8.6079   45.652   3.2130   42.640   4.4729   48.862   4.6182  234.957   12.482  251.926   11.977 -16.96942 17.29864 
1 1 1    1   12   47 o  215.645   9.5495   35.740   3.1520   34.137   4.3148   37.574   4.6156  209.889   13.503  220.192   13.764 -10.30260 19.28121 
1 1 1    1   12   48 o  145.336   13.728   16.463   3.0178   18.834   4.2521   14.058   4.2838  154.511   18.337  132.272   21.927 22.23849 28.58368 
1 1 1    1   12   49 o  186.050   12.518   26.848   3.5440   25.050   5.9211   27.851   4.4239  177.117   22.338  188.868   15.438 -11.75041 27.15329 
1 1 1    1   12   50 o  517.870   7.0931  205.897   5.6225  213.831   7.2818  194.184   8.8478  527.241   9.0231  501.632   11.523 25.60864 14.63578 
1 1 1    1   12   51 o  116.908   17.069   10.873   2.9643   13.212   4.1226   8.3706   4.2653  127.730   21.874  100.408   27.116 27.32193 34.83882 
1 1 1    1   12   52 f   92.300   21.351   6.9901   2.9565   5.8916   4.2558   8.0148   4.1103   86.197   28.095   98.166   26.664 -11.96874 38.73353 
1 1 1    1   12   53 f   75.932   23.697   4.6057   3.0541  -2.4254   4.3467   11.461   4.2921   53.028   24.184  117.640   24.627 -64.61194 34.51557 
1 1 1    1   12   54 o  113.084   21.498   10.468   3.5851   8.0569   4.7512   13.655   5.4632   98.123   29.354  126.977   28.775 -28.85412 41.10567 
1 1 1    1   12   55 o  281.513   10.164   61.219   4.3796   60.073   5.3409   63.572   7.6519  278.190   12.543  283.701   17.710 -5.511261 21.70173 
1 1 1    1   12   56 o  151.331   16.370   18.176   3.7313   17.818   4.6859   18.796   6.1684  148.040   21.292  149.137   28.052 -1.097900 35.21725 
1 1 1    1   12   57 o  118.098   21.836   11.521   3.8018   11.205   5.9000   11.745   4.9716  113.007   32.421  116.907   28.125 -3.899910 42.92011 
1 1 1    1   12   58 o  134.321   17.505   14.519   3.5134   14.355   4.8604   14.698   5.0846  130.308   25.281  131.472   26.187 -1.163803 36.39887 
1 1 1    1   12   59 o  191.740   13.971   29.004   4.0721   31.864   5.8901   26.385   5.6360  198.204   19.675  179.562   20.897 18.64236 28.70175 
1 1 1    1   12   60 o   64.224   24.838   2.5646   3.4720   0.2908   4.9347   4.7938   4.8861   63.224   27.453   79.859   29.791 -16.63428 40.51100 
1 1 1    1   12   61 o   54.810   24.414  -0.7916   4.1385  -0.7584   6.9753  -0.8097   5.1411   70.067   31.417   60.822   27.143 9.244957 41.51800 
1 1 1    1   12   62 f  221.256   13.057   38.784   4.4024   43.171   5.6845   32.210   6.9589  231.430   16.149  194.000   23.943 37.43001 28.88017 
1 1 1    1   12   63 o   82.704   25.412   6.0893   3.5277   11.209   5.1903   1.6940   4.8094  108.838   30.130   65.467   27.733 43.37101 40.95019 
1 1 1    1   12   64 o   84.161   24.908   6.3991   3.4346  -0.0297   4.8613   12.806   4.8532   59.827   26.565  117.506   27.475 -57.67871 38.21743 
1 1 1    1   13    2 o  994.858   14.581  758.668   22.203   0.0000   0.0000  758.668   22.203  ?   ?   994.858   14.581 0.000000 14.58061 
1 1 1    1   13    3 o  641.110   8.1857  314.722   8.0326  316.982   11.487  312.559   11.236  643.239   11.668  638.745   11.493 4.494141 16.37743 
1 1 1    1   13    4 o  1141.45   9.2723  997.806   16.200  994.195   19.783  1005.16   28.225  1139.19   11.346  1144.87   16.107 -5.678589 19.70129 
1 1 1    1   13    5 o  571.001   5.5891  249.588   4.8848  249.686   6.8986  249.489   6.9177  571.041   7.8927  570.815   7.9176 0.2261353 11.17958 
1 1 1    1   13    6 o  679.951   5.9505  353.936   6.1930  353.288   8.7367  354.591   8.7799  679.227   8.4035  680.477   8.4296 -1.249817 11.90279 
1 1 1    1   13    7 o  664.398   5.9104  337.930   6.0105  336.864   8.4646  339.013   8.5362  663.251   8.3380  665.361   8.3818 -2.109985 11.82271 
1 1 1    1   13    8 o  626.704   5.8072  300.673   5.5705  303.490   7.9504  297.955   7.8074  629.539   8.2508  623.775   8.1773 5.763672 11.61653 
1 1 1    1   13    9 o  512.792   5.5184  201.299   4.3314  202.990   6.1448  199.630   6.1064  514.871   7.7972  510.591   7.8135 4.280182 11.03841 
1 1 1    1   13   10 o  425.553   5.4400  138.633   3.5434  138.921   5.0057  138.343   5.0166  425.937   7.6780  425.049   7.7108 0.8876038 10.88152 
1 1 1    1   13   11 o  637.095   8.3691  310.836   8.1612  310.836   8.1612   0.0000   0.0000  637.095   8.3691  ?   ?  0.000000 8.369127 
1 1 1    1   13   12 o  306.852   8.2950   72.106   3.8960   73.881   5.5182   70.342   5.5013  310.512   11.610  302.976   11.863 7.535919 16.59907 
1 1 1    1   13   13 o  710.511   8.8701  386.625   9.6465  382.581   13.485  390.863   13.805  706.541   12.469  714.135   12.630 -7.593811 17.74804 
1 1 1    1   13   14 o  692.075   6.2646  366.685   6.6361  372.752   9.4937  360.888   9.2798  697.656   8.8905  686.468   8.8318 11.18854 12.53157 
1 1 1    1   13   15 o  653.372   6.1872  326.811   6.1876  330.458   8.7877  323.225   8.7140  656.905   8.7398  649.675   8.7630 7.230286 12.37638 
1 1 1    1   13   16 o  207.665   7.5802   33.019   2.4094   35.124   3.4267   30.960   3.3886  214.141   10.455  200.732   11.072 13.40877 15.22757 
1 1 1    1   13   17 o  968.052   7.4823  717.477   11.087  714.488   15.601  720.526   15.758  965.846   10.553  969.914   10.615 -4.068298 14.96778 
1 1 1    1   13   18 o  316.861   6.6815   76.861   3.2405   75.898   4.5356   77.865   4.6315  314.825   9.4122  318.878   9.4891 -4.052521 13.36536 
1 1 1    1   13   19 o  1169.12   8.4655  1046.52   15.149  1042.97   21.377  1050.09   21.470  1166.90   11.969  1170.87   11.980 -3.969971 16.93451 
1 1 1    1   13   20 o  207.154   11.588   32.969   3.6596   30.654   5.2355   35.181   5.1174  199.218   17.343  213.678   15.758 -14.46039 23.43225 
1 1 1    1   13   21 o  473.157   8.7257  171.404   6.3194  167.338   8.8575  175.620   9.0186  467.417   12.380  478.847   12.305 -11.42981 17.45517 
1 1 1    1   13   22 o  150.977   10.193   17.533   2.3418   17.899   2.8422   16.759   4.1326  152.380   12.290  146.649   18.847 5.731003 22.50039 
1 1 1    1   13   23 o  795.320   5.7412  484.167   6.9890  489.488   9.9793  479.044   9.7911  799.612   8.1537  791.038   8.0866 8.574646 11.48368 
1 1 1    1   13   24 o  1362.13   7.8030  1420.39   16.269  1408.47   22.790  1432.79   23.232  1356.19   10.979  1367.84   11.096 -11.65063 15.60940 
1 1 1    1   13   25 o  494.447   5.5332  187.133   4.1876  180.425   5.7746  194.573   6.0817  485.466   7.7713  504.139   7.8815 -18.67236 11.06842 
1 1 1    1   13   26 o  713.671   5.7924  389.868   6.3274  384.857   8.7975  395.238   9.1073  709.007   8.1066  718.499   8.2812 -9.492249 11.58857 
1 1 1    1   13   27 o  601.122   6.5301  276.614   6.0083  287.772   7.6807  259.021   9.6449  613.081   8.1849  581.562   10.835 31.51910 13.57904 
1 1 1    1   13   28 f  596.294   5.9957  272.182   5.4723  271.072   7.8402  273.237   7.6416  595.004   8.6086  597.383   8.3572 -2.378845 11.99798 
1 1 1    1   13   29 o  794.450   7.5571  483.217   9.1895  484.511   13.004  481.926   12.988  795.359   10.682  793.234   10.697 2.125549 15.11725 
1 1 1    1   13   30 o  1003.09   7.6331  770.381   11.720  773.498   14.949  765.410   18.877  1004.99   9.7184  999.507   12.339 5.478943 15.70666 
1 1 1    1   13   31 o  451.554   8.0674  156.128   5.5759  155.252   9.8108  156.546   6.7767  450.042   14.242  452.103   9.7929 -2.061554 17.28428 
1 1 1    1   13   32 o  1277.50   8.7560  1249.81   17.121  1243.16   27.246  1254.16   22.010  1273.45   13.978  1279.45   11.239 -5.995605 17.93602 
1 1 1    1   13   33 o  713.706   6.6873  389.993   7.3053  393.422   10.413  386.670   10.252  716.687   9.4923  710.514   9.4265 6.172241 13.37766 
1 1 1    1   13   34 o  1128.91   7.5227  975.896   12.999  973.612   18.316  978.213   18.451  1127.26   10.615  1129.92   10.668 -2.654297 15.04994 
1 1 1    1   13   35 o  465.896   8.1113  166.242   5.7843  157.347   8.1008  175.495   8.2620  453.078   11.681  478.519   11.280 -25.44083 16.23853 
1 1 1    1   13   36 o  337.292   8.8529   87.155   4.5705   83.437   6.5881   90.606   6.3460  329.822   13.050  343.754   12.061 -13.93204 17.76986 
1 1 1    1   13   37 f   73.346   24.522   3.9115   3.2353   1.3575   5.2355   5.4892   4.1150   72.151   29.613   85.449   27.609 -13.29822 40.48699 
1 1 1    1   13   38 o  280.682   8.7471   60.373   3.7579   59.595   4.7960   61.610   6.0484  278.748   11.241  283.256   13.950 -4.508331 17.91568 
1 1 1    1   13   39 o  365.010   7.5082  102.078   4.1948   98.340   6.7261  104.457   5.3663  357.933   12.277  369.116   9.4982 -11.18243 15.52227 
1 1 1    1   13   40 o  458.032   6.7655  160.722   4.7432  158.731   7.6079  161.988   6.0665  454.811   10.929  459.685   8.6220 -4.874084 13.92021 
1 1 1    1   13   41 o  441.291   6.2912  149.185   4.2494  151.780   5.9996  146.574   6.0195  444.897   8.8104  437.182   8.9956 7.715424 12.59141 
1 1 1    1   13   42 o  404.552   7.9221  125.478   4.9055  114.854   8.3357  131.106   6.0674  386.301   14.098  413.355   9.5898 -27.05411 17.05014 
1 1 1    1   13   43 o   99.202   22.980   7.9566   3.4209   12.307   5.1690   4.5659   4.5632  122.932   28.086   81.622   29.035 41.30984 40.39625 
1 1 1    1   13   44 o  193.277   9.9732   28.765   2.9404   27.649   4.1486   29.892   4.1682  188.834   14.463  196.473   13.951 -7.638336 20.09500 
1 1 1    1   13   45 o  211.541   10.209   34.388   3.3057   34.479   5.3654   34.332   4.1969  210.443   16.797  210.696   13.078 -0.2536316 21.28813 
1 1 1    1   13   46 o  210.525   9.3235   34.048   3.0044   35.815   4.2235   32.239   4.2745  215.169   12.883  203.947   13.774 11.22226 18.86003 
1 1 1    1   13   47 o  530.374   6.3472  215.704   5.1527  216.090   7.1405  215.284   7.4428  530.371   8.7959  529.289   9.1870 1.081299 12.71885 
1 1 1    1   13   48 o  586.780   6.3072  264.076   5.6647  264.125   8.3542  264.034   7.7072  586.089   9.3126  586.193   8.5898 -0.1040649 12.66922 
1 1 1    1   13   49 f  156.724   14.452   19.189   3.4277   18.293   5.9712   19.628   4.1861  149.306   27.128  157.757   17.638 -8.450577 32.35743 
1 1 1    1   13   50 o  300.412   8.6693   69.401   3.9863   64.715   4.8939   78.642   6.8718  289.659   11.038  318.531   14.095 -28.87192 17.90248 
1 1 1    1   13   51 o  261.779   8.5416   52.711   3.4225   52.074   4.8222   53.357   4.8582  259.528   12.139  262.718   12.081 -3.189972 17.12670 
1 1 1    1   13   52 o  201.829   11.352   31.570   3.4926   28.664   4.5399   35.785   5.4666  191.191   15.651  213.364   16.877 -22.17336 23.01668 
1 1 1    1   13   53 o  274.754   9.3899   58.182   3.9489   64.140   5.2186   50.200   6.0402  287.883   11.843  253.180   15.664 34.70372 19.63692 
1 1 1    1   13   54 o  254.832   9.6901   50.103   3.7797   50.665   5.2145   49.481   5.4863  254.983   13.408  251.669   14.301 3.314377 19.60369 
1 1 1    1   13   55 o   51.649   22.513  -0.3609   3.3446   5.1605   4.2294  -9.5771   5.4642   81.583   28.030   46.965   22.954 34.61760 36.22981 
1 1 1    1   13   56 o  115.533   20.908   10.949   3.5612   13.515   5.3270   8.8749   4.7886  125.739   28.355  101.886   29.202 23.85339 40.70295 
1 1 1    1   13   57 o  221.027   10.804   37.870   3.6549   38.275   5.1504   37.459   5.1876  220.282   15.372  217.788   15.667 2.493759 21.94833 
1 1 1    1   13   58 o  167.884   13.767   22.210   3.5067   21.375   4.8743   23.106   5.0487  162.106   20.074  168.684   19.940 -6.578232 28.29384 
1 1 1    1   13   59 o  143.218   16.987   16.521   3.6511   24.359   5.3096   9.4908   5.0288  172.460   20.517  103.453   30.005 69.00762 36.34879 
1 1 1    1   13   60 o   92.251   27.132   7.4353   4.0866   7.6326   7.0749   7.3365   5.0061   95.646   35.814   91.864   30.497 3.781517 47.03951 
1 1 1    1   13   61 o  134.297   19.974   14.989   3.9807   14.846   4.9466   15.250   6.7059  130.464   25.685  126.872   33.890 3.592430 42.52369 
1 1 1    1   13   62 o   67.979   24.919   3.5422   3.3922  -0.2397   4.7645   7.4302   4.8308   59.551   26.378   90.459   29.954 -30.90810 39.91297 
1 1 1    1   13   63 o  246.729   10.921   47.815   4.1243   50.244   5.7457   45.234   5.9235  249.622   15.109  235.639   16.528 13.98347 22.39343 
1 1 1    1   14    2 o  1551.28   20.554  1848.44   48.805   0.0000   0.0000  1848.44   48.805  ?   ?   1551.28   20.554 0.000000 20.55440 
1 1 1    1   14    3 o  517.218   7.8276  204.842   6.1969  212.514   8.9682  197.832   8.5726  526.671   11.125  508.157   11.022 18.51376 15.66009 
1 1 1    1   14    4 o  439.997   7.6545  148.239   5.1551  142.021   7.1170  155.103   7.4771  430.560   10.799  449.951   10.857 -19.39105 15.31320 
1 1 1    1   14    5 o  626.679   6.7483  300.681   6.4731  309.621   8.1006  284.889   10.767  635.860   8.3231  609.762   11.536 26.09821 14.22505 
1 1 1    1   14    6 o  388.548   5.3966  115.570   3.2095  115.476   4.5250  115.665   4.5530  388.340   7.6126  388.656   7.6536 -0.3165588 10.79486 
1 1 1    1   14    7 o  1078.43   7.7794  890.573   12.841  878.593   17.899  903.278   18.433  1070.86   10.920  1085.79   11.091 -14.92029 15.56512 
1 1 1    1   14    8 o  230.681   6.1891   40.740   2.1853   42.211   3.0723   39.233   3.1090  234.772   8.5496  226.331   8.9745 8.440826 12.39499 
1 1 1    1   14    9 o  652.431   6.9139  325.910   6.9045  325.716   8.4519  326.300   11.971  652.166   8.4670  652.535   11.986 -0.3692017 14.67458 
1 1 1    1   14   10 o  307.135   8.1684   72.237   3.8400   74.634   5.4933   69.947   5.3701  312.096   11.499  302.134   11.612 9.962158 16.34251 
1 1 1    1   14   11 o  223.644   7.6075   38.298   2.6042   37.788   4.5054   38.554   3.1913  221.629   13.343  224.362   9.2928 -2.732880 16.26036 
1 1 1    1   14   12 o  335.875   5.8270   86.361   2.9957   80.568   4.1404   92.725   4.3396  324.365   8.3395  347.981   8.1476 -23.61667 11.65889 
1 1 1    1   14   13 o  953.729   7.3199  696.434   10.686  704.175   15.269  689.003   14.959  958.802   10.404  948.425   10.305 10.37769 14.64361 
1 1 1    1   14   14 o  1029.44   7.6953  811.411   12.125  807.975   17.073  814.908   17.223  1027.02   10.861  1031.42   10.910 -4.393188 15.39428 
1 1 1    1   14   15 o  217.693   7.4252   36.283   2.4741   33.529   3.4577   39.172   3.5417  208.941   10.849  226.154   10.231 -17.21349 14.91253 
1 1 1    1   14   16 o  1082.18   8.0020  896.645   13.255  896.969   18.729  896.320   18.761  1082.14   11.307  1081.75   11.331 0.3939209 16.00752 
1 1 1    1   14   17 o  229.202   7.5171   40.219   2.6372   42.854   3.7440   37.624   3.7153  236.556   10.340  221.642   10.951 14.91435 15.06160 
1 1 1    1   14   18 o  1091.47   8.0792  912.067   13.498  912.612   19.079  911.521   19.097  1091.60   11.419  1090.94   11.437 0.6538086 16.16151 
1 1 1    1   14   19 o  452.282   8.6810  156.615   6.0096  156.985   8.4276  156.232   8.5721  452.729   12.162  451.635   12.400 1.094025 17.36875 
1 1 1    1   14   20 o  882.709   8.3741  596.527   11.314  597.385   13.995  594.906   19.225  883.261   10.351  881.213   14.253 2.048767 17.61539 
1 1 1    1   14   21 o  706.236   6.8128  381.803   7.3645  391.770   10.620  372.572   10.221  715.310   9.7000  697.568   9.5730 17.74261 13.62835 
1 1 1    1   14   22 o  1159.09   8.6124  1028.56   15.280  1035.73   21.759  1021.60   21.461  1162.90   12.224  1154.95   12.140 7.953735 17.22840 
1 1 1    1   14   23 o  1281.02   8.2192  1256.31   16.116  1248.35   20.579  1268.94   25.914  1276.81   10.530  1287.09   13.154 -10.28333 16.84974 
1 1 1    1   14   24 o  246.081   9.8475   46.368   3.7091   43.905   5.2980   48.735   5.1945  238.943   14.555  251.865   13.524 -12.92252 19.86846 
1 1 1    1   14   25 o  1270.99   7.5029  1236.69   14.596  1240.90   20.658  1232.50   20.626  1272.95   10.603  1268.64   10.622 4.315552 15.00819 
1 1 1    1   14   26 o  1403.97   8.0643  1509.12   17.330  1499.23   24.276  1519.40   24.747  1399.10   11.336  1408.47   11.479 -9.364502 16.13306 
1 1 1    1   14   27 o  478.353   5.9778  175.160   4.3768  175.759   6.1716  174.554   6.2082  479.117   8.4156  477.470   8.4947 1.646759 11.95751 
1 1 1    1   14   28 f  392.893   11.283  118.239   6.7851   0.0000   0.0000  118.239   6.7851  ?   ?   392.893   11.283 0.000000 11.28264 
1 1 1    1   14   29 o  1340.13   8.7767  1375.22   18.003  1376.19   23.108  1373.73   28.716  1340.36   11.264  1338.83   14.013 1.531128 17.97869 
1 1 1    1   14   30 o  385.242   8.0521  113.638   4.7480  108.886   5.7236  124.124   8.5025  377.052   9.9175  402.428   13.803 -25.37613 16.99678 
1 1 1    1   14   31 o  570.867   7.5352  249.525   6.5842  242.215   11.290  253.293   8.1054  562.173   13.120  575.094   9.2080 -12.92065 16.02890 
1 1 1    1   14   32 o  1167.92   7.5340  1044.46   13.468  1041.44   18.996  1047.51   19.098  1165.94   10.645  1169.33   10.670 -3.390381 15.07196 
1 1 1    1   14   33 f  886.494   6.9066  601.721   9.3715  607.910   13.335  595.683   13.173  890.831   9.7801  881.828   9.7594 9.002380 13.81651 
1 1 1    1   14   34 o  507.473   7.9057  197.226   6.1408  201.947   8.7855  192.715   8.5866  513.336   11.181  501.465   11.187 11.87152 15.81677 
1 1 1    1   14   35 o  732.316   6.8165  410.665   7.6407  413.990   10.853  407.397   10.759  735.062   9.6461  729.185   9.6396 5.876282 13.63703 
1 1 1    1   14   36 o  651.518   6.8708  325.076   6.8518  316.481   9.6768  333.718   9.7031  642.620   9.8380  659.909   9.6063 -17.28906 13.75021 
1 1 1    1   14   37 o  717.657   7.9472  394.570   8.7298  389.740   14.921  397.084   10.764  712.524   13.681  719.748   9.7710 -7.223816 16.81222 
1 1 1    1   14   38 o  205.249   15.068   32.550   4.7006   33.854   9.3233   32.106   5.4430  206.443   30.417  203.473   17.652 2.970108 35.16763 
1 1 1    1   14   39 o  346.069   8.8939   91.812   4.7111   90.513   6.5804   93.178   6.7478  343.328   12.522  348.334   12.656 -5.005615 17.80385 
1 1 1    1   14   40 f  386.218   8.2398  114.344   4.8710  114.228   6.8996  114.461   6.8777  385.701   11.687  386.099   11.638 -0.3986206 16.49325 
1 1 1    1   14   41 o  413.020   13.064  131.157   8.2589   0.0000   0.0000  131.157   8.2589  ?   ?   413.020   13.064 0.000000 13.06422 
1 1 1    1   14   42 o  441.755   6.9145  149.565   4.6753  147.879   7.5015  150.636   5.9785  438.749   11.170  443.134   8.8143 -4.385284 14.22912 
1 1 1    1   14   43 o  229.753   9.3901   40.518   3.3022   40.350   4.2360   40.778   5.2722  228.731   12.143  229.467   15.095 -0.7365723 19.37273 
1 1 1    1   14   44 o  509.628   6.6069  199.092   5.1537  197.081   8.1505  200.432   6.6524  506.415   10.515  511.066   8.5042 -4.650726 13.52351 
1 1 1    1   14   45 o  544.929   5.9741  227.594   4.9829  239.356   7.1939  216.748   6.9086  558.425   8.4165  531.383   8.4939 27.04120 11.95763 
1 1 1    1   14   46 o  435.073   6.4126  145.141   4.2704  150.538   6.0310  139.715   6.0475  442.698   8.9004  426.422   9.2654 16.27637 12.84776 
1 1 1    1   14   47 o  210.516   9.6768   34.079   3.1181   30.328   4.3306   38.117   4.4932  197.507   14.425  221.780   13.297 -24.27315 19.61879 
1 1 1    1   14   48 o  317.790   8.3002   77.594   4.0374   78.510   6.6397   77.056   5.0856  318.608   13.615  316.315   10.504 2.292511 17.19609 
1 1 1    1   14   49 o  221.372   9.2020   37.701   3.1180   42.147   4.4219   33.304   4.3972  233.239   12.431  206.908   13.966 26.33115 18.69729 
1 1 1    1   14   50 o   52.673   22.066   0.4864   2.9906   0.6588   3.6006   0.1029   5.3704   57.900   24.231   67.253   28.920 -9.352768 37.72894 
1 1 1    1   14   51 o  105.206   19.697   8.9657   3.0553   5.2800   3.9152   14.706   4.8860   82.096   26.956  133.839   24.763 -51.74334 36.60367 
1 1 1    1   14   52 o  160.167   13.654   20.052   3.3153   22.423   4.3609   16.804   5.1031  168.468   17.151  143.312   24.121 25.15579 29.59685 
1 1 1    1   14   53 o   69.853   23.448   3.7217   2.9583  -0.6342   4.1586   8.1842   4.2091   56.846   24.931   98.805   27.044 -41.95871 36.78225 
1 1 1    1   14   54 o  123.226   16.211   12.081   2.9835   12.983   4.0733   11.037   4.3821  125.982   21.920  114.755   25.599 11.22627 33.70142 
1 1 1    1   14   55 f   55.852   22.968   1.0103   3.1575   0.1223   3.8792   2.7533   5.4351   57.260   24.599   75.504   30.474 -18.24469 39.16357 
1 1 1    1   14   56 o  230.661   11.048   41.237   3.9007   35.071   5.7308   46.560   5.3243  209.848   18.016  243.654   14.340 -33.80621 23.02652 
1 1 1    1   14   57 o  197.319   11.593   30.357   3.4860   30.417   4.8256   30.292   5.0413  195.796   16.249  195.044   17.058 0.7509613 23.55846 
1 1 1    1   14   58 o  164.579   14.565   21.446   3.6311   19.092   5.1974   23.690   5.0751  151.440   23.158  170.732   19.787 -19.29210 30.46040 
1 1 1    1   14   59 o  177.162   13.163   24.739   3.5439   22.446   5.0175   27.022   5.0061  165.484   20.230  182.898   18.121 -17.41460 27.15906 
1 1 1    1   14   60 o  123.662   22.541   12.937   4.1095   13.575   6.9709   12.598   5.0875  119.617   35.504  118.968   28.342 0.6486969 45.42964 
1 1 1    1   14   61 o   70.093   26.597   3.5323   3.9311   2.0507   4.9532   6.0538   6.4616   68.202   28.470   87.230   33.842 -19.02847 44.22530 
1 1 1    1   14   62 o  163.949   14.243   21.568   3.5386   16.694   5.0096   26.421   4.9992  137.962   24.627  178.846   18.531 -40.88380 30.81986 
1 1 1    1   14   63 o  105.968   21.672   9.7703   3.3966   6.0336   4.8724   13.303   4.7376   82.563   29.926  120.928   26.341 -38.36524 39.86700 
1 1 1    1   15    2 o  740.557   12.523  420.322   14.195   0.0000   0.0000  420.322   14.195  ?   ?   740.557   12.523 0.000000 12.52340 
1 1 1    1   15    3 o  840.768   9.4803  541.438   12.200  545.213   17.389  537.778   17.122  843.341   13.471  837.583   13.355 5.758240 18.96906 
1 1 1    1   15    4 o  279.644   8.1300   59.884   3.4799   58.775   4.9074   61.006   4.9353  276.957   11.576  282.168   11.427 -5.210785 16.26625 
1 1 1    1   15    5 o  528.428   6.5151  213.785   5.2696  214.149   6.4856  213.078   9.0395  528.825   8.0125  527.355   11.199 1.469971 13.77003 
1 1 1    1   15    6 o  286.590   6.7468   62.884   2.9596   64.056   3.6619   60.677   5.0257  289.219   8.2719  281.400   11.668 7.818604 14.30274 
1 1 1    1   15    7 o  340.265   7.9450   88.658   4.1379   93.579   5.9647   84.093   5.7452  349.486   11.150  331.291   11.330 18.19431 15.89651 
1 1 1    1   15    8 o  351.475   6.6299   94.580   3.5668   98.633   6.1636   92.539   4.3734  358.798   11.223  347.626   8.2193 11.17218 13.91107 
1 1 1    1   15    9 o  148.396   9.9551   16.943   2.2481   17.826   4.1017   16.565   2.6878  151.339   18.064  146.531   12.092 4.808029 21.73753 
1 1 1    1   15   10 o  877.780   6.9437  589.907   9.3293  592.172   13.243  587.677   13.144  879.286   9.8401  875.946   9.8038 3.340576 13.89035 
1 1 1    1   15   11 o  599.566   5.9939  275.193   5.5006  275.056   7.7837  275.330   7.7745  599.331   8.4849  599.630   8.4707 -0.2992554 11.98944 
1 1 1    1   15   12 o  1386.69   9.4695  1472.63   20.099  1487.77   28.771  1458.19   28.090  1393.31   13.491  1379.42   13.304 13.89539 18.94731 
1 1 1    1   15   13 o  313.482   6.2444   75.229   2.9962   76.601   4.3035   73.938   4.1741  316.283   8.8894  310.740   8.7760 5.543091 12.49160 
1 1 1    1   15   14 o  571.672   6.0824  250.173   5.3222  250.125   7.5382  250.220   7.5154  571.547   8.6168  571.657   8.5891 -0.1094360 12.16643 
1 1 1    1   15   15 o  276.572   6.7005   58.557   2.8365   57.735   4.0156   59.375   4.0073  274.584   9.5544  278.461   9.4020 -3.876556 13.40465 
1 1 1    1   15   16 o  1069.86   7.9523  876.293   13.022  881.131   18.515  871.556   18.319  1072.61   11.278  1066.77   11.219 5.839722 15.90761 
1 1 1    1   15   17 o  1528.25   11.908  1788.81   27.855  1844.67   49.752  1763.30   33.618  1550.69   20.961  1517.04   14.478 33.64661 25.47524 
1 1 1    1   15   18 o  670.697   9.0419  344.410   9.2823  342.299   13.105  346.535   13.149  668.498   12.808  672.622   12.772 -4.124512 18.08769 
1 1 1    1   15   19 o  764.023   6.8768  446.842   8.0420  446.083   11.401  447.593   11.345  763.283   9.7585  764.576   9.6946 -1.293091 13.75552 
1 1 1    1   15   20 o  801.273   7.0641  491.482   8.6638  489.913   12.207  493.075   12.298  799.896   9.9702  802.472   10.013 -2.575745 14.13008 
1 1 1    1   15   21 o  1059.39   8.1621  859.191   13.235  862.414   18.766  856.001   18.668  1061.19   11.554  1057.24   11.536 3.951538 16.32683 
1 1 1    1   15   22 o  906.893   7.5986  629.621   10.548  639.248   15.152  620.569   14.692  913.663   10.835  900.224   10.662 13.43921 15.20128 
1 1 1    1   15   23 o  1143.14   8.6304  1000.47   15.101  1009.22   21.542  992.023   21.174  1147.89   12.261  1138.08   12.155 9.815918 17.26487 
1 1 1    1   15   24 o  1220.95   9.0424  1141.39   16.899  1136.25   23.744  1146.67   24.056  1217.93   12.737  1223.49   12.846 -5.560181 18.08964 
1 1 1    1   15   25 o  1500.73   9.2892  1724.52   21.338  1694.58   26.877  1775.55   35.092  1487.42   11.805  1522.14   15.062 -34.72864 19.13733 
1 1 1    1   15   26 o   64.037   25.244   1.7436   3.6428   1.7436   3.6428   0.0000   0.0000   64.037   25.244  ?   ?  0.000000 25.24401 
1 1 1    1   15   27 o  642.830   10.077  316.466   9.9155  316.466   9.9155   0.0000   0.0000  642.830   10.077  ?   ?  0.000000 10.07741 
1 1 1    1   15   28 o  258.428   9.7728   51.146   3.8657   57.240   4.7357   38.978   6.6921  273.358   11.318  224.515   19.672 48.84319 22.69567 
1 1 1    1   15   29 o  195.677   12.640   29.461   3.7657   30.734   4.4765   26.380   6.9642  199.688   14.750  183.477   25.487 16.21135 29.44722 
1 1 1    1   15   30 o  626.713   7.2327  300.720   6.9381  291.889   11.461  305.828   8.7166  617.201   12.132  631.938   9.0117 -14.73663 15.11283 
1 1 1    1   15   31 o  230.926   10.025   40.848   3.5435   40.216   4.9303   41.523   5.0964  228.595   14.161  232.273   14.406 -3.677689 20.20043 
1 1 1    1   15   32 o  697.353   6.5535  372.327   6.9951  370.747   9.7939  373.973   9.9942  695.731   9.1970  698.743   9.3446 -3.011475 13.11130 
1 1 1    1   15   33 o  421.919   8.0053  136.331   5.1698  139.108   7.4366  133.735   7.1920  426.044   11.404  417.742   11.248 8.301636 16.01754 
1 1 1    1   15   34 o  265.287   9.7992   53.923   3.9790   52.829   5.7545   54.926   5.5080  262.011   14.404  267.263   13.508 -5.251892 19.74713 
1 1 1    1   15   35 o  166.154   17.551   21.451   4.3959   15.968   8.8355   23.255   5.0677  140.911   39.419  172.784   19.503 -31.87332 43.97985 
1 1 1    1   15   36 o  388.286   9.3339  115.543   5.5473  116.615   10.352  115.110   6.5702  389.423   17.368  387.450   11.079 1.973572 20.60078 
1 1 1    1   15   37 o  299.693   9.3376   68.846   4.2833   59.285   6.1230   78.008   5.9942  277.427   14.469  318.830   12.283 -41.40228 18.97981 
1 1 1    1   15   38 o  787.896   6.9555  475.565   8.3882  478.881   11.944  472.336   11.783  790.241   9.8746  784.833   9.8087 5.408203 13.91824 
1 1 1    1   15   39 o  225.216   11.630   39.043   3.9954   45.439   5.7242   32.967   5.5793  242.505   15.503  206.031   17.869 36.47420 23.65663 
1 1 1    1   15   40 o  219.339   12.956   37.108   4.3305   37.205   6.1685   37.013   6.0808  218.730   18.601  218.204   18.378 0.5261383 26.14855 
1 1 1    1   15   41 o  478.447   10.774  175.779   7.8900  175.779   7.8900   0.0000   0.0000  478.447   10.774  ?   ?  0.000000 10.77386 
1 1 1    1   15   42 o  357.237   10.148   97.992   5.5489   97.194   6.5302  100.066   10.525  355.545   11.999  358.972   19.224 -3.426544 22.66196 
1 1 1    1   15   43 o  400.054   9.6937  122.895   5.9358  113.476   11.172  126.600   7.0066  382.580   19.077  405.799   11.281 -23.21844 22.16304 
1 1 1    1   15   44 o  270.431   12.340   56.308   5.1079   51.839   10.034   57.871   5.9344  255.640   26.007  273.528   14.223 -17.88802 29.64209 
1 1 1    1   15   45 o  231.543   11.213   41.258   3.9738   38.208   5.5653   44.430   5.6760  221.513   16.533  239.174   15.590 -17.66090 22.72422 
1 1 1    1   15   46 o   61.398   24.992   1.2732   3.6906   1.9786   5.1928   0.5533   5.2463   73.053   29.680   68.444   28.978 4.608345 41.48044 
1 1 1    1   15   47 o  335.276   7.9947   86.328   4.1027   84.478   6.7149   87.431   5.1826  330.659   13.267  337.072   10.045 -6.412231 16.64122 
1 1 1    1   15   48 f  280.915   8.9406   60.682   3.8442   74.760   6.7835   54.021   4.6658  310.667   14.266  264.636   11.519 46.03030 18.33543 
1 1 1    1   15   49 o   76.953   25.067   4.5950   3.3882   2.9954   3.5774   18.530   10.559   68.625   25.512  145.141   43.837 -76.51611 50.72023 
1 1 1    1   15   50 o   70.150   23.744   3.6874   3.0336   0.6194   3.8746   8.5474   4.8766   59.579   25.046  101.434   29.584 -41.85523 38.76227 
1 1 1    1   15   51 o  374.593   7.1186  107.790   4.0815  111.365   5.8719  104.447   5.6773  380.042   10.094  368.053   10.078 11.98880 14.26380 
1 1 1    1   15   52 o  198.105   10.962   30.411   3.3110   22.132   4.8062   37.888   4.5678  166.644   19.193  220.492   13.601 -53.84802 23.52387 
1 1 1    1   15   53 o  226.987   9.8607   39.759   3.4259   41.832   4.6310   37.253   5.0918  231.745   13.109  217.934   15.363 13.81029 20.19557 
1 1 1    1   15   54 o   56.166   22.930   1.1243   3.1184  -2.2579   3.9397   6.7976   5.1026   50.239   22.956   91.771   30.796 -41.53194 38.41001 
1 1 1    1   15   55 o  225.388   10.027   39.264   3.4590   37.175   4.6926   41.750   5.1187  217.819   14.152  230.727   14.569 -12.90785 20.31078 
1 1 1    1   15   56 o  318.785   9.1196   78.476   4.4499   81.835   6.9757   76.171   5.7782  323.538   14.086  313.022   12.060 10.51578 18.54353 
1 1 1    1   15   57 o   96.896   22.100   7.8790   3.2052   9.2012   4.4980   6.5151   4.5684  103.092   27.848   88.415   29.122 14.67711 40.29424 
1 1 1    1   15   58 f  322.011   8.8543   80.198   4.3641   94.025   6.8701   70.845   5.6506  346.599   12.950  301.206   12.256 45.39304 17.83032 
1 1 1    1   15   59 o  356.958   9.8413   98.911   5.3770   79.788   7.8138  116.113   7.4107  316.452   16.186  385.039   12.574 -68.58658 20.49634 
1 1 1    1   15   60 o   96.138   23.223   7.9761   3.3790   8.9077   4.6664   6.9491   4.8994   99.567   28.911   89.298   30.175 10.26906 41.78978 
1 1 1    1   15   61 o   93.617   25.626   7.8098   3.7791   7.4873   4.7408   8.3719   6.2592   90.969   29.652   95.419   33.999 -4.450249 45.11322 
1 1 1    1   15   62 o  162.611   13.694   21.181   3.3768   14.137   4.7937   28.118   4.7575  125.631   25.793  185.412   16.951 -59.78069 30.86424 
1 1 1    1   15   63 o  113.939   20.153   11.111   3.3860   10.964   4.9909   11.236   4.6090  107.155   29.497  109.904   27.473 -2.748611 40.30939 
1 1 1    1   16    2 o  735.500   12.598  414.580   14.182   0.0000   0.0000  414.580   14.182  ?   ?   735.500   12.598 0.000000 12.59779 
1 1 1    1   16    3 o  860.398   9.6621  567.010   12.724  582.389   18.471  553.119   17.554  871.616   13.845  849.465   13.501 22.15076 19.33814 
1 1 1    1   16    4 o  684.101   8.6927  358.394   9.1022  358.205   12.908  358.582   12.837  683.696   12.335  684.061   12.261 -0.3646240 17.39143 
1 1 1    1   16    5 o  454.837   7.9631  158.410   5.5438  154.632   7.8055  162.256   7.8751  449.257   11.351  460.206   11.180 -10.94846 15.93225 
1 1 1    1   16    6 o  1108.32   11.346  941.093   19.248  943.041   27.352  939.182   27.090  1108.87   16.115  1106.62   15.994 2.253174 22.70458 
1 1 1    1   16    7 o  461.671   5.7696  163.163   4.0771  158.035   5.6946  168.555   5.8399  454.298   8.1894  469.176   8.1320 -14.87863 11.54107 
1 1 1    1   16    8 o  565.987   5.9102  245.228   5.1201  249.883   7.3190  240.767   7.1653  571.255   8.3705  560.738   8.3484 10.51611 11.82209 
1 1 1    1   16    9 o  444.587   5.7892  151.309   3.9396  153.864   5.6295  148.856   5.5150  448.269   8.2047  440.914   8.1719 7.355560 11.58003 
1 1 1    1   16   10 o  127.310   10.087   12.491   1.9495   12.241   2.7900   12.729   2.7251  125.506   14.809  128.100   14.134 -2.594147 20.47099 
1 1 1    1   16   11 o  796.962   6.7028  486.236   8.1765  483.489   11.529  489.017   11.598  794.587   9.4791  799.116   9.4823 -4.529053 13.40772 
1 1 1    1   16   12 o  687.462   6.3419  361.784   6.6733  364.354   9.5054  359.287   9.3710  689.809   9.0026  684.998   8.9377 4.810852 12.68582 
1 1 1    1   16   13 o  1114.06   8.1254  950.236   13.856  966.097   19.942  935.434   19.265  1123.09   11.601  1105.14   11.389 17.95032 16.25684 
1 1 1    1   16   14 o  504.414   6.0569  194.762   4.6764  192.942   6.5354  196.672   6.6942  502.000   8.5055  506.826   8.6292 -4.826141 12.11639 
1 1 1    1   16   15 o  522.571   7.0391  209.048   5.6303  204.608   9.5429  211.419   6.9733  516.858   12.063  525.489   8.6698 -8.630981 14.85494 
1 1 1    1   16   16 o  976.797   10.622  730.635   15.881  754.433   23.167  709.540   21.813  992.271   15.254  962.329   14.809 29.94263 21.25966 
1 1 1    1   16   17 o  699.496   7.6161  374.571   8.1543  366.612   9.9117  391.240   14.344  691.974   9.3581  714.689   13.112 -22.71533 16.10910 
1 1 1    1   16   18 o  723.582   6.7826  400.786   7.5120  393.137   10.430  409.030   10.828  716.567   9.5094  730.902   9.6791 -14.33502 13.56881 
1 1 1    1   16   19 o  1097.95   8.2586  922.892   13.879  944.959   20.099  902.779   19.188  1110.81   11.821  1085.75   11.546 25.05737 16.52451 
1 1 1    1   16   20 o  856.432   7.3562  561.490   9.6431  574.182   13.906  549.733   13.384  865.938   10.492  847.309   10.320 18.62970 14.71647 
1 1 1    1   16   21 o  705.568   6.9679  381.087   7.5250  377.231   10.530  385.113   10.758  701.904   9.8010  709.195   9.9104 -7.291321 13.93830 
1 1 1    1   16   22 o  294.190   8.5760   66.262   3.8618   65.496   5.4710   67.023   5.4517  292.425   12.223  295.818   12.040 -3.392365 17.15740 
1 1 1    1   16   23 o  297.157   8.8644   67.609   4.0318   67.738   5.6350   67.474   5.7712  297.378   12.380  296.792   12.704 0.5862732 17.73857 
1 1 1    1   16   24 o  1719.87   11.554  2265.55   30.415  2295.95   43.727  2237.05   42.333  1730.65   16.507  1708.36   16.190 22.29102 23.12098 
1 1 1    1   16   25 o  307.540   14.112   72.475   6.6428   69.006   9.0178   76.591   9.8225  299.257   19.799  315.276   20.465 -16.01965 28.47518 
1 1 1    1   16   26 o  1026.52   9.6355  806.948   15.140  810.304   18.390  799.891   26.669  1028.50   11.682  1021.34   17.059 7.158875 20.67577 
1 1 1    1   16   27 o  638.365   6.7353  311.974   6.5811  319.639   8.3966  299.765   10.597  646.098   8.4905  625.577   11.067 20.52063 13.94872 
1 1 1    1   16   28 o  1481.61   9.3682  1681.11   21.245  1659.46   26.897  1717.04   34.643  1471.73   11.940  1496.55   15.123 -24.82593 19.26867 
1 1 1    1   16   29 o  661.820   7.0784  335.349   7.1704  337.325   11.944  334.236   8.9656  663.529   11.761  660.644   8.8663 2.884949 14.72844 
1 1 1    1   16   30 o  745.814   6.4289  425.852   7.3390  424.781   10.395  426.916   10.363  744.739   9.1193  746.611   9.0678 -1.871948 12.86031 
1 1 1    1   16   31 o  439.562   7.0672  147.941   4.7549  139.220   6.7222  156.673   6.7266  426.295   10.302  452.253   9.7172 -25.95731 14.16200 
1 1 1    1   16   32 o  842.337   7.7814  543.362   10.033  546.335   14.220  540.415   14.156  844.370   11.003  839.782   11.013 4.588074 15.56774 
1 1 1    1   16   33 o  472.250   6.9397  170.777   5.0163  162.051   7.0109  179.930   7.1804  459.887   9.9598  484.609   9.6802 -24.72202 13.88901 
1 1 1    1   16   34 o  215.980   13.036   35.911   4.2894   18.615   8.1916   42.445   5.0348  151.674   35.851  234.770   14.076 -83.09587 38.51558 
1 1 1    1   16   35 o  113.752   23.520   10.350   3.9598  -3.9404   8.1827   14.720   4.5249   75.137   33.831  136.408   22.453 -61.27065 40.60397 
1 1 1    1   16   36 o  620.320   6.8871  294.736   6.5391  282.742   9.1445  307.286   9.3545  607.305   9.8374  633.135   9.6529 -25.83020 13.78232 
1 1 1    1   16   37 o  549.726   7.0767  231.507   5.9545  236.013   8.5606  227.284   8.2879  554.766   10.082  544.424   9.9457 10.34161 14.16173 
1 1 1    1   16   38 o  323.883   8.6017   80.415   4.2643   83.260   6.1799   77.829   5.8916  329.281   12.261  318.376   12.090 10.90533 17.21948 
1 1 1    1   16   39 o  734.853   8.9217  414.105   10.035  449.934   13.908  375.198   14.493  765.393   11.872  698.565   13.555 66.82776 18.01846 
1 1 1    1   16   40 o  404.935   9.0033  125.776   5.5803  129.548   7.9407  122.096   7.8436  410.509   12.638  398.497   12.859 12.01239 18.02982 
1 1 1    1   16   41 o  246.000   10.800   46.482   4.0665   47.964   5.6520   44.890   5.8551  249.052   14.895  240.720   15.982 8.331940 21.84663 
1 1 1    1   16   42 o  586.409   10.356  264.145   9.2949  264.145   9.2949   0.0000   0.0000  586.409   10.356  ?   ?  0.000000 10.35558 
1 1 1    1   16   43 o  267.149   12.318   54.936   5.0369   41.324   9.9080   59.680   5.8491  227.031   29.188  278.250   13.734 -51.21869 32.25765 
1 1 1    1   16   44 o  227.829   11.177   39.934   3.8977   38.314   5.5443   41.517   5.4808  221.895   16.441  231.223   15.577 -9.328415 22.64824 
1 1 1    1   16   45 o  207.971   12.723   33.475   4.0305   35.283   5.8113   31.799   5.5948  212.364   18.049  201.460   18.345 10.90373 25.73532 
1 1 1    1   16   46 o  305.046   9.9841   71.584   4.6617   64.188   6.8545   77.949   6.3587  287.372   15.642  317.734   13.075 -30.36172 20.38695 
1 1 1    1   16   47 o  278.115   10.362   59.560   4.4112   54.651   6.0436   65.158   6.4532  265.123   14.954  289.663   14.602 -24.53989 20.90066 
1 1 1    1   16   48 o  416.863   14.015  134.606   8.9422  125.924   12.448  143.864   12.854  400.045   20.397  428.514   19.598 -28.46835 28.28616 
1 1 1    1   16   49 o  226.054   12.873   39.660   4.4356   39.085   6.3398   40.211   6.2081  222.674   18.776  226.111   18.089 -3.436462 26.07216 
1 1 1    1   16   50 o  191.817   14.127   28.705   4.1184   32.347   5.8113   25.030   5.8375  202.193   19.000  176.595   22.079 25.59752 29.12864 
1 1 1    1   16   51 o  123.029   21.902   12.327   3.9733   11.039   5.7049   13.541   5.5369  113.948   31.604  126.678   29.160 -12.73081 43.00121 
1 1 1    1   16   52 o  194.765   16.103   29.837   4.7575   22.797   6.6724   37.117   6.7851  165.839   27.232  215.527   20.827 -49.68790 34.28319 
1 1 1    1   16   53 o   79.903   24.445   5.1933   3.2684   3.6954   5.5391   5.9934   4.0482   79.731   31.222   85.900   27.346 -6.169487 41.50413 
1 1 1    1   16   54 o  203.616   12.113   32.278   3.7580   31.410   4.7246   33.774   6.2007  199.747   15.576  205.375   19.978 -5.628067 25.33272 
1 1 1    1   16   55 o   90.005   23.946   6.7970   3.3566   6.2622   5.1347   7.1961   4.4356   88.801   30.864   92.546   28.505 -3.744858 42.01307 
1 1 1    1   16   56 o  135.352   16.388   14.637   3.3260   13.606   4.5923   15.776   4.8236  127.297   24.458  137.623   23.758 -10.32568 34.09715 
1 1 1    1   16   57 o  295.451   13.215   68.285   5.9761   67.892   8.2742   68.713   8.6408  290.956   18.678  292.173   19.432 -1.217224 26.95338 
1 1 1    1   16   58 o   77.218   24.407   4.9618   3.2292   11.658   4.5068  -2.1040   4.6294  116.097   26.007   54.749   24.965 61.34815 36.04985 
1 1 1    1   16   59 o  181.643   14.757   26.252   4.0673   15.542   6.6506   32.651   5.1408  129.465   33.355  201.595   16.814 -72.12996 37.35307 
1 1 1    1   16   60 o  152.992   17.107   19.034   3.9375   19.963   4.8774   17.294   6.6720  154.403   21.197  135.969   32.500 18.43466 38.80209 
1 1 1    1   16   61 o  181.334   16.165   26.661   4.4396   30.152   6.3631   23.350   6.1972  188.180   22.540  162.974   25.694 25.20526 34.17974 
1 1 1    1   16   62 o  112.158   19.694   10.686   3.2575   8.7823   4.7210   12.415   4.5004   96.564   29.346  117.263   25.777 -20.69920 39.05877 
1 1 1    1   17    2 o  351.369   11.791   94.586   6.3413   0.0000   0.0000   94.586   6.3413  ?   ?   351.369   11.791 0.000000 11.79085 
1 1 1    1   17    3 o  1464.55   13.989  1643.96   31.359  1630.09   43.970  1658.32   44.736  1457.29   19.713  1469.82   19.885 -12.52856 27.99992 
1 1 1    1   17    4 o  953.185   10.364  695.893   15.121  694.669   21.384  697.116   21.384  951.964   14.676  953.642   14.650 -1.677979 20.73618 
1 1 1    1   17    5 o  1091.83   11.278  913.168   18.847  908.218   26.553  918.195   26.756  1088.36   15.939  1094.32   15.974 -5.956787 22.56602 
1 1 1    1   17    6 o  415.503   6.7132  132.168   4.2695  132.650   5.2235  131.197   7.4107  416.228   8.1990  413.841   11.699 2.387115 14.28620 
1 1 1    1   17    7 o  293.792   6.2828   66.075   2.8253   65.484   3.9774   66.677   4.0140  292.437   8.8858  295.087   8.8871 -2.650635 12.56733 
1 1 1    1   17    8 o  1367.68   9.4084  1432.38   19.695  1432.07   27.847  1432.69   27.860  1367.13   13.308  1367.43   13.311 -0.2941895 18.82218 
1 1 1    1   17    9 o  1403.11   9.5997  1507.56   20.617  1497.38   28.945  1518.05   29.373  1397.96   13.527  1407.57   13.633 -9.605469 19.20559 
1 1 1    1   17   10 o  474.295   5.9554  172.198   4.3234  170.738   6.0909  173.681   6.1379  472.229   8.4268  476.281   8.4195 -4.052582 11.91211 
1 1 1    1   17   11 o  702.844   6.4355  378.148   6.9232  372.514   9.6715  384.068   9.9149  697.508   9.0589  708.239   9.1462 -10.73077 12.87308 
1 1 1    1   17   12 o  272.067   6.7524   56.663   2.8119   54.350   3.9177   59.121   4.0384  266.422   9.6071  277.871   9.4949 -11.44919 13.50740 
1 1 1    1   17   13 o  537.213   7.0370  220.926   5.7863  231.996   10.303  215.826   6.9934  550.363   12.230  530.942   8.6054 19.42139 14.95449 
1 1 1    1   17   14 o  929.886   10.341  662.115   14.718  672.552   21.151  652.317   20.494  936.924   14.749  922.738   14.510 14.18585 20.69018 
1 1 1    1   17   15 o  1298.70   10.511  1291.48   20.893  1296.44   25.718  1281.86   35.832  1301.01   12.915  1293.16   18.103 7.846436 22.23749 
1 1 1    1   17   16 o  550.368   6.3371  231.862   5.3384  232.462   7.5310  231.256   7.5684  551.027   8.9292  549.594   8.9969 1.432556 12.67576 
1 1 1    1   17   17 o  1226.96   8.8309  1152.56   16.585  1143.38   23.267  1162.04   23.646  1221.84   12.441  1231.77   12.542 -9.923340 17.66573 
1 1 1    1   17   18 o  391.913   6.8459  117.576   4.1067  116.023   5.7771  119.162   5.8389  389.272   9.6958  394.503   9.6696 -5.230438 13.69346 
1 1 1    1   17   19 o  360.016   7.2043   99.219   3.9699   98.353   5.5844  100.104   5.6447  358.395   10.180  361.572   10.200 -3.176941 14.41043 
1 1 1    1   17   20 o  985.483   7.8774  743.494   11.882  737.999   16.685  749.148   16.926  981.679   11.104  989.062   11.180 -7.382935 15.75774 
1 1 1    1   17   21 f  1045.54   8.1840  836.901   13.097  850.000   18.798  824.544   18.258  1053.49   11.658  1037.60   11.496 15.88440 16.37248 
1 1 1    1   17   22 o  445.418   7.2581  151.882   4.9483  151.625   6.9934  152.139   7.0026  444.974   10.268  445.729   10.264 -0.7545776 14.51832 
1 1 1    1   17   23 o  897.046   7.7422  616.063   10.630  614.599   14.967  617.554   15.102  895.819   10.915  897.966   10.987 -2.147217 15.48757 
1 1 1    1   17   24 o  653.031   10.843  326.613   10.838  354.346   16.171  303.994   14.603  679.924   15.538  629.790   15.149 50.13416 21.70084 
1 1 1    1   17   25 o  839.328   7.9093  539.370   10.161  545.077   14.756  534.223   14.013  843.563   11.428  835.151   10.962 8.411682 15.83571 
1 1 1    1   17   26 o  838.227   7.9724  537.973   10.229  539.159   14.517  536.804   14.415  838.957   11.305  837.126   11.250 1.830322 15.94862 
1 1 1    1   17   27 o  1338.33   8.7404  1371.58   17.905  1358.16   22.757  1393.40   29.008  1331.52   11.166  1348.31   14.056 -16.79065 17.95123 
1 1 1    1   17   28 o  1093.51   7.8861  915.596   13.199  923.340   21.373  910.822   16.782  1097.68   12.721  1090.48   10.054 7.196167 16.21483 
1 1 1    1   17   29 o  636.911   7.1776  310.594   6.9972  323.525   8.9563  290.337   11.210  649.949   9.0028  615.548   11.898 34.40082 14.92009 
1 1 1    1   17   30 o  283.937   9.9638   61.758   4.3303   64.811   5.2328   55.125   7.7128  290.817   11.756  267.258   18.978 23.55865 22.32377 
1 1 1    1   17   31 o  545.842   7.3160  228.148   6.1124  220.888   8.5628  235.691   8.7280  536.932   10.419  554.640   10.281 -17.70825 14.63742 
1 1 1    1   17   32 o  646.173   7.4851  319.759   7.4031  320.847   12.609  319.187   9.1456  646.869   12.734  645.482   9.2567 1.386963 15.74328 
1 1 1    1   17   33 o  352.338   9.2770   95.116   5.0031  109.428   9.5444   89.694   5.8749  377.447   16.520  342.057   11.221 35.39029 19.97088 
1 1 1    1   17   34 o  389.183   7.4048  116.013   4.4110  119.262   6.3267  112.941   6.1531  394.430   10.479  383.834   10.473 10.59540 14.81580 
1 1 1    1   17   35 o  901.985   6.9218  623.155   9.5562  625.221   13.560  621.117   13.470  903.104   9.8096  900.140   9.7763 2.963989 13.84934 
1 1 1    1   17   36 o  623.175   6.7706  297.473   6.4581  294.161   9.0384  300.927   9.2310  619.425   9.5331  626.498   9.6263 -7.072754 13.54786 
1 1 1    1   17   37 o  202.838   11.780   31.689   3.6415   29.734   5.1252   33.682   5.1749  195.722   17.286  208.550   16.342 -12.82780 23.78774 
1 1 1    1   17   38 o  157.592   14.526   19.265   3.4643   16.333   4.9202   22.148   4.8787  143.387   23.212  168.279   19.289 -24.89143 30.18043 
1 1 1    1   17   39 o  784.381   8.4623  471.785   10.160  461.737   14.162  482.440   14.584  775.234   11.935  792.401   12.024 -17.16620 16.94172 
1 1 1    1   17   40 o  432.101   7.5282  143.137   4.9790  134.895   6.9136  152.018   7.1767  419.101   10.777  444.941   10.538 -25.83994 15.07308 
1 1 1    1   17   41 o  563.637   8.2724  243.686   7.1368  250.560   8.7530  230.051   12.327  571.229   10.011  546.288   14.742 24.94104 17.82001 
1 1 1    1   17   42 o  298.723   15.196   69.049   6.9251   73.115   9.8003   64.994   9.7867  305.904   21.059  287.946   22.381 17.95773 30.73117 
1 1 1    1   17   43 o  470.788   9.0824  170.196   6.5448  142.859   11.728  182.561   7.8872  429.268   17.849  487.299   10.574 -58.03027 20.74625 
1 1 1    1   17   44 o  369.147   8.8419  104.658   4.9959  102.049   6.7973  107.723   7.3677  363.937   12.202  373.774   12.878 -9.837463 17.74101 
1 1 1    1   17   45 o  282.639   15.009   61.993   6.4700   0.0000   0.0000   61.993   6.4700  ?   ?   282.639   15.009 0.000000 15.00946 
1 1 1    1   17   46 o  196.387   16.159   30.136   4.8143   32.332   5.4068   21.730   10.577  203.094   17.566  157.886   42.727 45.20854 46.19726 
1 1 1    1   17   47 o  140.809   22.455   15.981   4.6770   14.634   5.2203   21.465   10.529  133.389   26.503  156.337   42.765 -22.94858 50.31158 
1 1 1    1   17   48 o  157.480   16.259   19.493   3.8627   17.962   5.6519   20.836   5.2914  148.180   25.860  161.180   22.024 -12.99915 33.96761 
1 1 1    1   17   49 o  136.121   19.052   14.793   3.8607   10.858   5.3462   19.081   5.5812  113.563   30.224  153.038   24.664 -39.47553 39.01067 
1 1 1    1   17   50 o  103.429   24.428   8.8670   3.8055   12.275   5.6679   6.0700   5.1349  120.298   30.684   89.094   30.870 31.20428 43.52575 
1 1 1    1   17   51 o  515.872   9.4119  205.093   7.4317  220.674   10.813  191.145   10.231  533.295   13.247  496.219   13.470 37.07605 18.89253 
1 1 1    1   17   52 o  128.253   21.991   13.427   4.1616   11.275   5.7229   15.842   6.0624  114.648   31.598  136.506   29.847 -21.85858 43.46550 
1 1 1    1   17   53 o  110.832   29.449   10.501   5.0808   11.940   5.7022   4.9539   11.193  117.664   31.166  102.190   42.740 15.47441 52.89621 
1 1 1    1   17   54 o  270.665   12.131   56.879   5.0256   55.845   6.7740   58.145   7.4950  266.011   16.722  270.707   18.194 -4.696777 24.71154 
1 1 1    1   17   55 o   80.857   31.361   4.1753   5.5475   19.165   11.740  -0.1338   6.2946  140.695   46.701   70.301   30.757 70.39421 55.91949 
1 1 1    1   17   56 o  287.996   15.303   65.425   6.7215   35.769   11.078   82.703   8.4557  197.818   37.968  322.659   17.183 -124.8413 41.67574 
1 1 1    1   17   57 o  155.437   20.651   19.823   4.7917   14.599   7.2085   23.958   6.4137  125.428   35.788  168.212   25.728 -42.78462 44.07652 
1 1 1    1   17   58 o   76.861   28.325   4.4467   4.3913   3.2334   6.1666   5.6949   6.2547   78.235   32.127   87.124   33.432 -8.888443 46.36671 
1 1 1    1   17   59 o   99.141   29.622   8.8504   4.8404  -0.9892   6.2671   23.397   7.6202   66.185   29.720  159.936   32.241 -93.75149 43.84968 
1 1 1    1   17   60 o   63.063   26.522   1.4686   4.3478  -2.1118   6.3072   4.7104   6.0016   63.123   28.918   80.974   32.249 -17.85171 43.31550 
1 1 1    1   17   61 o  215.129   19.656   38.545   6.4008   37.511   8.9348   39.635   9.1742  202.316   29.740  208.136   29.634 -5.819595 41.98407 
1 1 1    1   17   62 o   86.194   26.525   6.7802   3.8418   11.050   6.7808   4.7613   4.6623  104.083   35.498   76.408   28.972 27.67502 45.82003 
1 1 1    1   18    2 o  778.356   13.326  464.180   15.876   0.0000   0.0000  464.180   15.876  ?   ?   778.356   13.326 0.000000 13.32594 
1 1 1    1   18    3 o  553.164   8.5047  234.285   7.2009  228.890   10.083  239.901   10.287  546.632   12.051  559.628   12.010 -12.99615 17.01344 
1 1 1    1   18    4 o  547.661   8.5724  229.647   7.1860  222.960   10.029  236.701   10.301  539.506   12.145  555.883   12.107 -16.37769 17.14880 
1 1 1    1   18    5 o  766.417   9.3878  449.781   11.013  446.109   15.480  453.544   15.670  763.080   13.254  769.410   13.306 -6.329529 18.78075 
1 1 1    1   18    6 f  858.974   9.9119  565.004   13.032  556.884   18.154  573.636   18.718  852.540   13.912  865.252   14.134 -12.71252 19.83204 
1 1 1    1   18    7 o  765.748   7.7045  448.910   9.0303  446.529   11.002  453.827   15.808  763.651   9.4126  769.664   13.419 -6.013550 16.39083 
1 1 1    1   18    8 o  1776.46   11.641  2417.00   31.652  2440.14   45.273  2394.88   44.271  1784.26   16.577  1767.66   16.362 16.59216 23.29221 
1 1 1    1   18    9 o  499.106   6.0648  190.682   4.6332  184.474   6.4805  197.173   6.6265  490.864   8.6254  507.480   8.5309 -16.61578 12.13154 
1 1 1    1   18   10 o  187.644   9.4776   27.028   2.7133   25.242   4.6668   27.941   3.3348  180.672   17.078  190.662   11.481 -9.990112 20.57833 
1 1 1    1   18   11 f  1468.58   11.566  1651.69   25.998  1683.73   45.726  1636.38   31.603  1481.74   20.161  1461.52   14.127 20.22180 24.61838 
1 1 1    1   18   12 o  182.184   11.924   25.528   3.3067   22.475   4.6614   28.621   4.6914  170.268   18.166  192.595   16.061 -22.32790 24.24809 
1 1 1    1   18   13 o  293.803   7.8895   66.082   3.5480   65.042   4.3913   68.036   6.0212  291.459   9.8434  298.036   13.199 -6.577240 16.46531 
1 1 1    1   18   14 o  674.583   6.5513  348.336   6.7644  343.995   9.4654  352.868   9.6705  670.299   9.2258  678.885   9.3064 -8.586853 13.10437 
1 1 1    1   18   15 o  673.485   6.6100  347.205   6.8139  349.628   9.6852  344.830   9.5882  675.761   9.3636  671.109   9.3341 4.652344 13.22134 
1 1 1    1   18   16 o  585.270   6.5832  262.206   5.8974  258.986   8.2018  265.654   8.4858  581.607   9.2132  589.041   9.4119 -7.434814 13.17068 
1 1 1    1   18   17 o  1020.37   7.9402  797.053   12.401  789.090   17.312  805.445   17.773  1015.10   11.142  1025.56   11.322 -10.45581 15.88492 
1 1 1    1   18   18 o  494.870   6.7459  187.466   5.1097  190.807   7.2829  184.227   7.1709  499.203   9.5315  490.519   9.5509 8.683594 13.49332 
1 1 1    1   18   19 o  538.274   6.7945  221.796   5.5980  223.909   7.9304  219.696   7.9033  540.767   9.5810  535.655   9.6394 5.112610 13.59099 
1 1 1    1   18   20 o  945.713   7.7698  684.705   11.247  682.123   15.820  687.344   15.993  943.773   10.951  947.373   11.029 -3.600342 15.54264 
1 1 1    1   18   21 o  1090.81   8.3989  911.000   14.023  930.282   20.239  893.195   19.448  1102.06   11.998  1079.89   11.766 22.17383 16.80453 
1 1 1    1   18   22 o  807.277   8.6596  498.982   10.700  497.654   13.030  501.732   18.750  806.112   10.561  809.115   15.140 -3.003601 18.45944 
1 1 1    1   18   23 o  298.133   13.909   68.109   6.3471   74.032   9.0707   62.427   8.8844  310.059   19.208  284.483   20.542 25.57596 28.12267 
1 1 1    1   18   24 o  951.598   8.1232  693.334   11.832  685.452   16.623  701.427   16.845  945.960   11.481  956.919   11.500 -10.95850 16.25013 
1 1 1    1   18   25 o  1071.49   8.6441  879.130   14.177  878.766   20.092  879.490   20.006  1070.98   12.257  1071.42   12.199 -0.4465332 17.29301 
1 1 1    1   18   26 o  640.133   7.8955  313.754   7.7360  314.722   10.992  312.803   10.890  640.964   11.204  639.010   11.134 1.953857 15.79502 
1 1 1    1   18   27 o  446.868   9.0294  152.929   6.1760  150.881   8.6501  155.058   8.8209  443.719   12.736  449.815   12.812 -6.096130 18.06528 
1 1 1    1   18   28 f  272.552   12.487   56.929   5.2091   52.108   7.2950   61.944   7.4407  259.896   18.458  283.610   17.222 -23.71402 25.24478 
1 1 1    1   18   29 o  879.392   6.6254  592.090   8.9180  596.539   12.706  587.770   12.520  882.502   9.4066  875.997   9.3373 6.504395 13.25397 
1 1 1    1   18   30 o  389.673   11.257  116.364   6.7141  116.364   6.7141   0.0000   0.0000  389.673   11.257  ?   ?  0.000000 11.25681 
1 1 1    1   18   31 o  394.053   10.634  118.994   6.4138  120.501   9.2559  117.603   8.8957  396.261   15.260  391.496   14.845 4.765137 21.28986 
1 1 1    1   18   32 o  494.324   6.7049  187.121   5.0731  180.730   7.2290  193.323   7.1212  485.649   9.7250  502.313   9.2620 -16.66464 13.42984 
1 1 1    1   18   33 o  775.850   6.6114  460.980   7.8513  466.252   11.208  455.900   11.002  780.013   9.3878  771.313   9.3187 8.700073 13.22751 
1 1 1    1   18   34 o  261.806   9.1769   52.532   3.6775   55.776   5.2964   49.512   5.1100  269.585   12.836  253.634   13.208 15.95137 18.41777 
1 1 1    1   18   35 o  357.719   9.4731   98.101   5.1868   64.296   9.4621  112.622   6.2016  287.766   21.641  383.201   10.573 -95.43536 24.08549 
1 1 1    1   18   36 f  523.179   6.8638  209.691   5.4965  213.231   7.8688  206.318   7.6809  527.305   9.7494  518.695   9.6746 8.609619 13.73493 
1 1 1    1   18   37 o  549.170   6.9361  231.077   5.8303  230.288   8.2409  231.867   8.2498  547.912   9.8263  549.791   9.8034 -1.878662 13.88031 
1 1 1    1   18   38 o   92.888   29.227   6.6944   4.6353   6.6944   4.6353   0.0000   0.0000   92.888   29.227  ?   ?  0.000000 29.22717 
1 1 1    1   18   39 o  117.890   18.258   10.986   3.1880   10.524   4.4363   11.479   4.5845  113.937   26.011  119.080   25.891 -5.143692 36.69979 
1 1 1    1   18   40 o  302.795   10.550   70.422   4.8896   64.139   5.6315   89.670   9.8562  288.731   12.743  339.785   19.028 -51.05359 22.90038 
1 1 1    1   18   41 o  300.708   11.201   69.516   5.1555   66.728   9.8148   70.578   6.0586  291.927   22.130  302.751   13.074 -10.82367 25.70342 
1 1 1    1   18   42 o  490.946   8.6179  185.005   6.4760  174.624   11.453  189.884   7.8516  475.345   15.742  497.061   10.320 -21.71564 18.82301 
1 1 1    1   18   43 o  214.465   11.108   35.485   3.6340   37.086   5.2426   34.004   5.0419  218.390   15.790  209.051   15.875 9.338730 22.39095 
1 1 1    1   18   44 o  136.500   23.385   15.014   4.7102   15.782   5.1288   10.880   11.902  139.597   24.917  123.929   46.444 15.66816 52.70577 
1 1 1    1   18   45 o  402.340   9.9608  124.546   6.1342  126.519   7.2784  119.707   11.397  405.099   11.738  391.720   19.008 13.37875 22.34041 
1 1 1    1   18   46 o   87.547   24.827   6.2422   3.4800  -1.0198   5.0756   12.685   4.7806   62.311   27.430  124.191   25.984 -61.87963 37.78346 
1 1 1    1   18   47 o  161.346   15.379   20.390   3.7520   22.584   5.4430   18.404   5.1790  168.093   21.659  151.021   23.142 17.07179 31.69683 
1 1 1    1   18   48 o  193.038   12.868   28.958   3.7804   29.419   5.4436   28.528   5.2539  192.993   18.661  190.142   18.278 2.851074 26.12092 
1 1 1    1   18   49 o   57.490   23.929   0.7757   3.4846  -2.9170   4.6703   5.4128   5.2336   54.208   24.852   86.437   31.058 -32.22912 39.77724 
1 1 1    1   18   50 o  172.098   15.698   23.273   4.0897   31.554   6.3320   17.347   5.3569  198.679   21.147  145.357   24.977 53.32249 32.72704 
1 1 1    1   18   51 o  213.965   14.694   35.818   4.7831   34.641   6.9370   36.884   6.6039  207.558   22.179  215.058   20.302 -7.500198 30.06796 
1 1 1    1   18   52 o  199.613   14.376   31.200   4.3628   29.604   5.9900   33.004   6.3671  192.103   20.698  202.898   20.796 -10.79544 29.34088 
1 1 1    1   18   53 o   74.623   29.567   3.0008   5.0209  -2.0374   5.5765   24.572   11.539   61.831   27.876  161.299   45.021 -99.46743 52.95227 
1 1 1    1   18   54 f  101.886   31.733   8.8857   5.4797   0.7602   12.174   10.950   6.1365   95.376   42.209  111.868   33.336 -16.49272 53.78574 
1 1 1    1   18   55 o  157.812   19.013   20.092   4.5001   25.067   6.2961   14.896   6.4344  173.872   24.324  129.563   32.501 44.30891 40.59524 
1 1 1    1   18   56 o   77.740   28.914   4.3740   4.5961   0.8920   6.3963   8.0910   6.6087   72.877   31.449   98.129   34.939 -25.25192 47.00820 
1 1 1    1   18   57 o   97.288   27.102   8.2495   4.1858   6.8195   5.9139   9.6850   5.9254   91.160   32.980  103.925   33.084 -12.76557 46.71452 
1 1 1    1   18   58 o   89.479   28.567   6.9599   4.4155   6.6213   6.0615   7.3427   6.4451   89.924   33.253   93.424   34.333 -3.500008 47.79652 
1 1 1    1   18   59 o   57.890   25.330   0.0105   4.2703  -7.8289   6.2047   7.0655   5.8861   52.629   25.428   90.395   32.872 -37.76613 41.55892 
1 1 1    1   18   60 o  173.745   16.437   24.527   4.3194   20.820   5.9989   28.518   6.2246  153.163   26.551  182.878   22.727 -29.71506 34.94957 
1 1 1    1   18   61 o   72.230   27.777   3.9492   4.3233   4.2110   6.2839   3.7139   5.9573   78.708   32.389   76.179   31.463 2.529762 45.15491 
1 1 1    1   19    2 o  224.809   14.732   38.889   5.0413   0.0000   0.0000   38.889   5.0413  ?   ?   224.809   14.732 0.000000 14.73216 
1 1 1    1   19    3 o  1754.83   16.315  2360.04   43.821  2340.66   61.372  2380.19   62.591  1746.41   22.959  1761.03   23.220 -14.62878 32.65438 
1 1 1    1   19    4 o  595.604   8.8067  271.601   8.0286  267.854   11.194  275.571   11.522  591.365   12.366  599.817   12.550 -8.451721 17.61889 
1 1 1    1   19    5 o  1347.31   13.259  1390.49   27.344  1346.80   37.357  1440.91   40.133  1325.42   18.414  1370.85   19.127 -45.43445 26.54996 
1 1 1    1   19    6 o  1230.43   17.524  1160.45   33.003   0.0000   0.0000  1160.45   33.003  ?   ?   1230.43   17.524 0.000000 17.52399 
1 1 1    1   19    7 o  188.272   12.107   27.260   3.4704   24.263   4.8696   30.352   4.9470  176.974   18.238  198.335   16.444 -21.36180 24.55699 
1 1 1    1   19    8 o  702.971   9.2322  378.351   9.9338  385.405   14.239  371.664   13.865  709.343   13.115  696.588   13.004 12.75500 18.46898 
1 1 1    1   19    9 o  1243.39   10.279  1183.79   19.563  1183.69   24.027  1183.98   33.699  1243.18   12.627  1242.87   17.714 0.3088379 21.75393 
1 1 1    1   19   10 o  1265.77   10.346  1226.79   20.044  1232.90   24.716  1215.04   34.260  1268.76   12.727  1259.07   17.777 9.687378 21.86344 
1 1 1    1   19   11 o  1406.45   9.6969  1514.55   20.875  1516.92   29.574  1512.19   29.469  1407.24   13.730  1405.05   13.703 2.190918 19.39807 
1 1 1    1   19   12 o  534.586   6.3819  218.755   5.2220  212.788   7.2687  225.120   7.5072  527.194   9.0077  542.255   9.0450 -15.06122 12.76520 
1 1 1    1   19   13 o  732.044   6.8279  410.213   7.6506  414.501   10.899  406.047   10.742  735.778   9.6776  728.237   9.6370 7.540527 13.65751 
1 1 1    1   19   14 o  457.971   6.5581  160.548   4.5971  158.005   6.4415  163.188   6.5628  454.282   9.2638  461.673   9.2872 -7.390717 13.11754 
1 1 1    1   19   15 o  1659.01   11.115  2107.64   28.225  2074.53   39.132  2143.55   40.749  1645.44   15.538  1672.55   15.917 -27.10181 22.24369 
1 1 1    1   19   16 o  683.303   6.8689  357.412   7.1841  358.586   10.153  356.236   10.167  684.343   9.6927  682.095   9.7380 2.247681 13.73958 
1 1 1    1   19   17 o  575.794   6.7770  253.792   5.9728  245.367   8.2760  262.949   8.6285  566.089   9.5514  586.018   9.6196 -19.92889 13.55600 
1 1 1    1   19   18 o  386.936   7.2841  114.615   4.3140  114.024   6.0143  115.242   6.1915  385.883   10.183  387.933   10.427 -2.049835 14.57433 
1 1 1    1   19   19 o  601.024   6.9017  276.530   6.3492  278.580   9.0162  274.514   8.9425  603.165   9.7660  598.748   9.7577 4.417236 13.80535 
1 1 1    1   19   20 o  959.037   7.8926  704.162   11.586  734.298   16.973  677.872   15.853  979.151   11.325  940.798   11.009 38.35333 15.79442 
1 1 1    1   19   21 o  1444.43   14.346  1598.81   31.717  1577.38   44.172  1621.62   45.571  1433.82   20.127  1453.72   20.480 -19.89978 28.71484 
1 1 1    1   19   22 o  606.794   8.4832  281.922   7.8790  295.430   14.269  275.997   9.4503  620.845   15.015  600.316   10.285 20.52869 18.19987 
1 1 1    1   19   23 o  722.561   7.5659  399.726   8.3677  394.401   11.820  405.077   11.848  717.585   10.762  727.239   10.643 -9.654114 15.13584 
1 1 1    1   19   24 o  988.668   8.3784  748.456   12.679  749.068   17.962  747.848   17.899  988.814   11.868  988.011   11.836 0.8026733 16.76120 
1 1 1    1   19   25 o  268.384   11.657   55.184   4.7888   57.264   6.8896   53.240   6.6610  272.746   16.582  262.947   16.636 9.798889 23.48848 
1 1 1    1   19   26 o  742.064   8.0984  421.658   9.1983  411.231   12.876  432.525   13.145  732.629   11.482  751.361   11.430 -18.73212 16.20135 
1 1 1    1   19   27 o  985.473   8.6102  743.733   12.988  745.210   18.414  742.272   18.321  986.122   12.200  984.181   12.162 1.941345 17.22626 
1 1 1    1   19   28 o  886.685   8.6076  602.130   11.682  600.249   16.636  603.960   16.408  884.969   12.282  887.723   12.076 -2.753540 17.22383 
1 1 1    1   19   29 o  1295.10   13.696  1286.22   27.150  1308.21   39.154  1265.86   37.681  1304.76   19.606  1283.58   19.179 21.18127 27.42668 
1 1 1    1   19   30 o  530.734   7.5318  215.719   6.1185  202.332   10.187  223.273   7.6526  513.664   12.957  539.854   9.2611 -26.19067 15.92619 
1 1 1    1   19   31 o  634.089   6.4301  307.879   6.2408  307.976   8.8127  307.781   8.8390  634.014   9.0811  633.811   9.1112 0.2028198 12.86390 
1 1 1    1   19   32 o  254.050   9.0803   49.456   3.5309   48.324   4.9872   50.594   4.9998  250.622   13.046  256.801   12.720 -6.179855 18.22062 
1 1 1    1   19   33 o  370.830   8.8532  105.383   5.0251  118.822   6.1090   77.263   8.8367  393.685   10.138  316.308   18.330 77.37619 20.94722 
1 1 1    1   19   34 o  658.409   6.6325  332.045   6.6841  335.884   9.5154  328.305   9.3913  661.925   9.3917  654.416   9.3756 7.509338 13.27055 
1 1 1    1   19   35 o  473.384   6.9607  171.679   5.0435  178.171   7.2480  165.584   7.0226  482.005   9.8242  464.662   9.8739 17.34351 13.92874 
1 1 1    1   19   36 f   59.534   22.618   1.9430   2.8449   2.9633   4.0109   0.9099   4.0359   71.581   26.934   62.701   25.896 8.879543 37.36408 
1 1 1    1   19   37 o  770.193   8.1675  454.784   9.6285  463.302   13.804  446.712   13.437  776.674   11.612  762.665   11.511 14.00928 16.35009 
1 1 1    1   19   38 o   52.704   21.734   0.6553   2.8369   5.1455   4.0078  -3.8540   4.0163   82.806   27.277   47.580   22.238 35.22604 35.19311 
1 1 1    1   19   39 o  531.013   8.2083  216.265   6.6715  215.606   8.0429  217.717   11.945  529.942   9.9155  531.536   14.682 -1.593445 17.71671 
1 1 1    1   19   40 o  419.942   7.4815  135.231   4.8090  125.830   6.7150  145.128   6.8902  404.646   10.842  434.646   10.357 -30.00031 14.99357 
1 1 1    1   19   41 o  192.152   14.649   28.654   4.2760   35.954   8.8551   26.434   4.8830  211.893   27.988  183.945   17.556 27.94765 33.03832 
1 1 1    1   19   42 o  427.221   7.6445  140.033   4.9989  145.274   7.0711  134.796   7.0679  434.637   10.629  418.592   11.031 16.04504 15.31882 
1 1 1    1   19   43 o  546.542   9.6930  229.619   8.1087  230.760   9.2109  225.690   17.094  547.553   10.990  537.600   20.774 9.953064 23.50208 
1 1 1    1   19   44 o  200.686   14.733   31.333   4.4941   28.963   5.0604   40.180   9.7768  192.282   17.382  222.506   29.429 -30.22443 34.17904 
1 1 1    1   19   45 o  235.021   10.588   42.542   3.8087   43.942   5.4051   41.161   5.3678  237.662   14.934  229.886   15.343 7.776443 21.41146 
1 1 1    1   19   46 o  298.799   9.3286   68.688   4.2664   64.003   6.0052   73.464   6.0626  287.571   13.643  308.287   12.848 -20.71579 18.74034 
1 1 1    1   19   47 o   66.729   24.630   2.8794   3.3224  -0.6817   4.6368   6.6367   4.7628   60.304   26.390   91.404   29.718 -31.10041 39.74376 
1 1 1    1   19   48 o  187.278   13.423   27.311   3.8221   28.524   5.4703   26.153   5.3425  189.794   19.089  181.512   19.537 8.282120 27.31514 
1 1 1    1   19   49 o   70.464   26.071   3.2632   3.7270   7.3754   5.3064  -0.7406   5.2360   95.670   31.381   63.728   27.962 31.94241 42.03087 
1 1 1    1   19   50 o   69.958   26.407   3.0641   3.8621   4.3148   5.5143   1.8599   5.4109   82.392   31.444   72.759   30.012 9.633324 43.46783 
1 1 1    1   19   51 o  233.489   12.463   42.391   4.4380   38.640   6.1977   46.339   6.3580  220.785   18.511  242.441   17.246 -21.65662 25.29947 
1 1 1    1   19   52 o  190.384   18.199   28.814   5.2387   28.721   5.9087   29.157   11.327  189.032   20.763  178.329   42.161 10.70317 46.99648 
1 1 1    1   19   53 o   72.305   29.382   2.3526   5.0900 -13.1655   12.038   5.7308   5.6168   75.078   36.056   87.755   32.081 -12.67684 48.26192 
1 1 1    1   19   54 o  199.783   15.812   31.557   4.7957   27.188   6.7724   35.951   6.7920  181.003   25.122  210.645   21.361 -29.64166 32.97601 
1 1 1    1   19   55 o  153.930   20.578   19.339   4.7271   23.034   6.6233   15.504   6.7486  164.652   27.233  131.318   33.475 33.33504 43.15322 
1 1 1    1   19   56 o  111.263   30.360   11.014   5.3143   5.0755   10.139   13.263   6.2401   95.983   40.441  120.936   32.856 -24.95280 52.10608 
1 1 1    1   19   57 o  131.012   22.458   14.408   4.3414   17.323   5.9246   11.027   6.3799  140.450   28.533  109.570   34.259 30.87975 44.58448 
1 1 1    1   19   58 o  190.789   16.212   29.250   4.6894   28.762   6.5703   29.758   6.6951  184.276   23.854  187.460   23.875 -3.184006 33.74958 
1 1 1    1   19   59 o  105.056   26.286   9.8788   4.2164   5.6993   6.0133   13.921   5.9137   84.602   32.696  121.691   31.503 -37.08912 45.40355 
1 1 1    1   19   60 o  185.833   14.883   27.811   4.1978   23.779   5.8834   31.993   5.9911  165.501   23.919  195.352   20.335 -29.85089 31.39451 
1 1 1    1   20    2 o  701.692   13.044  377.122   14.010   0.0000   0.0000  377.122   14.010  ?   ?   701.692   13.044 0.000000 13.04417 
1 1 1    1   20    3 o  1104.89   16.757  935.512   28.339   0.0000   0.0000  935.512   28.339  ?   ?   1104.89   16.757 0.000000 16.75678 
1 1 1    1   20    4 o  2057.49   26.860  3250.76   84.589  3250.76   84.589   0.0000   0.0000  2057.49   26.860  ?   ?  0.000000 26.86015 
1 1 1    1   20    5 o  2033.07   26.310  3173.59   81.872  3173.59   81.872   0.0000   0.0000  2033.07   26.310  ?   ?  0.000000 26.30952 
1 1 1    1   20    6 f  311.474   13.820   74.314   6.5887   74.314   6.5887   0.0000   0.0000  311.474   13.820  ?   ?  0.000000 13.82004 
1 1 1    1   20    7 o  1305.92   18.477  1307.27   36.933  1307.27   36.933   0.0000   0.0000  1305.92   18.477  ?   ?  0.000000 18.47692 
1 1 1    1   20    8 o  1361.29   10.985  1419.00   22.888  1411.17   27.852  1435.27   40.166  1357.34   13.406  1368.28   19.179 -10.94116 23.39951 
1 1 1    1   20    9 f  1453.42   9.9962  1617.42   22.238  1612.21   31.324  1622.72   31.576  1450.74   14.107  1455.46   14.174 -4.717773 19.99719 
1 1 1    1   20   10 o  2020.45   13.091  3126.68   40.485  3113.69   56.923  3139.98   57.590  2015.45   18.452  2023.91   18.590 -8.464966 26.19323 
1 1 1    1   20   11 o  237.823   8.2327   43.300   2.9968   43.611   4.2179   42.983   4.2588  238.638   11.547  236.912   11.744 1.726013 16.47035 
1 1 1    1   20   12 o  965.737   7.7038  713.974   11.388  715.206   16.056  712.727   16.154  966.434   10.854  964.753   10.939 1.680847 15.41018 
1 1 1    1   20   13 o  1778.83   11.762  2423.30   32.026  2402.23   44.779  2445.36   45.821  1770.49   16.524  1786.28   16.759 -15.78931 23.53493 
1 1 1    1   20   14 o  1277.11   9.1732  1248.77   17.932  1255.49   25.506  1242.20   25.215  1280.27   13.016  1273.48   12.936 6.787598 18.35070 
1 1 1    1   20   15 f  902.343   7.5408  623.322   10.415  615.825   14.547  631.207   14.918  896.769   10.598  907.893   10.735 -11.12402 15.08516 
1 1 1    1   20   16 o  528.247   6.8089  213.611   5.5053  204.557   7.6228  223.484   7.9596  516.865   9.6353  540.248   9.6256 -23.38312 13.61952 
1 1 1    1   20   17 o  2011.77   13.092  3100.41   40.313  3074.42   56.431  3127.49   57.610  2002.37   18.412  2019.53   18.637 -17.15845 26.19840 
1 1 1    1   20   18 o  462.343   7.0950  163.643   5.0210  166.845   7.1157  160.468   7.0858  466.777   9.9596  457.766   10.113 9.011505 14.19385 
1 1 1    1   20   19 o  1169.90   12.421  1048.45   22.241  1047.51   31.478  1049.39   31.429  1168.81   17.595  1169.86   17.552 -1.055176 24.85304 
1 1 1    1   20   20 o  975.899   9.3855  729.286   14.019  771.468   25.408  710.823   16.810  1003.12   16.548  963.336   11.400 39.78479 20.09515 
1 1 1    1   20   21 o  102.107   29.732   8.1773   4.9290   0.0000   0.0000   8.1773   4.9290  ?   ?   102.107   29.732 0.000000 29.73174 
1 1 1    1   20   22 o  129.488   19.677   13.159   3.7772   12.657   5.4318   13.629   5.2561  125.740   28.837  130.707   27.159 -4.967438 39.61280 
1 1 1    1   20   23 o  1064.62   8.6123  867.906   14.034  863.536   19.741  872.371   19.955  1061.64   12.149  1067.05   12.218 -5.410278 17.22968 
1 1 1    1   20   24 o  283.451   10.803   61.546   4.6872   54.287   6.5566   69.134   6.7031  265.562   16.208  300.301   14.583 -34.73880 21.80289 
1 1 1    1   20   25 o  260.081   12.059   51.832   4.8004   46.350   6.7063   57.591   6.8745  245.103   18.002  273.509   16.498 -28.40562 24.41832 
1 1 1    1   20   26 o  616.431   11.532  291.164   10.881  291.164   10.881   0.0000   0.0000  616.431   11.532  ?   ?  0.000000 11.53241 
1 1 1    1   20   27 o  216.137   18.896   36.150   6.1886   38.183   8.8465   34.202   8.6604  221.014   26.691  208.807   27.787 12.20729 38.52982 
1 1 1    1   20   28 o  315.251   14.503   76.234   6.9981   86.878   10.191   66.738   9.6265  335.614   19.929  293.777   21.559 41.83734 29.35854 
1 1 1    1   20   29 o   59.102   26.220  -1.6666   4.7254   1.6670   6.8496  -4.6941   6.5276   82.150   33.812   63.926   29.335 18.22387 44.76332 
1 1 1    1   20   30 o  704.061   8.5564  379.747   9.2209  364.071   12.749  396.940   13.352  689.033   12.089  719.460   12.125 -30.42700 17.12147 
1 1 1    1   20   31 o  1217.44   7.6987  1135.35   14.346  1141.72   20.414  1129.13   20.165  1220.29   10.930  1213.55   10.856 6.735352 15.40481 
1 1 1    1   20   32 o  315.345   7.7614   76.183   3.7462   79.533   5.3492   72.959   5.2482  322.044   10.852  308.431   11.117 13.61316 15.53533 
1 1 1    1   20   33 o  375.848   7.3279  108.221   4.2156  111.383   6.0356  105.210   5.8907  381.103   10.347  370.389   10.391 10.71420 14.66356 
1 1 1    1   20   34 o  300.906   7.9990   69.390   3.6842   65.309   5.0879   73.887   5.3418  291.720   11.395  310.298   11.247 -18.57843 16.01041 
1 1 1    1   20   35 o  171.479   12.159   22.696   3.1707   18.034   4.4167   27.653   4.5547  151.614   19.483  188.860   15.904 -37.24628 25.15003 
1 1 1    1   20   36 o  393.009   12.147  118.666   7.3070   0.0000   0.0000  118.666   7.3070  ?   ?   393.009   12.147 0.000000 12.14692 
1 1 1    1   20   37 o  316.358   8.2096   76.743   3.9753   82.207   5.5633   71.043   5.6824  327.163   11.110  304.025   12.211 23.13812 16.50856 
1 1 1    1   20   38 o  458.167   8.3996  161.011   5.8905  160.978   7.0161  161.090   10.843  457.905   10.010  457.056   15.499 0.8492432 18.45060 
1 1 1    1   20   39 o   41.424   18.894  -1.6982   2.6538   0.9516   3.7150  -4.4595   3.7924   60.466   24.896   44.270   20.972 16.19619 32.55166 
1 1 1    1   20   40 o  275.154   10.744   58.197   4.5249   53.619   8.9148   59.785   5.2516  261.267   22.512  278.693   12.311 -17.42505 25.65853 
1 1 1    1   20   41 o  386.772   9.2237  114.895   5.4605  124.180   6.5269   93.238   9.9682  401.865   10.611  345.962   18.896 55.90289 21.67123 
1 1 1    1   20   42 o  179.859   16.009   25.241   4.3613   24.767   4.7789   27.604   10.667  177.747   17.805  180.389   39.711 -2.641876 43.51942 
1 1 1    1   20   43 o  227.329   10.580   39.776   3.6813   38.962   5.1250   40.643   5.2913  223.857   15.045  228.618   15.208 -4.760620 21.39200 
1 1 1    1   20   44 o  140.227   15.337   15.420   3.2382   8.1695   4.4307   23.733   4.7443   99.680   27.925  173.628   18.119 -73.94883 33.28779 
1 1 1    1   20   45 o  533.588   7.7283  218.671   6.3119  219.378   9.2459  218.054   8.6379  533.369   11.325  532.004   10.608 1.364868 15.51732 
1 1 1    1   20   46 o  214.876   11.335   35.720   3.7149   34.996   5.2186   36.464   5.2894  211.488   16.245  215.938   16.120 -4.450592 22.88567 
1 1 1    1   20   47 o  117.531   19.515   11.109   3.3876   10.016   4.7799   12.212   4.8018  109.442   28.318  121.291   26.597 -11.84950 38.84969 
1 1 1    1   20   48 f   87.974   24.950   6.3629   3.5145   9.7486   5.1429   3.3963   4.8140  107.674   30.058   76.007   29.288 31.66666 41.96735 
1 1 1    1   20   49 o  177.257   15.611   24.679   4.1924   33.340   6.0720   16.788   5.7955  204.836   19.606  141.861   27.684 62.97432 33.92376 
1 1 1    1   20   50 o   52.588   24.366  -3.4774   4.6613 -32.3691   10.839   3.0775   5.1630   54.643   27.566   75.927   30.014 -21.28374 40.75261 
1 1 1    1   20   51 o  185.516   14.364   26.973   4.0470   29.811   5.6925   24.074   5.7547  193.238   19.513  172.337   22.342 20.90128 29.66358 
1 1 1    1   20   52 o   71.968   29.132   2.3709   4.9825  -0.8675   5.4863   17.614   11.903   64.299   28.401  137.428   47.030 -73.12858 54.94085 
1 1 1    1   20   53 o  221.465   18.074   39.049   6.0734   31.580   12.492   41.361   6.9502  181.600   45.137  226.882   20.226 -45.28206 49.46098 
1 1 1    1   20   54 f  201.306   15.951   32.109   4.8748   33.572   6.8772   30.631   6.9109  202.521   22.569  192.574   23.964 9.947784 32.91906 
1 1 1    1   20   55 o  219.231   15.237   38.052   5.0812   50.675   7.6417   28.048   6.8030  250.168   20.127  182.951   24.944 67.21672 32.05148 
1 1 1    1   20   56 o  119.214   24.891   12.173   4.3953   12.252   6.1086   12.088   6.3289  115.928   32.899  114.851   33.762 1.077721 47.14005 
1 1 1    1   20   57 o  113.416   25.211   11.163   4.2631   6.6984   6.0714   15.505   5.9875   90.132   33.290  131.047   30.433 -40.91503 45.10413 
1 1 1    1   20   58 o  194.261   15.124   30.223   4.4617   32.956   6.4183   27.667   6.2066  198.609   21.454  180.762   22.950 17.84656 31.41566 
1 1 1    1   20   59 o  157.559   19.417   20.667   4.5837   19.284   5.9684   22.655   7.1570  146.392   27.649  156.019   31.062 -9.627258 41.58501 
1 1 1    1   20   60 o  120.164   25.356   12.937   4.5171   7.9838   6.3177   18.118   6.4608   92.360   33.985  137.812   31.337 -45.45151 46.22759 
1 1 1    1   21    2 o  491.141   12.875  184.749   9.6792   0.0000   0.0000  184.749   9.6792  ?   ?   491.141   12.875 0.000000 12.87544 
1 1 1    1   21    3 o  870.175   10.314  579.783   13.738  588.883   19.712  571.189   19.156  876.756   14.689  863.496   14.494 13.26080 20.63584 
1 1 1    1   21    4 o  1172.83   12.166  1053.43   21.840  1042.80   30.613  1064.45   31.169  1166.50   17.146  1178.54   17.278 -12.03259 24.34163 
1 1 1    1   21    5 o  1353.01   13.436  1402.19   27.825  1391.97   39.090  1412.68   39.617  1347.51   18.952  1357.48   19.067 -9.971191 26.88383 
1 1 1    1   21    6 o  837.336   10.171  536.846   13.035  532.696   18.353  541.072   18.518  833.891   14.379  840.421   14.396 -6.529724 20.34653 
1 1 1    1   21    7 o  732.842   9.7509  411.202   10.938  404.981   15.257  417.780   15.688  727.117   13.709  738.510   13.879 -11.39307 19.50764 
1 1 1    1   21    8 o  832.707   8.3306  530.845   10.618  525.444   12.898  542.202   18.703  828.393   10.172  841.283   14.524 -12.89032 17.73213 
1 1 1    1   21    9 o  1191.80   8.7270  1087.44   15.920  1097.27   22.742  1077.98   22.293  1196.95   12.413  1186.39   12.277 10.55640 17.45838 
1 1 1    1   21   10 o  1238.61   8.9676  1174.58   17.001  1183.92   24.201  1165.49   23.889  1243.28   12.717  1233.56   12.652 9.713013 17.93896 
1 1 1    1   21   11 o  592.634   6.6852  268.850   6.0642  267.926   8.5280  269.796   8.6249  591.548   9.4186  593.607   9.4926 -2.059387 13.37236 
1 1 1    1   21   12 o  1416.61   9.8744  1536.61   21.411  1529.13   30.130  1544.23   30.431  1412.81   13.933  1419.76   14.003 -6.953613 19.75404 
1 1 1    1   21   13 o  581.062   6.7380  258.458   5.9927  256.328   8.4167  260.649   8.5345  578.593   9.5038  583.448   9.5567 -4.854736 13.47786 
1 1 1    1   21   14 o  840.027   7.3525  540.202   9.4536  550.454   13.516  530.383   13.228  847.833   10.415  832.234   10.384 15.59863 14.70721 
1 1 1    1   21   15 o  1415.11   9.9062  1533.43   21.457  1528.80   30.248  1538.12   30.443  1412.57   13.990  1416.87   14.037 -4.293945 19.81819 
1 1 1    1   21   16 o  157.788   15.416   19.263   3.6757   17.321   4.4432   23.472   6.5428  148.942   19.995  172.965   25.477 -24.02338 32.38610 
1 1 1    1   21   17 o  1086.02   11.915  903.439   19.806  913.300   28.327  894.007   27.703  1091.44   16.956  1079.87   16.760 11.56812 23.84142 
1 1 1    1   21   18 o  1299.05   10.895  1292.47   21.664  1358.09   39.411  1264.06   25.933  1330.52   19.352  1284.46   13.191 46.05859 23.41989 
1 1 1    1   21   19 o  385.352   8.0066  113.695   4.7225  118.684   6.7653  108.955   6.5953  393.633   11.229  377.148   11.425 16.48459 16.01902 
1 1 1    1   21   20 o  330.085   8.8464   83.432   4.4696   83.293   6.3337   83.570   6.3082  329.718   12.550  330.267   12.479 -0.5490112 17.69804 
1 1 1    1   21   21 o  159.922   16.081   19.807   3.8830   15.297   5.4640   24.409   5.5191  138.703   26.706  177.107   20.753 -38.40436 33.82117 
1 1 1    1   21   22 o  243.771   11.605   45.526   4.3302   48.104   6.1490   42.990   6.0990  249.936   16.160  236.135   16.988 13.80077 23.44630 
1 1 1    1   21   23 o   65.925   26.229   1.7089   3.9664   0.5678   5.5566   2.8945   5.6636   71.604   30.042   80.364   31.541 -8.759857 43.55869 
1 1 1    1   21   24 o  142.390   20.193   15.880   4.2778   18.528   6.0870   13.295   6.0131  152.880   27.000  128.716   30.910 24.16458 41.04153 
1 1 1    1   21   25 o  274.901   11.741   57.910   4.9401   52.519   6.9985   63.264   6.9742  260.990   17.622  286.727   15.954 -25.73764 23.77169 
1 1 1    1   21   26 o  750.804   11.010  431.952   12.653  423.804   17.703  440.462   18.092  743.227   15.561  757.688   15.600 -14.46161 22.03465 
1 1 1    1   21   27 o  242.930   13.545   45.399   5.0164   42.033   6.9567   49.045   7.2402  233.024   19.689  251.937   18.913 -18.91254 27.30137 
1 1 1    1   21   28 o  792.079   11.763  480.990   14.261   0.0000   0.0000  480.990   14.261  ?   ?   792.079   11.763 0.000000 11.76263 
1 1 1    1   21   29 o  383.119   10.353  112.503   6.0713  107.408   8.6888  117.364   8.4869  374.019   15.177  391.049   14.179 -17.03049 20.77016 
1 1 1    1   21   30 o  484.965   9.2505  180.237   6.8666  178.041   9.7041  182.440   9.7177  481.669   13.162  487.596   13.021 -5.927490 18.51453 
1 1 1    1   21   31 o  448.600   9.9430  154.281   6.8273  146.641   9.5020  162.434   9.8160  436.958   14.207  459.916   13.944 -22.95834 19.90675 
1 1 1    1   21   32 o  254.200   10.660   49.562   4.1477   52.180   4.9110   43.049   7.7465  260.730   12.306  235.109   21.773 25.62126 25.01012 
1 1 1    1   21   33 o  461.031   6.8250  162.831   4.8162  169.689   6.8784  156.235   6.7458  470.413   9.5530  451.359   9.7644 19.05438 13.66023 
1 1 1    1   21   34 o  428.180   7.5998  140.505   4.9808  139.143   6.5219  142.410   7.7152  425.885   10.005  430.666   11.704 -4.781006 15.39758 
1 1 1    1   21   35 o  295.110   9.1759   66.799   4.1448   68.389   5.8139   65.155   5.9105  298.297   12.734  291.106   13.265 7.190735 18.38748 
1 1 1    1   21   36 o  403.763   8.6338  125.032   5.3358  100.073   9.4016  136.891   6.4806  360.107   17.057  422.320   10.025 -62.21274 19.78504 
1 1 1    1   21   37 o  360.332   9.0285   99.623   4.9796   97.948   5.8476  104.042   9.4981  357.105   10.698  367.061   16.905 -9.955658 20.00618 
1 1 1    1   21   38 o  103.405   19.356   8.5491   2.9509   9.9132   4.1499   7.1539   4.1969  110.494   25.108   94.441   27.417 16.05311 37.17616 
1 1 1    1   21   39 o  456.546   10.788  160.219   7.5389  169.874   10.808  151.069   10.521  469.129   15.051  442.277   15.542 26.85144 21.63547 
1 1 1    1   21   40 o  170.961   14.752   22.733   3.8226   24.282   4.3213   17.162   8.1961  176.450   16.181  143.070   37.112 33.38063 40.48579 
1 1 1    1   21   41 o  184.598   12.074   26.362   3.3926   29.205   4.6688   23.182   4.9383  193.605   15.895  171.612   19.125 21.99380 24.86846 
1 1 1    1   21   42 o  350.729   7.9700   94.441   4.2786   99.839   6.1536   89.390   5.9531  360.062   11.166  340.653   11.417 19.40909 15.96946 
1 1 1    1   21   43 o  470.459   8.9312  170.128   6.4313  146.070   11.796  180.303   7.6718  433.141   17.793  483.961   10.357 -50.81949 20.58764 
1 1 1    1   21   44 o  184.961   12.083   26.515   3.4021   18.981   4.6499   35.192   4.9906  154.458   20.148  212.423   15.455 -57.96471 25.39315 
1 1 1    1   21   45 o  130.805   16.851   13.532   3.2954   11.509   4.4157   16.076   4.9510  118.257   25.168  140.731   23.835 -22.47433 34.66310 
1 1 1    1   21   46 o  252.870   10.592   49.301   4.0995   52.298   5.6081   45.862   6.0078  259.311   14.183  242.149   16.304 17.16147 21.60981 
1 1 1    1   21   47 o  161.130   15.407   20.379   3.7535   15.195   5.1257   26.372   5.5117  135.825   25.594  182.026   20.119 -46.20070 32.55465 
1 1 1    1   21   48 o   81.259   25.593   5.2888   3.5531   5.9076   5.4142   4.8207   4.7091   89.000   31.631   81.876   29.456 7.124039 43.22244 
1 1 1    1   21   49 f  334.644   11.715   86.661   6.0008   75.536   12.368   90.086   6.8627  304.423   26.816  340.701   13.160 -36.27878 29.87146 
1 1 1    1   21   50 o  181.546   18.659   26.230   5.1111   34.991   5.7934  -4.5299   10.856  210.113   18.193   82.798   37.934 127.3147 42.07119 
1 1 1    1   21   51 o   55.062   25.139  -2.5385   4.7133  -4.2716   5.2472   4.7007   10.724   54.654   25.501  100.108   41.850 -45.45436 49.00739 
1 1 1    1   21   52 o   79.429   30.302   4.1482   5.1196  -7.7563   11.978   6.8091   5.6629   81.405   38.160   92.451   32.396 -11.04544 50.05703 
1 1 1    1   21   53 o   43.705   20.892  -4.9020   3.9391  -9.4369   5.2503   0.9380   5.9581   45.515   22.299   71.479   30.591 -25.96418 37.85577 
1 1 1    1   21   54 o  300.290   13.989   70.691   6.4297   72.811   7.8630   66.413   11.170  302.597   17.046  281.903   26.186 20.69406 31.24532 
1 1 1    1   21   55 o  257.917   18.610   53.538   7.2975   60.929   10.496   46.621   10.153  269.371   25.772  232.574   29.162 36.79680 38.91766 
1 1 1    1   21   56 o  175.515   16.691   24.746   4.4300   24.996   6.3605   24.511   6.1735  171.656   24.938  170.318   24.376 1.337677 34.87252 
1 1 1    1   21   57 o  149.342   18.893   18.335   4.2220   19.465   5.9806   17.213   5.9610  148.754   27.272  138.484   29.049 10.27020 39.84498 
1 1 1    1   21   58 o  139.268   23.666   16.744   4.8643   2.6470   8.5195   23.563   5.9250   82.151   35.866  165.321   24.125 -83.16958 43.22478 
1 1 1    1   21   59 f   77.273   27.546   5.0512   4.1092   3.9511   6.1095   5.9599   5.5529   77.739   31.957   83.800   31.656 -6.060509 44.98177 
1 1 1    1   22    2 o  1508.81   20.726  1745.85   47.864   0.0000   0.0000  1745.85   47.864  ?   ?   1508.81   20.726 0.000000 20.72570 
1 1 1    1   22    4 o  827.713   10.214  524.591   12.940  526.484   18.355  522.720   18.245  828.992   14.465  826.025   14.430 2.967163 20.43227 
1 1 1    1   22    5 o  743.406   9.8196  423.154   11.174  418.722   15.735  427.663   15.870  739.325   13.904  747.178   13.876 -7.853210 19.64401 
1 1 1    1   22    6 o  1292.92   13.060  1280.43   25.846  1263.04   36.058  1298.80   37.066  1283.58   18.353  1301.59   18.605 -18.01587 26.13397 
1 1 1    1   22    7 o  1416.63   13.951  1537.38   30.251  1535.97   42.772  1538.80   42.792  1415.28   19.745  1416.58   19.736 -1.301636 27.91669 
1 1 1    1   22    8 o  1247.60   12.770  1192.21   24.386  1180.21   34.163  1204.68   34.821  1240.79   17.988  1253.57   18.148 -12.77856 25.55219 
1 1 1    1   22    9 o  821.811   8.3580  517.063   10.513  525.227   13.043  501.920   17.763  828.195   10.289  809.398   14.338 18.79633 17.64804 
1 1 1    1   22   10 o   93.792   19.098   6.9914   2.6485   8.2154   3.6901   5.6909   3.8037  101.425   24.122   86.075   26.377 15.34995 35.74375 
1 1 1    1   22   11 o  810.740   7.2247  503.186   8.9654  496.896   12.512  509.823   12.853  805.543   10.148  815.948   10.291 -10.40472 14.45287 
1 1 1    1   22   12 o  223.992   9.5070   38.418   3.2595   37.956   4.5899   38.887   4.6295  222.170   13.562  224.894   13.512 -2.724594 19.14426 
1 1 1    1   22   13 o  702.397   9.9709  377.797   10.720   0.0000   0.0000  377.797   10.720  ?   ?   702.397   9.9709 0.000000 9.970929 
1 1 1    1   22   14 o  542.002   8.0174  224.911   6.6513  225.857   8.1047  222.960   11.640  543.090   9.7498  539.427   14.098 3.662964 17.14090 
1 1 1    1   22   15 o  1227.94   12.754  1155.14   23.971  1145.39   33.672  1165.16   34.132  1222.12   18.001  1232.61   18.091 -10.48645 25.52096 
1 1 1    1   22   16 o  1948.36   14.783  2909.36   44.088  2861.12   74.702  2935.14   54.613  1929.51   25.294  1956.25   18.239 -26.74426 31.18399 
1 1 1    1   22   17 o  472.903   7.5587  171.219   5.4713  172.593   7.7339  169.843   7.7412  474.706   10.644  470.906   10.740 3.800262 15.12093 
1 1 1    1   22   18 o  661.172   7.3714  334.684   7.4599  328.613   10.486  340.907   10.616  655.020   10.458  667.164   10.395 -12.14380 14.74595 
1 1 1    1   22   19 o  866.508   7.8387  574.886   10.397  575.047   14.681  574.724   14.725  866.434   11.070  866.188   11.106 0.2462769 15.68110 
1 1 1    1   22   20 o  1017.88   8.4115  793.355   13.105  792.281   18.537  794.428   18.529  1016.91   11.910  1018.29   11.888 -1.379211 16.82767 
1 1 1    1   22   21 o  666.154   7.6806  339.780   7.8314  343.485   11.129  336.146   11.022  669.616   10.859  662.423   10.871 7.193176 15.36481 
1 1 1    1   22   22 o  632.447   7.8052  306.278   7.5557  309.216   10.735  303.394   10.636  635.307   11.040  629.297   11.042 6.009399 15.61447 
1 1 1    1   22   23 o  203.505   14.353   31.912   4.4421   23.687   6.1672   40.780   6.4036  173.886   23.796  229.753   18.363 -55.86662 30.05721 
1 1 1    1   22   24 o  519.163   11.163  206.530   8.8702  223.996   13.049  191.526   12.094  540.337   15.777  499.638   15.814 40.69839 22.33892 
1 1 1    1   22   25 o  178.582   18.722   24.765   5.0414   20.091   6.3296   32.875   8.3374  159.260   26.925  204.672   27.294 -45.41154 38.33958 
1 1 1    1   22   26 o  497.844   8.6080  189.850   6.5594  189.220   9.1857  190.505   9.3698  496.805   12.080  498.475   12.281 -1.670258 17.22587 
1 1 1    1   22   27 o  730.958   8.2305  409.273   9.2085  394.972   12.658  425.350   13.421  717.766   11.522  744.828   11.772 -27.06238 16.47221 
1 1 1    1   22   28 o  519.515   8.8177  206.792   7.0117  213.598   10.045  200.324   9.7921  527.698   12.436  511.029   12.519 16.66855 17.64582 
1 1 1    1   22   29 o  420.222   9.7752  135.355   6.2874  131.214   8.9435  139.402   8.8410  413.393   14.134  426.152   13.554 -12.75894 19.58282 
1 1 1    1   22   30 o  378.918   10.481  110.101   6.0789  112.680   8.5140  107.418   8.6823  382.982   14.524  373.868   15.172 9.114258 21.00338 
1 1 1    1   22   31 o  881.441   8.6940  595.499   11.730  595.306   16.512  595.695   16.665  880.645   12.250  880.910   12.359 -0.2647095 17.40180 
1 1 1    1   22   32 o  124.937   26.456   12.575   4.9018   12.492   6.8659   12.661   7.0005  124.299   34.741  125.140   35.116 -0.8412399 49.39685 
1 1 1    1   22   33 o  157.824   18.576   19.480   4.4015   19.597   4.6889   18.616   12.770  158.069   19.815  152.265   48.578 5.804138 52.46397 
1 1 1    1   22   34 o  312.510   8.9663   74.902   4.2889   74.380   5.8918   75.490   6.2554  311.121   12.372  313.363   13.042 -2.242584 17.97667 
1 1 1    1   22   35 f  383.332   7.1149  112.622   4.1746  115.136   5.8494  110.013   5.9597  387.326   9.8666  378.564   10.285 8.762299 14.25253 
1 1 1    1   22   36 o  505.892   7.8296  196.244   6.0627  197.452   7.3560  193.683   10.706  507.220   9.4749  501.529   13.946 5.690796 16.85990 
1 1 1    1   22   37 o  444.965   6.9179  151.778   4.7116  153.651   6.6640  149.906   6.6624  447.341   9.7325  441.838   9.8514 5.502869 13.84822 
1 1 1    1   22   38 o  205.520   18.439   32.992   5.7386   43.988   8.2472   22.670   7.9902  236.322   23.095  166.225   32.569 70.09702 39.92661 
1 1 1    1   22   39 o  132.053   17.872   13.757   3.5195   11.235   3.8609   26.154   8.5598  118.147   22.164  178.555   32.518 -60.40723 39.35319 
1 1 1    1   22   40 o  303.403   8.6446   70.688   4.0145   69.005   5.5536   72.530   5.8098  299.282   12.123  306.789   12.372 -7.507355 17.32201 
1 1 1    1   22   41 o  213.848   9.9713   35.171   3.2638   33.059   4.5647   37.380   4.6685  206.262   14.552  219.512   13.967 -13.25073 20.17046 
1 1 1    1   22   42 o  113.340   16.630   10.180   2.7991   6.8980   3.9265   13.571   3.9914   92.054   26.460  130.163   20.729 -38.10831 33.61282 
1 1 1    1   22   43 o  146.692   13.995   16.800   3.1042   19.343   4.5307   14.551   4.2617  156.185   19.367  134.594   21.403 21.59119 28.86494 
1 1 1    1   22   44 o  232.581   10.129   41.658   3.6058   38.565   5.1427   44.649   5.0571  222.420   15.197  239.755   13.839 -17.33527 20.55420 
1 1 1    1   22   45 o  378.339   8.3550  110.047   4.8383  103.140   6.7497  117.348   6.9391  365.371   12.069  389.858   11.629 -24.48618 16.75982 
1 1 1    1   22   46 o  150.680   15.077   17.818   3.4306   22.424   4.8184   13.084   4.8855  168.062   19.069  125.662   26.247 42.40047 32.44227 
1 1 1    1   22   47 o  193.228   14.012   29.136   4.1161   32.262   5.8051   25.976   5.8372  201.804   19.018  179.983   21.621 21.82101 28.79524 
1 1 1    1   22   48 o  368.357   8.8433  104.489   4.9860  112.479   7.1700   97.008   6.9383  381.083   12.292  353.723   12.815 27.36041 17.75737 
1 1 1    1   22   49 o  205.969   16.239   33.384   5.0781   2.9921   11.301   41.072   5.6843   98.736   42.190  228.538   16.358 -129.8018 45.25055 
1 1 1    1   22   50 o  376.206   11.208  109.548   6.4537  111.507   7.4081  103.381   13.144  378.919   12.773  357.515   24.162 21.40399 27.33022 
1 1 1    1   22   51 o  128.025   26.004   13.783   4.9217   3.5122   11.617   16.030   5.4335   99.515   42.656  138.018   26.685 -38.50237 50.31514 
1 1 1    1   22   52 o  278.577   14.010   60.799   5.9548   64.688   6.7920   47.876   12.381  286.613   15.540  232.782   35.902 53.83144 39.12094 
1 1 1    1   22   53 o  268.636   13.221   56.389   5.4361   48.432   7.5731   64.846   7.8080  244.801   20.397  285.102   17.985 -40.30080 27.19330 
1 1 1    1   22   54 o   95.520   27.361   7.9009   4.2052   4.0762   5.6883   12.510   6.2447   80.037   31.547  117.493   33.235 -37.45651 45.82367 
1 1 1    1   22   55 o  230.040   21.009   43.349   7.3158   39.721   9.9346   47.646   10.813  211.802   31.612  232.637   31.150 -20.83513 44.38062 
1 1 1    1   22   56 o  291.035   12.518   66.480   5.5763   58.943   7.6947   74.817   8.0924  269.335   18.783  304.788   17.419 -35.45337 25.61629 
1 1 1    1   22   57 o  112.621   24.806   11.134   4.1605   4.9137   5.7980   17.736   5.9737   81.356   31.919  140.132   28.813 -58.77613 43.00000 
1 1 1    1   22   58 o   56.825   24.656   0.3733   3.9746  -6.3281   5.5239   7.5672   5.7233   50.589   24.328   91.079   32.505 -40.49080 40.60097 
1 1 1    1   23    2 o  462.223   13.553  163.667   9.5884   0.0000   0.0000  163.667   9.5884  ?   ?   462.223   13.553 0.000000 13.55264 
1 1 1    1   23    3 o  444.861   9.6071  151.531   6.5416  149.927   9.2632  153.126   9.2394  442.388   13.680  447.090   13.501 -4.701874 19.22055 
1 1 1    1   23    4 o  210.606   13.339   34.114   4.2778   40.507   6.0602   27.764   6.0393  229.220   17.403  189.059   21.237 40.16098 27.45666 
1 1 1    1   23    5 o  1341.31   13.426  1378.22   27.564  1396.68   39.626  1360.92   38.366  1349.57   19.183  1332.23   18.815 17.34070 26.86967 
1 1 1    1   23    6 o  728.925   9.7985  406.850   10.932  400.369   15.284  413.639   15.643  722.908   13.813  734.785   13.909 -11.87738 19.60257 
1 1 1    1   23    7 o  516.363   9.4121  204.157   7.4390  199.432   10.440  209.031   10.603  510.224   13.368  522.364   13.261 -12.13989 18.82956 
1 1 1    1   23    8 o  1061.31   11.559  862.680   18.777  868.219   26.753  857.302   26.360  1064.30   16.422  1057.60   16.284 6.699097 23.12689 
1 1 1    1   23    9 o  121.924   18.090   11.646   3.2736   10.670   4.0316   13.534   5.6086  115.808   23.546  130.134   28.909 -14.32576 37.28481 
1 1 1    1   23   10 o  480.825   7.9756  177.002   5.8697  175.217   7.1765  180.608   10.202  478.349   9.8016  485.519   13.728 -7.170624 16.86826 
1 1 1    1   23   11 o  627.105   7.9630  301.084   7.6434  299.780   9.3495  303.712   13.272  625.685   9.7625  629.594   13.772 -3.909363 16.88148 
1 1 1    1   23   12 o  809.925   10.432  502.371   12.933  495.238   18.092  509.826   18.494  803.885   14.703  815.630   14.814 -11.74561 20.87188 
1 1 1    1   23   13 o  529.641   8.1351  214.777   6.5950  205.455   11.104  219.857   8.1973  517.803   14.011  535.811   9.9952 -18.00769 17.21050 
1 1 1    1   23   14 o  1119.33   9.9523  959.495   17.051  918.006   28.250  983.271   21.386  1094.19   16.868  1132.92   12.333 -38.72510 20.89532 
1 1 1    1   23   15 o  661.503   7.2491  335.012   7.3398  339.908   10.478  330.295   10.285  666.198   10.276  656.712   10.232 9.485596 14.50097 
1 1 1    1   23   16 o  622.387   7.4366  296.574   7.0845  303.042   10.151  290.431   9.8921  629.012   10.543  615.787   10.495 13.22424 14.87635 
1 1 1    1   23   17 o  254.182   10.494   49.486   4.0829   51.865   5.7848   47.126   5.7635  259.709   14.612  247.461   15.291 12.24767 21.15003 
1 1 1    1   23   18 o  479.253   7.8706  175.864   5.7735  175.934   8.1675  175.795   8.1626  479.232   11.135  479.043   11.132 0.1885986 15.74496 
1 1 1    1   23   19 o  979.650   8.3212  734.896   12.478  723.499   17.447  746.828   17.851  971.754   11.730  987.289   11.813 -15.53455 16.64757 
1 1 1    1   23   20 o  499.143   8.1007  190.781   6.1890  190.656   8.7435  190.906   8.7615  498.841   11.451  499.166   11.467 -0.3258667 16.20595 
1 1 1    1   23   21 o  855.587   8.0642  560.563   10.561  558.759   14.898  562.385   14.972  853.957   11.398  856.722   11.418 -2.764893 16.13326 
1 1 1    1   23   22 o  214.976   17.802   35.719   5.8050   33.778   8.1088   37.759   8.3140  207.805   26.067  220.042   25.136 -12.23698 36.21223 
1 1 1    1   23   23 o  430.029   11.936  141.738   7.8564  141.738   11.186  141.738   11.037  429.697   17.007  429.715   16.781 -0.1727295E-01 23.89195 
1 1 1    1   23   24 o  351.729   9.8460   94.786   5.3008  105.115   7.5224   84.597   7.4707  370.230   13.274  332.062   14.698 38.16879 19.80544 
1 1 1    1   23   25 o  673.455   8.0779  347.389   8.3268  344.674   11.697  350.179   11.857  670.544   11.396  675.871   11.461 -5.327271 16.16281 
1 1 1    1   23   26 o  560.392   8.4048  240.577   7.2092  252.784   10.393  229.256   10.009  574.155   11.826  546.771   11.959 27.38464 16.81893 
1 1 1    1   23   27 o  408.151   9.4847  127.669   5.9254  134.012   8.4998  121.673   8.2646  417.888   13.289  398.162   13.561 19.72577 18.98650 
1 1 1    1   23   28 o  394.336   9.7099  119.198   5.8607  113.062   8.1285  125.842   8.4579  383.736   13.839  404.860   13.649 -21.12408 19.43723 
1 1 1    1   23   29 o  531.284   8.8149  216.334   7.1682  217.014   9.9744  215.608   10.309  531.757   12.255  529.975   12.708 1.782288 17.65424 
1 1 1    1   23   30 o  451.636   9.3000  156.383   6.4289  163.316   9.2021  149.773   8.9855  461.143   13.037  441.578   13.294 19.56445 18.62006 
1 1 1    1   23   31 o  423.127   9.8298  137.318   6.3663  139.187   8.9566  135.410   9.0507  425.552   13.751  419.694   14.089 5.857758 19.68700 
1 1 1    1   23   32 o  220.470   25.060   38.239   8.3064   39.444   11.658   36.997   11.839  221.036   35.671  213.320   37.633 7.716324 51.85247 
1 1 1    1   23   33 o  200.520   17.596   31.260   5.3461   26.725   7.6022   35.696   7.5195  182.975   28.038  213.176   23.432 -30.20062 36.54004 
1 1 1    1   23   34 f  320.229   9.2141   78.675   4.5163   83.054   5.3363   67.621   8.4792  328.888   10.600  295.133   18.869 33.75412 21.64250 
1 1 1    1   23   35 o  561.175   7.7212  241.469   6.6321  245.809   8.1547  232.990   11.398  565.935   9.4139  550.156   13.536 15.77924 16.48738 
1 1 1    1   23   36 o  299.223   13.129   68.932   6.0129   69.908   8.5977   67.997   8.4124  299.824   18.830  295.720   18.681 4.103638 26.52490 
1 1 1    1   23   37 o   90.434   31.180   5.9816   5.2355   4.5015   7.5451   7.3560   7.2707   92.945   36.427  102.149   36.617 -9.203384 51.65057 
1 1 1    1   23   38 o  114.896   15.708   10.389   2.6901   8.2373   3.7249   12.735   3.8892  100.556   24.440  126.291   20.847 -25.73525 32.12369 
1 1 1    1   23   39 o  190.258   11.046   27.948   3.2028   28.205   4.4180   27.663   4.6499  190.378   15.290  188.317   16.292 2.060699 22.34369 
1 1 1    1   23   40 o  194.494   11.280   29.228   3.3437   21.729   4.4745   38.712   5.0318  166.285   17.860  223.225   14.811 -56.94041 23.20234 
1 1 1    1   23   41 o  331.849   8.1411   84.579   4.1351   83.252   5.7851   85.965   5.9130  328.657   11.500  333.954   11.568 -5.296967 16.31142 
1 1 1    1   23   42 o  354.428   7.8208   96.474   4.2428   94.142   5.9347   98.911   6.0679  349.505   11.094  358.255   11.066 -8.749908 15.66906 
1 1 1    1   23   43 o  264.549   11.714   54.005   4.7433   28.217   9.6824   62.149   5.4410  182.438   35.952  283.626   12.533 -101.1881 38.07391 
1 1 1    1   23   44 o  269.997   9.4937   56.115   3.9234   57.001   5.5484   55.228   5.5487  271.353   13.359  266.702   13.638 4.650818 19.09048 
1 1 1    1   23   45 o  222.828   10.649   38.296   3.6322   34.477   5.0128   42.517   5.2703  209.918   15.715  233.495   14.823 -23.57707 21.60313 
1 1 1    1   23   46 o  201.123   13.174   31.478   4.0332   36.560   5.9311   27.107   5.5008  215.276   18.170  184.621   19.774 30.65431 26.85389 
1 1 1    1   23   47 o  516.973   7.9666  205.554   6.3039  224.799   9.2244  188.690   8.6349  539.345   11.174  494.027   11.419 45.31812 15.97659 
1 1 1    1   23   48 o  419.286   14.886  137.025   9.5533  149.214   13.931  126.205   13.125  433.676   20.987  397.887   21.633 35.78845 30.14061 
1 1 1    1   23   49 o  275.288   12.968   58.863   5.4641   66.171   6.1821   32.770   11.682  291.574   13.852  190.370   41.280 101.2044 43.54206 
1 1 1    1   23   50 o  420.174   10.862  136.652   6.9857  132.115   14.570  138.006   7.9604  404.134   23.656  421.564   12.337 -17.42941 26.68004 
1 1 1    1   23   51 o  171.017   20.218   23.625   5.1900   12.981   11.759   26.200   5.7838  122.257   46.094  179.627   21.461 -57.37039 50.84564 
1 1 1    1   23   52 o  325.888   15.533   83.564   7.7481   83.564   7.7481   0.0000   0.0000  325.888   15.533  ?   ?  0.000000 15.53317 
1 1 1    1   23   53 o   86.856   27.208   6.3805   4.0219   5.9800   5.7017   6.7771   5.6742   87.746   32.285   91.101   32.381 -3.354439 45.72597 
1 1 1    1   23   54 o  176.876   16.498   25.037   4.4149   24.535   6.2164   25.547   6.2713  170.792   24.479  174.550   24.117 -3.758179 34.36403 
1 1 1    1   23   55 o  231.791   15.664   42.868   5.5246   30.429   9.5804   49.065   6.7621  180.172   35.999  246.429   18.053 -66.25713 40.27203 
1 1 1    1   23   56 o   36.079   18.056 -10.7835   4.1967 -10.3867   5.7461 -11.2373   6.1441   46.490   22.886   47.744   23.535 -1.253578 32.82806 
1 1 1    1   23   57 f  132.420   21.444   14.901   4.1978   14.480   5.9263   15.325   5.9470  123.935   31.248  127.994   30.741 -4.058266 43.83451 
1 1 1    1   23   58 o  185.062   25.610   30.198   7.0599   30.198   7.0599   0.0000   0.0000  185.062   25.610  ?   ?  0.000000 25.61020 
1 1 1    1   24    1 o  740.320   14.274  419.945   16.174   0.0000   0.0000  419.945   16.174  ?   ?   740.320   14.274 0.000000 14.27355 
1 1 1    1   24    2 o  563.407   9.5254  243.060   8.2144  244.889   11.753  241.313   11.485  565.369   13.582  561.234   13.369 4.134216 19.05821 
1 1 1    1   24    3 o  849.068   10.452  552.081   13.584  551.237   19.178  552.931   19.242  848.147   14.773  849.448   14.800 -1.300293 20.91092 
1 1 1    1   24    4 o  856.635   10.475  561.970   13.735  569.119   19.616  555.096   19.237  861.782   14.871  851.107   14.767 10.67578 20.95731 
1 1 1    1   24    5 o  503.309   9.7115  193.979   7.4815  190.867   10.512  197.173   10.650  499.114   13.760  507.294   13.716 -8.179596 19.42850 
1 1 1    1   24    6 o  1259.21   12.944  1214.73   24.948  1228.21   35.701  1201.86   34.876  1265.52   18.431  1251.91   18.200 13.61804 25.90268 
1 1 1    1   24    7 o  119.167   23.240   11.279   4.0867   15.115   5.9256   7.7984   5.6437  137.611   29.045  101.598   32.282 36.01315 43.42490 
1 1 1    1   24    8 o  804.691   10.281  495.890   12.663  501.167   18.000  490.720   17.818  808.694   14.542  800.220   14.547 8.473389 20.56898 
1 1 1    1   24    9 o  804.366   10.309  495.498   12.693  487.144   17.828  504.085   18.075  797.284   14.609  811.033   14.560 -13.74835 20.62544 
1 1 1    1   24   10 o  1027.26   11.502  808.308   18.085  783.797   24.844  835.937   26.377  1011.15   16.052  1044.19   16.504 -33.04077 23.02279 
1 1 1    1   24   11 o  940.375   9.1314  677.150   13.143  663.799   22.338  684.219   16.255  930.553   15.683  945.136   11.236 -14.58264 19.29286 
1 1 1    1   24   12 o  1116.17   8.6258  953.951   14.737  965.146   21.102  943.294   20.589  1122.41   12.283  1109.65   12.122 12.76367 17.25746 
1 1 1    1   24   13 o  370.958   8.1710  105.365   4.6395  104.382   6.5447  106.357   6.5778  369.137   11.583  372.613   11.533 -3.476837 16.34598 
1 1 1    1   24   14 o  185.728   12.923   26.559   3.6508   22.662   5.1902   30.376   5.1362  170.633   20.269  198.282   17.090 -27.64864 26.51234 
1 1 1    1   24   15 o  266.253   14.531   54.502   5.8995   0.0000   0.0000   54.502   5.8995  ?   ?   266.253   14.531 0.000000 14.53097 
1 1 1    1   24   16 o  450.349   7.9876  155.294   5.5060  159.995   7.8760  150.802   7.7001  456.999   11.260  443.673   11.339 13.32581 15.97954 
1 1 1    1   24   17 o  844.095   7.9165  545.565   10.228  536.611   14.252  555.073   14.687  836.929   11.126  851.193   11.273 -14.26367 15.83845 
1 1 1    1   24   18 o  306.705   10.146   72.056   4.7629   71.227   6.7228   72.891   6.7487  304.798   14.410  308.341   14.299 -3.542725 20.30084 
1 1 1    1   24   19 o  618.498   7.7351  292.923   7.3228  288.778   10.298  297.164   10.415  613.937   10.959  622.789   10.926 -8.852661 15.47459 
1 1 1    1   24   20 o  272.256   13.027   56.822   5.4287   67.236   8.7418   50.284   6.9260  295.224   19.454  255.314   17.835 39.90965 26.39250 
1 1 1    1   24   21 o  706.912   10.782  382.913   11.667  388.134   16.495  377.687   16.504  711.292   15.151  701.630   15.368 9.662109 21.58022 
1 1 1    1   24   22 o  579.282   8.0574  257.004   7.1442  268.027   10.243  246.562   9.9696  591.361   11.316  567.175   11.484 24.18652 16.12254 
1 1 1    1   24   23 o  629.021   8.0326  303.053   7.7338  308.262   11.057  298.063   10.822  634.148   11.391  623.573   11.338 10.57458 16.07186 
1 1 1    1   24   24 o  906.388   8.4059  629.342   11.662  635.005   16.548  623.756   16.437  910.020   11.881  901.920   11.907 8.099976 16.82003 
1 1 1    1   24   25 o  1054.98   8.8890  852.789   14.354  862.398   20.487  843.524   20.117  1060.27   12.624  1048.62   12.533 11.64868 17.78887 
1 1 1    1   24   26 o  211.656   14.578   34.566   4.6938   35.887   6.6990   33.291   6.5788  214.831   20.626  206.766   21.082 8.065063 29.49395 
1 1 1    1   24   27 o  505.087   8.7652  195.510   6.7764  197.975   9.6137  193.077   9.5530  507.915   12.366  501.584   12.443 6.331421 17.54274 
1 1 1    1   24   28 o  198.214   15.407   30.388   4.6377   34.510   6.5373   26.211   6.5804  210.504   20.551  182.492   24.152 28.01244 31.71211 
1 1 1    1   24   29 o  159.081   19.387   19.805   4.6230   14.672   6.4677   25.167   6.6104  134.381   31.918  178.519   24.867 -44.13861 40.46177 
1 1 1    1   24   30 o  536.834   19.832  222.584   16.296   0.0000   0.0000  222.584   16.296  ?   ?   536.834   19.832 0.000000 19.83188 
1 1 1    1   24   31 o  766.937   12.741  452.009   14.957  462.674   21.478  441.968   20.841  774.306   18.122  756.827   17.991 17.47870 25.53587 
1 1 1    1   24   32 o  381.353   10.450  111.633   6.0996  102.415   8.4761  121.534   8.7844  364.663   15.186  397.365   14.443 -32.70239 20.95710 
1 1 1    1   24   33 o  195.706   17.565   29.813   5.2057   29.679   7.3081   29.951   7.4170  193.550   25.271  194.378   25.548 -0.8273163 35.93565 
1 1 1    1   24   34 o  401.346   10.670  123.730   6.5544  130.742   9.3696  117.010   9.1723  411.851   14.863  389.524   15.384 22.32706 21.39131 
1 1 1    1   24   35 o  100.763   30.259   8.1222   5.0416   5.1998   7.2949   10.795   6.9756   94.517   36.144  115.889   35.755 -21.37181 50.84113 
1 1 1    1   24   36 o  236.315   11.606   42.959   4.1980   31.721   8.0555   47.149   4.9188  199.135   27.135  247.066   13.053 -47.93146 30.11165 
1 1 1    1   24   37 o  461.091   7.5296  163.094   5.3141  157.399   7.3057  169.493   7.7438  452.455   10.549  469.469   10.776 -17.01324 15.08037 
1 1 1    1   24   38 f  485.750   7.4508  181.032   5.5397  174.347   7.6761  188.298   8.0027  476.102   10.533  494.775   10.567 -18.67337 14.92044 
1 1 1    1   24   39 o  105.972   16.979   8.9254   2.6610   7.0633   3.5825   11.217   3.9744   93.027   24.733  117.663   22.892 -24.63572 33.70100 
1 1 1    1   24   40 o   94.024   19.063   7.1350   2.6495   3.3319   3.5357   12.005   4.0012   70.436   25.498  121.873   22.270 -51.43693 33.85445 
1 1 1    1   24   41 o  438.066   7.3563  147.315   4.9325  148.403   6.9399  146.203   7.0118  439.031   10.327  435.717   10.514 3.313995 14.73751 
1 1 1    1   24   42 o  282.249   11.009   61.412   4.7561   69.460   5.5294   38.524   9.3245  299.962   12.043  217.454   28.717 82.50896 31.14050 
1 1 1    1   24   43 o  263.149   9.4828   53.300   3.8195   51.186   5.2172   55.743   5.6071  256.832   13.317  267.938   13.718 -11.10550 19.11893 
1 1 1    1   24   44 o  182.115   12.280   25.755   3.4031   25.027   4.7907   26.497   4.8351  178.095   17.813  183.410   17.433 -5.315460 24.92408 
1 1 1    1   24   45 o  271.533   10.358   56.864   4.3050   56.517   6.0876   57.211   6.0888  269.233   14.829  270.914   14.739 -1.681366 20.90808 
1 1 1    1   24   46 o  191.103   12.663   28.414   3.6830   25.583   5.2115   31.240   5.2056  179.335   19.289  199.069   17.255 -19.73418 25.88041 
1 1 1    1   24   47 f  286.080   9.9432   63.142   4.3539   63.753   6.2129   62.553   6.1034  286.273   14.179  283.603   14.060 2.669708 19.96822 
1 1 1    1   24   48 o  467.926   9.9454  169.014   7.1231  166.854   8.2405  175.398   14.167  464.212   11.598  470.865   19.656 -6.652863 22.82283 
1 1 1    1   24   49 o  184.503   13.828   26.664   3.8767   22.024   5.3153   31.938   5.6666  164.831   21.587  200.206   18.709 -35.37546 28.56571 
1 1 1    1   24   50 o  327.253   18.163   84.986   9.0622   91.916   13.263   78.918   12.411  334.157   26.140  309.230   26.476 24.92642 37.20631 
1 1 1    1   24   51 o  146.309   19.917   17.387   4.3443   10.171   6.0453   25.094   6.2473  107.616   33.299  174.114   24.087 -66.49819 41.09763 
1 1 1    1   24   52 o  187.714   14.774   27.861   4.2107   27.311   6.0485   28.378   5.8653  182.311   22.129  186.554   20.900 -4.242264 30.43823 
1 1 1    1   24   53 o   64.392   25.811   2.1232   3.8701   3.3130   5.4297   0.8946   5.5178   76.122   30.552   68.420   29.364 7.702652 42.37542 
1 1 1    1   24   54 o  168.386   17.290   22.884   4.3931   19.018   6.1466   26.920   6.2810  147.210   28.307  179.089   23.479 -31.87843 36.77718 
1 1 1    1   24   55 o  118.294   24.066   12.099   4.2093   11.426   5.9679   12.764   5.9378  110.360   32.873  116.907   32.171 -6.546753 45.99551 
1 1 1    1   24   56 o   94.593   27.270   8.0759   4.1652   11.083   6.0003   5.2788   5.7865  107.611   33.155   82.428   32.013 25.18296 46.08756 
1 1 1    1   24   57 o  121.695   26.258   13.310   4.7475   18.308   6.5369   7.7297   6.9064  139.083   31.444   92.459   35.213 46.62406 47.20932 
1 1 1    1   25    1 o  444.539   14.169  151.432   9.6407   0.0000   0.0000  151.432   9.6407  ?   ?   444.539   14.169 0.000000 14.16874 
1 1 1    1   25    2 f  219.617   14.128   37.113   4.7239   40.206   6.7962   34.221   6.5708  228.083   19.659  210.160   20.695 17.92360 28.54438 
1 1 1    1   25    3 o  1405.69   13.985  1514.16   30.089  1524.68   42.901  1503.97   42.213  1409.66   19.883  1400.08   19.698 9.571167 27.98814 
1 1 1    1   25    4 o  274.983   12.171   57.926   5.1229   56.874   7.3022   58.945   7.1889  271.761   17.651  276.739   17.055 -4.978577 24.54384 
1 1 1    1   25    5 o  1077.86   11.875  889.955   19.592  889.207   27.616  890.713   27.798  1076.91   16.754  1077.81   16.850 -0.8997803 23.76180 
1 1 1    1   25    6 o  275.639   12.983   58.212   5.4773   62.088   8.0869   54.926   7.4451  283.883   18.716  266.972   18.330 16.91132 26.19736 
1 1 1    1   25    7 o  1041.03   11.728  830.185   18.688  831.137   26.583  829.255   26.277  1041.13   16.681  1039.97   16.508 1.159302 23.46836 
1 1 1    1   25    8 o  1212.56   12.828  1126.54   23.809  1129.39   33.863  1123.74   33.483  1213.40   18.233  1210.38   18.073 3.012939 25.67236 
1 1 1    1   25    9 o  200.647   16.437   31.076   5.0036   22.033   7.0098   40.470   7.1446  166.904   28.460  228.690   20.633 -61.78639 35.15232 
1 1 1    1   25   10 f  749.510   10.484  430.269   12.027  426.439   16.946  434.157   17.073  745.869   14.844  752.590   14.821 -6.720825 20.97625 
1 1 1    1   25   11 o  170.293   16.133   22.435   4.1550   18.256   5.0006   31.755   7.4673  152.614   22.046  201.755   24.697 -49.14117 33.10529 
1 1 1    1   25   12 o  710.745   7.4508  386.769   8.1057  392.732   11.589  381.060   11.341  716.049   10.574  705.332   10.505 10.71674 14.90513 
1 1 1    1   25   13 o  898.114   7.9819  617.620   10.973  624.862   15.684  610.677   15.356  903.133   11.346  892.833   11.237 10.30066 15.96849 
1 1 1    1   25   14 o  1204.69   9.1604  1111.45   16.891  1117.90   24.045  1105.17   23.733  1207.76   13.007  1200.88   12.912 6.882080 18.32750 
1 1 1    1   25   15 o  491.551   7.8403  185.014   5.8989  185.069   8.3811  184.960   8.3040  491.493   11.141  491.353   11.041 0.1396179 15.68531 
1 1 1    1   25   16 o  484.251   7.8855  179.564   5.8448  177.113   8.2439  182.042   8.2877  480.798   11.202  487.447   11.108 -6.648682 15.77584 
1 1 1    1   25   17 o  575.468   8.8292  253.630   7.7770  263.054   13.645  249.096   9.4648  585.640   15.222  570.195   10.845 15.44434 18.69004 
1 1 1    1   25   18 o  1289.11   13.552  1274.13   26.740  1307.27   38.821  1244.21   36.886  1304.50   19.442  1272.77   18.934 31.72729 27.13832 
1 1 1    1   25   19 o  715.779   9.1092  392.448   9.9800  390.031   12.231  397.263   17.262  713.409   11.201  719.532   15.674 -6.122742 19.26474 
1 1 1    1   25   20 o  421.969   8.8057  136.392   5.6874  137.267   7.9303  135.465   8.1610  423.145   12.244  420.331   12.685 2.813263 17.63020 
1 1 1    1   25   21 o  934.595   8.3501  669.059   11.945  673.631   16.894  664.488   16.892  937.381   11.774  930.987   11.854 6.393921 16.70779 
1 1 1    1   25   22 o  312.863   10.437   75.022   4.9980   77.669   7.0172   72.297   7.1203  318.121   14.411  306.877   15.159 11.24402 20.91588 
1 1 1    1   25   23 o  375.754   9.7924  108.209   5.6320  104.469   7.9172  112.039   8.0135  368.932   14.020  382.089   13.702 -13.15765 19.60392 
1 1 1    1   25   24 o  1040.01   8.8615  828.822   14.106  833.405   20.069  824.346   19.832  1042.21   12.580  1036.55   12.500 5.663330 17.73454 
1 1 1    1   25   25 o  203.068   14.949   31.852   4.6138   34.038   6.6557   29.830   6.4014  209.045   21.089  195.440   21.769 13.60513 30.30906 
1 1 1    1   25   26 o  524.103   8.6963  210.521   6.9762  211.551   9.8991  209.505   9.8330  525.005   12.319  522.464   12.296 2.541260 17.40508 
1 1 1    1   25   27 o  342.976   10.240   90.220   5.3755   86.699   7.5588   93.823   7.6462  335.832   14.705  349.399   14.297 -13.56766 20.50963 
1 1 1    1   25   28 o  598.003   8.4692  274.122   7.7520  303.432   11.387  248.805   10.583  628.680   11.833  569.235   12.147 59.44464 16.95783 
1 1 1    1   25   29 o  529.986   13.143  215.868   10.662  214.396   14.912  217.408   15.249  527.099   18.483  530.719   18.772 -3.620239 26.34430 
1 1 1    1   25   30 o  283.898   15.020   62.218   6.5036   50.888   11.528   67.507   7.8770  253.154   30.355  295.311   17.505 -42.15779 35.04079 
1 1 1    1   25   31 o  273.638   12.894   57.574   5.4005   52.561   7.4526   63.118   7.8367  260.103   18.847  285.319   18.037 -25.21570 26.08766 
1 1 1    1   25   32 o  590.643   9.0257  267.651   8.1597  267.998   11.503  267.300   11.577  590.301   12.731  589.508   12.830 0.7924805 18.07450 
1 1 1    1   25   33 o  445.203   10.043  152.196   6.8437  159.998   9.8908  145.031   9.4791  455.719   14.180  433.861   14.274 21.85748 20.11995 
1 1 1    1   25   34 o  746.674   9.0137  427.920   10.302  423.838   14.508  432.071   14.630  742.020   12.774  749.198   12.758 -7.177673 18.05371 
1 1 1    1   25   35 o  532.075   9.7214  217.459   7.9172  213.782   11.161  221.183   11.233  526.568   13.847  535.646   13.701 -9.078186 19.47961 
1 1 1    1   25   36 o  809.242   9.3121  503.019   11.534  489.771   13.459  539.661   22.383  797.931   11.020  834.334   17.527 -36.40356 20.70368 
1 1 1    1   25   37 o  354.713   7.4773   96.539   4.0597   98.516   5.7533   94.579   5.7293  357.882   10.503  350.628   10.675 7.253571 14.97580 
1 1 1    1   25   38 o  398.052   8.8937  121.739   5.4187  103.527   10.116  129.067   6.4170  364.825   18.115  409.597   10.235 -44.77219 20.80653 
1 1 1    1   25   39 o  198.594   9.8347   30.340   2.9895   30.967   4.2505   29.725   4.2054  199.638   13.999  195.543   14.146 4.095093 19.90159 
1 1 1    1   25   40 o  199.905   10.057   30.834   3.0675   29.241   4.2929   32.496   4.3848  193.781   14.580  204.451   14.098 -10.66986 20.28130 
1 1 1    1   25   41 o  151.701   12.125   17.877   2.7918   15.130   3.9043   20.752   3.9936  137.915   19.000  162.617   16.263 -24.70137 25.00943 
1 1 1    1   25   42 o   64.107   22.571   2.8968   2.7506  -2.8921   3.7248   9.8403   4.0793   47.197   21.838  109.212   24.950 -62.01429 33.15676 
1 1 1    1   25   43 o  404.336   9.4968  125.881   5.8775  138.599   6.9894   95.173   10.860  423.903   10.772  347.186   20.528 76.71686 23.18281 
1 1 1    1   25   44 o  292.264   10.006   65.840   4.4762   57.380   6.3024   74.451   6.3586  271.164   15.247  309.914   13.404 -38.75067 20.30120 
1 1 1    1   25   45 o  164.761   13.459   21.197   3.3645   29.541   5.0157   14.370   4.5365  193.615   17.100  132.624   23.192 60.99200 28.81492 
1 1 1    1   25   46 o   68.008   23.813   3.3611   3.0594  -0.6637   4.5299   6.7365   4.1484   59.307   26.015   90.473   27.511 -31.16636 37.86393 
1 1 1    1   25   47 o  253.470   32.492   54.244   12.316   0.0000   0.0000   54.244   12.316  ?   ?   253.470   32.492 0.000000 32.49221 
1 1 1    1   25   48 f   71.163   24.947   3.7462   3.3581   6.2614   4.7446   1.2218   4.7534   88.387   29.696   66.643   27.861 21.74345 40.71945 
1 1 1    1   25   49 o  102.931   28.690   9.0680   4.6893   16.524   11.388   7.5457   5.1458  133.202   45.983   95.086   30.888 38.11573 55.39429 
1 1 1    1   25   50 f   85.105   26.851   6.0102   3.9098   9.7116   5.5011   2.2317   5.5581  105.574   31.587   73.669   30.405 31.90482 43.84282 
1 1 1    1   25   51 o   86.381   34.516   4.6447   6.8966   7.7652   9.9579   1.7682   9.5608  103.349   41.411   87.537   38.111 15.81168 56.27944 
1 1 1    1   25   52 o  120.946   21.420   12.164   3.8201   8.2889   5.4003   16.045   5.4047   97.539   31.640  136.588   26.809 -39.04903 41.47091 
1 1 1    1   25   53 o   64.093   26.213   1.8485   4.0843   6.6838   5.9274  -2.5228   5.6358   90.254   32.962   59.728   27.353 30.52516 42.83289 
1 1 1    1   25   54 o  208.449   16.041   34.862   5.0788   30.986   7.0078   39.150   7.3709  190.715   24.578  216.240   22.604 -25.52470 33.39199 
1 1 1    1   25   55 o   86.269   27.383   6.5847   4.0616  -0.6137   5.6985   14.017   5.7906   63.679   28.485  122.713   30.860 -59.03397 41.99686 
1 1 1    1   25   56 o  138.463   23.030   16.542   4.7095   13.544   6.7644   19.361   6.5607  116.703   35.051  144.094   30.687 -27.39104 46.58613 
1 1 1    1   26    1 o  367.970   15.799  103.810   8.8983   0.0000   0.0000  103.810   8.8983  ?   ?   367.970   15.799 0.000000 15.79881 
1 1 1    1   26    2 o  1312.68   13.455  1320.44   27.033  1321.39   38.405  1319.51   38.059  1312.28   19.120  1311.37   18.961 0.9064941 26.92776 
1 1 1    1   26    3 o  374.741   11.292  107.573   6.4772  101.457   9.1945  113.598   9.1263  363.743   16.514  384.937   15.489 -21.19443 22.64165 
1 1 1    1   26    4 o  1029.10   11.700  811.304   18.430  804.879   25.927  817.867   26.203  1024.51   16.533  1032.73   16.576 -8.227539 23.41221 
1 1 1    1   26    5 o  571.286   10.273  249.968   8.9829  257.030   12.933  243.384   12.487  579.072   14.591  563.496   14.477 15.57544 20.55446 
1 1 1    1   26    6 o  256.671   14.426   50.656   5.6447   56.357   8.0379   45.110   7.9288  270.278   19.562  241.394   21.691 28.88373 29.20876 
1 1 1    1   26    7 o  776.533   10.684  461.887   12.699  473.309   18.262  451.191   17.671  785.729   15.185  767.164   15.049 18.56580 21.37853 
1 1 1    1   26    8 o  203.608   17.384   32.032   5.3658   38.343   7.8558   26.512   7.3465  222.139   23.459  183.698   26.927 38.44092 35.71313 
1 1 1    1   26    9 o  171.215   20.433   22.826   5.2492   27.463   7.6972   18.795   7.1769  186.870   27.754  153.337   31.629 33.53212 42.07916 
1 1 1    1   26   10 o  397.073   11.754  120.799   7.1438  122.445   10.249  119.245   9.9624  399.537   16.760  394.295   16.507 5.241943 23.52395 
1 1 1    1   26   11 o  1293.83   11.057  1282.45   21.897  1278.56   26.755  1290.33   38.107  1291.54   13.534  1296.47   19.203 -4.928223 23.49312 
1 1 1    1   26   12 o  1005.52   8.4068  774.262   12.939  781.951   18.492  766.886   18.111  1010.19   11.959  1000.42   11.827 9.765198 16.81980 
1 1 1    1   26   13 o  622.865   7.6364  297.067   7.2804  296.616   10.244  297.528   10.349  622.231   10.756  623.182   10.849 -0.9502563 15.27738 
1 1 1    1   26   14 o  249.613   12.565   47.875   4.7854   34.616   8.0562   55.104   5.9485  210.520   25.523  267.670   14.574 -57.14958 29.39116 
1 1 1    1   26   15 o  626.900   8.7653  301.000   8.4107  318.488   14.765  292.599   10.233  644.387   14.970  617.967   10.819 26.41956 18.47007 
1 1 1    1   26   16 o  145.591   24.002   16.743   5.1623   17.157   7.2992   16.329   7.3019  146.024   33.385  142.403   33.975 3.620804 47.63192 
1 1 1    1   26   17 f  719.048   8.8910  396.039   9.7853  390.213   11.950  407.898   17.049  713.578   10.941  729.108   15.277 -15.53027 18.79032 
1 1 1    1   26   18 o  269.208   10.843   55.542   4.4678   57.694   6.2804   53.338   6.3571  273.785   15.045  263.128   15.858 10.65756 21.85919 
1 1 1    1   26   19 o   39.742   19.364  -6.9049   3.8025  -6.2703   5.3542  -7.5509   5.4013   52.858   25.004   50.879   24.359 1.979195 34.90826 
1 1 1    1   26   20 o  420.837   8.8616  135.688   5.7081  139.035   8.1026  132.389   8.0427  425.773   12.433  415.458   12.648 10.31567 17.73535 
1 1 1    1   26   21 o  536.086   8.2077  220.163   6.7348  227.010   9.5636  213.427   9.4857  544.097   11.484  527.544   11.747 16.55304 16.42785 
1 1 1    1   26   22 o  284.884   11.095   62.235   4.8379   60.600   6.7529   63.959   6.9343  280.392   15.799  288.086   15.786 -7.694183 22.33384 
1 1 1    1   26   23 o  594.880   8.1292  271.142   7.4020  273.133   10.444  269.133   10.492  596.726   11.435  592.324   11.572 4.402466 16.26891 
1 1 1    1   26   24 o  502.534   8.5984  193.540   6.6138  199.404   9.4213  187.843   9.2868  509.748   12.075  494.728   12.264 15.01953 17.21074 
1 1 1    1   26   25 o  191.862   15.283   28.482   4.4510   22.412   6.3006   34.529   6.2887  168.259   25.243  210.678   19.731 -42.41922 32.03978 
1 1 1    1   26   26 o  212.975   14.383   35.027   4.6611   32.016   6.6018   38.020   6.5817  202.380   21.648  221.106   19.653 -18.72530 29.23786 
1 1 1    1   26   27 o  514.268   13.004  203.212   10.236  216.184   14.547  190.490   14.405  529.478   17.950  496.806   18.944 32.67255 26.09732 
1 1 1    1   26   28 o  292.425   14.421   65.788   6.4547   79.829   11.675   59.607   7.7462  319.778   24.028  277.309   18.353 42.46942 30.23574 
1 1 1    1   26   29 o  630.999   8.5649  305.325   8.2722  314.330   11.852  296.772   11.551  639.602   12.106  621.474   12.143 18.12817 17.14689 
1 1 1    1   26   30 o  692.820   8.5879  368.145   9.1070  369.855   12.931  366.461   12.828  693.673   12.179  690.492   12.138 3.180847 17.19444 
1 1 1    1   26   31 o  277.952   12.548   59.420   5.3383   52.038   7.5005   66.998   7.5995  258.596   19.084  294.070   16.955 -35.47397 25.52838 
1 1 1    1   26   32 o  509.787   9.3933  199.490   7.3295  196.345   10.319  202.691   10.412  504.983   13.351  513.100   13.258 -8.117157 18.81531 
1 1 1    1   26   33 o  226.409   15.309   39.744   5.2742   39.187   7.5884   40.264   7.3359  223.146   22.526  226.516   21.412 -3.370483 31.07866 
1 1 1    1   26   34 o  618.412   13.094  294.678   12.394   0.0000   0.0000  294.678   12.394  ?   ?   618.412   13.094 0.000000 13.09404 
1 1 1    1   26   35 o  208.307   21.650   34.218   6.8021   33.345   9.4832   35.143   9.7621  202.317   31.661  207.788   31.698 -5.470825 44.80154 
1 1 1    1   26   36 o  102.046   30.481   8.4474   5.1260   5.9286   7.1989   11.038   7.3005   96.063   36.096  116.482   36.684 -20.41857 51.46540 
1 1 1    1   26   37 o   43.609   19.913  -1.8772   2.9582  -4.4506   3.2296   11.535   7.3729   39.267   18.809  118.389   36.798 -79.12198 41.32641 
1 1 1    1   26   38 o   77.029   20.282   4.8077   2.4242   6.5718   3.4051   2.9945   3.4521   89.742   24.225   68.220   25.118 21.52219 34.89689 
1 1 1    1   26   39 o  241.080   11.215   44.795   4.1382   47.339   4.7014   36.044   8.7195  247.323   12.459  210.959   27.671 36.36380 30.34657 
1 1 1    1   26   40 o   80.161   21.015   5.2306   2.6100  -0.1798   3.6664   10.790   3.7164   55.248   23.826  115.334   21.852 -60.08580 32.32951 
1 1 1    1   26   41 o  128.278   14.630   12.922   2.8212   11.267   3.9400   14.663   4.0414  117.602   22.711  135.340   20.121 -17.73819 30.34223 
1 1 1    1   26   42 o  248.441   9.2767   47.511   3.5277   46.199   4.9916   48.820   4.9861  243.865   13.424  250.813   13.033 -6.948837 18.71026 
1 1 1    1   26   43 o   45.560   20.245  -0.9081   2.8283   1.2193   4.0544  -2.9248   3.9474   63.044   25.988   48.799   22.544 14.24483 34.40395 
1 1 1    1   26   44 o   48.635   21.121  -0.3104   2.9217  -2.0562   4.0742   1.5379   4.1920   52.049   23.612   65.051   26.575 -13.00140 35.54926 
1 1 1    1   26   45 o  372.969   14.928  108.367   8.5222  103.446   11.997  113.381   12.109  360.210   21.862  377.722   21.027 -17.51239 30.33303 
1 1 1    1   26   46 o  352.516   10.650   96.024   5.7462   95.250   6.5525   98.602   11.956  350.563   12.212  350.900   22.377 -0.3368530 25.49248 
1 1 1    1   26   47 o  137.404   16.756   15.024   3.4510   17.615   4.9633   12.599   4.8015  146.735   22.842  122.355   26.412 24.38004 34.91909 
1 1 1    1   26   48 o   83.310   28.602   5.4565   4.4031   4.2092   10.992   5.6949   4.8056   99.081   41.947   85.459   29.849 13.62201 51.48295 
1 1 1    1   26   49 o  255.378   11.697   50.665   4.5721   51.492   6.4968   49.853   6.4356  254.982   16.739  250.815   16.862 4.167145 23.75950 
1 1 1    1   26   50 o  137.547   18.387   15.301   3.7743   15.369   5.2469   15.229   5.4332  134.250   26.475  133.083   27.579 1.166962 38.22949 
1 1 1    1   26   51 o  194.369   13.840   29.774   4.0906   25.757   5.6940   34.058   5.8805  177.166   21.433  205.462   18.911 -28.29556 28.58367 
1 1 1    1   26   52 o   83.170   26.754   5.8445   3.8673   10.274   5.6863   2.0327   5.2751  106.600   32.164   70.644   29.426 35.95606 43.59365 
1 1 1    1   26   53 o  190.371   18.307   29.479   5.2685   35.237   6.3699   17.011   9.3737  206.849   20.384  128.928   41.672 77.92023 46.39015 
1 1 1    1   26   54 o   54.076   24.028  -0.5951   3.9839  -3.7279   5.5527   2.7281   5.7190   55.896   26.132   73.559   30.640 -17.66244 40.26989 
1 1 1    1   26   55 o   65.637   27.254   2.0303   4.5046  -0.0640   6.5223   3.9405   6.2288   68.446   30.556   78.572   32.280 -10.12624 44.44881 
1 1 1    1   27    1 o  277.093   19.241   59.218   8.1101   0.0000   0.0000   59.218   8.1101  ?   ?   277.093   19.241 0.000000 19.24107 
1 1 1    1   27    2 o  659.106   10.426  332.759   10.518  348.605   15.531  319.335   14.295  674.296   15.048  645.412   14.471 28.88422 20.87707 
1 1 1    1   27    3 o  930.531   11.302  663.366   16.098  695.516   23.749  636.035   21.896  952.282   16.293  910.721   15.708 41.56067 22.63163 
1 1 1    1   27    4 o   63.469   27.236  -0.3235   4.7455  -4.1778   6.7379   3.4701   6.6846   66.466   30.234   87.432   34.282 -20.96558 45.70914 
1 1 1    1   27    5 o  331.552   12.427   84.237   6.3063   82.624   8.9267   85.843   8.9102  327.655   17.867  334.034   17.488 -6.378693 25.00101 
1 1 1    1   27    6 f  387.939   11.630  115.309   6.9056  126.774   10.119  105.316   9.4475  406.546   16.261  370.525   16.658 36.02148 23.27945 
1 1 1    1   27    7 o  1315.42   13.605  1326.36   27.393  1337.39   39.099  1315.74   38.389  1319.80   19.355  1309.12   19.158 10.68201 27.23317 
1 1 1    1   27    8 o  938.903   11.531  675.447   16.572  704.834   24.293  649.870   22.664  958.513   16.558  920.445   16.087 38.06897 23.08567 
1 1 1    1   27    9 o  817.421   11.023  511.930   13.791  517.637   19.694  506.438   19.319  821.504   15.663  812.583   15.532 8.920898 22.05847 
1 1 1    1   27   10 o  743.929   15.171  424.463   17.275   0.0000   0.0000  424.463   17.275  ?   ?   743.929   15.171 0.000000 15.17107 
1 1 1    1   27   11 o  581.606   15.397  259.478   13.707   0.0000   0.0000  259.478   13.707  ?   ?   581.606   15.397 0.000000 15.39734 
1 1 1    1   27   12 o  845.867   15.881  548.978   20.561  548.978   20.561   0.0000   0.0000  845.867   15.881  ?   ?  0.000000 15.88093 
1 1 1    1   27   13 o  732.440   9.1163  410.931   10.220  404.305   12.547  423.992   17.617  726.341   11.286  743.370   15.483 -17.02966 19.16020 
1 1 1    1   27   14 o  443.135   9.4325  150.434   6.3978  146.969   7.8538  157.268   11.031  437.884   11.718  452.671   15.920 -14.78754 19.76788 
1 1 1    1   27   15 o  629.384   11.046  303.599   10.641   0.0000   0.0000  303.599   10.641  ?   ?   629.384   11.046 0.000000 11.04598 
1 1 1    1   27   16 o  118.200   22.167   11.105   3.8631   7.4298   5.4186   14.903   5.5089   98.980   31.651  136.535   27.314 -37.55455 41.80742 
1 1 1    1   27   17 o  340.849   9.3808   89.018   4.8941   96.221   6.9295   81.849   6.9131  354.191   12.782  326.609   13.829 27.58170 18.83093 
1 1 1    1   27   18 o  136.644   20.078   14.674   4.0742   19.069   5.8658   10.578   5.6631  155.133   25.596  114.905   31.335 40.22752 40.46035 
1 1 1    1   27   19 o  521.900   11.503  208.879   9.1887   0.0000   0.0000  208.879   9.1887  ?   ?   521.900   11.503 0.000000 11.50256 
1 1 1    1   27   20 o  201.579   13.939   31.345   4.2745   36.846   6.1072   26.062   5.9846  218.042   18.473  182.552   21.852 35.48961 28.61427 
1 1 1    1   27   21 o  454.653   8.5343  158.400   5.9391  156.860   8.4030  159.937   8.3953  452.141   12.142  456.567   12.013 -4.426178 17.08058 
1 1 1    1   27   22 o  298.330   10.788   68.263   4.9260   73.591   6.9453   62.869   6.9877  309.468   14.662  285.477   16.057 23.99088 21.74418 
1 1 1    1   27   23 o  384.031   13.135  113.261   7.7207  113.261   7.7207   0.0000   0.0000  384.031   13.135  ?   ?  0.000000 13.13473 
1 1 1    1   27   24 o  307.570   10.668   72.577   5.0222   70.908   7.0993   74.249   7.1057  303.231   15.346  310.726   14.940 -7.494995 21.41734 
1 1 1    1   27   25 o  160.895   22.707   20.429   5.4366   27.443   6.6774   6.6371   9.3637  186.664   23.921  107.337   40.973 79.32698 47.44454 
1 1 1    1   27   26 o  746.517   12.197  428.075   13.937  409.310   19.251  448.745   20.204  728.628   17.261  762.908   17.302 -34.27936 24.43997 
1 1 1    1   27   27 o  106.789   27.008   9.2362   4.4175   5.6874   6.1876   12.925   6.3086   92.803   33.710  125.865   32.516 -33.06208 46.83648 
1 1 1    1   27   28 o  870.756   8.7113  581.526   11.610  589.687   16.554  573.626   16.288  875.893   12.348  863.892   12.318 12.00116 17.44149 
1 1 1    1   27   29 o  396.686   9.9512  120.793   6.0422  120.950   8.4951  120.633   8.5957  396.359   14.003  395.808   14.188 0.5517578 19.93428 
1 1 1    1   27   30 o  348.150   10.819   93.118   5.7654   85.290   8.1731  100.873   8.1340  332.430   16.063  361.774   14.689 -29.34357 21.76651 
1 1 1    1   27   31 o  136.227   23.081   14.845   4.6408   23.862   6.7976   6.9743   6.3512  172.589   26.586   98.189   34.314 74.40007 43.40820 
1 1 1    1   27   32 o  559.974   9.2350  240.756   7.9154  240.894   11.176  240.618   11.212  559.235   13.057  558.901   13.106 0.3341064 18.50001 
1 1 1    1   27   33 o   88.551   32.407   5.2166   5.7338   5.9528   8.3474   4.5590   7.8895  100.355   38.595   94.270   37.154 6.085091 53.57266 
1 1 1    1   27   34 f  300.170   14.267   69.575   6.5551   65.708   8.5449   75.104   10.219  290.015   19.361  309.354   21.718 -19.33871 29.09502 
1 1 1    1   27   35 o  288.957   13.645   64.468   6.0349   56.359   8.5058   72.688   8.5638  267.826   20.915  305.196   18.419 -37.37006 27.86873 
1 1 1    1   27   36 o   57.639   26.174  -2.6807   5.0222  -5.2138   7.2954  -0.3989   6.9240   66.290   30.633   74.970   32.536 -8.680222 44.68728 
1 1 1    1   27   37 o   86.153   31.468   5.0598   5.4023   4.2493   7.9327   5.7607   7.3775   92.641   37.018   95.623   36.400 -2.982239 51.91596 
1 1 1    1   27   38 o  118.088   18.676   11.131   3.2634   10.478   3.6029   14.116   7.7014  113.797   21.472  129.030   37.048 -15.23363 42.82026 
1 1 1    1   27   39 o   44.792   19.247  -0.1058   2.3756  -1.6755   3.2515   1.6915   3.4793   46.773   21.168   61.706   24.561 -14.93217 32.42399 
1 1 1    1   27   40 o  122.147   14.850   11.740   2.7193   13.641   3.7751   9.6913   3.9204  130.620   19.478  108.532   24.214 22.08847 31.07590 
1 1 1    1   27   41 o   47.128   19.926   0.2119   2.4751   1.9195   3.4486  -1.6023   3.5546   62.467   24.582   49.458   22.280 13.00897 33.17641 
1 1 1    1   27   42 o  188.624   12.026   27.618   3.4540   21.548   4.7621   34.355   5.0172  164.604   19.265  209.465   15.764 -44.86069 24.89322 
1 1 1    1   27   43 o  224.213   9.9666   38.762   3.4204   36.885   4.9426   40.488   4.7383  217.217   14.957  228.019   13.639 -10.80209 20.24169 
1 1 1    1   27   44 o  102.929   20.096   8.6332   3.0524   8.7915   4.5608   8.5047   4.1080  102.280   28.215  100.809   26.334 1.470947 38.59530 
1 1 1    1   27   45 o  114.357   24.258   10.862   4.1144   11.459   4.4948   7.7727   10.219  117.043   25.786  107.409   42.300 9.633728 49.54026 
1 1 1    1   27   46 o   62.855   23.527   2.5127   3.0525   4.0800   4.2358   0.8194   4.4027   76.171   27.857   63.213   26.643 12.95804 38.54682 
1 1 1    1   27   47 o  368.868   21.443  109.230   12.055   0.0000   0.0000  109.230   12.055  ?   ?   368.868   21.443 0.000000 21.44340 
1 1 1    1   27   48 o   89.016   26.261   6.6724   3.8231   3.2568   5.4976   9.8712   5.3202   77.114   30.815  106.549   30.850 -29.43511 43.60410 
1 1 1    1   27   49 o  283.402   13.832   62.877   6.0000   79.111   7.4019   31.770   10.246  317.123   15.249  186.823   37.139 130.3002 40.14775 
1 1 1    1   27   50 o  162.512   16.279   21.087   3.9949   20.937   5.9104   21.213   5.4207  157.493   25.381  159.951   22.785 -2.458786 34.10778 
1 1 1    1   27   51 f  192.333   14.574   29.318   4.2587   31.913   6.2499   27.069   5.8185  197.175   21.033  181.249   21.385 15.92667 29.99530 
1 1 1    1   27   52 o   48.945   22.547  -2.2978   3.9076  -3.5488   5.6531  -1.1532   5.4074   57.282   26.641   61.412   27.590 -4.129372 38.35293 
1 1 1    1   27   53 o   40.210   19.625  -6.5133   3.9536  -2.1966   5.3706 -11.6201   5.8414   58.254   26.686   45.551   22.545 12.70259 34.93490 
1 1 1    1   27   54 o   90.791   28.473   7.4657   4.4031   3.0196   6.1031   12.292   6.3586   75.379   31.546  112.393   34.035 -37.01408 46.40609 
1 1 1    1   28    1 o  645.286   14.882  319.335   14.699   0.0000   0.0000  319.335   14.699  ?   ?   645.286   14.882 0.000000 14.88172 
1 1 1    1   28    2 o  227.435   15.479   39.859   5.3564   47.613   7.9398   33.383   7.2564  248.018   21.116  207.036   23.303 40.98245 31.44729 
1 1 1    1   28    3 o  781.157   10.907  467.529   13.041  466.909   18.567  468.132   18.321  780.183   15.548  781.230   15.322 -1.047485 21.82867 
1 1 1    1   28    4 o  194.600   26.117   29.684   7.5829   0.0000   0.0000   29.684   7.5829  ?   ?   194.600   26.117 0.000000 26.11698 
1 1 1    1   28    5 o  374.890   16.798  107.857   9.6389   0.0000   0.0000  107.857   9.6389  ?   ?   374.890   16.798 0.000000 16.79795 
1 1 1    1   28    6 o  336.390   18.220   87.142   9.3461   0.0000   0.0000   87.142   9.3461  ?   ?   336.390   18.220 0.000000 18.21964 
1 1 1    1   28    7 o  581.074   15.055  259.007   13.390   0.0000   0.0000  259.007   13.390  ?   ?   581.074   15.055 0.000000 15.05519 
1 1 1    1   28    9 o  523.190   15.904  210.067   12.736  210.067   12.736   0.0000   0.0000  523.190   15.904  ?   ?  0.000000 15.90406 
1 1 1    1   28   10 o  333.004   19.249   85.504   9.7696   85.504   9.7696   0.0000   0.0000  333.004   19.249  ?   ?  0.000000 19.24933 
1 1 1    1   28   11 o  509.581   16.079  199.337   12.542  199.337   12.542   0.0000   0.0000  509.581   16.079  ?   ?  0.000000 16.07940 
1 1 1    1   28   12 o  581.782   11.299  259.444   10.061  242.819   13.901  277.736   14.581  562.372   16.149  601.486   15.838 -39.11334 22.61959 
1 1 1    1   28   13 o  649.091   9.0496  322.784   8.9909  326.200   11.036  316.041   15.505  652.347   11.052  641.581   15.789 10.76575 19.27271 
1 1 1    1   28   14 o  374.413   8.9991  107.404   5.1573  107.132   7.2505  107.684   7.3373  373.735   12.675  374.689   12.794 -0.9539795 18.00903 
1 1 1    1   28   15 f  369.801   8.8998  104.778   5.0375  102.252   7.0716  107.381   7.1778  365.103   12.654  374.157   12.533 -9.053619 17.81052 
1 1 1    1   28   16 o  483.059   8.2835  178.769   6.1247  177.113   8.6474  180.435   8.6758  480.563   11.756  485.054   11.686 -4.490875 16.57593 
1 1 1    1   28   17 o  353.147   9.3472   95.579   5.0525   91.567   7.0126   99.909   7.2859  345.411   13.264  360.808   13.193 -15.39639 18.70788 
1 1 1    1   28   18 o  207.961   13.570   33.342   4.2959   36.757   6.2059   30.200   5.9526  217.703   18.809  196.981   20.021 20.72200 27.47041 
1 1 1    1   28   19 o  632.912   7.9554  306.919   7.7068  299.390   10.699  315.040   11.111  624.751   11.188  640.854   11.328 -16.10291 15.92113 
1 1 1    1   28   20 o  103.414   25.350   8.6122   3.9816   6.8113   5.6949   10.334   5.5690   96.451   32.533  113.367   31.139 -16.91538 45.03383 
1 1 1    1   28   21 o  417.692   8.7787  133.733   5.6125  131.994   7.9489  135.462   7.9256  414.628   12.525  420.062   12.327 -5.433594 17.57346 
1 1 1    1   28   22 o  414.602   12.633  132.012   8.0171  132.012   8.0171   0.0000   0.0000  414.602   12.633  ?   ?  0.000000 12.63326 
1 1 1    1   28   23 o   88.698   33.611   4.5234   6.2725   11.181   8.7827  -2.4075   8.9612  121.270   40.400   82.047   36.267 39.22325 54.29056 
1 1 1    1   28   24 f  464.850   12.943  166.057   9.2089  166.679   13.131  165.456   12.919  464.730   18.459  463.070   18.227 1.660431 25.94137 
1 1 1    1   28   25 o  502.215   8.7985  193.420   6.7634  192.742   9.5011  194.116   9.6301  500.835   12.394  502.596   12.518 -1.761230 17.61572 
1 1 1    1   28   26 o  530.375   8.6918  215.736   7.0560  228.115   10.176  204.275   9.7922  544.820   12.203  515.528   12.410 29.29181 17.40444 
1 1 1    1   28   27 f  472.197   9.1547  171.069   6.6166  175.118   9.3155  166.947   9.3997  477.190   12.754  465.849   13.183 11.34192 18.34236 
1 1 1    1   28   28 o  548.220   8.8773  230.591   7.4491  234.508   10.564  226.717   10.506  552.175   12.499  542.895   12.643 9.280396 17.77819 
1 1 1    1   28   29 o  382.224   10.200  112.206   5.9676  107.769   8.3818  116.767   8.4985  373.888   14.646  389.258   14.264 -15.36908 20.44423 
1 1 1    1   28   30 o  620.778   8.9088  295.783   8.4650  288.305   11.912  303.411   12.031  611.961   12.717  627.845   12.520 -15.88440 17.84572 
1 1 1    1   28   31 o  267.422   14.729   55.362   6.0055   56.705   9.7388   54.539   7.6286  268.181   23.978  264.428   18.974 3.753174 30.57719 
1 1 1    1   28   32 o  360.558   14.105  100.328   7.7842  101.551   11.231   99.198   10.799  360.555   20.435  356.538   19.867 4.016968 28.50037 
1 1 1    1   28   33 f  229.432   15.558   40.910   5.4314   43.461   7.7926   38.500   7.5743  234.790   21.938  220.617   22.757 14.17310 31.60945 
1 1 1    1   28   34 o  292.961   13.084   66.233   5.8671   76.668   8.5467   56.933   8.0686  313.584   17.880  269.529   19.694 44.05524 26.60014 
1 1 1    1   28   35 o  449.277   10.618  155.379   7.3020  164.559   10.659  147.262   10.023  460.993   15.106  436.123   15.015 24.87021 21.29936 
1 1 1    1   28   36 o  297.785   13.772   68.562   6.2771   75.912   9.0614   61.780   8.7036  311.332   19.108  280.279   20.429 31.05353 27.97192 
1 1 1    1   28   37 o   96.674   32.024   7.3394   5.5212   7.8838   7.9689   6.8369   7.6568  104.600   38.216  100.044   37.298 4.555626 53.40075 
1 1 1    1   28   38 o  118.804   30.621   11.830   5.6033   10.666   7.8630   13.030   7.9871  114.596   38.229  124.221   38.249 -9.624397 54.07792 
1 1 1    1   28   39 o  156.104   15.129   19.090   3.5694   22.388   3.9968   6.0996   7.9332  169.038   15.624   97.889   37.631 71.14825 40.74552 
1 1 1    1   28   40 o  165.816   12.693   21.391   3.1972   23.560   4.5100   19.199   4.5330  172.923   17.271  155.291   19.501 17.63274 26.04922 
1 1 1    1   28   41 o   57.472   22.225   1.7723   2.7798   0.4894   3.9529   3.0275   3.9098   59.560   25.182   70.209   26.553 -10.64843 36.59478 
1 1 1    1   28   42 o  133.344   14.325   13.969   2.8779   17.843   4.1833   10.488   3.9654  149.675   18.666  112.761   23.726 36.91386 30.18862 
1 1 1    1   28   43 o  188.252   11.218   27.489   3.2177   30.921   4.6088   24.225   4.4944  198.608   15.278  175.145   16.978 23.46284 22.84036 
1 1 1    1   28   44 o  270.382   12.105   56.648   5.0098   61.220   5.7162   41.503   10.404  280.722   13.303  222.056   31.491 58.66658 34.18608 
1 1 1    1   28   45 o  210.385   24.175   36.073   7.6434   32.248   11.039   39.596   10.593  189.790   39.294  215.058   33.255 -25.26811 51.47771 
1 1 1    1   28   46 o   89.681   29.288   6.6011   4.6243   7.4540   13.155   6.4809   4.9395  111.579   46.473   89.597   30.298 21.98164 55.47711 
1 1 1    1   28   47 o  143.035   17.744   16.414   3.8013   17.789   5.3939   15.058   5.3581  145.881   25.059  132.983   27.240 12.89786 37.01306 
1 1 1    1   28   48 o   71.644   25.781   3.7752   3.6073   5.1015   5.1639   2.5110   5.0413   82.992   30.691   72.058   29.256 10.93375 42.40133 
1 1 1    1   28   49 o  256.677   14.986   52.029   5.8622   33.630   11.050   59.236   6.9158  189.566   39.369  272.973   16.631 -83.40706 42.73793 
1 1 1    1   28   50 o  236.367   15.986   44.485   5.7494   53.596   6.9529   24.784   10.224  258.441   17.683  158.559   41.605 99.88297 45.20702 
1 1 1    1   28   51 o   85.558   26.491   6.3327   3.8254   3.8283   5.3619   8.9289   5.4592   76.931   30.531   99.393   31.768 -22.46175 44.06089 
1 1 1    1   28   52 o  161.057   17.704   21.157   4.2924   18.122   6.1159   24.103   6.0258  141.813   29.150  167.845   24.150 -26.03229 37.85454 
1 1 1    1   29    2 o  219.387   24.193   37.524   7.9889   37.524   7.9889   0.0000   0.0000  219.387   24.193  ?   ?  0.000000 24.19305 
1 1 1    1   29    3 f  495.196   16.056  188.232   12.169  188.232   12.169   0.0000   0.0000  495.196   16.056  ?   ?  0.000000 16.05556 
1 1 1    1   29    4 o  384.622   16.928  113.598   9.9659  113.598   9.9659   0.0000   0.0000  384.622   16.928  ?   ?  0.000000 16.92823 
1 1 1    1   29    5 o  628.961   15.446  303.618   14.870  303.618   14.870   0.0000   0.0000  628.961   15.446  ?   ?  0.000000 15.44586 
1 1 1    1   29    6 o  626.304   15.439  301.077   14.800  301.077   14.800   0.0000   0.0000  626.304   15.439  ?   ?  0.000000 15.43894 
1 1 1    1   29    7 o  405.509   12.160  126.080   7.5478  133.362   10.665  118.774   10.683  416.711   16.722  393.172   17.752 23.53845 24.38714 
1 1 1    1   29    8 o  335.526   13.021   86.347   6.6872   78.229   9.5626   94.116   9.3552  318.312   19.724  349.989   17.463 -31.67752 26.34401 
1 1 1    1   29    9 o  298.021   14.018   68.151   6.3942   60.084   9.0516   76.187   9.0340  278.537   21.395  314.210   18.872 -35.67282 28.52840 
1 1 1    1   29   10 o  283.878   14.488   62.013   6.2744   66.606   9.2256   58.060   8.5586  293.429   20.673  273.876   20.567 19.55255 29.16105 
1 1 1    1   29   11 o  717.314   11.118  394.483   12.207  379.475   16.817  411.192   17.745  702.929   15.631  731.680   15.845 -28.75116 22.25713 
1 1 1    1   29   12 o  668.045   11.078  342.174   11.328  323.476   15.539  363.381   16.549  648.945   15.644  687.797   15.720 -38.85211 22.17747 
1 1 1    1   29   13 o  184.741   17.251   26.466   4.8217   27.314   5.8835   24.734   8.4146  187.140   20.897  175.659   32.493 11.48114 38.63238 
1 1 1    1   29   14 o  390.159   8.9028  116.650   5.3166  115.077   7.5003  118.239   7.5376  387.264   12.653  392.556   12.545 -5.292145 17.81783 
1 1 1    1   29   15 o  368.655   9.1916  104.162   5.1866  109.123   7.4500   99.496   7.2251  377.066   12.908  360.033   13.111 17.03262 18.39884 
1 1 1    1   29   16 o  490.414   8.1974  184.285   6.1533  183.283   8.6083  185.333   8.7989  488.791   11.506  491.497   11.696 -2.706360 16.40693 
1 1 1    1   29   17 o  325.657   10.005   81.318   4.9873   79.141   6.9385   83.645   7.1734  320.966   14.123  329.966   14.203 -8.999512 20.03002 
1 1 1    1   29   18 o  279.193   10.784   59.794   4.6085   74.916   6.7233   46.393   6.3294  312.253   14.067  244.924   16.989 67.32922 22.05657 
1 1 1    1   29   19 o  568.192   8.0991  247.419   7.0437  243.133   9.8182  251.965   10.111  562.867   11.396  572.979   11.529 -10.11273 16.21064 
1 1 1    1   29   20 o  676.641   9.3892  351.086   9.7243  350.825   11.875  351.617   16.942  676.061   11.476  675.794   16.379 0.2673950 19.99913 
1 1 1    1   29   21 o  413.047   13.094  131.098   8.2780  133.927   11.818  128.374   11.599  416.636   18.532  407.900   18.577 8.736633 26.24047 
1 1 1    1   29   22 o  153.852   22.938   18.738   5.2366   30.898   9.2535   13.009   6.3514  196.124   31.923  126.361   32.617 69.76247 45.63934 
1 1 1    1   29   23 o  397.406   9.2642  121.141   5.6353  119.072   7.9480  123.232   7.9911  393.541   13.195  400.379   13.040 -6.837555 18.55077 
1 1 1    1   29   24 o  337.531   10.443   87.456   5.3955   83.033   7.5355   92.109   7.7288  328.355   14.993  345.891   14.598 -17.53598 20.92637 
1 1 1    1   29   25 o   90.607   27.855   6.4422   4.2380   6.5630   5.9360   6.3167   6.0526   95.519   33.186   94.807   33.470 0.7118149 47.13321 
1 1 1    1   29   26 f  488.503   9.0279  183.101   6.7503  183.357   9.5905  182.850   9.5029  488.204   12.834  487.547   12.734 0.6564026 18.07974 
1 1 1    1   29   27 o  315.814   11.137   76.650   5.3838   81.756   7.6450   71.626   7.5830  325.557   15.342  304.134   16.349 21.42328 22.42053 
1 1 1    1   29   28 o  626.240   8.7827  300.970   8.4186  294.064   11.799  308.131   12.015  618.147   12.471  632.778   12.405 -14.63031 17.59011 
1 1 1    1   29   29 o   92.529   30.896   6.4839   5.1356   12.696   8.2070   2.4856   6.5841  124.930   38.822   82.193   33.410 42.73722 51.21913 
1 1 1    1   29   30 o  453.002   12.705  158.092   8.8093  171.762   12.773  145.691   12.166  470.716   17.728  433.329   18.342 37.38660 25.50930 
1 1 1    1   29   31 o  297.788   13.848   68.439   6.3120   67.507   8.0290   69.947   10.213  294.409   17.902  298.210   22.541 -3.800415 28.78541 
1 1 1    1   29   32 o  346.664   11.332   92.529   6.0127   85.122   8.3539  100.490   8.6609  331.393   16.469  360.272   15.706 -28.87970 22.75778 
1 1 1    1   29   33 o  123.989   27.485   12.653   5.0792   7.5283   7.2606   17.564   7.1078  101.975   36.588  145.012   32.792 -43.03668 49.13227 
1 1 1    1   29   34 o  432.059   10.649  143.713   7.0422  141.918   10.012  145.472   9.9075  428.016   15.282  433.460   14.933 -5.444763 21.36637 
1 1 1    1   29   35 o   72.921   29.701   1.9580   5.2167  -8.7325   7.4383   12.306   7.3183   60.970   29.023  121.320   36.462 -60.34969 46.60332 
1 1 1    1   29   36 o   97.565   31.882   7.5521   5.4791   5.6325   7.8821   9.3469   7.6216   96.582   37.404  109.230   37.623 -12.64794 53.05190 
1 1 1    1   29   37 o  391.120   12.097  118.117   7.2418  124.708   10.391  111.891   10.098  400.181   16.964  378.884   17.413 21.29697 24.31017 
1 1 1    1   29   38 o  236.840   16.939   43.931   6.1000   41.568   8.6177   46.303   8.6357  227.243   25.201  240.602   23.760 -13.35904 34.63495 
1 1 1    1   29   39 o  179.260   40.502   28.186   10.851   12.884   14.672   46.663   16.122  131.351   50.985  226.906   47.922 -95.55557 69.97142 
1 1 1    1   29   40 o  338.306   14.059   88.835   7.2799   83.134   10.205   94.742   10.388  324.046   20.683  346.552   19.665 -22.50540 28.53933 
1 1 1    1   29   41 o   40.492   18.645  -1.9269   2.6678  -1.9702   3.7362  -1.8819   3.8106   49.692   22.569   50.534   22.889 -0.8413696 32.14415 
1 1 1    1   29   42 o  458.371   9.1014  161.860   6.3855  153.539   12.036  165.120   7.5331  442.357   17.776  462.404   10.643 -20.04724 20.71889 
1 1 1    1   29   43 o  199.706   14.533   31.229   4.4119   36.841   4.9349   8.8823   9.8474  216.851   14.959  109.741   41.987 107.1096 44.57255 
1 1 1    1   29   44 o  341.659   15.844   91.401   8.2857   85.243   11.816   97.358   11.622  324.530   23.957  348.459   21.901 -23.92902 32.45925 
1 1 1    1   29   45 o   53.621   24.476  -2.3795   4.4645   4.8808   12.327  -3.4757   4.7897  104.147   44.271   53.198   24.667 50.94884 50.67929 
1 1 1    1   29   46 o  135.318   18.443   14.770   3.7205   17.062   5.2119   12.388   5.3126  142.946   24.715  119.551   29.268 23.39426 38.30712 
1 1 1    1   29   47 o  189.510   13.598   28.222   3.9180   21.876   5.4616   34.951   5.6239  163.005   22.489  209.172   17.733 -46.16681 28.63911 
1 1 1    1   29   48 o  101.589   25.179   8.8447   3.8955   10.118   5.4577   7.5226   5.5620  106.845   31.336   94.300   32.150 12.54482 44.89472 
1 1 1    1   29   49 o   85.936   26.066   6.3167   3.7273   0.9875   5.0527   12.679   5.5209   66.175   28.242  119.049   30.239 -52.87417 41.37670 
1 1 1    1   29   50 o   43.016   20.526  -4.3637   3.7676  -4.8669   5.1425  -3.7806   5.5356   51.599   24.437   56.163   26.201 -4.563717 35.82829 
1 1 1    1   29   51 o  106.091   34.951   10.679   6.5801   6.9925   9.0954   14.726   9.5312   95.430   39.083  119.406   42.018 -23.97598 57.38466 
1 1 1    1   29   52 o  131.811   22.956   14.924   4.4632   16.480   6.1607   13.205   6.4748  133.163   30.833  116.684   34.105 16.47974 45.97690 
1 1 1    1   30    1 f  301.833   19.466   70.380   8.9451   0.0000   0.0000   70.380   8.9451  ?   ?   301.833   19.466 0.000000 19.46572 
1 1 1    1   30    2 o  965.165   11.836  714.332   17.485  689.117   24.114  742.292   25.392  947.066   16.635  982.871   16.878 -35.80469 23.69798 
1 1 1    1   30    3 f  637.450   10.753  311.491   10.492  307.665   14.776  315.382   14.900  632.997   15.250  640.895   15.189 -7.898376 21.52397 
1 1 1    1   30    4 o  744.818   10.980  425.300   12.518  418.722   17.689  431.898   17.716  738.375   15.652  749.939   15.434 -11.56403 21.98150 
1 1 1    1   30    5 o  367.659   12.379  103.682   6.9660   98.069   9.9940  108.986   9.7149  356.621   18.371  376.586   16.854 -19.96439 24.93114 
1 1 1    1   30    6 o  705.886   10.950  382.021   11.831  388.699   17.107  375.899   16.380  711.356   15.712  699.613   15.296 11.74323 21.92777 
1 1 1    1   30    7 o  469.468   11.345  169.007   8.1520  175.620   11.870  163.103   11.215  478.075   16.221  460.759   15.903 17.31668 22.71582 
1 1 1    1   30    8 o  540.414   11.124  223.941   9.2015  217.502   12.913  230.584   13.115  532.056   15.856  547.853   15.640 -15.79639 22.27187 
1 1 1    1   30    9 o  274.547   14.577   58.045   6.1036   51.048   8.5860   65.194   8.6785  256.333   22.099  290.311   19.646 -33.97842 29.56937 
1 1 1    1   30   10 o  845.528   11.435  548.328   14.799  555.284   21.134  541.637   20.729  849.934   16.245  839.451   16.133 10.48370 22.89507 
1 1 1    1   30   11 o  349.556   12.999   93.786   6.9553   89.015   9.8450   98.539   9.8275  339.465   19.024  357.381   18.024 -17.91647 26.20622 
1 1 1    1   30   12 o  507.205   11.516  197.349   8.9401  200.467   12.873  194.443   12.426  510.565   16.472  502.884   16.143 7.680939 23.06348 
1 1 1    1   30   13 o  259.031   15.882   51.782   6.2665   47.529   8.7904   56.178   8.9358  246.849   23.551  268.869   21.903 -22.02029 32.16213 
1 1 1    1   30   14 o  602.652   9.1913  278.409   8.4784  280.664   10.412  273.971   14.606  604.842   11.247  596.843   15.988 7.998840 19.54774 
1 1 1    1   30   15 o  617.562   7.9362  292.250   7.5017  284.721   10.519  300.041   10.701  609.159   11.282  625.347   11.180 -16.18823 15.88319 
1 1 1    1   30   16 o  369.348   9.3297  104.595   5.2744  101.126   7.5344  107.928   7.3861  362.800   13.568  374.875   12.872 -12.07526 18.70256 
1 1 1    1   30   17 o  936.739   9.8426  672.992   14.112  664.255   17.141  691.375   24.863  930.143   12.040  947.380   17.146 -17.23688 20.95078 
1 1 1    1   30   18 o  182.198   18.151   25.848   4.9944   24.054   6.1400   29.355   8.5863  174.646   23.571  191.631   30.279 -16.98456 38.37200 
1 1 1    1   30   19 o  120.321   31.933   11.755   5.9786   13.139   8.4139   10.343   8.4967  128.195   39.222  117.482   39.738 10.71262 55.83393 
1 1 1    1   30   20 o   63.173   27.122  -0.2135   4.7100  -6.4008   8.2887   2.7371   5.7239   70.587   32.630   79.412   31.536 -8.825684 45.37873 
1 1 1    1   30   21 o  204.221   14.879   32.276   4.6191   30.231   6.2862   34.675   6.8100  196.457   21.243  210.513   21.434 -14.05608 30.17760 
1 1 1    1   30   22 o  434.775   9.0674  145.004   6.0341  142.507   8.4612  147.588   8.6078  430.513   12.840  438.121   12.836 -7.608032 18.15590 
1 1 1    1   30   23 o  190.377   15.399   28.113   4.4489   26.352   6.1631   30.030   6.4286  182.869   22.493  195.528   21.854 -12.65958 31.36116 
1 1 1    1   30   24 o  377.035   9.9252  109.134   5.7278   98.902   7.9230  120.336   8.2902  358.303   14.447  395.356   13.700 -37.05325 19.90950 
1 1 1    1   30   25 o  467.770   9.1530  167.928   6.5534  173.899   9.3468  162.154   9.1909  475.368   12.846  458.987   13.082 16.38065 18.33485 
1 1 1    1   30   26 o  189.013   16.428   27.806   4.7056   30.466   6.6653   25.163   6.6441  196.528   22.567  177.706   25.128 18.82231 33.77382 
1 1 1    1   30   27 o  534.631   10.182  219.612   8.3319  225.031   13.993  216.636   10.371  539.315   16.951  530.399   12.774 8.915710 21.22571 
1 1 1    1   30   28 o   68.128   29.465  -0.3958   5.6393  -4.0507   7.8219   3.5604   8.1378   71.879   32.649   92.228   37.266 -20.34966 49.54526 
1 1 1    1   30   29 o  468.248   10.887  168.657   7.8031  178.494   9.9268  152.750   12.623  481.059   13.482  443.465   18.597 37.59436 22.96956 
1 1 1    1   30   30 o  223.617   15.188   38.847   5.1675   42.455   7.3596   35.339   7.2574  232.318   20.921  211.235   22.808 21.08328 30.95008 
1 1 1    1   30   31 o  347.724   11.484   93.131   6.1122   95.302   8.6729   90.988   8.6153  350.659   16.159  342.558   16.431 8.100494 23.04537 
1 1 1    1   30   32 o  225.728   15.769   39.674   5.4140   43.670   7.7410   35.848   7.5747  235.125   21.756  212.199   23.728 22.92596 32.19196 
1 1 1    1   30   33 o  178.365   20.154   25.166   5.4056   28.870   7.6106   21.396   7.6793  188.886   27.100  160.271   32.417 28.61548 42.25293 
1 1 1    1   30   34 o  489.651   10.517  184.628   7.8825  184.781   10.978  184.466   11.326  488.425   14.684  487.814   15.168 0.6118774 21.11141 
1 1 1    1   30   35 o  211.664   18.090   35.185   5.8045   48.683   8.3295   22.442   8.0931  247.748   22.201  163.397   33.485 84.35130 40.17606 
1 1 1    1   30   36 o  530.137   10.337  216.510   8.3879  211.169   11.818  221.930   11.907  521.763   14.799  535.016   14.539 -13.25262 20.74590 
1 1 1    1   30   37 o  210.079   23.516   35.371   7.4319   31.630   8.4474   48.187   15.633  196.252   28.995  233.026   45.463 -36.77437 53.92202 
1 1 1    1   30   38 o   77.989   36.069  -6.2934   10.146 -18.5597   14.746   4.7359   13.982   81.561   39.355  111.833   47.326 -30.27283 61.55101 
1 1 1    1   30   39 o  195.386   21.359   30.499   6.2837   27.621   8.6873   33.657   9.1002  180.979   32.558  201.247   30.499 -20.26909 44.61141 
1 1 1    1   30   40 o   93.738   33.772   6.5370   6.1920   1.6757   8.5061   12.017   9.0310   86.365   36.746  119.670   40.966 -33.30473 55.03110 
1 1 1    1   30   41 o  139.235   21.701   15.718   4.4742   15.718   4.4742   0.0000   0.0000  139.235   21.701  ?   ?  0.000000 21.70120 
1 1 1    1   30   42 o  107.531   24.849   9.6600   4.0079   9.7268   4.3743   9.3108   10.004  107.451   26.712  111.260   42.378 -3.808395 50.09412 
1 1 1    1   30   43 o  164.123   16.993   21.374   4.2069   21.094   10.414   21.429   4.5988  150.734   43.019  163.740   18.684 -13.00551 46.90128 
1 1 1    1   30   44 o  293.838   10.149   66.766   4.5647   64.397   6.3196   69.351   6.6004  286.726   14.446  297.888   14.476 -11.16180 20.45107 
1 1 1    1   30   45 o  264.232   12.658   54.382   5.1194   62.418   5.8816   29.264   10.398  282.705   13.592  178.527   39.133 104.1785 41.42590 
1 1 1    1   30   46 o  169.814   15.017   22.821   3.8631   26.644   5.4549   18.974   5.4716  181.403   19.977  150.613   24.583 30.78972 31.67626 
1 1 1    1   30   47 o  158.299   15.924   19.978   3.8060   15.389   5.4879   24.231   5.2831  133.391   27.781  172.389   20.419 -38.99776 34.47780 
1 1 1    1   30   48 o  138.790   18.809   15.720   3.8927   12.974   5.4549   18.570   5.5567  120.647   29.731  147.486   25.540 -26.83942 39.19462 
1 1 1    1   30   49 o   44.435   20.910  -3.3442   3.6563   1.5405   5.1349  -8.3679   5.2075   67.895   28.703   46.151   22.524 21.74387 36.48531 
1 1 1    1   30   50 o  151.574   21.704   19.310   4.8916   4.0105   9.3251   25.118   5.7455   88.487   38.080  172.798   22.239 -84.31174 44.09824 
1 1 1    1   31    0 o  291.408   18.946   66.003   8.3687   66.003   8.3687   66.003   8.3687  291.408   18.946  291.408   18.946 0.000000 0.000000 
1 1 1    1   31    1 o  900.929   11.535  622.584   15.907  613.165   22.450  632.082   22.543  893.057   16.424  906.773   16.242 -13.71692 23.09847 
1 1 1    1   31    2 o  221.566   16.786   37.964   5.6506   29.938   8.0450   45.778   7.9383  194.627   27.795  242.674   21.597 -48.04752 35.19953 
1 1 1    1   31    3 o  952.087   11.783  695.386   17.171  689.493   24.208  701.352   24.358  946.909   16.703  955.028   16.663 -8.118958 23.59329 
1 1 1    1   31    4 o  700.223   10.923  376.020   11.707  396.322   17.377  359.146   15.842  718.066   15.811  683.682   15.139 34.38434 21.88960 
1 1 1    1   31    5 o  720.231   10.935  397.829   12.055  400.840   17.181  394.910   16.920  722.178   15.543  716.840   15.420 5.337463 21.89446 
1 1 1    1   31    6 o  348.838   12.344   93.384   6.5911   94.012   9.4930   92.798   9.1586  349.047   17.828  347.295   17.229 1.752014 24.79250 
1 1 1    1   31    7 o  422.940   11.665  137.239   7.5515  132.703   10.817  141.550   10.547  415.313   17.016  429.056   16.060 -13.74371 23.39816 
1 1 1    1   31    8 o  453.951   11.597  158.107   8.0577  159.903   11.422  156.327   11.369  455.956   16.366  450.813   16.476 5.143066 23.22297 
1 1 1    1   31    9 f  343.480   13.034   90.585   6.8524   92.431   9.7980   88.817   9.5870  345.895   18.574  339.052   18.544 6.843140 26.24636 
1 1 1    1   31   10 o  118.243   29.536   11.306   5.3298   13.844   7.3516   8.4930   7.7383  130.740   35.722  109.047   37.890 21.69227 52.07405 
1 1 1    1   31   11 o  628.254   11.098  302.831   10.672  314.724   15.403  291.853   14.799  639.662   15.732  615.990   15.696 23.67255 22.22354 
1 1 1    1   31   12 o   50.929   24.245  -6.6075   5.1921  -1.0117   7.5044 -11.7457   7.1911   77.796   33.818   56.043   27.148 21.75384 43.36669 
1 1 1    1   31   13 o  574.223   11.452  253.072   10.065  234.254   13.998  273.218   14.484  551.601   16.579  595.858   15.880 -44.25726 22.95756 
1 1 1    1   31   14 o  472.319   11.907  171.278   8.6085  167.714   12.075  174.961   12.276  466.622   16.906  476.611   16.828 -9.988831 23.85354 
1 1 1    1   31   15 f  710.043   9.3686  386.635   10.182  378.164   12.361  404.510   17.956  701.855   11.507  724.795   16.185 -22.94055 19.85878 
1 1 1    1   31   16 o  331.837   14.456   84.702   7.3424   92.262   10.630   77.806   10.154  344.920   20.224  316.461   21.082 28.45837 29.21425 
1 1 1    1   31   17 o  242.280   14.232   45.308   5.2545   36.969   9.1410   49.423   6.4215  215.862   28.352  252.691   16.697 -36.82860 32.90302 
1 1 1    1   31   18 o  536.591   8.4145  220.771   6.9110  210.505   9.6392  231.630   9.9140  523.454   12.031  549.132   11.795 -25.67828 16.84820 
1 1 1    1   31   19 o  264.198   11.558   53.617   4.6737   56.280   6.4542   50.682   6.7769  269.809   15.696  255.687   17.420 14.12215 23.44844 
1 1 1    1   31   20 o  494.109   8.6868  187.258   6.5698  195.842   9.3414  178.856   9.2416  504.788   12.090  482.327   12.518 22.46082 17.40329 
1 1 1    1   31   21 o   82.567   27.501   5.0774   4.0698   1.4651   5.6322   9.0244   5.8874   74.255   30.623  106.653   32.838 -32.39774 44.90118 
1 1 1    1   31   22 o   65.411   26.416   1.5372   4.0868   1.5288   5.5586   1.5470   6.0292   74.015   30.461   76.620   31.649 -2.605293 43.92637 
1 1 1    1   31   23 o  191.443   15.994   28.484   4.6437   20.763   6.3950   37.097   6.7542  160.724   26.949  217.692   20.512 -56.96817 33.86729 
1 1 1    1   31   24 o  314.493   10.883   76.016   5.2388   73.819   7.2077   78.477   7.6278  309.289   15.225  318.826   15.630 -9.536926 21.82010 
1 1 1    1   31   25 o  199.434   17.856   31.045   5.3932   32.621   9.2892   30.245   6.6239  200.647   31.265  195.700   22.524 4.947250 38.53381 
1 1 1    1   31   26 o  182.973   21.967   26.469   6.0292   26.409   8.4541   26.531   8.6008  179.749   31.896  179.999   32.409 -0.2507172 45.47232 
1 1 1    1   31   27 o  240.684   15.448   44.964   5.6609   43.336   7.1189   47.764   9.3358  235.162   19.966  245.321   25.222 -10.15918 32.16817 
1 1 1    1   31   28 o  225.265   15.261   39.420   5.2311   41.214   7.3058   37.533   7.4934  228.850   21.094  217.792   22.817 11.05737 31.07405 
1 1 1    1   31   29 o  118.485   27.249   11.543   4.8386   6.7595   6.7466   16.610   6.9434   97.711   35.245  141.115   32.774 -43.40333 48.12820 
1 1 1    1   31   30 o  254.525   14.382   50.246   5.5801   49.280   7.7541   51.284   8.0365  250.384   20.410  255.346   20.741 -4.962555 29.09946 
1 1 1    1   31   31 o  157.077   21.988   19.700   5.1416   21.078   7.3109   18.353   7.2324  159.612   31.043  148.165   32.761 11.44661 45.13259 
1 1 1    1   31   32 o  375.148   16.917  109.389   9.7137  109.389   9.7137   0.0000   0.0000  375.148   16.917  ?   ?  0.000000 16.91658 
1 1 1    1   31   33 o  380.194   11.700  111.490   6.8085  103.880   9.5115  119.486   9.7502  365.415   17.006  392.182   16.243 -26.76682 23.51627 
1 1 1    1   31   34 o   53.718   25.215  -5.0660   5.2602   0.0916   7.4651 -10.1523   7.4133   78.590   33.945   58.604   28.183 19.98611 44.11988 
1 1 1    1   31   35 o  274.040   15.020   58.456   6.2762   73.751   8.9730   43.804   8.7820  306.326   19.235  233.546   24.953 72.77956 31.50634 
1 1 1    1   31   36 o  129.974   43.529   14.344   10.195   7.8314   14.229   21.214   14.613  119.232   48.864  153.490   52.112 -34.25856 71.43797 
1 1 1    1   31   37 o  256.894   16.502   51.663   6.4543   42.348   9.2924   60.346   8.9715  228.098   27.149  275.679   21.430 -47.58061 34.58769 
1 1 1    1   31   38 o  190.784   21.067   29.071   6.0494   30.061   8.5341   28.071   8.5763  190.002   30.367  182.783   31.810 7.219055 43.97760 
1 1 1    1   31   39 o   76.371   31.762   1.8447   6.1323   3.3355   8.4317   0.1707   8.9349   90.395   37.390   84.503   36.815 5.891762 52.47293 
1 1 1    1   31   40 f   84.454   32.966   4.2437   6.1604  -0.6101   8.4837   9.6580   8.9601   80.536   35.458  110.849   40.520 -30.31310 53.84378 
1 1 1    1   31   41 o  102.385   35.105   8.5521   6.6318  -0.3820   9.3102   17.755   9.4490   84.201   37.105  139.944   41.285 -55.74349 55.50909 
1 1 1    1   31   42 o  165.493   17.689   21.802   4.4114   13.007   11.697   23.261   4.7631  123.654   46.100  170.681   18.530 -47.02664 49.68465 
1 1 1    1   31   43 o  274.698   10.847   58.448   4.5609   57.723   6.2291   59.286   6.6963  271.098   15.071  274.303   16.019 -3.205811 21.99407 
1 1 1    1   31   44 o  284.533   9.7916   62.621   4.2644   62.770   5.9370   62.463   6.1290  283.444   13.685  282.182   14.236 1.262146 19.74680 
1 1 1    1   31   45 o  230.381   11.597   41.369   4.0765   36.816   5.8011   45.811   5.7295  214.653   17.817  240.715   15.635 -26.06183 23.70497 
1 1 1    1   31   46 o  268.439   13.011   56.356   5.3458   45.425   10.950   59.777   6.1254  227.350   32.381  275.359   14.585 -48.00893 35.51407 
1 1 1    1   31   47 o   83.906   26.074   5.9936   3.7021   2.2372   5.1339   10.063   5.3435   70.697   29.204  105.834   30.997 -35.13636 42.58713 
1 1 1    1   31   48 o  187.951   24.399   29.952   6.8535   21.725   9.5907   38.538   9.7973  146.630   41.087  206.814   31.982 -60.18378 52.06687 
1 1 1    1   31   49 o  134.669   26.570   15.964   5.2824 -10.3790   9.1251   29.241   6.4782   63.390   30.677  185.819   23.288 -122.4285 38.51564 
1 1 1    1   31   50 o  162.388   18.137   21.637   4.4311   21.576   6.1479   21.703   6.3922  156.453   26.627  156.043   27.781 0.4097900 38.48079 
1 1 1    1   32    0 o  148.115   37.899   19.934   7.4274   19.934   7.4274   19.934   7.4274  148.115   37.899  148.115   37.899 0.000000 0.000000 
1 1 1    1   32    1 o  455.377   11.367  159.115   7.9230  158.209   11.284  159.997   11.127  453.462   16.257  456.065   15.940 -2.602234 22.76821 
1 1 1    1   32    2 o  112.675   29.211   10.250   5.0798   19.727   7.2030   0.8739   7.1649  156.382   31.186   81.055   34.066 75.32656 46.18511 
1 1 1    1   32    3 o  174.513   20.931   23.843   5.4793   29.628   7.9233   18.541   7.5856  193.421   27.541  151.060   33.668 42.36145 43.49708 
1 1 1    1   32    4 o  393.396   12.500  118.822   7.5271  118.963   10.627  118.680   10.662  393.000   17.667  392.522   17.747 0.4779968 25.04155 
1 1 1    1   32    5 o  489.623   11.434  183.970   8.5694  179.385   12.024  188.702   12.216  482.811   16.270  495.217   16.117 -12.40573 22.90125 
1 1 1    1   32    6 o  394.857   12.276  119.703   7.4194  120.280   10.613  119.151   10.377  395.153   17.546  393.338   17.236 1.814850 24.59539 
1 1 1    1   32    7 o  650.149   11.054  324.347   11.000  313.971   15.539  334.770   15.575  638.769   15.893  659.692   15.424 -20.92291 22.14734 
1 1 1    1   32    8 o  326.491   13.139   81.890   6.5658   78.662   9.2650   85.147   9.3061  318.767   19.077  331.819   18.395 -13.05188 26.50079 
1 1 1    1   32    9 o  216.472   18.258   36.382   5.9931   51.952   8.8188   23.021   8.1695  258.123   22.547  168.689   32.821 89.43433 39.81997 
1 1 1    1   32   10 o  177.865   20.722   24.771   5.5358   21.487   7.9716   27.830   7.6933  162.733   33.130  187.140   27.695 -24.40715 43.18093 
1 1 1    1   32   11 o  508.562   11.443  198.549   8.9078  217.690   13.147  182.303   12.112  531.699   16.154  486.547   16.264 45.15210 22.92287 
1 1 1    1   32   12 f  289.486   14.627   64.630   6.4601   69.213   9.2679   60.300   9.0095  298.546   20.404  278.378   21.306 20.16766 29.50039 
1 1 1    1   32   13 o  296.863   14.767   67.814   6.7101   72.507   9.6790   63.472   9.3107  305.458   20.826  285.564   21.458 19.89456 29.90289 
1 1 1    1   32   14 o  329.408   13.961   83.464   7.0390   85.278   10.378   81.918   9.5789  331.380   20.563  325.035   19.341 6.345032 28.22965 
1 1 1    1   32   15 o  562.364   11.616  242.912   9.9991  236.137   14.190  249.595   14.092  553.386   16.752  569.081   16.179 -15.69513 23.28927 
1 1 1    1   32   16 o  283.219   12.613   61.661   5.4679   64.126   6.6928   56.714   9.4816  288.138   15.229  269.246   23.235 18.89188 27.78118 
1 1 1    1   32   17 o  188.563   14.944   27.556   4.2779   25.639   5.9893   29.554   6.1122  180.456   22.149  194.204   20.891 -13.74850 30.44663 
1 1 1    1   32   18 o  391.778   9.3190  117.778   5.5883  119.797   7.8358  115.687   7.9720  394.638   12.972  387.737   13.433 6.900452 18.67391 
1 1 1    1   32   19 o  380.999   9.7297  111.426   5.6740  112.292   8.0025  110.551   8.0462  381.918   13.689  378.915   13.873 3.002686 19.49028 
1 1 1    1   32   20 o  309.989   10.757   73.824   5.1041   79.446   7.2009   68.147   7.2358  321.053   14.654  296.727   15.991 24.32599 21.68932 
1 1 1    1   32   21 o  178.422   16.753   24.811   4.5217   24.153   6.2879   25.517   6.5071  174.316   24.221  179.220   24.351 -4.903458 34.34613 
1 1 1    1   32   22 o  327.564   10.847   82.471   5.4383   88.258   7.7574   76.879   7.6260  338.202   14.985  315.106   15.862 23.09528 21.82140 
1 1 1    1   32   23 o  247.966   14.584   47.603   5.5110   49.336   8.9666   46.551   6.9863  250.159   23.700  244.269   18.831 5.890076 30.27061 
1 1 1    1   32   24 o  105.274   31.849   8.9334   5.5701   13.741   7.7070   3.6762   8.0594  128.748   37.089   92.244   37.151 36.50401 52.49565 
1 1 1    1   32   25 o  652.617   9.9571  327.344   9.9463  327.912   12.358  326.300   16.760  652.429   12.375  649.003   16.872 3.426636 20.92327 
1 1 1    1   32   26 o   88.300   28.932   6.0066   4.5111   8.5261   6.3089   3.3708   6.4529  104.235   34.218   84.238   33.474 19.99754 47.86825 
1 1 1    1   32   27 o  472.115   9.7440  171.352   7.0414  166.579   9.8952  176.248   10.022  464.410   13.920  477.765   13.705 -13.35532 19.53452 
1 1 1    1   32   28 o  218.082   15.769   37.029   5.2282   31.755   7.3708   42.369   7.4171  199.348   24.684  231.855   21.132 -32.50764 32.49419 
1 1 1    1   32   29 o  308.605   12.466   73.466   5.8885   78.928   8.4014   68.191   8.2558  318.262   17.311  295.427   18.348 22.83545 25.22572 
1 1 1    1   32   30 o  230.508   15.569   41.372   5.4608   43.872   7.5798   38.674   7.8740  235.708   21.237  220.345   23.720 15.36388 31.83845 
1 1 1    1   32   31 o   91.940   30.846   6.5208   5.1193   4.3019   7.1471   8.8587   7.3361   89.699   35.360  106.922   36.906 -17.22311 51.11152 
1 1 1    1   32   32 o  159.712   22.913   20.487   5.4409   19.824   7.5698   21.195   7.8257  153.484   33.188  158.788   33.264 -5.303650 46.98865 
1 1 1    1   32   33 o   81.695   30.835   4.2038   5.2659   8.6613   7.3737  -0.4359   7.5229  105.854   36.975   77.482   33.768 28.37277 50.07404 
1 1 1    1   32   34 o  281.024   24.075   63.089   10.256   78.831   14.683   48.093   14.331  310.026   31.374  235.770   41.211 74.25662 51.79437 
1 1 1    1   32   35 o  120.199   35.595   12.284   7.0124   5.2046   14.194   14.570   8.0655  113.493   47.836  129.963   38.087 -16.47035 61.14671 
1 1 1    1   32   36 o   57.389   26.630  -4.2739   5.5979   0.0900   7.7842  -8.9479   8.0561   79.589   34.519   63.578   30.248 16.01152 45.89669 
1 1 1    1   32   37 o  297.884   15.256   69.254   6.9326   64.684   9.6778   74.070   9.9356  284.692   22.390  305.286   21.398 -20.59317 30.97045 
1 1 1    1   32   38 o  248.606   17.882   48.713   6.7592   48.273   9.7438   49.121   9.3844  243.305   26.597  246.179   25.263 -2.873764 36.68297 
1 1 1    1   32   39 o  270.162   17.297   57.469   7.1151   61.026   9.9708   53.779   10.156  274.993   23.927  256.717   26.215 18.27560 35.49279 
1 1 1    1   32   40 o  135.439   32.220   15.874   6.5824   16.013   9.1137   15.722   9.5172  133.275   40.828  132.047   41.918 1.227737 58.51471 
1 1 1    1   32   41 o  260.408   23.208   54.957   9.1534   58.352   12.986   51.604   12.904  261.117   33.245  243.501   35.682 17.61615 48.76906 
1 1 1    1   32   42 o  121.613   37.811   13.307   7.7840   8.2288   9.9589   21.280   12.479  106.248   41.785  147.333   48.113 -41.08528 63.72529 
1 1 1    1   32   43 o  166.475   14.638   21.875   3.6920   20.535   5.0673   23.391   5.3901  158.556   21.429  169.458   21.248 -10.90207 30.17733 
1 1 1    1   32   44 f  175.343   13.891   24.215   3.6976   32.376   5.3566   16.786   5.1104  201.301   17.561  141.478   24.485 59.82242 30.13177 
1 1 1    1   32   45 o   63.506   24.441   2.4870   3.3493  -1.6210   4.7777   6.4568   4.6966   57.123   25.773   87.866   29.545 -30.74286 39.20657 
1 1 1    1   32   46 o  179.442   25.856   27.443   6.8967   29.859   9.7002   24.973   9.8074  178.645   36.703  159.917   40.131 18.72762 54.38391 
1 1 1    1   32   47 o   95.951   24.295   7.9945   3.5716   3.6736   4.8768   12.993   5.2455   74.565   29.267  120.379   28.846 -45.81413 41.09352 
1 1 1    1   32   48 o  334.874   12.222   88.075   6.2647  106.026   8.0931   61.240   9.8952  365.550   14.464  268.483   24.344 97.06778 28.31680 
1 1 1    1   33    0 o   66.536   39.487   3.8484   6.9938   3.8484   6.9938   3.8484   6.9938   66.536   39.487   66.536   39.487 0.000000 0.000000 
1 1 1    1   33    1 o  333.449   13.293   85.446   6.7848   78.963   9.5361   92.092   9.6553  319.192   19.614  345.056   18.347 -25.86404 26.85726 
1 1 1    1   33    2 o  330.351   13.012   83.853   6.5795   73.147   9.2390   94.869   9.3720  307.132   19.758  350.827   17.453 -43.69482 26.36253 
1 1 1    1   33    3 o  209.325   18.173   34.044   5.7650   50.107   8.4378   19.981   7.8950  253.517   21.962  156.599   33.919 96.91797 40.40823 
1 1 1    1   33    4 o  375.286   12.742  108.204   7.3193  107.574   10.508  108.798   10.201  373.414   18.384  375.634   17.743 -2.220612 25.54957 
1 1 1    1   33    5 o  395.602   12.641  120.234   7.6541  137.597   11.078  104.374   10.588  422.526   17.129  367.245   18.899 55.28094 25.50695 
1 1 1    1   33    6 o  753.115   11.369  435.445   13.105  428.792   18.493  442.156   18.575  746.132   16.193  757.722   16.015 -11.59094 22.77493 
1 1 1    1   33    7 o  436.103   11.949  146.069   7.9759  147.762   11.440  144.468   11.126  437.818   17.071  432.961   16.788 4.856354 23.94331 
1 1 1    1   33    8 o  140.674   26.434   15.892   5.4827   27.294   8.0659   6.0996   7.4752  184.671   29.530   98.965   36.862 85.70586 47.23158 
1 1 1    1   33    9 o  732.005   11.436  411.469   12.813  398.298   17.960  425.121   18.285  718.936   16.321  742.823   16.082 -23.88757 22.91294 
1 1 1    1   33   10 o  396.025   12.525  120.528   7.5920  127.339   11.009  114.351   10.484  406.221   17.706  384.932   17.794 21.28928 25.10177 
1 1 1    1   33   11 o  338.878   13.494   88.323   6.9994   87.330   9.8508   89.335   9.9473  335.576   19.259  339.426   19.226 -3.850189 27.21264 
1 1 1    1   33   12 o   55.223   25.807  -5.1179   5.4067  -9.5339   8.1348  -1.6235   7.2363   64.502   30.602   74.527   32.782 -10.02509 44.84561 
1 1 1    1   33   13 o  665.977   11.555  340.745   11.779  351.335   17.061  331.100   16.282  674.898   16.516  655.261   16.234 19.63678 23.15831 
1 1 1    1   33   14 o  197.866   20.938   30.679   6.2448   30.625   8.9741   30.729   8.6955  195.044   31.105  195.707   29.984 -0.6633301 43.20314 
1 1 1    1   33   15 o  286.459   16.004   63.489   6.9889   59.284   10.015   67.481   9.7576  274.890   24.044  294.014   21.838 -19.12378 32.48138 
1 1 1    1   33   16 o  139.519   23.490   15.552   4.8382   16.994   5.8007   12.254   8.7702  145.121   27.112  124.474   40.316 20.64710 48.58409 
1 1 1    1   33   17 o  142.606   19.857   16.058   4.2167   19.650   6.2900   13.126   5.6828  156.201   27.303  126.660   29.809 29.54134 40.42249 
1 1 1    1   33   18 o  306.558   10.799   72.213   5.0673   69.913   7.0691   74.644   7.2674  300.625   15.415  311.051   15.264 -10.42538 21.69349 
1 1 1    1   33   19 o  447.047   9.3167  153.430   6.3751  157.457   9.1093  149.565   8.9250  452.171   13.162  440.678   13.232 11.49286 18.66313 
1 1 1    1   33   20 o  185.662   18.321   26.964   5.1386   19.727   8.3544   31.368   6.5172  153.919   36.088  199.577   21.683 -45.65813 42.10099 
1 1 1    1   33   21 o  577.431   11.996  256.628   10.602  254.866   14.705  258.536   15.300  573.907   16.740  577.810   17.299 -3.902832 24.07282 
1 1 1    1   33   22 o  322.201   12.750   79.987   6.2880   79.314   7.8599   81.184   10.480  319.811   16.108  321.982   21.387 -2.170746 26.77445 
1 1 1    1   33   23 o  114.277   26.860   10.703   4.6189   10.642   6.5006   10.766   6.5641  114.155   34.378  114.779   34.541 -0.6246338 48.73281 
1 1 1    1   33   24 o  187.055   17.038   27.348   4.8248   26.336   6.7512   28.404   6.8977  181.388   24.979  188.647   24.464 -7.259399 34.96367 
1 1 1    1   33   25 o  171.160   18.871   23.060   4.8617   29.563   6.8434   16.433   6.9079  192.665   23.706  140.389   32.748 52.27585 40.42757 
1 1 1    1   33   26 o  159.568   20.343   20.180   4.8554   23.026   6.7975   17.216   6.9379  168.497   27.290  143.747   32.318 24.74942 42.29840 
1 1 1    1   33   27 o   79.435   29.523   4.0406   4.7899   1.7306   6.7277   6.4153   6.8212   79.970   33.265   96.432   35.339 -16.46270 48.53189 
1 1 1    1   33   28 o  233.675   15.565   42.507   5.5353   58.557   8.0038   27.793   7.6636  273.290   19.257  184.962   27.940 88.32813 33.93371 
1 1 1    1   33   29 o  146.299   24.146   17.307   5.2183   13.674   7.2802   21.146   7.4836  127.249   35.847  159.386   31.790 -32.13703 47.91296 
1 1 1    1   33   30 o  260.943   14.587   52.907   5.8028   51.406   8.0640   54.520   8.3566  255.221   20.824  262.837   20.946 -7.616150 29.53581 
1 1 1    1   33   31 o  184.705   20.033   27.027   5.5728   25.394   7.8894   28.654   7.8730  175.177   30.534  187.228   28.360 -12.05150 41.67298 
1 1 1    1   33   32 o   87.381   34.351   4.2019   6.7280   4.8246   7.9315   2.6042   12.705   93.858   37.170  104.504   44.696 -10.64629 58.13214 
1 1 1    1   33   33 o   78.378   35.294  -2.9626   8.9094  -3.3656   13.059  -2.6117   12.186   94.585   42.649   92.653   41.536 1.932037 59.53268 
1 1 1    1   33   34 o  114.295   30.765   11.015   5.5010   3.3531   7.8122   18.549   7.7473   88.591   36.245  146.971   34.950 -58.38071 50.35055 
1 1 1    1   33   35 o  299.433   14.566   69.668   6.6757   74.755   9.6352   64.971   9.2578  307.238   20.608  286.013   21.300 21.22525 29.63737 
1 1 1    1   33   36 o  164.770   25.007   22.171   6.1087   21.792   8.5149   22.573   8.7685  158.529   35.923  161.178   36.403 -2.649094 51.14295 
1 1 1    1   33   37 o  297.599   15.542   69.274   7.0549   61.348   9.6858   78.230   10.296  276.411   23.105  313.227   21.608 -36.81604 31.63488 
1 1 1    1   33   38 o  128.870   32.462   14.352   6.4000   11.106   9.0653   17.578   9.0367  115.616   40.946  139.835   40.125 -24.21946 57.32920 
1 1 1    1   33   39 o  234.164   21.275   44.023   7.5422   53.665   11.880   37.514   9.7619  252.147   31.467  210.473   31.251 41.67403 44.34804 
1 1 1    1   33   40 o  103.145   38.814   8.1443   8.3298   1.6075   11.075   16.659   12.640   93.877   40.941  134.148   48.259 -40.27101 63.28637 
1 1 1    1   33   41 o  129.512   33.846   14.921   6.7839   25.239   9.6509   4.8436   9.5380  166.127   38.677   95.895   39.725 70.23191 55.44326 
1 1 1    1   33   42 f  173.060   27.897   25.404   7.1384   27.726   9.8910   22.880   10.313  173.985   38.189  154.787   42.315 19.19806 56.99999 
1 1 1    1   33   43 o  226.426   30.926   44.344   10.438   0.0000   0.0000   44.344   10.438  ?   ?   226.426   30.926 0.000000 30.92645 
1 1 1    1   33   44 o   79.056   25.518   5.1815   3.5160   2.6899   4.8298   7.9906   5.1282   71.271   28.740   95.801   30.808 -24.53035 42.13237 
1 1 1    1   33   45 o  205.631   12.733   33.268   3.9879   28.757   5.6063   37.889   5.6737  187.503   19.836  217.116   17.214 -29.61258 26.26348 
1 1 1    1   33   46 o  206.295   17.207   34.351   5.3836   4.1326   9.2876   49.642   6.6068   89.406   38.227  247.991   17.518 -158.5850 42.04940 
1 1 1    1   34    1 o  101.523   36.671   6.9778   7.3074   6.9778   7.3074   0.0000   0.0000  101.523   36.671  ?   ?  0.000000 36.67137 
1 1 1    1   34    2 o  390.682   12.437  117.303   7.4374  113.692   10.501  120.939   10.536  383.765   17.876  395.899   17.386 -12.13431 24.93670 
1 1 1    1   34    3 o  437.720   11.831  147.196   7.9267  147.291   11.303  147.103   11.119  436.996   16.898  436.769   16.633 0.2265015 23.71060 
1 1 1    1   34    4 o  528.718   11.536  214.725   9.3361  217.408   13.452  212.231   12.968  530.982   16.551  524.718   16.147 6.264038 23.12256 
1 1 1    1   34    5 o  550.836   11.556  233.078   9.7433  251.666   14.478  217.690   13.173  571.263   16.558  531.392   16.195 39.87146 23.16134 
1 1 1    1   34    6 o  384.186   12.830  113.485   7.5445  115.762   10.831  111.339   10.515  387.098   18.280  379.666   18.095 7.432007 25.72079 
1 1 1    1   34    7 o  312.841   14.340   75.343   6.8665   78.483   9.9669   72.507   9.4732  317.659   20.610  305.327   20.388 12.33218 28.99028 
1 1 1    1   34    8 o  423.859   12.539  138.126   8.1351  139.197   11.712  137.127   11.308  424.466   18.026  421.404   17.532 3.061493 25.14602 
1 1 1    1   34    9 o  246.681   16.586   47.160   6.2260   34.644   8.6417   60.667   8.9776  208.678   27.743  278.915   21.187 -70.23663 34.90799 
1 1 1    1   34   10 o  307.674   15.259   72.961   7.1858   75.660   10.516   70.596   9.8423  311.335   22.212  300.868   21.514 10.46692 30.92314 
1 1 1    1   34   11 o  208.108   19.169   33.799   6.0373   30.682   8.6623   36.743   8.4189  195.462   29.905  215.372   26.069 -19.90955 39.67231 
1 1 1    1   34   12 o  299.869   14.736   69.298   6.7637   52.545   9.2430   88.610   9.9239  258.707   23.602  337.728   19.277 -79.02112 30.47379 
1 1 1    1   34   13 o  664.497   11.890  339.510   12.093  375.146   17.987  310.112   16.337  696.862   16.863  633.592   16.846 63.26959 23.83584 
1 1 1    1   34   14 o  384.799   13.691  114.046   8.0638  110.021   11.439  118.021   11.369  376.102   19.943  390.292   19.031 -14.18951 27.56598 
1 1 1    1   34   15 o  843.404   12.307  547.311   15.887  572.977   23.291  524.978   21.727  860.514   17.684  823.912   17.228 36.60211 24.68843 
1 1 1    1   34   16 o  575.139   12.354  254.569   10.876  237.360   15.193  272.654   15.575  553.661   17.928  593.694   17.139 -40.03345 24.80261 
1 1 1    1   34   17 o  226.534   19.563   40.127   6.7168   38.832   9.0282   41.731   10.052  220.622   27.319  228.083   29.483 -7.461624 40.19458 
1 1 1    1   34   18 o  335.737   14.608   86.993   7.5071   92.638   10.993   82.060   10.277  344.336   20.957  324.048   20.830 20.28857 29.54742 
1 1 1    1   34   19 o  136.529   24.953   15.055   5.0224   15.679   6.2700   13.939   8.3897  137.994   30.497  129.823   39.045 8.170746 49.54385 
1 1 1    1   34   20 o  451.822   10.883  157.029   7.5261  162.861   9.3155  146.068   12.771  459.577   13.243  433.438   19.250 26.13873 23.36535 
1 1 1    1   34   21 o  297.587   11.928   68.206   5.4330   70.244   7.6026   66.079   7.7669  300.675   16.583  291.349   17.498 9.326874 24.10770 
1 1 1    1   34   22 o  357.531   10.749   98.351   5.8822   93.361   8.1835  103.685   8.4609  347.376   15.391  366.154   15.097 -18.77783 21.55912 
1 1 1    1   34   23 o  183.698   17.717   26.442   4.9197   20.343   6.8727   32.851   7.0454  157.497   29.596  203.432   23.032 -45.93427 37.50207 
1 1 1    1   34   24 o  371.724   10.909  106.368   6.2068  114.478   8.9707   98.919   8.5967  384.574   15.240  357.359   15.717 27.21539 21.89204 
1 1 1    1   34   25 o  485.751   9.8824  181.479   7.3476  178.861   10.335  184.154   10.448  481.024   14.037  488.108   13.984 -7.084045 19.81442 
1 1 1    1   34   26 o  335.166   11.765   86.604   6.0358   95.252   8.6361   78.346   8.4391  350.389   16.103  316.941   17.463 33.44849 23.75419 
1 1 1    1   34   27 o   83.798   30.463   4.8154   5.0544   10.283   7.2160  -0.4508   7.0819  112.604   36.577   75.500   32.836 37.10451 49.15369 
1 1 1    1   34   28 o   69.947   28.886   1.4490   5.0206  -5.6103   6.9556   9.1276   7.2542   63.403   29.509  107.757   36.716 -44.35409 47.10447 
1 1 1    1   34   29 o  151.316   23.417   18.472   5.2483   23.218   7.5141   13.951   7.3337  167.414   30.445  128.137   35.937 39.27773 47.09940 
1 1 1    1   34   30 o  247.786   18.978   48.298   7.1429   44.712   8.4056   57.618   13.550  236.641   23.518  263.137   34.472 -26.49559 41.73030 
1 1 1    1   34   31 o  362.492   19.194  103.229   10.612  110.304   14.878   95.904   15.139  370.551   26.405  343.697   29.050 26.85391 39.25695 
1 1 1    1   34   32 o  239.635   16.299   44.931   5.9429   47.692   8.4723   42.256   8.3383  244.382   22.917  229.409   24.107 14.97224 33.26194 
1 1 1    1   34   33 o  146.897   25.894   17.731   5.6094   18.642   7.8692   16.790   7.9981  147.044   35.391  139.041   36.950 8.002426 51.16452 
1 1 1    1   34   34 o   65.030   28.683  -1.0170   5.5764  -4.0175   8.0278   1.7808   7.7518   71.678   32.758   83.656   35.310 -11.97802 48.16531 
1 1 1    1   34   35 f  288.001   15.050   64.768   6.6116   65.346   9.2579   64.165   9.4452  286.487   21.264  283.525   21.935 2.962616 30.55031 
1 1 1    1   34   36 o   87.936   33.170   5.2432   6.0911   13.322   8.5055  -3.2622   8.7271  123.591   39.669   76.109   34.539 47.48220 52.59760 
1 1 1    1   34   37 o   88.728   33.812   5.2904   6.3701  -0.9590   8.8950   11.870   9.1270   81.200   36.000  118.056   41.142 -36.85624 54.66870 
1 1 1    1   34   38 o  115.617   38.840   11.587   8.1165   9.8351   11.266   13.477   11.704  114.172   44.577  124.963   46.207 -10.79118 64.20420 
1 1 1    1   34   39 o   73.342   32.395  -0.6385   7.1370   4.0926   9.0844  -8.2671   11.536   92.900   38.650   78.930   37.142 13.96951 53.60367 
1 1 1    1   34   40 o  130.025   33.462   15.032   6.6986   17.706   9.3078   12.159   9.6477  137.509   41.075  117.468   42.173 20.04037 58.86986 
1 1 1    1   34   41 o  267.105   18.483   57.008   7.5102   74.173   10.762   40.713   10.486  301.011   23.545  216.040   32.735 84.97043 40.32327 
1 1 1    1   34   42 o  128.128   33.798   14.896   6.7238   13.829   9.6208   15.913   9.4007  121.252   42.241  128.735   41.745 -7.483154 59.38789 
1 1 1    1   34   43 o   62.041   28.548  -3.0756   6.2409  -5.3636   8.9321  -0.8932   8.7236   70.758   33.100   77.905   35.017 -7.146324 48.18541 
1 1 1    1   34   44 o  110.636   33.969   11.353   6.3047   10.157   8.9219   12.547   8.9105  106.227   40.126  114.240   40.581 -8.013115 57.06934 
1 1 1    1   34   45 o  159.512   15.370   20.401   3.7061   18.552   5.0107   22.636   5.5069  148.118   22.835  164.054   22.525 -15.93654 32.07537 
1 1 1    1   35    0 o  514.218   11.464  203.080   9.0128  203.080   9.0128  203.080   9.0128  514.218   11.464  514.218   11.464 0.000000 0.000000 
1 1 1    1   35    1 o  340.301   13.530   89.134   7.0472   89.134   7.0472   0.0000   0.0000  340.301   13.530  ?   ?  0.000000 13.52952 
1 1 1    1   35    2 o  493.735   16.892  188.232   12.766  188.232   12.766   0.0000   0.0000  493.735   16.892  ?   ?  0.000000 16.89185 
1 1 1    1   35    3 o  288.771   21.665   65.109   9.5061   65.109   9.5061   0.0000   0.0000  288.771   21.665  ?   ?  0.000000 21.66490 
1 1 1    1   35    4 o  398.244   12.785  122.008   7.7933  128.092   11.215  116.327   10.838  407.020   18.001  387.822   18.257 19.19785 25.63947 
1 1 1    1   35    5 o  582.993   11.537  261.228   10.295  247.901   14.590  274.442   14.528  566.569   16.824  596.410   15.915 -29.84076 23.15913 
1 1 1    1   35    6 o  380.094   13.084  111.182   7.6118  109.833   10.894  112.468   10.640  376.169   18.982  381.293   18.230 -5.123169 26.31866 
1 1 1    1   35    7 o  406.755   12.552  127.281   7.8149  133.362   11.343  121.786   10.782  415.261   17.846  396.851   17.751 18.41010 25.17040 
1 1 1    1   35    8 o  351.309   13.626   95.044   7.3270  101.080   10.693   89.702   10.060  360.630   19.444  339.671   19.430 20.95914 27.48756 
1 1 1    1   35    9 o  329.009   14.461   83.438   7.2824   81.429   10.299   85.448   10.299  323.117   20.936  331.175   20.417 -8.057495 29.24330 
1 1 1    1   35   10 o  116.378   31.756   11.084   5.8142   18.635   8.5406   4.5609   7.9375  149.577   37.402   94.833   37.302 54.74416 52.82358 
1 1 1    1   35   11 o  236.154   17.942   43.414   6.4370   42.587   9.3189   44.169   8.9020  231.507   26.794  236.372   24.984 -4.864944 36.63439 
1 1 1    1   35   12 o  351.059   14.549   95.055   7.8178   93.655   11.223   96.375   10.896  346.323   21.275  351.635   20.331 -5.311340 29.42801 
1 1 1    1   35   13 o  164.162   38.116   22.550   9.3936   0.0000   0.0000   22.550   9.3936  ?   ?   164.162   38.116 0.000000 38.11593 
1 1 1    1   35   14 o  411.437   19.020  131.386   11.978   0.0000   0.0000  131.386   11.978  ?   ?   411.437   19.020 0.000000 19.01963 
1 1 1    1   35   16 o   78.977   35.299  -2.8536   8.7314  -2.8536   8.7314   0.0000   0.0000   78.977   35.299  ?   ?  0.000000 35.29929 
1 1 1    1   35   17 o  405.018   20.734  128.186   12.810  128.186   12.810   0.0000   0.0000  405.018   20.734  ?   ?  0.000000 20.73364 
1 1 1    1   35   18 o  276.838   14.333   59.343   6.0527   60.007   7.2293   57.787   11.068  277.711   17.090  269.140   27.243 8.571381 32.16031 
1 1 1    1   35   19 o  584.294   8.8960  262.223   7.9560  268.177   11.317  256.404   11.187  589.844   12.535  576.705   12.674 13.13879 17.82542 
1 1 1    1   35   20 o  337.243   11.030   87.538   5.6937   91.533   8.2791   83.953   7.8427  343.847   15.731  329.342   15.558 14.50467 22.12463 
1 1 1    1   35   21 o  210.252   15.743   34.419   5.0296   34.824   7.1225   34.017   7.1035  209.644   22.551  207.103   22.785 2.540543 32.05820 
1 1 1    1   35   22 o   56.039   25.146  -1.8510   4.4774  -1.5784   6.4573  -2.1035   6.2138   69.445   30.737   66.723   29.804 2.721657 42.81341 
1 1 1    1   35   23 f  507.982   9.6509  198.436   7.5039  199.825   10.524  196.999   10.703  508.586   13.519  504.861   13.850 3.725769 19.35407 
1 1 1    1   35   24 o  104.116   29.441   8.9246   4.9010   11.482   6.8987   6.3190   6.9638  117.604   35.415   96.354   35.640 21.24982 50.24314 
1 1 1    1   35   25 o  326.102   12.425   82.077   6.2019   90.935   8.6985   72.918   8.8450  342.114   16.611  305.087   19.036 37.02756 25.26488 
1 1 1    1   35   26 o  275.501   13.749   58.716   5.7978   58.632   8.0257   58.807   8.3847  273.251   19.313  273.343   20.183 -0.9240723E-01 27.93514 
1 1 1    1   35   27 o  384.609   11.356  114.073   6.6851  121.891   9.4662  106.295   9.4421  396.237   15.608  369.645   16.688 26.59174 22.84980 
1 1 1    1   35   28 o  231.825   20.267   42.467   7.1191   38.534   8.4649   51.971   13.158  218.625   25.793  249.182   35.504 -30.55742 43.88402 
1 1 1    1   35   29 o   91.310   34.658   5.3774   6.6759   20.160   12.151  -1.0136   7.9897  150.410   47.321   78.237   34.429 72.17303 58.52009 
1 1 1    1   35   30 o  142.488   26.271   16.698   5.5185   16.611   7.8562   16.782   7.7534  138.751   36.501  139.579   36.042 -0.8276825 51.29631 
1 1 1    1   35   31 o  214.448   18.250   36.250   5.9333   29.090   8.0979   44.550   8.7184  187.691   29.132  235.270   24.573 -47.57878 38.11180 
1 1 1    1   35   32 o  353.497   12.719   96.753   6.8819  106.253   9.7552   87.340   9.7099  368.643   17.289  332.934   19.134 35.70898 25.78805 
1 1 1    1   35   33 o  306.646   14.111   73.061   6.6232   67.980   9.2072   78.510   9.5346  292.621   20.690  314.990   19.878 -22.36951 28.69156 
1 1 1    1   35   34 o   80.607   31.673   3.6614   5.7174  -3.7867   7.9232   11.753   8.2583   71.304   32.570  117.552   39.176 -46.24806 50.94712 
1 1 1    1   35   35 o   75.306   31.198   1.9944   5.8834   1.0521   8.1368   3.0268   8.5170   82.715   35.583   89.282   37.307 -6.567154 51.55583 
1 1 1    1   35   36 o   76.346   33.191   0.2193   7.2305  -7.7344   9.7501   9.9386   10.778   72.828   34.232  113.911   43.844 -41.08361 55.62432 
1 1 1    1   35   37 o  181.958   27.990   27.780   7.5456   37.233   9.6832   13.167   12.040  209.056   31.218  123.849   46.653 85.20695 56.13401 
1 1 1    1   35   38 o  221.114   30.115   41.509   9.9270   41.509   9.9270   0.0000   0.0000  221.114   30.115  ?   ?  0.000000 30.11480 
1 1 1    1   35   39 o  317.721   22.426   81.928   10.836   0.0000   0.0000   81.928   10.836  ?   ?   317.721   22.426 0.000000 22.42635 
1 1 1    1   35   40 o  171.854   27.290   25.059   6.9385   19.104   9.8767   30.861   9.7496  140.749   42.372  185.106   35.705 -44.35690 55.40967 
1 1 1    1   35   41 o   85.441   33.746   4.8544   6.5213   1.9793   9.1831   7.7793   9.2624   86.108   37.420  101.188   40.137 -15.07963 54.87505 
1 1 1    1   35   42 o   58.569   27.360  -4.2532   6.0678  -4.9441   8.5138  -3.5401   8.6501   69.426   32.424   72.399   33.421 -2.972542 46.56458 
1 1 1    1   35   43 f  201.495   30.643   36.108   9.1529   36.108   9.1529   0.0000   0.0000  201.495   30.643  ?   ?  0.000000 30.64322 
1 1 1    1   35   44 f  149.727   32.728   20.770   7.2912   22.427   8.8702   17.317   12.803  150.801   38.343  125.750   47.931 25.05089 61.38083 
1 1 1    1   36    0 o  329.039   14.234   83.622   7.1383   83.622   7.1383   83.622   7.1383  329.039   14.234  329.039   14.234 0.000000 0.000000 
1 1 1    1   36    1 o   84.328   28.648   5.2362   4.4161   7.3070   5.4835   1.4146   7.4494   97.438   31.897   83.220   34.842 14.21804 47.23781 
1 1 1    1   36    2 o  339.418   13.591   88.756   7.0607   93.118   10.283   84.864   9.7120  345.922   19.501  330.244   19.297 15.67825 27.43489 
1 1 1    1   36    3 o  672.617   16.676  349.735   17.168  349.735   17.168   0.0000   0.0000  672.617   16.676  ?   ?  0.000000 16.67564 
1 1 1    1   36    4 o  556.213   16.905  239.243   14.392  239.243   14.392   0.0000   0.0000  556.213   16.905  ?   ?  0.000000 16.90466 
1 1 1    1   36    5 o  601.753   17.014  280.089   15.671  280.089   15.671   0.0000   0.0000  601.753   17.014  ?   ?  0.000000 17.01400 
1 1 1    1   36    6 o  385.936   13.372  114.754   7.8990  115.292   11.397  114.257   10.957  384.959   19.405  383.895   18.648 1.064545 26.91278 
1 1 1    1   36    7 o  487.061   17.292  183.620   12.892   0.0000   0.0000  183.620   12.892  ?   ?   487.061   17.292 0.000000 17.29230 
1 1 1    1   36    8 f  411.796   18.403  131.480   11.599   0.0000   0.0000  131.480   11.599  ?   ?   411.796   18.403 0.000000 18.40285 
1 1 1    1   36    9 o  511.814   17.552  202.914   13.750   0.0000   0.0000  202.914   13.750  ?   ?   511.814   17.552 0.000000 17.55237 
1 1 1    1   36   10 o  255.166   26.948   51.801   10.366   0.0000   0.0000   51.801   10.366  ?   ?   255.166   26.948 0.000000 26.94763 
1 1 1    1   36   11 o  312.485   22.785   76.704   10.823   76.704   10.823   0.0000   0.0000  312.485   22.785  ?   ?  0.000000 22.78481 
1 1 1    1   36   12 o  530.937   17.555  218.537   14.267  218.537   14.267   0.0000   0.0000  530.937   17.555  ?   ?  0.000000 17.55529 
1 1 1    1   36   13 o  412.855   19.601  132.609   12.387  132.609   12.387   0.0000   0.0000  412.855   19.601  ?   ?  0.000000 19.60124 
1 1 1    1   36   14 o  170.081   25.997   23.268   6.5530   29.044   9.5966   18.221   8.9698  187.323   34.749  146.798   39.187 40.52489 52.37502 
1 1 1    1   36   15 o  637.873   12.382  313.536   12.089  324.606   17.630  303.712   16.610  646.676   17.812  625.747   17.342 20.92938 24.85921 
1 1 1    1   36   16 o  368.490   14.868  104.971   8.3859  112.280   12.211   98.445   11.537  378.611   21.155  354.362   21.370 24.24921 30.07025 
1 1 1    1   36   17 o  653.829   12.539  329.572   12.549  330.817   17.906  328.370   17.591  652.580   17.926  650.297   17.673 2.283142 25.17322 
1 1 1    1   36   18 o  234.222   20.678   43.157   7.3370   36.602   10.354   49.768   10.399  211.065   33.140  249.088   27.746 -38.02237 43.22168 
1 1 1    1   36   19 o  123.820   29.193   12.687   5.4426   17.573   6.7362   3.5021   9.2367  145.555   31.175   95.739   39.318 49.81557 50.17770 
1 1 1    1   36   20 o  113.487   27.230   10.618   4.6695   5.4993   6.4934   16.100   6.7199   91.856   34.327  138.836   32.240 -46.98016 47.09361 
1 1 1    1   36   21 o  348.802   11.332   93.735   6.0498   95.891   8.6152   91.638   8.4974  351.625   16.007  343.697   16.153 7.927917 22.74064 
1 1 1    1   36   22 o  256.870   13.899   51.167   5.4444   43.746   7.6692   58.706   7.7302  235.252   21.538  273.841   18.552 -38.58890 28.42613 
1 1 1    1   36   23 o  223.449   15.625   38.913   5.3105   35.063   7.4743   42.838   7.5467  209.575   23.718  232.720   21.427 -23.14525 31.96320 
1 1 1    1   36   24 o  476.945   10.151  175.122   7.4102  165.767   10.429  184.663   10.531  462.526   14.731  488.434   14.087 -25.90784 20.38211 
1 1 1    1   36   25 o   76.062   31.505   1.7463   5.9985   6.6590   7.1620  -9.7975   10.979   97.819   36.151   76.987   36.230 20.83189 51.18089 
1 1 1    1   36   26 o  221.831   25.175   39.572   8.3965   51.481   11.781   27.275   11.971  250.226   31.454  175.128   44.551 75.09825 54.53546 
1 1 1    1   36   27 o  341.476   14.891   90.508   7.7830  101.175   14.128   85.861   9.3255  355.039   26.183  330.862   18.488 24.17676 32.05266 
1 1 1    1   36   28 o   65.558   28.476  -0.3455   5.3129  -3.6709   7.4895   3.0232   7.5380   69.854   31.814   86.660   35.546 -16.80614 47.70372 
1 1 1    1   36   29 o  357.728   12.373   98.971   6.7747   98.610   9.5532   99.335   9.6087  355.195   17.572  356.482   17.610 -1.286957 24.87726 
1 1 1    1   36   30 o  233.611   16.852   42.825   5.9853   40.858   8.2955   44.962   8.6442  225.111   24.469  236.365   24.236 -11.25372 34.44028 
1 1 1    1   36   31 o  251.611   16.264   49.615   6.2302   53.486   8.7033   45.546   8.9225  258.732   22.192  237.305   24.938 21.42754 33.38190 
1 1 1    1   36   32 o  205.190   29.027   34.911   8.8620   0.0000   0.0000   34.911   8.8620  ?   ?   205.190   29.027 0.000000 29.02674 
1 1 1    1   36   33 o  126.836   30.815   13.781   5.9234   4.2273   8.0749   24.910   8.7156   91.133   37.017  169.515   34.758 -78.38232 50.77740 
1 1 1    1   36   34 o  112.877   35.527   10.990   6.8485   11.200   10.614   10.841   8.9639  117.539   43.896  114.133   40.685 3.405701 59.85095 
1 1 1    1   36   35 o  285.379   19.479   64.886   8.4578   56.837   11.224   75.462   12.866  261.216   28.536  301.580   28.199 -40.36435 40.11874 
1 1 1    1   36   36 o  219.442   19.761   38.602   6.5661   34.967   8.9659   42.806   9.6429  203.188   29.706  225.913   28.522 -22.72493 41.18227 
1 1 1    1   36   37 o  165.445   25.838   22.872   6.3293   22.821   8.7587   22.928   9.1564  158.888   36.747  158.315   38.220 0.5727386 53.02004 
1 1 1    1   36   38 o   77.957   32.604   2.3238   6.5129   3.8981   9.0992   0.6700   9.3262   91.531   38.425   84.774   37.254 6.757126 53.51962 
1 1 1    1   36   39 o   77.742   32.247   2.6891   6.2966   7.1894   9.0663  -1.5042   8.7517   99.543   39.639   77.473   34.925 22.07032 52.82989 
1 1 1    1   36   40 o  199.991   21.688   32.918   6.5326   42.003   9.3700   24.326   9.1124  221.005   28.353  160.594   37.714 60.41103 47.18309 
1 1 1    1   36   41 o   93.999   33.469   7.5729   6.0643   5.0747   8.5344   10.121   8.6186   90.711   37.577  106.123   39.570 -15.41227 54.56931 
1 1 1    1   36   42 o  180.744   23.188   27.492   6.2670   33.338   9.0373   22.078   8.6981  192.155   31.842  150.735   37.775 41.41945 49.40499 
1 1 1    1   36   43 o   87.660   36.929   4.4826   8.4525   13.496   12.312  -3.5529   11.625  115.749   46.161   81.639   38.047 34.10988 59.81987 
1 1 1    1   37    0 o   81.392   44.972   7.4032   8.1776   7.4032   8.1776   7.4032   8.1776   81.392   44.972   81.392   44.972 0.000000 0.000000 
1 1 1    1   37    1 f  206.094   19.294   33.280   6.0154   34.371   8.7032   32.282   8.3236  206.836   28.228  200.462   27.883 6.374237 39.67669 
1 1 1    1   37    2 o  421.846   18.247  138.068   11.782   0.0000   0.0000  138.068   11.782  ?   ?   421.846   18.247 0.000000 18.24709 
1 1 1    1   37    3 o   87.230   37.157   0.8239   8.7159   0.0000   0.0000   0.8239   8.7159  ?   ?    87.230   37.157 0.000000 37.15696 
1 1 1    1   37    4 o  294.624   23.493   68.366   10.506   68.366   10.506   0.0000   0.0000  294.624   23.493  ?   ?  0.000000 23.49300 
1 1 1    1   37    5 o   72.263   33.081  -4.9486   8.2338  -4.9486   8.2338   0.0000   0.0000   72.263   33.081  ?   ?  0.000000 33.08123 
1 1 1    1   37    6 o  614.485   17.614  292.794   16.567  292.794   16.567   0.0000   0.0000  614.485   17.614  ?   ?  0.000000 17.61436 
1 1 1    1   37    7 o  100.832   38.272   6.3472   8.1412   6.3472   8.1412   0.0000   0.0000  100.832   38.272  ?   ?  0.000000 38.27233 
1 1 1    1   37    8 o  221.155   29.291   39.416   9.6713   39.416   9.6713   0.0000   0.0000  221.155   29.291  ?   ?  0.000000 29.29139 
1 1 1    1   37    9 f  214.386   20.566   36.137   6.6657   33.166   9.2220   39.388   9.6458  201.996   30.802  221.055   29.225 -19.05949 42.45979 
1 1 1    1   37   10 o  124.260   31.278   12.794   5.9446   12.404   8.7369   13.129   8.1117  123.804   40.250  126.063   38.501 -2.259506 55.69887 
1 1 1    1   37   11 o  255.521   17.940   50.931   6.9721   51.801   10.362   50.211   9.4249  254.733   26.986  251.559   24.800 3.173981 36.65096 
1 1 1    1   37   12 o  825.627   12.556  525.449   15.867  542.202   23.099  510.484   21.832  835.490   18.063  810.995   17.588 24.49506 25.21127 
1 1 1    1   37   13 o  486.717   13.507  182.838   10.062  195.949   14.802  171.573   13.720  501.681   19.276  469.517   19.091 32.16406 27.12980 
1 1 1    1   37   14 o  112.971   35.541   10.356   6.8544   22.550   10.182   0.2487   9.2695  162.268   40.983   87.919   37.900 74.34915 55.82177 
1 1 1    1   37   15 o  202.214   24.238   32.605   7.3525   36.376   10.946   29.505   9.9251  209.328   35.426  187.929   35.812 21.39961 50.37357 
1 1 1    1   37   16 o  357.410   15.541   98.941   8.5021   94.963   12.380  102.492   11.696  346.794   23.462  361.324   21.242 -14.52927 31.64903 
1 1 1    1   37   17 o  142.548   32.073   16.949   6.8288   16.809   10.171   17.063   9.2142  140.529   43.145  141.413   40.500 -0.8839569 59.17545 
1 1 1    1   37   18 o   91.192   34.951   5.0168   6.8310   11.228   9.7960  -0.8625   9.5306  120.431   42.574   86.301   37.799 34.13049 56.93222 
1 1 1    1   37   19 o  340.569   16.438   90.054   8.5689   83.669   11.935   96.845   12.310  324.775   24.183  350.053   23.104 -25.27835 33.44580 
1 1 1    1   37   20 o  291.416   14.917   65.956   6.6313   72.181   8.2715   54.757   11.094  303.950   17.858  260.479   28.280 43.47134 33.44648 
1 1 1    1   37   21 o  661.128   9.2221  336.122   9.3322  345.664   13.332  326.956   13.067  668.853   13.023  650.453   13.125 18.39984 18.48932 
1 1 1    1   37   22 o  308.269   14.522   73.625   6.8521   72.264   8.3177   76.497   12.087  303.931   17.959  309.263   25.769 -5.332672 31.41015 
1 1 1    1   37   23 o  299.020   15.302   69.571   6.9799   66.998   8.4235   75.208   12.468  292.152   18.939  305.833   26.909 -13.68149 32.90549 
1 1 1    1   37   24 o  288.732   20.482   65.772   8.9932   64.460   12.419   67.218   13.040  281.533   29.247  287.040   30.129 -5.507202 41.99044 
1 1 1    1   37   25 o  208.905   20.519   34.604   6.4764   26.635   12.204   37.728   7.6411  172.203   45.587  217.131   23.359 -44.92821 51.22278 
1 1 1    1   37   26 o  230.934   16.374   41.740   5.7502   49.336   8.4636   35.227   7.8367  248.842   22.463  208.942   25.001 39.89978 33.60976 
1 1 1    1   37   27 o  300.353   13.795   69.946   6.3420   71.000   8.9735   68.893   8.9645  300.031   19.649  295.396   19.943 4.634979 27.99655 
1 1 1    1   37   28 o  324.936   13.308   81.837   6.6189   88.898   9.4210   74.954   9.3012  336.285   18.372  308.027   19.833 28.25812 27.03523 
1 1 1    1   37   29 o  348.979   12.839   94.368   6.8579  104.271   9.8392   85.012   9.5637  364.852   17.619  328.267   19.117 36.58536 25.99736 
1 1 1    1   37   30 o  140.192   27.409   16.401   5.6708   8.4955   7.8297   25.124   8.2243  104.839   37.945  171.902   32.446 -67.06383 49.92603 
1 1 1    1   37   31 o  232.070   17.811   42.548   6.2785   41.908   8.6810   43.250   9.0914  226.699   25.458  229.868   26.314 -3.169601 36.61301 
1 1 1    1   37   32 o  166.451   28.186   23.196   6.9249   17.910   10.484   27.286   9.2229  139.624   43.960  176.878   35.303 -37.25478 56.38070 
1 1 1    1   37   33 o   82.067   33.323   3.3123   6.5410   4.9052   8.3203   0.7350   10.583   93.232   37.678   90.750   39.788 2.481956 54.79682 
1 1 1    1   37   34 o  206.671   20.710   34.396   6.4632   42.392   9.0314   26.001   9.2532  226.203   26.592  170.763   36.508 55.44032 45.16635 
1 1 1    1   37   35 o   56.650   26.749  -5.7857   6.0771  -4.1431   8.2458  -7.7385   8.9911   71.181   32.777   68.774   32.493 2.407227 46.15293 
1 1 1    1   37   36 o  110.911   33.890   10.883   6.2841   26.322   8.5932  -6.8648   9.2132  172.575   33.741   70.801   33.278 101.7743 47.39042 
1 1 1    1   37   37 o  249.034   18.016   49.591   6.8210   48.649   9.4656   50.609   9.8379  241.158   26.058  245.582   26.597 -4.424423 37.23441 
1 1 1    1   37   38 o  114.440   33.255   11.889   6.1721   11.159   8.8482   12.581   8.6138  111.143   40.321  116.093   39.996 -4.950050 56.79310 
1 1 1    1   37   39 o   63.727   28.639  -1.3071   5.8315   4.2010   8.3607  -6.5253   8.1379   88.213   36.921   65.221   30.844 22.99274 48.10939 
1 1 1    1   37   40 o  161.034   25.279   22.180   6.0256   19.871   8.4760   24.539   8.5677  143.033   38.051  161.679   35.586 -18.64626 52.09833 
1 1 1    1   37   41 o  103.890   39.364   9.7968   8.6026   14.108   12.089   5.3740   12.244  117.977   46.145   98.518   43.004 19.45956 63.07730 
1 1 1    1   38    0 o  172.670   25.177   24.514   6.2409   24.514   6.2409   24.514   6.2409  172.670   25.177  172.670   25.177 0.000000 0.000000 
1 1 1    1   38    1 f  211.527   17.259   34.922   5.5393   34.721   6.7623   35.331   9.6576  209.843   21.351  208.346   31.248 1.496780 37.84560 
1 1 1    1   38    2 o  242.434   18.283   45.904   6.7346   45.138   9.6405   46.634   9.4118  237.619   26.985  242.002   25.807 -4.382797 37.33878 
1 1 1    1   38    3 o  589.530   12.241  267.783   11.046  258.913   15.442  277.077   15.807  577.676   17.464  597.682   17.278 -20.00635 24.56672 
1 1 1    1   38    4 o  348.692   14.612   93.954   7.7985   89.034   10.954   99.010   11.105  336.978   21.348  355.754   20.480 -18.77664 29.58322 
1 1 1    1   38    5 o  265.519   17.400   54.925   7.0325   52.874   10.138   56.827   9.7635  257.687   26.062  267.981   24.059 -10.29373 35.46910 
1 1 1    1   38    6 o  242.539   18.818   46.015   6.9311   44.667   10.116   47.209   9.5160  235.645   28.634  243.367   25.946 -7.722458 38.64052 
1 1 1    1   38    7 o  339.612   22.632   90.747   11.697   90.747   11.697   0.0000   0.0000  339.612   22.632  ?   ?  0.000000 22.63247 
1 1 1    1   38    8 o   98.238   39.650   4.4037   9.2011   4.4037   9.2011   0.0000   0.0000   98.238   39.650  ?   ?  0.000000 39.64995 
1 1 1    1   38    9 o   58.857   28.996 -18.7667   9.2819 -18.7667   9.2819   0.0000   0.0000   58.857   28.996  ?   ?  0.000000 28.99632 
1 1 1    1   38   10 o  118.566   34.038   11.666   6.5015   16.291   9.6873   7.8747   8.7700  138.763   42.007  107.329   39.936 31.43382 57.96084 
1 1 1    1   38   11 o   84.685   33.453   3.6067   6.4094  -3.1642   9.7055   8.8431   8.5352   82.584   37.042  109.976   39.647 -27.39170 54.25830 
1 1 1    1   38   12 o  249.948   20.050   49.064   7.6060   52.583   10.820   45.627   10.694  255.775   28.100  237.222   30.132 18.55327 41.20196 
1 1 1    1   38   13 o  345.933   16.218   92.808   8.5872   81.542   11.882  105.127   12.425  320.767   24.383  365.403   22.322 -44.63617 33.05744 
1 1 1    1   38   14 o  227.376   21.746   40.876   7.4760   42.418   10.757   39.435   10.397  227.733   31.722  219.374   31.899 8.358765 44.98688 
1 1 1    1   38   15 o  182.829   25.977   26.959   7.0649   33.722   10.249   20.837   9.7518  201.340   34.499  155.509   40.550 45.83069 53.24025 
1 1 1    1   38   16 o  337.690   16.557   88.566   8.5577   91.264   12.805   86.389   11.504  338.889   24.860  330.607   22.874 8.281433 33.78226 
1 1 1    1   38   17 o  136.628   33.910   15.753   7.0583   8.3829   9.9010   23.369   10.065  111.273   42.214  164.499   40.293 -53.22640 58.35645 
1 1 1    1   38   18 o  205.051   23.756   33.603   7.3179   37.016   10.616   30.512   10.101  210.963   34.034  190.254   36.007 20.70874 49.54612 
1 1 1    1   38   19 o  254.438   20.328   51.037   7.8505   53.298   11.619   49.138   10.649  255.661   30.280  246.074   28.819 9.586975 41.80204 
1 1 1    1   38   20 o  291.698   18.785   66.752   8.3428   54.888   11.714   78.963   11.884  259.431   30.057  314.554   24.887 -55.12299 39.02282 
1 1 1    1   38   21 o  233.155   22.270   43.223   7.8508   41.082   11.245   45.260   10.966  221.810   34.223  234.521   31.332 -12.71037 46.39895 
1 1 1    1   38   22 o  353.449   13.573   96.723   7.3428  103.904   13.356   93.612   8.7906  361.046   24.309  346.742   16.563 14.30420 29.41574 
1 1 1    1   38   23 o  167.963   20.887   22.513   5.2539   17.865   7.5947   26.779   7.2758  144.545   34.755  181.080   27.082 -36.53447 44.06075 
1 1 1    1   38   24 o  148.622   25.163   18.044   5.5199   14.104   7.7801   22.037   7.8329  128.085   37.370  161.499   32.806 -33.41408 49.72725 
1 1 1    1   38   25 o  167.998   21.609   22.630   5.4277   31.567   8.0204   15.080   7.3722  196.409   27.427  132.262   35.620 64.14716 44.95631 
1 1 1    1   38   26 o  299.867   13.781   69.772   6.3255   70.580   9.3192   69.082   8.6136  298.484   20.523  295.951   19.117 2.532776 28.04724 
1 1 1    1   38   27 o  184.568   20.823   27.236   5.7797   30.711   8.5127   24.264   7.8722  192.059   29.933  169.580   31.488 22.47867 43.44532 
1 1 1    1   38   28 o  182.721   21.933   26.868   6.0115   12.700   8.2319   43.058   8.7996  121.279   39.036  230.128   25.405 -108.8491 46.57514 
1 1 1    1   38   29 o  306.131   15.038   73.098   7.0463   83.911   10.220   63.302   9.7278  324.704   20.672  280.650   22.843 44.05359 30.80821 
1 1 1    1   38   30 o   76.421   33.079   0.4090   7.1200  -0.9303   9.9255   1.8287   10.219   85.383   37.933   92.230   39.777 -6.846947 54.96469 
1 1 1    1   38   31 o  311.371   16.705   76.375   7.9323   73.230   9.7607   82.493   13.613  302.246   21.233  315.312   28.515 -13.06595 35.55180 
1 1 1    1   38   32 o  135.949   29.917   15.901   6.0565   17.451   8.3806   14.206   8.7626  138.648   38.247  125.403   40.265 13.24529 55.53475 
1 1 1    1   38   33 o  158.688   26.538   21.121   6.2182   13.170   8.5733   29.947   9.0325  120.998   39.897  185.575   33.009 -64.57761 51.78196 
1 1 1    1   38   34 o  102.687   33.396   9.0903   6.0146   5.8438   8.2948   12.690   8.7339   94.854   37.870  118.584   40.288 -23.73082 55.29218 
1 1 1    1   38   35 o  328.837   14.541   84.885   7.3187   83.521   10.245   86.307   10.459  321.313   20.946  326.572   21.035 -5.258942 29.68492 
1 1 1    1   38   36 o   62.870   28.644  -2.3996   6.0783   5.7527   8.5398 -10.7702   8.6534   93.860   38.088   62.172   30.036 31.68826 48.50602 
1 1 1    1   38   37 o  109.682   32.866   10.930   5.9524   12.491   8.3329   9.3041   8.5058  115.156   39.351  103.994   39.204 11.16106 55.54698 
1 1 1    1   38   38 o  296.579   15.077   69.799   6.8217   58.800   9.5640   81.189   9.7327  265.205   23.815  315.490   20.262 -50.28482 31.26791 
1 1 1    1   38   39 o   61.999   28.803  -3.7109   6.5783   2.3579   7.9797 -16.5832   11.622   81.458   35.140   67.210   32.979 14.24813 48.19144 
1 1 1    1   39    0 o  862.306   12.693  571.683   16.744  571.683   16.744  571.683   16.744  862.306   12.693  862.306   12.693 0.000000 0.000000 
1 1 1    1   39    1 o  179.911   16.924   25.331   4.6056   32.687   6.5227   18.018   6.5041  203.387   21.267  147.874   29.766 55.51283 36.58284 
1 1 1    1   39    2 o  251.203   14.981   48.994   5.7341   51.033   6.9796   44.762   10.058  255.610   17.953  235.698   28.454 19.91261 33.64452 
1 1 1    1   39    3 o  245.705   18.802   47.268   7.0174   42.766   9.4952   52.686   10.417  230.710   27.426  256.574   26.927 -25.86357 38.43483 
1 1 1    1   39    4 o  133.649   33.119   14.950   6.7405   7.5001   9.5691   22.287   9.4963  108.244   41.396  161.724   38.849 -53.47989 56.77022 
1 1 1    1   39    5 o   52.142   25.283 -10.0611   6.2746 -16.5079   9.1252  -4.2794   8.6416   60.310   29.516   75.303   34.248 -14.99278 45.21212 
1 1 1    1   39    6 o  242.736   19.784   46.267   7.2865   46.663   10.251   45.863   10.359  240.637   28.378  238.279   29.001 2.358383 40.57492 
1 1 1    1   39    7 o  450.734   13.730  156.973   9.4727  143.527   13.089  171.762   13.727  428.742   19.945  469.405   19.105 -40.66348 27.61902 
1 1 1    1   39    8 o  145.466   31.049   17.572   6.7026   18.202   9.4384   16.931   9.5201  145.727   40.733  140.827   41.410 4.900574 58.08620 
1 1 1    1   39    9 o  100.345   35.262   7.5033   6.7112   10.503   9.2709   4.2004   9.7278  117.030   41.412   99.178   40.496 17.85122 57.92134 
1 1 1    1   39   10 o  526.003   18.841  215.714   15.169  215.714   15.169   0.0000   0.0000  526.003   18.841  ?   ?  0.000000 18.84123 
1 1 1    1   39   11 o  388.787   22.105  119.057   13.100  119.057   13.100   0.0000   0.0000  388.787   22.105  ?   ?  0.000000 22.10505 
1 1 1    1   39   12 o  392.277   14.900  119.188   8.9466  128.939   12.994  110.398   12.337  405.118   21.027  374.505   21.614 30.61264 30.15417 
1 1 1    1   39   13 o  122.497   34.494   12.608   6.7423   9.2986   9.7564   15.633   9.3283  113.756   42.163  135.427   41.271 -21.67149 59.00004 
1 1 1    1   39   14 o  161.522   28.643   21.425   6.8221   13.741   9.7680   28.743   9.5323  128.597   42.595  185.016   34.941 -56.41858 55.09274 
1 1 1    1   39   15 o  269.650   19.491   57.141   7.9904   48.648   11.409   65.316   11.194  243.678   31.314  285.636   25.885 -41.95825 40.62791 
1 1 1    1   39   16 o  533.947   13.671  220.594   11.173  234.725   16.089  207.431   15.528  547.898   19.185  514.757   19.708 33.14044 27.50439 
1 1 1    1   39   17 o  306.083   18.770   73.476   8.7515   63.952   12.159   83.716   12.607  280.963   28.674  323.487   25.672 -42.52448 38.48700 
1 1 1    1   39   18 o  123.833   36.005   13.005   7.2330   22.842   10.588   4.3980   9.9043  161.120   42.369   99.523   40.775 61.59720 58.80251 
1 1 1    1   39   19 o  263.716   21.253   55.062   8.5060   48.103   12.130   61.796   11.932  240.299   33.921  275.839   28.679 -35.53915 44.42029 
1 1 1    1   39   20 o   77.966   33.426   0.5504   7.1359   6.1486   10.660  -3.9943   9.6052  106.145   42.736   79.687   36.190 26.45817 56.00056 
1 1 1    1   39   21 o  135.085   36.394   15.721   7.6943   27.896   11.294   5.1764   10.511  177.629   42.171  103.036   42.085 74.59267 59.57808 
1 1 1    1   39   22 o   77.646   33.881  -0.3650   7.5935   5.9095   10.995  -6.0865   10.500  106.070   43.152   79.855   36.848 26.21535 56.74393 
1 1 1    1   39   23 o  254.974   17.856   51.123   6.9247   51.284   13.524   51.066   8.0618  245.022   37.231  253.562   20.960 -8.539597 42.72566 
1 1 1    1   39   24 o  120.645   28.600   12.249   5.2008   8.4327   7.6171   15.582   7.1183  104.543   37.479  134.382   34.447 -29.83886 50.90452 
1 1 1    1   39   25 o  257.365   15.322   51.792   6.0086   64.853   8.8469   40.610   8.1864  285.866   20.352  224.146   24.248 61.71962 31.65664 
1 1 1    1   39   26 o  178.992   21.200   25.732   5.6952   29.105   8.3336   22.777   7.8012  186.289   30.265  163.368   32.342 22.92136 44.29448 
1 1 1    1   39   27 o   88.850   33.586   5.3876   6.2532   10.447   10.237   2.3766   7.8977  115.134   43.087   85.186   35.782 29.94830 56.00769 
1 1 1    1   39   28 o  377.320   16.793  111.763   9.6987  114.068   14.369  109.833   13.145  374.658   25.203  369.100   23.388 5.558563 34.38262 
1 1 1    1   39   29 o  152.182   30.581   19.839   6.8761   24.384   9.0782   13.722   10.531  165.570   36.778  124.700   44.136 40.87045 57.45144 
1 1 1    1   39   30 o   79.913   32.074   3.3816   5.9844   2.2797   8.4848   4.4724   8.4416   86.396   36.728   92.105   37.679 -5.708847 52.61796 
1 1 1    1   39   31 o  208.478   20.625   35.035   6.4953   39.891   9.0618   29.903   9.3150  218.355   27.739  184.636   34.221 33.71869 44.05130 
1 1 1    1   39   32 o  101.753   33.449   8.8825   6.0277   1.9430   8.2495   16.831   8.8288   83.990   35.972  134.399   39.971 -50.40859 53.77449 
1 1 1    1   39   33 o   80.098   32.206   3.6200   6.0456   2.3317   8.5168   4.9285   8.5830   85.386   36.559   92.386   37.917 -7.000053 52.67123 
1 1 1    1   39   34 o  183.446   23.629   27.980   6.4805   32.496   9.2929   23.704   9.0419  191.276   32.929  159.289   37.676 31.98701 50.03782 
1 1 1    1   39   35 o   57.624   27.032  -4.7050   6.0291  -6.9100   8.5107  -2.4836   8.5422   66.544   31.493   74.136   33.846 -7.591949 46.23140 
1 1 1    1   39   36 o   52.516   25.125  -6.4472   5.7227  -8.8758   8.1832  -4.1226   8.0060   61.921   29.735   68.462   31.795 -6.540924 43.53244 
1 1 1    1   39   37 o  125.190   34.866   14.800   6.9284   10.702   8.2965   24.244   12.595  107.419   39.032  148.085   48.335 -40.66642 62.12748 
1 1 1    1   40    0 o  371.959   14.999  107.033   8.5078  107.033   8.5078  107.033   8.5078  371.959   14.999  371.959   14.999 0.000000 0.000000 
1 1 1    1   40    1 o  280.481   12.154   60.684   5.2178   69.264   7.5029   52.647   7.2613  298.234   16.500  259.319   18.414 38.91519 24.72495 
1 1 1    1   40    2 o  164.947   22.293   21.730   5.4842   20.219   6.8148   24.508   9.2387  156.665   29.502  170.137   36.565 -13.47203 46.98268 
1 1 1    1   40    3 o  463.541   13.884  166.152   9.8511  178.067   13.883  154.068   13.981  477.743   18.985  443.640   20.588 34.10266 28.00588 
1 1 1    1   40    4 o  633.805   12.795  310.161   12.413  307.665   17.399  312.747   17.713  628.497   18.087  633.557   18.266 -5.059937 25.70527 
1 1 1    1   40    5 o  295.104   17.301   67.957   7.7804   77.137   11.057   58.954   10.950  312.087   23.315  271.152   26.731 40.93515 35.47080 
1 1 1    1   40    6 o  291.633   17.378   66.394   7.7220   68.055   11.015   64.789   10.828  292.325   24.855  285.084   25.070 7.241150 35.30209 
1 1 1    1   40    7 o  152.544   29.577   19.226   6.6566   19.115   9.5293   19.331   9.3025  148.746   40.682  149.742   39.876 -0.9961548 56.96587 
1 1 1    1   40    8 o  286.117   17.852   64.006   7.7791   72.309   11.060   55.877   10.944  301.601   24.161  263.398   27.552 38.20264 36.64506 
1 1 1    1   40    9 o  251.465   19.672   49.739   7.5114   48.225   11.029   51.048   10.258  243.193   30.286  251.827   27.036 -8.634003 40.59778 
1 1 1    1   40   10 o  197.974   23.613   31.349   7.0142   26.136   10.226   35.980   9.6394  174.256   39.279  209.220   31.042 -34.96405 50.06417 
1 1 1    1   40   11 o  314.493   17.366   77.248   8.3272   73.702   11.145   81.730   12.529  304.343   24.122  319.705   25.824 -15.36240 35.33763 
1 1 1    1   40   12 o   74.956   34.397  -5.1340   8.9762  -5.1340   8.9762   0.0000   0.0000   74.956   34.397  ?   ?  0.000000 34.39734 
1 1 1    1   40   13 o   87.124   37.599   0.4868   9.1432   0.4868   9.1432   0.0000   0.0000   87.124   37.599  ?   ?  0.000000 37.59933 
1 1 1    1   40   14 o  262.196   20.197   54.221   8.0431   58.041   11.452   50.503   11.299  267.581   28.395  248.447   30.343 19.13358 41.55666 
1 1 1    1   40   15 o  194.146   25.770   30.494   7.4689   22.193   10.701   38.380   10.430  158.501   43.011  214.910   32.740 -56.40976 54.05436 
1 1 1    1   40   16 o  433.742   15.045  146.058   9.9886  151.244   14.491  141.362   13.788  438.076   21.611  423.181   21.355 14.89514 30.38185 
1 1 1    1   40   17 o   99.383   35.921   7.2721   7.0129   11.887   10.184   3.1096   9.6716  121.827   43.371   95.143   39.756 26.68427 58.83528 
1 1 1    1   40   18 o  171.645   30.617   24.550   7.7487   30.409   11.290   19.331   10.654  186.311   40.726  147.519   43.918 38.79260 59.89504 
1 1 1    1   40   19 o  276.703   20.676   60.638   8.6936   57.618   12.474   63.491   12.123  263.971   31.494  278.875   28.816 -14.90396 42.68768 
1 1 1    1   40   20 o  186.222   29.858   28.793   8.2230   34.588   11.754   23.237   11.509  198.843   40.004  160.099   45.060 38.74390 60.25497 
1 1 1    1   40   21 o  304.492   19.790   73.300   9.1734   58.418   13.073   87.735   12.875  264.229   33.047  329.725   25.715 -65.49667 41.87300 
1 1 1    1   40   22 o  251.736   18.435   50.018   7.0540   48.062   8.4756   54.427   12.724  244.745   22.891  254.247   33.514 -9.501541 40.58535 
1 1 1    1   40   23 o  400.005   14.283  124.472   8.7446  136.792   10.805  101.080   14.888  417.987   16.888  351.646   27.890 66.34140 32.60429 
1 1 1    1   40   24 o  285.005   20.597   64.688   8.9248   0.0000   0.0000   64.688   8.9248  ?   ?   285.005   20.597 0.000000 20.59715 
1 1 1    1   40   25 o  319.555   25.105   82.944   12.181   0.0000   0.0000   82.944   12.181  ?   ?   319.555   25.105 0.000000 25.10520 
1 1 1    1   40   26 o  362.337   15.116  102.608   8.3836  114.032   11.253   88.356   12.568  378.952   19.466  329.485   25.110 49.46716 31.77185 
1 1 1    1   40   27 o  106.474   32.651   9.7374   5.8269   8.3106   8.3033   11.122   8.1792  103.874   38.818  113.762   38.986 -9.888298 55.01563 
1 1 1    1   40   28 o  177.677   23.269   25.827   6.1761   27.904   8.8595   23.864   8.6143  179.000   33.569  164.176   35.327 14.82402 48.73293 
1 1 1    1   40   29 o  177.874   23.298   25.959   6.1906   30.950   8.8491   21.175   8.6635  189.521   31.619  152.740   37.364 36.78090 48.94767 
1 1 1    1   40   30 o  117.378   32.852   12.235   6.1353   9.2998   8.7646   15.056   8.5913  106.606   39.873  127.444   39.740 -20.83833 56.29543 
1 1 1    1   40   31 o  126.942   31.693   14.328   6.1392   9.6235   8.5368   19.367   8.8350  106.659   39.458  143.420   39.150 -36.76130 55.58486 
1 1 1    1   40   32 o  160.602   26.903   22.023   6.3794   20.207   9.0288   23.833   9.0149  145.438   39.526  159.859   37.492 -14.42195 54.47861 
1 1 1    1   40   33 o  102.479   33.822   9.3614   6.1605   4.8577   8.7458   13.797   8.6793   91.449   37.974  120.176   40.165 -28.72733 55.27395 
1 1 1    1   40   34 o  154.515   27.635   20.738   6.2960   17.863   8.7395   23.840   9.0778  135.080   39.664  157.969   38.006 -22.88885 54.93346 
1 1 1    1   40   35 o   72.493   32.092   0.0320   7.0428   4.9871   8.7063  -9.3495   11.980   90.674   37.790   76.255   36.446 14.41958 52.50117 
1 1 1    1   41    0 o  102.019   49.261   12.470   8.9433   12.470   8.9433   12.470   8.9433  102.019   49.261  102.019   49.261 0.000000 0.000000 
1 1 1    1   41    1 o  199.653   19.125   31.424   5.7729   31.322   7.0416   31.632   10.082  197.802   23.732  193.954   35.259 3.847824 42.50117 
1 1 1    1   41    2 o  305.128   14.180   72.093   6.6226   73.661   8.1888   69.128   11.260  307.026   17.498  294.134   25.255 12.89124 30.72446 
1 1 1    1   41    3 o  103.478   34.135   8.5438   6.2756   8.9165   8.7998   8.1580   8.9522  110.031   40.166  107.867   40.307 2.163498 56.90297 
1 1 1    1   41    4 o  120.198   34.921   12.158   6.8064   22.183   9.5625   1.8644   9.6901  160.161   39.301   92.639   39.311 67.52246 55.58735 
1 1 1    1   41    5 o  100.712   34.536   7.8560   6.4188   0.5887   8.8156   16.056   9.3643   86.006   37.019  136.599   41.289 -50.59304 55.45398 
1 1 1    1   41    6 o  183.908   25.293   27.312   6.9315   13.346   9.5097   43.143   10.124  126.573   42.033  229.968   29.438 -103.3949 51.31654 
1 1 1    1   41    7 o  175.320   27.259   25.073   7.0773   24.291   10.041   25.844   9.9773  167.350   39.782  173.231   38.614 -5.880951 55.44112 
1 1 1    1   41    8 o  447.019   14.535  154.902   9.9449  145.127   14.158  164.420   13.972  428.881   21.638  457.991   19.931 -29.10916 29.41820 
1 1 1    1   41    9 o  243.347   20.672   46.820   7.6269   50.258   10.676   43.237   10.900  248.700   28.563  228.790   32.002 19.91075 42.89480 
1 1 1    1   41   10 f  124.224   34.789   13.099   6.8778   11.990   9.9869   14.099   9.4859  122.179   43.009  129.006   41.939 -6.827118 60.07197 
1 1 1    1   41   11 o  236.917   21.427   44.530   7.6861   62.822   11.007   27.124   10.737  279.528   26.026  176.281   40.628 103.2477 48.24930 
1 1 1    1   41   12 o  121.317   35.399   12.489   6.9806   8.6888   9.6099   16.734   10.157  110.610   41.677  138.586   43.208 -27.97619 60.03290 
1 1 1    1   41   13 o  150.826   32.862   19.263   7.3720   13.534   9.8470   26.569   11.120  126.894   42.780  173.285   42.295 -46.39018 60.15802 
1 1 1    1   41   14 o  327.411   24.738   85.853   12.306   85.853   12.306   0.0000   0.0000  327.411   24.738  ?   ?  0.000000 24.73800 
1 1 1    1   41   15 o  195.596   38.301   33.063   11.056   33.063   11.056   0.0000   0.0000  195.596   38.301  ?   ?  0.000000 38.30100 
1 1 1    1   41   16 o   78.704   34.136   0.0631   7.6123   0.5030   10.300  -0.4663   11.300   91.065   39.602   92.855   40.901 -1.789024 56.93166 
1 1 1    1   41   17 o  150.727   33.665   19.448   7.5706   17.449   11.039   21.223   10.402  140.072   45.216  153.825   42.679 -13.75362 62.17765 
1 1 1    1   41   18 o  231.753   25.170   43.498   8.7849   28.235   12.339   59.189   12.510  175.568   45.531  267.041   31.195 -91.47305 55.19270 
1 1 1    1   41   19 o   82.528   35.705   0.5350   8.2868 -10.6633   11.936   10.955   11.514   78.840   37.307  119.640   45.490 -40.80062 58.83139 
1 1 1    1   41   20 o  234.745   25.594   44.846   9.0472   38.220   12.452   52.253   13.167  207.521   40.657  246.960   35.883 -39.43871 54.22729 
1 1 1    1   41   21 o  313.023   31.464   81.871   14.871   0.0000   0.0000   81.871   14.871  ?   ?   313.023   31.464 0.000000 31.46363 
1 1 1    1   41   23 o  315.303   19.499   78.998   9.3644   78.998   9.3644   0.0000   0.0000  315.303   19.499  ?   ?  0.000000 19.49939 
1 1 1    1   41   24 o  209.007   27.984   36.390   8.7278   36.390   8.7278   0.0000   0.0000  209.007   27.984  ?   ?  0.000000 27.98447 
1 1 1    1   41   25 o  109.265   32.469   10.334   5.8274   5.4437   8.4725   14.724   8.0278   95.104   38.166  127.920   38.131 -32.81555 53.95033 
1 1 1    1   41   26 o  421.876   14.607  139.213   9.4321  135.903   17.807  140.503   11.120  403.423   29.031  422.061   17.214 -18.63763 33.75089 
1 1 1    1   41   27 o  233.600   22.724   44.467   8.0224   55.077   15.625   40.669   9.3487  242.295   43.741  219.622   28.481 22.67374 52.19609 
1 1 1    1   41   28 o  117.351   34.082   12.350   6.4845   6.9216   9.0304   18.129   9.3173   99.475   39.577  138.242   41.051 -38.76723 57.02156 
1 1 1    1   41   29 o  118.368   33.692   12.655   6.3967   23.238   9.0913   2.2786   9.0021  157.917   38.060   86.686   37.359 71.23105 53.33147 
1 1 1    1   41   30 o   74.194   31.291   1.9006   6.0796   10.020   8.4655  -6.7466   8.7365  107.119   39.351   68.087   32.126 39.03188 50.79914 
1 1 1    1   41   31 o   78.775   31.847   3.5631   5.9467  -2.4543   8.3809   9.6646   8.4393   73.511   33.547  105.290   39.177 -31.77968 51.57707 
1 1 1    1   41   32 o  299.448   15.665   71.274   7.1550   74.322   10.078   68.175   10.160  300.411   22.071  286.445   23.378 13.96652 32.15042 
1 1 1    1   41   33 o  196.501   26.154   33.018   7.6710   40.865   9.6426   19.491   12.660  215.443   30.060  134.208   48.297 81.23538 56.88769 
1 1 1    1   42    0 o  253.714   27.876   52.178   10.493   52.178   10.493   52.178   10.493  253.714   27.876  253.714   27.876 0.000000 0.000000 
1 1 1    1   42    1 o  183.058   21.078   26.691   5.7982   25.844   10.076   27.111   7.0896  172.606   39.051  182.671   26.098 -10.06502 46.96891 
1 1 1    1   42    2 o  441.770   11.511  150.633   7.7838  134.774   13.051  159.389   9.6973  414.032   20.594  453.522   13.970 -39.48959 24.88497 
1 1 1    1   42    3 o  223.402   17.803   39.209   6.0372   38.666   7.3166   40.366   10.687  220.367   21.985  220.301   32.684 0.6568909E-01 39.38997 
1 1 1    1   42    4 f  494.674   13.731  189.571   10.397  169.973   14.144  212.608   15.334  465.339   19.857  520.840   19.235 -55.50092 27.64583 
1 1 1    1   42    5 f  345.938   16.369   93.196   8.6673   84.667   11.945  102.680   12.596  325.657   24.136  359.440   23.015 -33.78320 33.34994 
1 1 1    1   42    6 o  242.891   20.977   46.777   7.7224   44.187   11.026   49.270   10.819  230.820   32.075  245.373   29.392 -14.55273 43.50528 
1 1 1    1   42    7 o  224.929   22.087   40.325   7.5059   36.404   10.170   45.016   11.124  208.678   32.932  232.944   32.049 -24.26669 45.95228 
1 1 1    1   42    8 o   79.661   33.365   1.7140   6.8352   0.5218   9.1893   3.1905   10.226   86.929   37.604   97.108   40.749 -10.17880 55.44881 
1 1 1    1   42    9 o  529.190   13.866  217.150   11.231  216.184   15.704  218.161   16.070  524.642   19.556  526.775   19.930 -2.132568 27.92221 
1 1 1    1   42   10 o   98.184   35.929   7.0054   7.0477   11.454   9.9261   2.4828   10.008  119.548   42.792   94.502   40.018 25.04594 58.58834 
1 1 1    1   42   11 o  228.234   22.036   41.581   7.6024   39.002   10.742   44.169   10.760  215.264   33.710  230.694   31.280 -15.43071 45.98682 
1 1 1    1   42   12 o  177.231   27.943   25.903   7.3291   28.762   10.262   22.927   10.471  181.839   38.091  160.097   42.150 21.74203 56.81133 
1 1 1    1   42   13 o  110.938   36.865   10.190   7.3146   12.950   10.090   7.1321   10.619  124.190   43.259  107.667   42.892 16.52343 60.91805 
1 1 1    1   42   14 o  255.558   21.503   52.071   8.3332   52.526   11.830   51.623   11.740  251.153   31.465  248.928   31.519 2.224579 44.53602 
1 1 1    1   42   15 o  379.196   17.337  112.640   10.063  114.727   14.129  110.492   14.335  377.645   24.577  369.919   25.473 7.725433 35.39627 
1 1 1    1   42   16 f  254.488   34.228   54.926   12.995   54.926   12.995   0.0000   0.0000  254.488   34.228  ?   ?  0.000000 34.22789 
1 1 1    1   42   18 o  123.160   48.078   11.727   13.103   0.0000   0.0000   11.727   13.103  ?   ?   123.160   48.078 0.000000 48.07798 
1 1 1    1   42   20 o  120.290   45.561   11.764   11.522   11.764   11.522   0.0000   0.0000  120.290   45.561  ?   ?  0.000000 45.56146 
1 1 1    1   42   21 f  243.113   36.927   51.736   13.309   51.736   13.309   0.0000   0.0000  243.113   36.927  ?   ?  0.000000 36.92680 
1 1 1    1   42   22 o  247.572   25.954   50.431   9.6886   45.166   13.304   56.375   14.137  223.744   40.332  252.757   37.694 -29.01295 55.20446 
1 1 1    1   42   23 o  115.507   41.467   11.459   9.3274   6.6474   12.828   16.856   13.587  108.826   45.651  134.549   49.779 -25.72269 67.54231 
1 1 1    1   42   24 o  224.031   22.844   40.929   7.7239   41.796   9.0768   38.653   14.705  223.738   27.054  197.305   48.932 26.43286 55.91328 
1 1 1    1   42   25 o  224.345   23.164   41.245   7.8396   45.834   9.3394   30.296   14.425  234.294   26.509  170.618   51.171 63.67545 57.62980 
1 1 1    1   42   26 o  138.706   31.510   17.021   6.5376   18.709   9.1380   15.252   9.3570  140.262   40.379  126.889   41.673 13.37354 58.02692 
1 1 1    1   42   27 o   86.987   33.286   5.4831   6.1893   0.2501   8.6735   10.912   8.8346   80.743   35.686  110.841   40.278 -30.09788 53.81239 
1 1 1    1   42   28 o   60.723   28.795  -6.6117   7.1853  -2.3680   13.282  -8.3675   8.5435   90.802   41.733   64.747   30.899 26.05537 51.92663 
1 1 1    1   42   29 o  203.599   24.952   34.883   7.6131   39.435   13.912   32.938   9.0958  195.649   47.036  192.458   32.001 3.190826 56.88998 
1 1 1    1   42   30 o   82.020   33.943   3.5833   6.9533   11.670   12.959   0.3137   8.2399  114.774   46.787   78.279   34.680 36.49524 58.23882 
1 1 1    1   43    0 o   46.499   31.520  -3.0089   6.6935  -3.0089   6.6935  -3.0089   6.6935   46.499   31.520   46.499   31.520 0.000000 0.000000 
1 1 1    1   43    1 o  426.506   10.405  140.312   6.7923  144.919   9.7139  135.905   9.5012  431.775   14.698  418.065   14.848 13.70959 20.89253 
1 1 1    1   43    2 o  358.569   13.512   99.708   7.4160  104.280   13.114   97.559   8.9919  361.016   23.866  353.494   16.619 7.521973 29.08257 
1 1 1    1   43    3 o  342.403   16.702   91.560   8.7534  107.010   12.510   76.742   12.252  366.640   22.400  308.040   26.235 58.59940 34.49702 
1 1 1    1   43    4 f  347.170   25.068   96.939   13.231   0.0000   0.0000   96.939   13.231  ?   ?   347.170   25.068 0.000000 25.06835 
1 1 1    1   43    5 o  199.825   26.004   32.540   7.7650   34.936   11.027   30.183   10.936  201.234   37.169  185.251   39.759 15.98259 54.42725 
1 1 1    1   43    6 o  420.743   15.733  137.998   10.132  124.892   14.343  151.056   14.316  395.000   23.834  436.814   21.412 -41.81406 32.03928 
1 1 1    1   43    7 o  110.560   36.676   10.144   7.2408   14.739   10.226   5.5246   10.254  130.194   43.597  102.293   41.650 27.90070 60.29472 
1 1 1    1   43    8 o  308.445   18.770   75.038   8.8196   74.163   12.468   75.914   12.477  301.741   27.292  305.526   26.957 -3.784821 38.36050 
1 1 1    1   43    9 o  227.480   24.308   41.833   8.3327   46.371   11.690   37.148   11.880  234.299   33.556  205.910   39.125 28.38927 51.54390 
1 1 1    1   43   10 o  475.041   14.998  175.811   10.905  202.255   16.292  154.350   14.678  505.186   21.070  440.824   21.753 64.36246 30.28432 
1 1 1    1   43   11 o  286.436   19.725   65.062   8.5955   67.848   12.076   62.201   12.237  287.740   27.763  274.170   29.632 13.56985 40.60622 
1 1 1    1   43   12 o  211.253   38.050   39.049   11.851   0.0000   0.0000   39.049   11.851  ?   ?   211.253   38.050 0.000000 38.04959 
1 1 1    1   43   13 o  143.719   45.621   19.030   11.274   0.0000   0.0000   19.030   11.274  ?   ?   143.719   45.621 0.000000 45.62139 
1 1 1    1   43   14 o  218.824   39.296   42.343   12.678   0.0000   0.0000   42.343   12.678  ?   ?   218.824   39.296 0.000000 39.29626 
1 1 1    1   43   16 o   82.346   37.877  -4.9232   10.972  -4.9232   10.972   0.0000   0.0000   82.346   37.877  ?   ?  0.000000 37.87711 
1 1 1    1   43   17 o  131.475   45.821   15.633   11.321   15.633   11.321   0.0000   0.0000  131.475   45.821  ?   ?  0.000000 45.82136 
1 1 1    1   43   18 o  176.088   46.183   29.599   12.602   29.599   12.602   0.0000   0.0000  176.088   46.183  ?   ?  0.000000 46.18302 
1 1 1    1   43   19 o  268.490   34.356   62.295   13.795   62.295   13.795   0.0000   0.0000  268.490   34.356  ?   ?  0.000000 34.35622 
1 1 1    1   43   20 o  191.175   36.412   32.524   10.266   27.482   13.131   40.451   16.464  166.415   48.548  198.381   53.148 -31.96596 71.98329 
1 1 1    1   43   21 o  171.233   38.363   26.803   9.8054   20.113   13.619   34.004   14.129  142.236   50.207  183.992   49.212 -41.75613 70.30326 
1 1 1    1   43   22 o  346.768   20.674   96.878   10.924  106.916   15.412   86.747   15.484  356.545   28.479  316.897   32.378 39.64813 43.12054 
1 1 1    1   43   23 o  148.695   39.947   20.925   9.2854   35.331   12.940   5.6319   13.332  189.756   45.198  105.683   45.506 84.07394 64.13754 
1 1 1    1   43   24 o  231.008   28.987   45.659   10.024   44.103   14.212   47.199   14.140  211.982   45.183  221.620   43.236 -9.637894 62.53690 
1 1 1    1   43   25 o  211.157   23.861   37.054   7.5766   30.045   8.8693   55.980   14.574  183.770   32.732  243.913   40.454 -60.14262 52.03719 
1 1 1    1   43   26 o   95.897   36.271   7.3889   7.2960   4.9043   8.6893   13.327   13.433   91.475   37.907  120.181   48.118 -28.70601 61.25583 
1 1 1    1   43   27 o  167.253   25.704   23.811   6.3697   20.944   8.8987   26.823   9.1216  147.425   38.878  169.831   36.197 -22.40662 53.11987 
1 1 1    1   44    0 f  312.444   18.668   76.576   8.8547   76.576   8.8547   76.576   8.8547  312.444   18.668  312.444   18.668 0.000000 0.000000 
1 1 1    1   44    1 o  116.107   28.819   11.435   5.0976   12.921   7.4031   10.096   7.0295  121.795   36.688  109.625   36.126 12.16945 51.48890 
1 1 1    1   44    2 o  163.698   21.988   21.666   5.3700   18.511   7.5817   24.842   7.6070  145.852   34.501  171.835   30.015 -25.98341 45.73000 
1 1 1    1   44    3 o  128.206   28.039   13.858   5.3490   10.551   7.6280   17.058   7.5029  112.039   37.653  139.666   35.130 -27.62609 51.49594 
1 1 1    1   44    4 o   69.750   31.292  -2.0317   6.9302  -2.4894   9.1762  -1.4240   10.573   79.542   35.819   87.301   38.945 -7.758659 52.91192 
1 1 1    1   44    5 o  293.371   30.509   71.641   13.500   0.0000   0.0000   71.641   13.500  ?   ?   293.371   30.509 0.000000 30.50931 
1 1 1    1   44    6 o  329.303   25.604   88.083   12.804   0.0000   0.0000   88.083   12.804  ?   ?   329.303   25.604 0.000000 25.60413 
1 1 1    1   44    7 o  405.729   23.057  132.139   14.260   0.0000   0.0000  132.139   14.260  ?   ?   405.729   23.057 0.000000 23.05724 
1 1 1    1   44    9 o  345.615   26.173   97.410   13.743   0.0000   0.0000   97.410   13.743  ?   ?   345.615   26.173 0.000000 26.17262 
1 1 1    1   44   10 o  102.660   42.468   5.4662   10.879   5.4662   10.879   0.0000   0.0000  102.660   42.468  ?   ?  0.000000 42.46752 
1 1 1    1   44   11 o   99.483   41.482   4.6437   10.499   4.6437   10.499   0.0000   0.0000   99.483   41.482  ?   ?  0.000000 41.48248 
1 1 1    1   44   12 f  104.432   42.177   6.7773   10.419   6.7773   10.419   0.0000   0.0000  104.432   42.177  ?   ?  0.000000 42.17712 
1 1 1    1   44   13 o  211.206   37.447   39.416   11.662   39.416   11.662   0.0000   0.0000  211.206   37.447  ?   ?  0.000000 37.44667 
1 1 1    1   44   14 o  279.947   21.827   63.109   9.2789   54.540   12.950   72.149   13.302  251.057   34.621  293.156   30.069 -42.09908 45.85633 
1 1 1    1   44   15 o  102.893   38.539   8.2064   8.1935   3.0428   11.633   13.289   11.542   98.285   42.414  123.391   45.834 -25.10557 62.44769 
1 1 1    1   44   16 o  304.314   20.384   74.279   9.4396   73.580   13.778   74.897   12.959  294.253   31.059  299.066   28.661 -4.812683 42.26296 
1 1 1    1   44   17 o  158.261   36.029   22.560   8.5318   18.786   12.300   26.061   11.845  138.856   47.796  163.406   45.616 -24.54984 66.07000 
1 1 1    1   44   18 o  112.467   39.669   11.110   8.5004   17.995   12.077   4.3491   11.967  135.862   47.326  100.691   43.230 35.17112 64.09873 
1 1 1    1   44   19 f  334.504   20.001   89.986   10.194   82.728   14.082   97.975   14.774  311.630   29.890  340.726   28.594 -29.09586 41.36417 
1 1 1    1   44   20 o  202.251   46.374   40.536   14.050   40.536   14.050   0.0000   0.0000  202.251   46.374  ?   ?  0.000000 46.37413 
1 1 1    1   44   21 o   71.491   34.819 -16.0279   12.261 -16.0279   12.261   0.0000   0.0000   71.491   34.819  ?   ?  0.000000 34.81895 
1 1 1    1   44   22 o  122.596   47.420   14.193   12.657   14.193   12.657   0.0000   0.0000  122.596   47.420  ?   ?  0.000000 47.41968 
1 1 1    1   44   23 o  324.344   20.562   85.465   10.155   97.222   14.295   73.486   14.430  338.033   27.877  287.550   33.408 50.48297 43.51101 
1 1 1    1   44   24 o   87.041   37.562   2.6948   9.1247 -10.3810   12.570   17.261   13.267   77.809   37.228  129.495   48.927 -51.68619 61.48023 
1 1 1    1   45    0 o   71.414   45.253   3.0230   10.683   3.0230   10.683   3.0230   10.683   71.414   45.253   71.414   45.253 0.000000 0.000000 
1 1 1    1   45    1 o  223.840   25.414   41.087   8.5529   54.070   11.941   27.407   12.257  252.855   31.538  169.817   46.012 83.03792 55.78262 
1 1 1    1   45    2 o  175.369   30.392   26.121   7.8623   26.121   7.8623   0.0000   0.0000  175.369   30.392  ?   ?  0.000000 30.39187 
1 1 1    1   45    3 o  214.157   24.707   37.524   7.9503   37.524   7.9503   0.0000   0.0000  214.157   24.707  ?   ?  0.000000 24.70729 
1 1 1    1   45    4 o  235.371   22.913   44.870   8.1501   44.870   8.1501   0.0000   0.0000  235.371   22.913  ?   ?  0.000000 22.91287 
1 1 1    1   45    5 o  323.605   26.448   85.994   12.986   85.994   12.986   0.0000   0.0000  323.605   26.448  ?   ?  0.000000 26.44836 
1 1 1    1   45    6 o  146.957   47.311   20.705   12.092   20.705   12.092   0.0000   0.0000  146.957   47.311  ?   ?  0.000000 47.31112 
1 1 1    1   45    7 o  121.059   44.252   12.668   10.687   0.0000   0.0000   12.668   10.687  ?   ?   121.059   44.252 0.000000 44.25207 
1 1 1    1   45    8 o   57.210   28.388 -20.0843   9.4871   0.0000   0.0000 -20.0843   9.4871  ?   ?    57.210   28.388 0.000000 28.38846 
1 1 1    1   45    9 o   78.868   33.253   1.9442   6.8626  -4.2380   10.017   7.4126   9.4208   78.911   36.258  102.906   40.587 -23.99549 54.42344 
1 1 1    1   45   10 o  175.939   27.231   25.990   7.0962   29.308   10.498   23.200   9.6292  179.036   39.380  158.549   39.752 20.48679 55.95554 
1 1 1    1   45   11 o   96.698   35.731   7.2675   6.9962   1.0522   10.275   12.640   9.5528   89.426   39.205  119.106   42.049 -29.68060 57.49058 
1 1 1    1   45   12 o   81.775   34.214   2.6370   7.1766   12.348   10.607  -5.5604   9.7457  118.673   43.968   75.230   34.985 43.44328 56.18846 
1 1 1    1   45   13 o   97.810   37.307   7.2262   7.7593   8.8055   11.501   5.9067   10.513  109.812   44.326  100.563   41.685 9.249062 60.84776 
1 1 1    1   45   14 o  150.879   36.746   20.832   8.4072   16.047   12.201   25.157   11.600  129.678   47.302  159.701   45.342 -30.02240 65.52373 
1 1 1    1   45   15 o  172.770   32.526   26.301   8.2857   33.110   12.697   21.251   10.935  183.392   45.461  146.844   44.669 36.54779 63.73401 
1 1 1    1   45   16 o  386.622   17.573  118.778   10.399  122.727   15.298  115.386   14.179  383.778   26.199  373.501   24.944 10.27631 36.17506 
1 1 1    1   45   17 o  304.948   20.248   75.164   9.3974   78.464   13.312   71.886   13.267  303.365   29.024  288.813   30.472 14.55170 42.08262 
1 1 1    1   45   18 o  342.401   18.857   94.151   9.8445  114.539   14.228   75.424   13.636  371.066   25.200  295.299   30.612 75.76648 39.65025 
1 1 1    1   45   19 o  205.743   29.729   36.704   9.0907   55.500   12.874   18.014   12.838  248.567   34.792  132.695   48.503 115.8728 59.69068 
1 1 1    1   45   20 o  164.000   35.671   24.797   8.6994   23.981   12.182   25.647   12.427  151.241   47.347  156.180   47.645 -4.938919 67.17007 
1 1 1    1   46    0 o  565.853   14.246  248.302   12.321  248.302   12.321  248.302   12.321  565.853   14.246  565.853   14.246 0.000000 0.000000 
1 1 1    1   46    1 o  126.204   27.674   13.664   5.1987   20.983   7.4960   6.8808   7.2161  154.287   32.755   95.507   36.085 58.78070 48.73356 
1 1 1    1   46    2 o  325.634   12.806   82.655   6.3826   85.745   9.1647   79.746   8.8941  328.103   18.322  316.296   18.451 11.80743 26.00292 
1 1 1    1   46    3 o  114.322   30.555   11.449   5.4493   12.953   7.8393   10.043   7.5801  119.460   38.056  107.816   37.498 11.64346 53.42642 
1 1 1    1   46    4 o  214.677   20.364   37.220   6.6112   31.333   7.9992   49.910   11.744  192.463   27.973  239.600   32.890 -47.13707 43.17653 
1 1 1    1   46    5 f  116.408   37.153   12.224   7.4690   11.153   10.803   13.204   10.338  114.913   43.975  120.680   43.613 -5.766891 61.93470 
1 1 1    1   46    6 o  235.199   22.618   45.189   8.0423   40.620   11.912   49.016   10.902  211.273   38.243  239.184   30.471 -27.91119 48.89799 
1 1 1    1   46    7 o  202.996   25.443   34.333   7.7318   32.903   11.533   35.501   10.421  186.876   41.408  199.320   35.456 -12.44427 54.51366 
1 1 1    1   46    8 o  155.183   32.260   21.264   7.4127   17.920   11.384   23.727   9.7671  135.253   45.995  158.624   40.182 -23.37144 61.07518 
1 1 1    1   46    9 o  110.084   42.446   10.005   10.116   0.0000   0.0000   10.005   10.116  ?   ?   110.084   42.446 0.000000 42.44632 
1 1 1    1   46   10 o  225.156   32.229   44.282   10.790   0.0000   0.0000   44.282   10.790  ?   ?   225.156   32.229 0.000000 32.22931 
1 1 1    1   46   11 o  180.367   28.825   27.945   7.6898   33.769   11.559   23.322   10.299  188.607   41.194  154.997   42.254 33.60982 59.01107 
1 1 1    1   46   12 o  107.523   36.901   10.275   7.3287   5.7392   10.684   14.306   10.072   99.389   41.676  122.798   43.195 -23.40923 60.02235 
1 1 1    1   46   13 o  112.254   37.050   11.481   7.3929   13.553   10.745   9.6186   10.188  120.282   44.310  108.232   42.354 12.04976 61.29654 
1 1 1    1   46   14 o  173.725   30.632   26.448   7.8477   25.082   11.162   27.783   11.035  158.260   44.319  168.304   42.754 -10.04321 61.57934 
1 1 1    1   46   15 o  283.149   21.495   65.472   9.2464   63.773   13.246   67.086   12.913  268.634   32.903  277.706   30.903 -9.072205 45.13969 
1 1 1    1   47    0 o   66.340   39.774   4.4846   7.2341   4.4846   7.2341   4.4846   7.2341   66.340   39.774   66.340   39.774 0.000000 0.000000 
1 1 1    1   47    1 o  295.791   13.664   68.558   6.1864   67.384   8.7390   69.738   8.7589  288.932   19.881  294.196   19.563 -5.264130 27.89209 
1 1 1    1   47    2 o   51.918   24.588  -5.1845   5.2057  -8.7693   7.3106  -1.4971   7.4145   58.288   28.020   71.690   32.248 -13.40252 42.72085 
1 1 1    1   47    3 o  243.365   16.119   47.023   5.9705   44.110   8.3992   49.999   8.4886  230.612   24.153  246.695   22.736 -16.08340 33.17115 
1 1 1    1   47    4 o  288.563   14.104   65.364   6.2297   73.946   9.0635   57.679   8.5768  302.831   19.660  266.195   21.227 36.63632 28.93247 
1 1 1    1   47    5 o  145.275   29.540   18.450   6.3448   19.956   7.7776   15.454   10.970  147.779   34.936  126.214   45.007 21.56502 56.97458 
1 1 1    1   47    6 o  206.058   26.472   35.871   8.1561   38.635   11.874   33.402   11.223  202.950   39.646  187.780   40.255 15.16968 56.50013 
1 1 1    2    0    3 o  552.076   6.6851  233.385   5.6472  233.385   5.6472  233.385   5.6472  552.076   6.6851  552.076   6.6851 0.000000 0.000000 
1 1 1    2    0    4 o  578.794   5.6131  256.473   4.9717  256.473   4.9717  256.473   4.9717  578.794   5.6131  578.794   5.6131 0.000000 0.000000 
1 1 1    2    0    5 o  230.939   3.9625   40.854   1.3997   40.854   1.3997   40.854   1.3997  230.939   3.9625  230.939   3.9625 0.000000 0.000000 
1 1 1    2    0    6 o  144.600   5.1628   16.064   1.1394   16.064   1.1394   16.064   1.1394  144.600   5.1628  144.600   5.1628 0.000000 0.000000 
1 1 1    2    0    7 o  249.811   4.2278   47.803   1.6155   47.803   1.6155   47.803   1.6155  249.811   4.2278  249.811   4.2278 0.000000 0.000000 
1 1 1    2    0    8 o   59.112   9.6913   2.8812   0.8060   2.8812   0.8060   2.8812   0.8060   59.112   9.6913   59.112   9.6913 0.000000 0.000000 
1 1 1    2    0    9 o  552.227   5.7911  233.481   4.8937  233.481   4.8937  233.481   4.8937  552.227   5.7911  552.227   5.7911 0.000000 0.000000 
1 1 1    2    0   10 o  743.424   6.7704  423.122   7.7027  423.122   7.7027  423.122   7.7027  743.424   6.7704  743.424   6.7704 0.000000 0.000000 
1 1 1    2    0   11 o  142.318   6.7821   15.608   1.4697   15.608   1.4697   15.608   1.4697  142.318   6.7821  142.318   6.7821 0.000000 0.000000 
1 1 1    2    0   12 o  167.167   5.6873   21.462   1.4514   21.462   1.4514   21.462   1.4514  167.167   5.6873  167.167   5.6873 0.000000 0.000000 
1 1 1    2    0   13 o  876.904   6.6023  588.659   8.8606  588.659   8.8606  588.659   8.8606  876.904   6.6023  876.904   6.6023 0.000000 0.000000 
1 1 1    2    0   14 o   42.857   18.755   2.0172   1.2820   2.0172   1.2820   2.0172   1.2820   42.857   18.755   42.857   18.755 0.000000 0.000000 
1 1 1    2    0   15 o  639.710   6.6072  313.327   6.4679  313.327   6.4679  313.327   6.4679  639.710   6.6072  639.710   6.6072 0.000000 0.000000 
1 1 1    2    0   16 o  449.568   6.1183  154.783   4.2084  154.783   4.2084  154.783   4.2084  449.568   6.1183  449.568   6.1183 0.000000 0.000000 
1 1 1    2    0   17 o  640.980   5.8561  314.549   5.7444  314.549   5.7444  314.549   5.7444  640.980   5.8561  640.980   5.8561 0.000000 0.000000 
1 1 1    2    0   18 o  208.781   6.5249   33.463   2.0805   33.463   2.0805   33.463   2.0805  208.781   6.5249  208.781   6.5249 0.000000 0.000000 
1 1 1    2    0   19 o  204.577   6.8699   32.145   2.1457   32.145   2.1457   32.145   2.1457  204.577   6.8699  204.577   6.8699 0.000000 0.000000 
1 1 1    2    0   20 o  1286.17   8.8817  1266.65   17.483  1266.65   17.483  1266.65   17.483  1286.17   8.8817  1286.17   8.8817 0.000000 0.000000 
1 1 1    2    0   21 o  306.313   6.2202   71.910   2.9137   71.910   2.9137   71.910   2.9137  306.313   6.2202  306.313   6.2202 0.000000 0.000000 
1 1 1    2    0   22 o  477.885   6.7256  174.919   4.9173  174.919   4.9173  174.919   4.9173  477.885   6.7256  477.885   6.7256 0.000000 0.000000 
1 1 1    2    0   23 o  824.379   7.8937  520.396   9.9583  520.396   9.9583  520.396   9.9583  824.379   7.8937  824.379   7.8937 0.000000 0.000000 
1 1 1    2    0   24 o  477.921   6.1022  174.916   4.4622  174.916   4.4622  174.916   4.4622  477.921   6.1022  477.921   6.1022 0.000000 0.000000 
1 1 1    2    0   25 o  360.711   6.6039   99.693   3.6434   99.693   3.6434   99.693   3.6434  360.711   6.6039  360.711   6.6039 0.000000 0.000000 
1 1 1    2    0   26 o  427.349   6.4887  139.883   4.2421  139.883   4.2421  139.883   4.2421  427.349   6.4887  427.349   6.4887 0.000000 0.000000 
1 1 1    2    0   27 o  1602.68   12.412  1966.99   30.444  1966.99   30.444  1966.99   30.444  1602.68   12.412  1602.68   12.412 0.000000 0.000000 
1 1 1    2    0   28 o  518.642   6.6848  205.988   5.3047  205.988   5.3047  205.988   5.3047  518.642   6.6848  518.642   6.6848 0.000000 0.000000 
1 1 1    2    0   29 o  310.288   9.3018   73.898   4.4088   73.898   4.4088   73.898   4.4088  310.288   9.3018  310.288   9.3018 0.000000 0.000000 
1 1 1    2    0   30 f  561.145   7.0353  241.131   6.0405  241.131   6.0405  241.131   6.0405  561.145   7.0353  561.145   7.0353 0.000000 0.000000 
1 1 1    2    0   31 o   88.646   28.730   7.6522   3.4466   7.6522   3.4466   7.6522   3.4466   88.646   28.730   88.646   28.730 0.000000 0.000000 
1 1 1    2    0   32 o   60.271   31.340   4.0555   3.7582   4.0555   3.7582   4.0555   3.7582   60.271   31.340   60.271   31.340 0.000000 0.000000 
1 1 1    2    0   33 o  391.458   8.7636  117.482   5.2450  117.482   5.2450  117.482   5.2450  391.458   8.7636  391.458   8.7636 0.000000 0.000000 
1 1 1    2    0   34 o  345.221   11.468   91.552   6.0444   91.552   6.0444   91.552   6.0444  345.221   11.468  345.221   11.468 0.000000 0.000000 
1 1 1    2    0   35 o  289.087   11.836   64.313   5.2174   64.313   5.2174   64.313   5.2174  289.087   11.836  289.087   11.836 0.000000 0.000000 
1 1 1    2    0   36 o  346.996   12.297   92.553   6.5128   92.553   6.5128   92.553   6.5128  346.996   12.297  346.996   12.297 0.000000 0.000000 
1 1 1    2    0   37 o  485.248   9.2669  180.473   6.8772  180.473   6.8772  180.473   6.8772  485.248   9.2669  485.248   9.2669 0.000000 0.000000 
1 1 1    2    0   38 o  641.945   8.4856  315.661   8.3345  315.661   8.3345  315.661   8.3345  641.945   8.4856  641.945   8.4856 0.000000 0.000000 
1 1 1    2    0   39 o   56.140   35.038   1.4577   6.1452   1.4577   6.1452   1.4577   6.1452   56.140   35.038   56.140   35.038 0.000000 0.000000 
1 1 1    2    0   40 o  525.226   9.2637  211.437   7.4421  211.437   7.4421  211.437   7.4421  525.226   9.2637  525.226   9.2637 0.000000 0.000000 
1 1 1    2    0   41 o  247.380   18.076   47.695   6.7604   47.695   6.7604   47.695   6.7604  247.380   18.076  247.380   18.076 0.000000 0.000000 
1 1 1    2    0   42 o   52.379   33.837  -0.0881   6.3393  -0.0881   6.3393  -0.0881   6.3393   52.379   33.837   52.379   33.837 0.000000 0.000000 
1 1 1    2    0   43 o  152.646   30.614   19.976   6.3436   19.976   6.3436   19.976   6.3436  152.646   30.614  152.646   30.614 0.000000 0.000000 
1 1 1    2    0   44 o  552.096   9.1308  233.700   7.7113  233.700   7.7113  233.700   7.7113  552.096   9.1308  552.096   9.1308 0.000000 0.000000 
1 1 1    2    0   45 o  258.105   14.504   51.610   5.6887   51.610   5.6887   51.610   5.6887  258.105   14.504  258.105   14.504 0.000000 0.000000 
1 1 1    2    0   46 o  479.582   10.890  176.616   7.9843  176.616   7.9843  176.616   7.9843  479.582   10.890  479.582   10.890 0.000000 0.000000 
1 1 1    2    0   47 o   78.929   38.183   7.1731   5.3758   7.1731   5.3758   7.1731   5.3758   78.929   38.183   78.929   38.183 0.000000 0.000000 
1 1 1    2    0   48 o   40.687   27.413  -2.0733   4.9150  -2.0733   4.9150  -2.0733   4.9150   40.687   27.413   40.687   27.413 0.000000 0.000000 
1 1 1    2    0   49 o  844.233   8.8885  546.588   11.483  546.588   11.483  546.588   11.483  844.233   8.8885  844.233   8.8885 0.000000 0.000000 
1 1 1    2    0   50 o   62.560   34.915   4.2388   4.9851   4.2388   4.9851   4.2388   4.9851   62.560   34.915   62.560   34.915 0.000000 0.000000 
1 1 1    2    0   51 o  167.229   26.769   23.344   6.3255   23.344   6.3255   23.344   6.3255  167.229   26.769  167.229   26.769 0.000000 0.000000 
1 1 1    2    0   52 o   54.027   35.030   0.0402   6.8782   0.0402   6.8782   0.0402   6.8782   54.027   35.030   54.027   35.030 0.000000 0.000000 
1 1 1    2    0   53 o   60.618   35.853   3.4586   5.7313   3.4586   5.7313   3.4586   5.7313   60.618   35.853   60.618   35.853 0.000000 0.000000 
1 1 1    2    0   54 o  447.067   10.740  153.864   7.3398  153.864   7.3398  153.864   7.3398  447.067   10.740  447.067   10.740 0.000000 0.000000 
1 1 1    2    0   55 o  459.906   10.641  162.847   7.4819  162.847   7.4819  162.847   7.4819  459.906   10.641  459.906   10.641 0.000000 0.000000 
1 1 1    2    0   56 o   74.293   37.903   6.5896   5.4303   6.5896   5.4303   6.5896   5.4303   74.293   37.903   74.293   37.903 0.000000 0.000000 
1 1 1    2    0   57 o   57.903   35.236   2.7664   5.8529   2.7664   5.8529   2.7664   5.8529   57.903   35.236   57.903   35.236 0.000000 0.000000 
1 1 1    2    0   58 o   36.496   25.865  -7.3145   6.0241  -7.3145   6.0241  -7.3145   6.0241   36.496   25.865   36.496   25.865 0.000000 0.000000 
1 1 1    2    0   59 o  111.523   39.274   13.146   6.0857   13.146   6.0857   13.146   6.0857  111.523   39.274  111.523   39.274 0.000000 0.000000 
1 1 1    2    0   60 o   46.284   30.510  -0.5941   5.5406  -0.5941   5.5406  -0.5941   5.5406   46.284   30.510   46.284   30.510 0.000000 0.000000 
1 1 1    2    0   61 o   46.221   30.229  -0.1373   5.2817  -0.1373   5.2817  -0.1373   5.2817   46.221   30.229   46.221   30.229 0.000000 0.000000 
1 1 1    2    0   62 o   43.044   29.288  -2.5600   5.8915  -2.5600   5.8915  -2.5600   5.8915   43.044   29.288   43.044   29.288 0.000000 0.000000 
1 1 1    2    0   63 o  163.764   28.259   23.390   6.4507   23.390   6.4507   23.390   6.4507  163.764   28.259  163.764   28.259 0.000000 0.000000 
1 1 1    2    0   64 o   51.558   31.812   2.2385   4.9216   2.2385   4.9216   2.2385   4.9216   51.558   31.812   51.558   31.812 0.000000 0.000000 
1 1 1    2    0   65 o   42.336   28.128  -0.5904   4.8617  -0.5904   4.8617  -0.5904   4.8617   42.336   28.128   42.336   28.128 0.000000 0.000000 
1 1 1    2    0   66 o  110.648   32.695   12.439   4.8146   12.439   4.8146   12.439   4.8146  110.648   32.695  110.648   32.695 0.000000 0.000000 
1 1 1    2    1    3 o  950.776   6.6438  691.964   9.6686  678.327   13.392  706.810   13.973  941.269   9.2953  960.819   9.5014 -19.55005 13.29209 
1 1 1    2    1    4 o  778.469   4.3701  463.832   5.2072  469.217   6.9569  456.971   7.8522  782.949   5.8051  772.646   6.6396 10.30347 8.819508 
1 1 1    2    1    5 o  356.371   3.1347   97.200   1.7099   95.574   2.2481   99.431   2.6339  353.372   4.1563  360.428   4.7742 -7.055695 6.329960 
1 1 1    2    1    6 o  1337.71   6.2193  1369.74   12.734  1382.08   18.204  1357.91   17.820  1343.60   8.8515  1331.80   8.7419 11.79541 12.44069 
1 1 1    2    1    7 o  829.566   4.3457  526.719   5.5180  524.950   7.7800  528.510   7.8276  828.136   6.1377  830.939   6.1544 -2.803101 8.691864 
1 1 1    2    1    8 o  749.845   4.1079  430.344   4.7148  425.812   6.6067  435.047   6.7305  745.858   5.7871  753.901   5.8326 -8.043823 8.216406 
1 1 1    2    1    9 o  2110.09   10.825  3409.40   34.962  3405.11   49.350  3413.71   49.537  2108.21   15.294  2110.86   15.332 -2.652588 21.65562 
1 1 1    2    1   10 o  323.735   3.4708   80.213   1.7198   79.263   2.2641   81.508   2.6444  321.806   4.5965  326.327   5.2942 -4.521088 7.011185 
1 1 1    2    1   11 o  974.016   5.2997  726.152   7.9010  740.908   12.318  715.839   10.299  983.774   8.1806  967.029   6.9577 16.74542 10.73925 
1 1 1    2    1   12 o  537.112   3.6723  220.799   3.0190  223.398   4.3038  218.280   4.2361  540.248   5.2046  534.024   5.1825 6.224121 7.344806 
1 1 1    2    1   13 o  1948.93   8.7607  2908.00   26.134  2881.41   36.530  2935.88   37.403  1939.65   12.304  1957.87   12.481 -18.22461 17.52645 
1 1 1    2    1   14 o  400.602   3.5857  122.828   2.1987  121.128   3.0936  124.563   3.1253  397.807   5.0808  403.409   5.0615 -5.601685 7.171684 
1 1 1    2    1   15 o  432.676   4.2397  143.288   2.8078  141.015   3.9575  145.592   3.9844  429.209   6.0239  436.120   5.9688 -6.910919 8.480264 
1 1 1    2    1   16 o  1041.49   6.1347  830.336   9.7796  835.407   13.914  825.385   13.749  1044.55   8.7024  1038.27   8.6515 6.281616 12.27112 
1 1 1    2    1   17 o  175.740   5.3132   23.641   1.4292   23.945   1.9194   23.263   2.1411  176.852   7.0908  174.307   8.0250 2.545273 10.70886 
1 1 1    2    1   18 o  432.263   3.8703  143.017   2.5607  144.876   3.6367  141.188   3.6063  435.039   5.4614  429.466   5.4861 5.572906 7.741098 
1 1 1    2    1   19 o  565.425   4.0864  244.712   3.5366  247.044   5.0213  242.416   4.9820  568.071   5.7749  562.724   5.7841 5.347168 8.173444 
1 1 1    2    1   20 o  202.541   5.1110   31.403   1.5845   32.033   2.2365   30.769   2.2451  204.538   7.1439  200.458   7.3170 4.079193 10.22612 
1 1 1    2    1   21 o   78.189   11.686   4.7882   1.3556   7.0816   1.9196   2.5065   1.9147   95.156   13.564   58.117   18.839 37.03924 23.21381 
1 1 1    2    1   22 o  280.510   5.2790   60.235   2.2666   60.131   3.1643   60.346   3.2481  280.231   7.3773  280.728   7.5593 -0.4966736 10.56251 
1 1 1    2    1   23 o  528.199   4.9578  213.565   4.0082  207.231   5.6034  220.202   5.7359  520.249   7.0368  536.286   6.9877 -16.03644 9.916855 
1 1 1    2    1   24 o  517.754   4.3744  205.189   3.4666  201.410   4.8634  209.093   4.9426  512.923   6.1947  522.615   6.1788 -9.692017 8.749420 
1 1 1    2    1   25 o  1000.46   5.4533  766.187   8.3509  769.606   11.859  762.825   11.761  1002.59   7.7281  998.161   7.6980 4.424988 10.90793 
1 1 1    2    1   26 o  642.242   4.6267  315.715   4.5482  312.334   6.3819  319.205   6.4834  638.750   6.5276  645.737   6.5596 -6.987366 9.254053 
1 1 1    2    1   27 o  358.424   5.7282   98.337   3.1426   95.349   4.4597  101.283   4.4291  352.902   8.2562  363.722   7.9556 -10.81927 11.46544 
1 1 1    2    1   28 o  1114.23   5.9157  950.320   10.089  942.261   14.148  958.657   14.391  1109.39   8.3321  1119.00   8.4019 -9.607178 11.83282 
1 1 1    2    1   29 o  192.833   8.8411   28.470   2.6095   27.230   3.5935   29.853   3.7956  188.131   12.551  197.014   12.654 -8.882889 17.82269 
1 1 1    2    1   30 o  618.821   4.9547  293.108   4.6930  292.559   6.6309  293.659   6.6430  618.201   7.0077  619.362   7.0072 -1.161255 9.910048 
1 1 1    2    1   31 o  513.496   5.1731  201.827   4.0659  198.647   5.7064  205.106   5.7948  509.397   7.3187  517.612   7.3142 -8.215057 10.34702 
1 1 1    2    1   32 o  685.339   5.2604  359.521   5.5181  354.953   7.7390  364.245   7.8702  680.915   7.4255  689.769   7.4544 -8.854492 10.52168 
1 1 1    2    1   33 o  352.171   6.5085   94.944   3.5084   96.444   4.9655   93.449   4.9577  354.894   9.1410  349.337   9.2718 5.557159 13.02014 
1 1 1    2    1   34 o  1549.78   8.7975  1839.16   20.869  1850.05   29.631  1828.45   29.397  1553.94   12.458  1544.84   12.432 9.097046 17.59986 
1 1 1    2    1   35 o  1223.31   7.0288  1145.73   13.161  1143.20   17.371  1149.13   20.164  1221.79   9.2889  1224.82   10.756 -3.022705 14.21158 
1 1 1    2    1   36 o  923.660   6.8763  653.186   9.7216  681.943   14.080  626.984   13.440  943.585   9.7485  904.767   9.7046 38.81818 13.75549 
1 1 1    2    1   37 o  392.465   7.2298  117.937   4.3431  117.235   6.0660  118.675   6.2211  391.205   10.130  393.593   10.326 -2.388397 14.46577 
1 1 1    2    1   38 o  342.082   8.0701   89.616   4.2255   84.743   5.9832   94.464   5.9683  332.529   11.755  351.110   11.106 -18.58041 16.17153 
1 1 1    2    1   39 o  520.896   7.6477  207.793   6.0975  212.890   8.7143  202.904   8.5349  527.071   10.802  514.558   10.837 12.51270 15.30060 
1 1 1    2    1   40 o  684.634   6.6246  358.928   6.9420  361.178   9.1946  355.945   10.587  686.629   8.7486  681.518   10.149 5.110657 13.39933 
1 1 1    2    1   41 o  557.361   7.4175  237.947   6.3280  232.854   8.8430  243.291   9.0591  551.132   10.483  563.345   10.506 -12.21356 14.84135 
1 1 1    2    1   42 o  538.774   6.5799  222.326   5.4262  220.199   7.5734  224.570   7.7783  535.988   9.2314  541.267   9.3887 -5.279053 13.16683 
1 1 1    2    1   43 o  389.452   8.2502  116.242   4.9180  115.344   7.3925  116.956   6.5871  387.592   12.461  390.428   11.023 -2.835999 16.63645 
1 1 1    2    1   44 o  439.176   7.5872  147.814   5.1002  141.546   7.7655  152.570   6.7634  429.340   11.817  445.966   9.9082 -16.62643 15.42104 
1 1 1    2    1   45 o  127.449   19.205   12.829   3.6302   15.689   5.2422   10.194   5.0319  139.877   25.422  112.044   29.086 27.83268 38.62936 
1 1 1    2    1   46 o  356.824   8.9488   97.685   4.8875  105.375   6.9230   90.043   6.9011  370.207   12.217  342.088   13.180 28.11938 17.97145 
1 1 1    2    1   47 o  101.410   25.222   8.3554   3.8987   2.5504   5.4962   14.234   5.5311   77.217   30.827  132.183   28.198 -54.96680 41.77810 
1 1 1    2    1   48 o   92.241   24.347   6.9010   3.4877   6.6334   4.9642   7.1619   4.9012   92.822   30.347   95.383   30.060 -2.560081 42.71489 
1 1 1    2    1   49 o  299.536   8.9979   68.910   4.1254   62.923   5.7920   75.074   5.8772  285.638   13.248  312.165   12.300 -26.52692 18.07765 
1 1 1    2    1   50 o  101.201   23.234   8.3545   3.5229   7.6974   5.0650   8.9702   4.9031   97.986   30.507  104.517   29.410 -6.531425 42.37423 
1 1 1    2    1   51 o  217.290   15.419   36.786   5.0950   33.718   7.8982   38.973   6.6678  204.740   25.775  222.441   19.790 -17.70193 32.49594 
1 1 1    2    1   52 o  257.455   13.300   51.415   5.2234   43.572   7.9156   57.464   6.9519  234.044   22.369  271.155   16.833 -37.11089 27.99485 
1 1 1    2    1   53 o   66.810   25.691   2.5261   3.6983   3.1914   5.2755   1.8832   5.1861   77.434   30.426   72.106   29.519 5.328400 42.39220 
1 1 1    2    1   54 o  148.509   18.360   17.531   4.0847   19.279   5.4169   15.227   6.2189  154.039   23.737  134.078   30.933 19.96095 38.99104 
1 1 1    2    1   55 o  118.660   22.904   11.554   4.0093   14.344   5.5131   8.4217   5.8412  130.627   28.385  101.233   32.910 29.39421 43.46011 
1 1 1    2    1   56 o   76.805   26.851   4.3986   3.8890   1.1476   5.5606   7.5111   5.4409   71.023   29.938   96.079   31.789 -25.05646 43.66717 
1 1 1    2    1   57 o  175.722   16.844   24.449   4.4749   24.535   6.2721   24.359   6.3864  172.998   24.361  172.083   24.976 0.9152985 34.88947 
1 1 1    2    1   58 o  173.280   16.336   23.776   4.2816   26.407   5.8260   20.686   6.3136  180.580   21.501  156.947   27.272 23.63304 34.72794 
1 1 1    2    1   59 o  191.867   15.183   29.037   4.4223   31.519   6.3071   26.637   6.2025  197.247   21.225  180.306   22.998 16.94048 31.29532 
1 1 1    2    1   60 o  173.094   16.129   23.824   4.2240   20.502   6.0403   27.002   5.9092  155.772   26.268  181.762   21.667 -25.98917 34.05119 
1 1 1    2    1   61 o  117.810   21.582   11.570   3.7483   11.657   5.3421   11.486   5.2606  114.583   30.078  113.838   29.831 0.7450867 42.36229 
1 1 1    2    1   62 o   95.003   30.030   7.9548   4.8887   4.7694   6.1771   13.295   7.9979   83.365   32.869  117.777   38.520 -34.41261 50.63810 
1 1 1    2    1   63 o  246.297   12.393   47.713   4.6570   46.990   6.6000   48.429   6.5721  240.841   18.035  244.794   17.659 -3.952591 25.24057 
1 1 1    2    1   64 o  168.491   14.598   22.757   3.7275   20.529   5.1769   25.155   5.3714  155.371   22.417  173.464   20.635 -18.09370 30.46871 
1 1 1    2    1   65 o  212.509   11.530   35.661   3.7363   40.675   5.3258   30.802   5.2429  224.178   15.619  193.288   17.926 30.89044 23.77532 
1 1 1    2    1   66 o  125.739   18.814   13.349   3.5097   6.0251   5.0179   20.363   4.9108   82.123   30.277  153.756   21.451 -71.63300 37.10561 
1 1 1    2    2    0 o  1819.31   22.942  2537.36   63.863  2537.36   63.863  2537.36   63.863  1819.31   22.942  1819.31   22.942 0.000000 0.000000 
1 1 1    2    2    1 o  221.236   7.2092   37.468   2.4412   37.468   2.4412   0.0000   0.0000  221.236   7.2092  ?   ?  0.000000 7.209172 
1 1 1    2    2    2 o  1153.12   8.8997  1018.00   15.708  1026.80   19.432  1001.39   26.684  1157.99   10.963  1143.28   15.248 14.71204 18.78044 
1 1 1    2    2    3 o  606.148   4.9724  281.220   4.6133  280.928   6.5184  281.513   6.5301  605.799   7.0298  606.430   7.0351 -0.6309204 9.945393 
1 1 1    2    2    4 o  1009.95   5.6915  780.739   8.7983  782.299   12.474  779.193   12.412  1010.89   8.0616  1008.88   8.0376 2.007507 11.38391 
1 1 1    2    2    5 o  318.865   3.0867   77.816   1.5065   76.738   1.9912   79.261   2.3038  316.641   4.1085  321.801   4.6773 -5.160065 6.225473 
1 1 1    2    2    6 o  760.787   4.0926  442.995   4.7658  435.954   6.6417  450.468   6.8424  754.688   5.7496  767.147   5.8272 -12.45850 8.186241 
1 1 1    2    2    7 o  829.084   4.3511  526.108   5.5217  517.907   7.6901  534.834   7.9332  822.563   6.1079  835.895   6.2005 -13.33179 8.703629 
1 1 1    2    2    8 o  360.131   3.6288   99.263   2.0003  100.068   2.8467   98.478   2.8114  361.577   5.1436  358.694   5.1206 2.882721 7.257952 
1 1 1    2    2    9 o  680.992   4.5326  354.948   4.7245  363.698   6.8007  346.785   6.5684  689.302   6.4458  673.085   6.3755 16.21637 9.066195 
1 1 1    2    2   10 o  875.012   4.9064  586.024   6.5712  574.911   8.5326  602.224   10.302  866.641   6.4324  886.955   7.5881 -20.31445 9.947603 
1 1 1    2    2   11 o  1568.90   7.7137  1884.28   18.524  1886.98   28.347  1882.27   24.471  1569.73   11.798  1567.90   10.197 1.830078 15.59404 
1 1 1    2    2   12 o  866.245   4.6192  574.335   6.1246  570.312   8.6088  578.458   8.7153  863.164   6.5159  869.306   6.5500 -6.141785 9.239030 
1 1 1    2    2   13 o  801.140   4.4364  491.246   5.4401  496.637   7.7754  486.076   7.6142  805.484   6.3066  796.876   6.2426 8.608398 8.873731 
1 1 1    2    2   14 o  514.143   3.7424  202.320   2.9451  201.843   4.1617  202.800   4.1683  513.517   5.2947  514.733   5.2907 -1.216309 7.485021 
1 1 1    2    2   15 o  308.799   4.2835   72.985   2.0246   75.183   2.9437   71.012   2.7891  313.397   6.1365  304.581   5.9826 8.816345 8.570206 
1 1 1    2    2   16 o  472.543   4.3546  170.912   3.1496  171.757   4.4444  170.061   4.4641  473.681   6.1300  471.335   6.1878 2.345367 8.710078 
1 1 1    2    2   17 o  280.839   4.3133   60.369   1.8541   60.046   2.4537   60.798   2.8306  280.074   5.7238  281.812   6.5623 -1.738403 8.707811 
1 1 1    2    2   18 o  1047.69   5.3892  840.241   8.6423  834.834   12.146  845.785   12.299  1044.19   7.5995  1051.02   7.6455 -6.823486 10.77990 
1 1 1    2    2   19 o  458.748   3.9740  161.083   2.7905  160.698   3.9370  161.472   3.9557  458.167   5.6140  459.269   5.6272 -1.102448 7.948683 
1 1 1    2    2   20 f  1015.09   5.3345  788.798   8.2884  785.712   11.670  791.940   11.774  1012.97   7.5267  1016.97   7.5639 -4.003845 10.67064 
1 1 1    2    2   21 o  1075.73   5.9495  885.929   9.7961  899.451   15.151  876.214   12.841  1083.66   9.1344  1069.68   7.8431 13.97510 12.03955 
1 1 1    2    2   22 o  239.077   5.8015   43.758   2.1230   45.488   2.9912   42.001   3.0137  243.724   8.0182  234.187   8.4074 9.536957 11.61793 
1 1 1    2    2   23 o  265.297   5.7541   53.880   2.3366   54.573   3.3530   53.226   3.2579  266.957   8.2059  263.645   8.0731 3.312042 11.51141 
1 1 1    2    2   24 o  161.689   7.2027   20.016   1.7826   17.495   2.5212   22.537   2.5207  150.720   11.005  171.267   9.6549 -20.54745 14.63969 
1 1 1    2    2   25 o  699.477   4.6779  374.502   5.0083  374.684   7.0963  374.321   7.0695  699.593   6.6270  699.255   6.6051 0.3379517 9.356565 
1 1 1    2    2   26 o  241.812   5.7776   44.760   2.1384   41.293   3.0152   48.268   3.0333  232.232   8.4825  251.087   7.8927 -18.85481 11.58648 
1 1 1    2    2   27 o  1391.39   7.8829  1482.15   16.788  1460.20   23.363  1505.59   24.141  1380.81   11.054  1402.10   11.249 -21.28259 15.77095 
1 1 1    2    2   28 o   98.011   14.344   7.5155   2.0882   5.2388   3.0977   9.4118   2.8270   81.731   23.504  109.455   17.461 -27.72424 29.28051 
1 1 1    2    2   29 f  1802.92   9.7269  2488.90   26.842  2496.51   38.104  2481.41   37.819  1805.23   13.790  1799.76   13.729 5.462280 19.45874 
1 1 1    2    2   30 o  1057.72   5.8458  856.372   9.4642  848.066   13.269  864.974   13.503  1052.48   8.2366  1062.92   8.2995 -10.43701 11.69291 
1 1 1    2    2   31 o  835.651   5.3916  534.516   6.8962  517.308   9.5089  553.611   10.016  822.024   7.5574  850.373   7.6954 -28.34930 10.78584 
1 1 1    2    2   32 o  727.697   5.3223  405.337   5.9281  404.457   8.3696  406.222   8.3978  726.845   7.5230  728.429   7.5320 -1.583984 10.64550 
1 1 1    2    2   33 o  609.428   5.4751  284.295   5.1072  280.786   7.1364  287.980   7.3121  605.596   7.6989  613.302   7.7893 -7.706177 10.95198 
1 1 1    2    2   34 f  682.962   6.3503  357.074   6.6384  364.366   9.3572  349.685   9.4193  689.807   8.8623  675.756   9.1066 14.05090 12.70714 
1 1 1    2    2   35 o  1208.31   7.0080  1117.80   12.961  1103.39   16.965  1137.98   20.087  1200.33   9.2341  1218.86   10.767 -18.52551 14.18423 
1 1 1    2    2   36 o  428.424   7.6152  140.540   4.9937  158.383   8.6311  131.562   6.1225  454.625   12.403  414.452   9.6513 40.17285 15.71601 
1 1 1    2    2   37 o  415.450   7.0045  132.152   4.4542  137.657   6.3003  126.652   6.2980  423.926   9.7097  406.613   10.119 17.31299 14.02422 
1 1 1    2    2   38 o  156.773   15.950   19.052   3.7742   22.395   5.3119   15.644   5.3634  169.418   20.929  140.305   25.930 29.11302 33.32228 
1 1 1    2    2   39 o  353.351   10.531   95.677   5.6958   93.946   7.4014   98.190   8.9195  349.980   13.817  357.645   16.294 -7.664734 21.36306 
1 1 1    2    2   40 o  608.269   6.7804  283.332   6.3128  280.024   8.3454  287.758   9.6517  604.565   9.0185  612.757   10.291 -8.191711 13.68328 
1 1 1    2    2   41 o  618.719   7.2652  293.214   6.8803  288.849   9.5225  297.980   9.9522  613.860   10.135  623.457   10.429 -9.597473 14.54226 
1 1 1    2    2   42 o  303.017   9.5310   70.386   4.4205   71.223   5.9398   69.348   6.6182  304.614   12.740  300.457   14.391 4.157257 19.21969 
1 1 1    2    2   43 o  230.167   11.069   40.649   3.8995   49.349   5.5556   32.200   5.4747  252.973   14.407  203.690   17.737 49.28325 22.85119 
1 1 1    2    2   44 o  523.799   6.5541  210.194   5.2547  207.312   7.5455  212.909   7.3221  519.899   9.4819  526.919   9.0787 -7.019165 13.12744 
1 1 1    2    2   45 f  491.831   7.0895  185.386   5.3370  185.793   8.2124  185.088   7.0220  491.903   10.907  491.185   9.3399 0.7182617 14.35991 
1 1 1    2    2   46 o  275.429   11.335   58.291   4.7786   53.285   7.2985   62.047   6.3222  261.874   18.324  283.418   14.623 -21.54437 23.44374 
1 1 1    2    2   47 o  100.936   25.261   8.2782   3.8934   9.9749   5.7034   6.7975   5.3279  110.835   31.899   94.673   31.463 16.16194 44.80458 
1 1 1    2    2   48 o  366.338   7.7057  102.949   4.3208  100.397   6.1845  105.382   6.0392  361.302   11.183  370.247   10.657 -8.945007 15.44749 
1 1 1    2    2   49 o  422.250   7.6772  136.808   4.9619  143.395   7.7322  132.196   6.4696  431.553   11.706  414.662   10.193 16.89154 15.52188 
1 1 1    2    2   50 o  149.303   17.292   17.534   3.8785   27.602   5.9228   9.9757   5.1319  186.745   21.090  109.898   29.771 76.84728 36.48422 
1 1 1    2    2   51 o  182.570   16.690   26.111   4.6123   31.961   6.7503   20.987   6.3167  200.438   22.385  160.570   26.635 39.86850 34.79236 
1 1 1    2    2   52 o  206.248   13.205   33.038   4.1467   27.293   6.1799   37.744   5.5926  184.798   22.299  219.557   16.768 -34.75819 27.90009 
1 1 1    2    2   53 o  150.626   17.999   17.975   4.0675   15.855   5.1704   21.417   6.5886  139.097   25.213  161.247   27.693 -22.15024 37.45142 
1 1 1    2    2   54 o   63.542   25.086   1.9755   3.6024   2.9083   5.1073   1.0520   5.0819   75.366   29.833   68.463   28.727 6.902725 41.41593 
1 1 1    2    2   55 o  118.587   22.808   11.536   3.9896   15.730   5.4628   6.7422   5.8403  137.462   26.927   93.636   32.895 43.82629 42.51030 
1 1 1    2    2   56 o  233.179   13.893   42.434   4.9361   47.079   7.5036   38.891   6.5538  243.031   20.359  221.089   19.569 21.94189 28.23900 
1 1 1    2    2   57 o  221.783   13.892   38.453   4.6919   41.558   6.4234   34.903   6.8698  228.776   18.502  208.019   21.905 20.75700 28.67356 
1 1 1    2    2   58 o  351.398   9.4190   95.333   5.0661   89.313   6.7397  103.153   7.6813  338.788   12.997  363.711   13.798 -24.92313 18.95528 
1 1 1    2    2   59 o  191.080   15.897   28.886   4.6072   30.836   6.7863   27.219   6.2748  193.968   23.325  182.264   23.004 11.70427 32.76091 
1 1 1    2    2   60 o  222.049   12.927   38.611   4.3745   35.104   6.1094   42.300   6.2665  208.778   19.338  230.098   17.934 -21.31941 26.37406 
1 1 1    2    2   61 o  269.903   11.143   56.680   4.6035   51.569   6.9817   60.611   6.1231  253.501   18.113  277.202   14.482 -23.70038 23.19014 
1 1 1    2    2   62 o  142.426   19.376   16.642   4.1143   21.429   6.5703   13.555   5.2770  156.409   28.494  123.728   28.458 32.68115 40.27128 
1 1 1    2    2   63 o   64.679   26.549   1.9406   4.2089  -4.3407   5.8802   8.5396   6.0271   56.898   26.693   97.352   33.461 -40.45444 42.80332 
1 1 1    2    2   64 o   67.957   25.571   3.3779   3.6152   4.2348   5.1717   2.5591   5.0555   76.765   30.137   70.086   28.968 6.679199 41.80146 
1 1 1    2    2   65 f  163.050   15.778   21.622   3.8884   22.107   5.9156   21.252   5.1596  158.045   25.308  157.448   22.012 0.5961761 33.54097 
1 1 1    2    2   66 o   72.860   25.856   4.5278   3.6164   5.1094   5.5934   4.1101   4.7405   79.265   31.270   73.387   28.840 5.877785 42.53856 
1 1 1    2    3    0 o  135.231   7.5211   14.127   1.5458   14.127   1.5458   14.127   1.5458  135.231   7.5211  135.231   7.5211 0.000000 0.000000 
1 1 1    2    3    1 f  1082.17   10.352  896.699   17.147  919.606   24.927  876.125   23.624  1095.62   14.864  1069.44   14.432 26.18481 20.71777 
1 1 1    2    3    2 o  494.491   4.5268  187.154   3.4263  186.099   4.8304  188.222   4.8607  493.073   6.4003  495.878   6.4040 -2.804688 9.054024 
1 1 1    2    3    3 f  778.675   5.8059  464.108   6.9199  468.039   9.8585  460.291   9.7153  781.904   8.2374  775.407   8.1857 6.497253 11.61296 
1 1 1    2    3    4 o  929.518   6.5854  661.366   9.3694  671.031   13.439  652.227   13.069  936.190   9.3787  922.985   9.2508 13.20532 13.17335 
1 1 1    2    3    5 o  1104.10   7.5276  933.192   12.721  920.034   17.711  947.216   18.285  1096.15   10.556  1112.22   10.741 -16.06445 15.05947 
1 1 1    2    3    6 o  636.045   4.2782  309.637   4.1650  306.667   5.8418  312.707   5.9399  632.962   6.0297  639.164   6.0715 -6.202576 8.556945 
1 1 1    2    3    7 o  466.841   3.5199  166.802   2.5152  169.947   3.8892  164.541   3.2977  471.204   5.3924  463.655   4.6466 7.548126 7.118204 
1 1 1    2    3    8 o  260.979   3.5711   52.128   1.4265   53.517   2.0131   50.728   2.0217  264.424   4.9738  257.442   5.1306 6.981842 7.145773 
1 1 1    2    3    9 o  383.269   3.7410  112.428   2.1946  110.022   3.0798  114.910   3.1281  379.134   5.3071  387.465   5.2745 -8.330994 7.482385 
1 1 1    2    3   10 o  891.865   4.9848  608.818   6.8048  605.063   10.354  611.672   9.0284  889.043   7.6089  893.915   6.5985 -4.871948 10.07153 
1 1 1    2    3   11 o  596.309   3.7924  272.151   3.4615  270.432   4.8843  273.886   4.9062  594.402   5.3685  598.186   5.3585 -3.783875 7.585133 
1 1 1    2    3   12 o  1495.64   6.9458  1712.36   15.901  1681.16   21.999  1746.49   23.009  1481.79   9.6996  1510.29   9.9532 -28.50171 13.89779 
1 1 1    2    3   13 o  963.363   4.9816  710.352   7.3456  708.014   10.349  712.726   10.428  961.716   7.0306  964.910   7.0604 -3.194153 9.963929 
1 1 1    2    3   14 o  824.859   5.2417  520.791   6.6179  518.450   9.3443  523.146   9.3741  822.942   7.4184  826.661   7.4085 -3.718567 10.48420 
1 1 1    2    3   15 o  690.660   4.8279  365.114   5.1037  369.068   7.2695  361.270   7.1671  694.343   6.8401  686.968   6.8161 7.374390 9.656423 
1 1 1    2    3   16 o  1699.24   8.3455  2210.78   21.706  2192.39   28.416  2236.53   33.631  1691.88   10.973  1708.58   12.860 -16.69946 16.90527 
1 1 1    2    3   17 o  585.239   4.3289  262.160   3.8778  260.610   5.0915  264.300   5.9840  583.479   5.7010  587.569   6.6537 -4.090454 8.762016 
1 1 1    2    3   18 o  1332.99   6.4264  1360.32   13.112  1347.31   18.347  1373.91   18.746  1326.38   9.0370  1339.40   9.1438 -13.02271 12.85597 
1 1 1    2    3   19 o  612.259   4.1987  286.933   3.9348  291.221   5.6289  282.835   5.5025  616.767   5.9625  607.824   5.9144 8.943237 8.398318 
1 1 1    2    3   20 o  829.078   4.7672  526.170   6.0497  522.204   8.5130  530.216   8.5988  825.858   6.7345  832.168   6.7508 -6.310669 9.535547 
1 1 1    2    3   21 o  303.608   5.0653   70.563   2.3539   72.886   3.3126   68.193   3.3455  308.530   7.0146  298.427   7.3240 10.10367 10.14127 
1 1 1    2    3   22 o  533.270   4.5205  217.680   3.6898  215.951   4.8901  219.965   5.6225  531.109   6.0154  535.995   6.8533 -4.885254 9.118854 
1 1 1    2    3   23 o  203.735   6.1839   31.777   1.9284   32.765   3.0006   31.082   2.5170  206.831   9.4780  201.470   8.1622 5.360306 12.50817 
1 1 1    2    3   24 o  225.181   5.6197   38.816   1.9369   42.382   2.7588   35.350   2.7201  235.272   7.6610  214.861   8.2710 20.41153 11.27385 
1 1 1    2    3   25 o  719.918   4.7174  396.709   5.1983  398.875   7.4151  394.616   7.2895  721.824   6.7114  717.962   6.6332 3.862000 9.436255 
1 1 1    2    3   26 o  896.908   5.1950  615.754   7.1319  618.951   10.156  612.643   10.018  899.158   7.3791  894.567   7.3162 4.591309 10.39124 
1 1 1    2    3   27 o  238.890   6.9596   43.687   2.5448   42.397   3.7538   44.784   3.4616  235.297   10.423  241.844   9.3513 -6.546936 14.00300 
1 1 1    2    3   28 o  231.147   6.8896   40.900   2.4375   40.275   3.5984   41.430   3.3136  229.337   10.251  232.617   9.3065 -3.279221 13.84539 
1 1 1    2    3   29 o  981.059   5.9869  736.734   8.9902  737.120   11.882  736.219   13.750  981.247   7.9110  980.593   9.1610 0.6544189 12.10404 
1 1 1    2    3   30 o  859.286   5.3537  565.175   7.0414  567.098   10.000  563.283   9.9165  860.680   7.5909  857.782   7.5529 2.898987 10.70834 
1 1 1    2    3   31 f  522.573   5.2325  209.027   4.1853  207.742   5.8940  210.334   5.9441  520.924   7.3921  524.164   7.4088 -3.239502 10.46581 
1 1 1    2    3   32 f  830.004   5.4483  527.326   6.9216  524.726   9.7657  529.951   9.8117  827.879   7.7067  831.991   7.7047 -4.111938 10.89750 
1 1 1    2    3   33 o  538.273   5.4847  221.785   4.5189  217.117   6.3208  226.665   6.4629  532.526   7.7546  544.108   7.7602 -11.58234 10.97059 
1 1 1    2    3   34 o  1049.28   6.9664  842.898   11.188  836.849   15.580  849.338   16.077  1045.33   9.7375  1053.09   9.9743 -7.753052 13.93933 
1 1 1    2    3   35 o  553.408   6.0959  234.453   5.1636  228.073   6.8194  243.027   7.9051  545.763   8.1634  563.333   9.1680 -17.57025 12.27573 
1 1 1    2    3   36 o   78.968   25.276   4.6823   3.4550  -3.5979   5.3410   10.641   4.5307   58.528   26.737  115.303   26.260 -56.77438 37.47578 
1 1 1    2    3   37 o  420.658   7.4722  135.495   4.8111  135.251   6.2146  135.861   7.6006  420.204   9.6624  421.061   11.793 -0.8570557 15.24600 
1 1 1    2    3   38 o  813.954   6.4210  507.252   7.9996  514.034   10.551  498.084   12.268  819.251   8.4144  806.325   9.9403 12.92664 13.02351 
1 1 1    2    3   39 o  624.827   7.1530  298.964   6.8410  309.382   9.9387  289.583   9.4306  635.423   10.219  614.769   10.022 20.65399 14.31308 
1 1 1    2    3   40 o  273.887   10.382   57.493   4.3523   60.505   6.6305   55.213   5.7692  280.293   15.515  267.866   14.121 12.42728 20.97908 
1 1 1    2    3   41 o  160.777   17.084   20.095   4.1399   13.221   5.3800   30.075   6.4823  128.186   28.187  196.294   21.951 -68.10860 35.72623 
1 1 1    2    3   42 o  474.529   6.8372  172.480   4.9660  181.053   7.1858  164.643   6.8709  485.970   9.6604  463.420   9.6865 22.54938 13.68035 
1 1 1    2    3   43 o  205.760   12.283   32.621   3.8507   32.190   5.3936   33.069   5.4995  203.689   17.469  206.455   17.570 -2.766129 24.77641 
1 1 1    2    3   44 o  485.279   6.7997  180.433   5.0507  182.777   7.2828  178.262   7.0105  488.128   9.7475  482.089   9.5006 6.038452 13.61156 
1 1 1    2    3   45 f  138.634   17.776   15.075   3.6851   12.024   5.4943   17.571   4.9684  121.484   29.779  148.869   22.507 -27.38499 37.32721 
1 1 1    2    3   46 o  254.769   12.208   49.908   4.7608   62.913   7.2089   39.849   6.3400  285.007   16.597  226.242   18.469 58.76433 24.83080 
1 1 1    2    3   47 o  235.885   12.405   42.933   4.4631   43.196   7.1843   42.767   5.6954  235.058   20.164  234.808   15.941 0.2500153 25.70403 
1 1 1    2    3   48 o  433.479   7.6049  144.137   5.0458  139.557   7.7965  147.439   6.6190  425.813   11.962  438.070   9.8714 -12.25662 15.50929 
1 1 1    2    3   49 o  119.163   20.774   11.379   3.6513   14.828   5.6206   8.8614   4.8028  134.494   28.204  104.087   29.043 30.40714 40.48432 
1 1 1    2    3   50 o  134.698   17.921   14.344   3.6031   10.942   5.0368   17.911   5.1566  115.021   28.702  149.320   23.324 -34.29893 36.98400 
1 1 1    2    3   51 o  269.859   11.667   56.161   4.8191   57.423   7.0525   55.055   6.6005  271.192   17.077  265.751   16.306 5.440826 23.61159 
1 1 1    2    3   52 o  491.039   7.4083  185.167   5.5681  199.839   8.6683  174.861   7.2651  509.027   11.126  476.519   9.9608 32.50830 14.93300 
1 1 1    2    3   53 o  240.726   12.010   44.781   4.4251   41.098   5.5548   51.177   7.3207  229.256   15.929  254.890   18.899 -25.63426 24.71617 
1 1 1    2    3   54 o  297.746   9.4068   68.287   4.2871   74.037   6.0635   62.540   6.0622  309.178   12.813  283.847   13.953 25.33163 18.94359 
1 1 1    2    3   55 o  247.868   10.893   47.460   4.1326   47.259   5.7393   47.676   5.9554  245.779   15.333  246.680   15.857 -0.9009399 22.05733 
1 1 1    2    3   56 o   57.971   24.494   0.5230   3.7362   2.9347   5.2638  -1.9260   5.3041   75.762   30.193   60.658   27.281 15.10450 40.69249 
1 1 1    2    3   57 o  339.466   10.355   89.067   5.3806   85.430   6.9381   94.555   8.5224  331.252   13.684  347.396   16.028 -16.14465 21.07455 
1 1 1    2    3   58 o  213.535   13.303   35.641   4.3263   30.234   5.7485   42.704   6.5700  194.201   19.607  231.543   18.698 -37.34181 27.09339 
1 1 1    2    3   59 o  255.331   12.013   50.678   4.6950   41.751   6.8577   58.553   6.4412  227.977   19.851  272.653   15.498 -44.67657 25.18429 
1 1 1    2    3   60 o  197.967   13.954   30.838   4.2012   24.490   5.8860   37.430   5.9985  172.318   22.882  216.152   18.303 -43.83336 29.30132 
1 1 1    2    3   61 o   57.284   24.650   0.2755   3.9066  -2.0656   5.1401   3.4771   6.0110   58.167   26.439   78.902   31.977 -20.73536 41.49128 
1 1 1    2    3   62 o   48.509   22.415  -2.5108   3.9054   0.3800   6.1326  -4.4831   5.0654   69.425   30.366   52.001   24.513 17.42417 39.02596 
1 1 1    2    3   63 o  122.074   24.275   12.857   4.3761   11.978   6.0054   13.852   6.3899  113.231   32.774  121.368   33.363 -8.137543 46.76780 
1 1 1    2    3   64 o  177.813   15.471   25.483   4.1687   28.232   6.3573   23.408   5.5215  181.642   23.410  166.029   22.290 15.61293 32.32502 
1 1 1    2    3   65 o  194.379   14.831   30.472   4.3792   25.532   6.0883   35.767   6.3036  171.141   23.894  206.326   20.220 -35.18475 31.30107 
1 1 1    2    3   66 o   88.353   24.454   7.0889   3.4194   12.457   4.8686   1.8629   4.8036  115.150   27.913   65.181   27.670 49.96981 39.30343 
1 1 1    2    4    0 o  360.061   8.1606   99.386   4.4923   99.386   4.4923   99.386   4.4923  360.061   8.1606  360.061   8.1606 0.000000 0.000000 
1 1 1    2    4    1 o  1099.30   10.540  925.317   17.735  973.158   26.495  886.477   23.872  1127.04   15.359  1075.74   14.498 51.30103 21.12076 
1 1 1    2    4    2 o  311.365   4.6788   74.203   2.2298   74.449   2.7488   73.730   3.8133  311.872   5.7583  310.341   8.0277 1.530731 9.879415 
1 1 1    2    4    3 o  596.989   5.0223  272.787   4.5892  263.602   6.3217  283.020   6.6727  586.820   7.0382  608.047   7.1696 -21.22711 10.04686 
1 1 1    2    4    4 o  598.622   5.0611  274.281   4.6373  280.499   6.6751  268.481   6.4471  605.333   7.2043  592.225   7.1122 13.10791 10.12353 
1 1 1    2    4    5 o  934.802   6.6638  668.908   9.5347  677.369   13.657  660.864   13.317  940.597   9.4862  929.072   9.3648 11.52502 13.32999 
1 1 1    2    4    6 o  759.333   5.8482  441.338   6.7971  427.687   9.3360  456.736   9.9153  747.441   8.1605  772.401   8.3867 -24.95996 11.70174 
1 1 1    2    4    7 o  230.621   4.6435   40.708   1.6391   41.631   2.3118   39.775   2.3245  233.210   6.4763  227.950   6.6622 5.259796 9.291227 
1 1 1    2    4    8 o  1279.90   9.8792  1254.24   19.354  1264.94   23.899  1233.86   32.989  1285.19   12.149  1268.90   16.985 16.29736 20.88290 
1 1 1    2    4    9 o  587.398   3.9469  264.080   3.5486  261.865   5.3956  265.768   4.7109  584.902   6.0268  589.256   5.2231 -4.354736 7.975159 
1 1 1    2    4   10 o  1131.53   5.9122  980.035   10.240  979.184   15.655  980.671   13.536  1130.92   9.0441  1131.83   7.8137 -0.9123535 11.95194 
1 1 1    2    4   11 o  808.827   5.0853  500.730   6.2957  477.775   10.391  514.045   7.9136  789.982   8.5933  819.484   6.3091 -29.50244 10.66062 
1 1 1    2    4   12 o  273.817   3.5406   57.384   1.4839   60.724   2.1445   54.315   2.0555  281.665   4.9741  266.387   5.0413 15.27881 7.082088 
1 1 1    2    4   13 o  550.080   3.7792  231.592   3.1820  229.584   4.4712  233.653   4.5293  547.669   5.3338  552.502   5.3558 -4.832458 7.558738 
1 1 1    2    4   14 o  775.243   5.0813  460.022   6.0296  475.003   8.8193  446.874   8.2621  787.704   7.3148  764.033   7.0649 23.67108 10.16957 
1 1 1    2    4   15 o  1133.18   6.0120  982.955   10.428  979.879   15.864  985.295   13.837  1131.24   9.1621  1134.43   7.9686 -3.193115 12.14256 
1 1 1    2    4   16 o  519.629   4.1512  206.670   3.3017  202.931   4.3070  211.998   5.1418  514.885   5.4651  526.243   6.3835 -11.35754 8.403305 
1 1 1    2    4   17 o  1237.87   6.0538  1173.03   11.470  1185.94   16.415  1160.71   16.035  1244.48   8.6174  1231.19   8.5087 13.29968 12.11020 
1 1 1    2    4   18 o  323.901   4.0121   80.302   1.9891   79.207   2.8091   81.402   2.8169  321.663   5.7055  326.090   5.6437 -4.427185 8.025187 
1 1 1    2    4   19 o  315.708   4.1495   76.292   2.0051   76.929   2.8435   75.663   2.8280  316.997   5.8604  314.378   5.8770 2.618622 8.299597 
1 1 1    2    4   20 o  346.387   4.1661   91.841   2.2088   89.138   3.1138   94.579   3.1338  341.222   5.9619  351.483   5.8250 -10.26169 8.335166 
1 1 1    2    4   21 o  526.180   4.8064  211.936   3.8710  216.847   5.5105  207.150   5.4390  532.184   6.7649  520.147   6.8316 12.03735 9.614234 
1 1 1    2    4   22 o  140.412   7.4478   15.139   1.5950   16.656   2.2257   13.536   2.2867  147.125   9.9419  132.427   11.392 14.69788 15.12046 
1 1 1    2    4   23 o  140.924   8.1037   15.258   1.7406   14.838   2.6761   15.565   2.2916  138.563   12.761  142.150   10.609 -3.587219 16.59514 
1 1 1    2    4   24 o  298.383   5.0003   68.151   2.2837   70.743   3.3255   65.837   3.1416  303.976   7.1474  293.249   6.9991 10.72678 10.00366 
1 1 1    2    4   25 o  813.963   4.9538  507.130   6.1718  516.092   8.8777  498.747   8.5861  821.054   7.0641  807.144   6.9499 13.91052 9.909728 
1 1 1    2    4   26 o  1011.03   5.5324  782.430   8.5615  793.490   12.285  771.986   11.938  1018.05   7.8839  1004.17   7.7669 13.88391 11.06712 
1 1 1    2    4   27 o  902.595   6.0535  623.609   8.3632  615.959   11.800  631.331   11.855  896.950   8.5947  908.076   8.5294 -11.12573 12.10865 
1 1 1    2    4   28 f  833.321   5.4756  531.536   6.9841  526.632   10.588  535.314   9.2922  829.382   8.3408  836.228   7.2598 -6.845764 11.05769 
1 1 1    2    4   29 o  582.116   5.2579  259.371   4.6848  259.625   6.2195  259.039   7.1228  582.369   6.9772  581.688   8.0000 0.6814575 10.61518 
1 1 1    2    4   30 o  1645.37   7.8698  2072.58   19.820  2070.09   27.990  2075.09   28.069  1644.10   11.122  1646.09   11.140 -1.981934 15.74218 
1 1 1    2    4   31 o  258.785   7.1410   51.268   2.8286   49.954   4.0001   52.582   4.0003  255.409   10.232  262.043   9.9735 -6.634384 14.28874 
1 1 1    2    4   32 o  695.090   5.2968  369.826   5.6354  371.657   8.0097  368.032   7.9302  696.746   7.5106  693.342   7.4725 3.404358 10.59469 
1 1 1    2    4   33 o  863.424   5.9479  570.679   7.8607  586.029   12.152  559.634   10.308  874.820   9.0750  854.951   7.8770 19.86957 12.01674 
1 1 1    2    4   34 o  168.418   13.262   21.870   3.3911   17.674   4.3643   28.264   5.3872  150.527   19.393  191.026   18.663 -40.49886 26.91464 
1 1 1    2    4   35 o  269.683   9.8732   55.704   4.0755   51.767   4.9632   63.853   7.1411  259.919   12.475  288.091   16.261 -28.17188 20.49509 
1 1 1    2    4   36 o  424.922   7.7924  138.257   5.0682  138.449   7.1415  138.062   7.1937  425.108   10.975  424.509   11.071 0.5981445 15.58952 
1 1 1    2    4   37 o  576.073   6.5884  254.081   5.8093  255.990   7.6284  251.446   8.9633  578.148   8.6204  572.911   10.221 5.236938 13.37115 
1 1 1    2    4   38 o  740.096   5.9452  419.351   6.7348  415.513   9.4652  423.287   9.5849  736.565   8.3956  743.423   8.4233 -6.857239 11.89273 
1 1 1    2    4   39 o  367.559   9.1779  103.498   5.1635  107.040   7.6775  100.572   6.9772  373.581   13.427  362.167   12.586 11.41443 18.40346 
1 1 1    2    4   40 o  227.403   11.760   39.758   4.0794   36.994   6.0385   42.078   5.5329  218.609   18.212  233.576   15.565 -14.96600 23.95735 
1 1 1    2    4   41 o  262.992   10.952   53.036   4.4086   49.187   5.6960   58.787   6.9625  252.638   14.795  276.050   16.555 -23.41243 22.20200 
1 1 1    2    4   42 o  289.787   9.0912   64.369   4.0324   62.198   5.6883   66.562   5.7173  284.623   13.057  294.464   12.685 -9.840942 18.20419 
1 1 1    2    4   43 o  119.271   20.427   11.288   3.5951   7.4803   4.9778   15.439   5.1978   97.894   30.204  138.972   25.370 -41.07809 39.44543 
1 1 1    2    4   44 o  593.926   6.2830  270.230   5.7118  262.376   8.0109  278.351   8.1461  584.934   8.9476  602.494   8.8334 -17.55969 12.57331 
1 1 1    2    4   45 o   66.745   25.148   2.5688   3.4989   3.6574   5.1192   1.6144   4.7932   79.986   30.351   70.080   28.499 9.905975 41.63398 
1 1 1    2    4   46 o  112.231   23.731   10.171   3.9491   11.754   5.4975   8.4827   5.6766  119.912   30.021  103.651   32.300 16.26049 44.09710 
1 1 1    2    4   47 o  253.248   10.821   49.290   4.1945   45.978   6.1351   52.197   5.7477  243.359   16.569  259.776   14.513 -16.41760 22.02659 
1 1 1    2    4   48 f  133.856   18.438   14.150   3.6774   15.293   5.7904   13.378   4.7608  136.742   28.586  128.510   25.104 8.231033 38.04382 
1 1 1    2    4   49 o  170.127   14.356   22.512   3.7034   27.750   5.6780   18.634   4.8857  187.703   20.074  153.061   21.443 34.64198 29.37295 
1 1 1    2    4   50 o  241.887   10.930   45.050   4.0467   50.753   5.5668   38.660   5.8929  255.809   14.274  222.384   17.452 33.42558 22.54644 
1 1 1    2    4   51 o  197.319   13.916   30.271   4.1759   35.021   7.0295   27.681   5.1911  209.907   22.217  187.553   18.317 22.35327 28.79376 
1 1 1    2    4   52 o  131.143   19.630   13.756   3.8192   15.216   5.8084   12.644   5.0690  135.153   28.950  123.377   27.540 11.77605 39.95674 
1 1 1    2    4   53 o  213.592   13.090   35.449   4.2589   33.963   5.4676   37.741   6.7916  207.870   17.343  218.065   20.592 -10.19475 26.92176 
1 1 1    2    4   54 o  320.317   8.9269   78.985   4.3767   86.787   6.2918   71.670   6.0923  334.893   12.274  304.103   13.088 30.79016 17.94344 
1 1 1    2    4   55 o  147.723   17.012   17.293   3.7763   11.062   5.3599   23.434   5.3213  114.093   30.214  170.960   20.761 -56.86781 36.65974 
1 1 1    2    4   56 o  226.348   11.943   39.796   4.1230   43.317   5.8118   36.229   5.8500  234.728   16.277  213.911   18.035 20.81691 24.29414 
1 1 1    2    4   57 o  102.259   25.783   8.8106   4.0346   4.6824   5.4215   13.934   6.0400   83.022   31.299  126.942   31.286 -43.92014 44.25476 
1 1 1    2    4   58 o  166.632   16.491   22.023   4.1509   20.454   5.5409   24.030   6.2663  157.657   23.694  170.617   24.715 -12.96004 34.23774 
1 1 1    2    4   59 o  229.225   13.664   41.174   4.7724   42.069   6.8139   40.312   6.6861  228.921   19.637  224.026   19.699 4.894836 27.81458 
1 1 1    2    4   60 o  318.016   9.5093   78.253   4.6288   76.627   6.5195   79.905   6.5731  312.910   13.612  319.626   13.436 -6.715637 19.12595 
1 1 1    2    4   61 o  137.963   19.760   15.600   4.0536   10.214   5.3990   22.560   6.1372  106.922   31.112  163.215   25.392 -56.29314 40.15852 
1 1 1    2    4   62 o  200.336   14.549   31.855   4.4308   31.952   7.2212   31.796   5.6112  194.269   24.855  197.856   18.752 -3.586807 31.13535 
1 1 1    2    4   63 o  162.021   18.938   21.539   4.6080   23.260   6.5500   19.853   6.4838  163.010   27.211  148.725   29.524 14.28438 40.15085 
1 1 1    2    4   64 o   79.779   25.823   5.5386   3.5985   1.0413   5.0444   10.199   5.1349   64.852   27.958  104.434   30.329 -39.58228 41.24870 
1 1 1    2    4   65 o   52.606   22.980   0.0931   3.5020  -0.8675   4.8192   1.1680   5.0977   57.543   25.931   64.793   28.018 -7.249363 38.17622 
1 1 1    2    4   66 o   60.952   24.380   2.3021   3.4446   1.4792   4.7356   3.2265   5.0195   63.576   27.242   70.719   29.007 -7.142452 39.79367 
1 1 1    2    5    0 o  484.472   9.1449  179.855   6.7760  179.855   6.7760  179.855   6.7760  484.472   9.1449  484.472   9.1449 0.000000 0.000000 
1 1 1    2    5    1 o  358.524   5.9234   98.389   3.2505   97.128   4.5797   99.669   4.6144  356.190   8.4001  360.820   8.3551 -4.630035 11.84782 
1 1 1    2    5    2 o  1283.95   9.8163  1262.20   19.292  1269.64   23.804  1247.98   32.931  1287.58   12.078  1276.15   16.859 11.43103 20.73919 
1 1 1    2    5    3 o  629.192   5.2082  303.012   5.0158  298.685   7.0110  307.550   7.1789  624.645   7.3329  633.846   7.3995 -9.200562 10.41749 
1 1 1    2    5    4 o  1107.97   7.5762  939.740   12.848  917.867   17.695  964.129   18.686  1094.86   10.559  1122.10   10.879 -27.23450 15.16106 
1 1 1    2    5    5 o  522.281   6.8733  208.805   5.4947  208.805   5.4947   0.0000   0.0000  522.281   6.8733  ?   ?  0.000000 6.873330 
1 1 1    2    5    6 f  1330.87   10.195  1356.18   20.769  1340.94   25.113  1389.15   36.943  1323.22   12.399  1346.29   17.928 -23.06348 21.79779 
1 1 1    2    5    7 o  1086.02   10.635  903.107   17.678  892.877   24.640  913.959   25.378  1079.58   14.911  1092.23   15.180 -12.65063 21.27828 
1 1 1    2    5    8 o  162.924   5.4136   20.317   1.3500   20.552   1.9248   20.091   1.8940  163.849   7.6751  162.001   7.6382 1.847504 10.82815 
1 1 1    2    5    9 o  717.036   5.8153  393.539   6.3824  391.951   8.9838  395.158   9.0688  715.532   8.2028  718.453   8.2468 -2.920715 11.63163 
1 1 1    2    5   10 o  515.644   4.1666  203.504   3.2885  203.031   4.6228  203.989   4.6789  515.023   5.8643  516.236   5.9215 -1.213135 8.333857 
1 1 1    2    5   11 o  411.586   3.9504  129.656   2.4887  135.096   3.6267  124.815   3.4214  420.115   5.6399  403.813   5.5355 16.30179 7.902549 
1 1 1    2    5   12 o  737.863   5.3762  416.730   6.0718  453.660   10.427  397.785   7.4686  769.766   8.8502  720.864   6.7688 48.90179 11.14193 
1 1 1    2    5   13 o  1365.25   7.4543  1426.90   15.577  1421.22   21.963  1432.65   22.096  1362.32   10.533  1367.79   10.554 -5.464600 14.91080 
1 1 1    2    5   14 o  576.307   4.1330  254.209   3.6458  246.599   5.4314  260.449   4.9184  567.578   6.2520  583.315   5.5088 -15.73682 8.332706 
1 1 1    2    5   15 o  1367.46   6.5030  1431.50   13.611  1431.66   19.245  1431.34   19.254  1367.35   9.1953  1367.20   9.2005 0.1516113 13.00782 
1 1 1    2    5   16 o  836.695   4.9986  535.860   6.4015  546.578   8.5970  522.522   9.5906  844.962   6.6472  826.119   7.5846 18.84259 10.08523 
1 1 1    2    5   17 o  714.730   4.3475  391.012   4.7561  393.259   6.7680  388.820   6.6850  716.725   6.1693  712.670   6.1283 4.054932 8.695798 
1 1 1    2    5   18 o  241.868   4.3887   44.779   1.6248   45.124   2.3070   44.439   2.2886  242.778   6.2083  240.927   6.2060 1.851059 8.778240 
1 1 1    2    5   19 o  791.664   4.6418  479.745   5.6246  472.826   7.8575  487.016   8.0550  785.856   6.5324  797.557   6.5984 -11.70135 9.284948 
1 1 1    2    5   20 o  701.956   4.7317  377.185   5.0838  374.380   7.6926  379.359   6.7740  699.243   7.1875  703.918   6.2871 -4.675171 9.549232 
1 1 1    2    5   21 o  801.240   5.9501  491.485   7.2972  496.449   9.4826  484.276   11.427  805.186   7.6941  795.144   9.3887 10.04181 12.13869 
1 1 1    2    5   22 o  328.115   4.5069   82.408   2.2635   82.802   3.2389   82.032   3.1645  328.868   6.4343  327.338   6.3160 1.530731 9.016221 
1 1 1    2    5   23 o  665.491   4.8608  339.006   4.9513  338.365   7.6414  339.470   6.5005  664.774   7.5098  665.900   6.3778 -1.126221 9.852590 
1 1 1    2    5   24 o  925.355   5.2172  655.452   7.3896  663.237   10.597  648.084   10.309  930.741   7.4388  920.053   7.3207 10.68762 10.43683 
1 1 1    2    5   25 o  242.516   5.5207   45.020   2.0493   45.849   2.9386   44.235   2.8592  244.714   7.8454  240.370   7.7714 4.344421 11.04290 
1 1 1    2    5   26 o  1175.42   6.4729  1057.62   11.646  1039.52   15.163  1083.65   18.183  1165.21   8.5020  1189.60   9.9863 -24.38464 13.11526 
1 1 1    2    5   27 o  522.901   5.3843  209.289   4.3094  195.792   7.2151  216.774   5.3731  505.681   9.3217  532.149   6.5966 -26.46851 11.41965 
1 1 1    2    5   28 o  1041.70   5.7304  830.612   9.1368  818.818   12.771  842.978   13.077  1034.19   8.0681  1049.33   8.1418 -15.14319 11.46221 
1 1 1    2    5   29 f  288.509   6.5435   63.717   2.8896   63.425   3.7327   64.155   4.5649  287.824   8.4727  289.450   10.304 -1.625214 13.33976 
1 1 1    2    5   30 o  256.795   6.9228   50.481   2.7211   53.177   3.8191   47.702   3.8779  263.533   9.4680  249.588   10.151 13.94516 13.88104 
1 1 1    2    5   31 o  371.625   5.7909  105.715   3.2940  101.763   4.6047  109.855   4.7139  364.577   8.2517  378.797   8.1303 -14.21970 11.58415 
1 1 1    2    5   32 o  1608.92   7.7899  1981.89   19.184  1973.67   27.016  1990.24   27.246  1605.28   10.995  1612.00   11.042 -6.721924 15.58295 
1 1 1    2    5   33 o  695.836   5.7794  370.641   6.1554  370.715   9.1638  370.580   8.3090  695.808   8.6043  695.713   7.8027 0.9527588E-01 11.61540 
1 1 1    2    5   34 o  696.866   7.0364  371.790   7.5053  374.651   8.3228  359.334   17.365  699.514   7.7733  684.519   16.574 14.99414 18.30620 
1 1 1    2    5   35 o  655.348   6.7630  328.809   6.7839  325.064   9.5602  332.608   9.6280  651.483   9.5873  659.002   9.5451 -7.518860 13.52867 
1 1 1    2    5   36 o  814.254   6.2774  507.587   7.8236  520.514   12.268  498.726   10.157  824.357   9.7226  807.015   8.2228 17.34222 12.73357 
1 1 1    2    5   37 o  380.833   7.2140  111.052   4.2051  111.992   5.8847  110.071   6.0113  382.350   10.055  379.046   10.361 3.304108 14.43812 
1 1 1    2    5   38 o  641.842   5.9960  315.402   5.8906  323.152   8.4051  307.920   8.2580  649.555   8.4539  634.059   8.5089 15.49591 11.99456 
1 1 1    2    5   39 o  260.073   11.439   51.848   4.5537   48.922   6.9423   54.057   6.0327  251.676   18.143  264.989   14.934 -13.31247 23.49932 
1 1 1    2    5   40 o  570.098   6.6658  248.894   5.8167  243.794   8.7765  252.889   7.7676  563.989   10.167  574.517   8.8331 -10.52838 13.46799 
1 1 1    2    5   41 o  555.809   6.9181  236.613   5.8855  233.422   7.6094  241.365   9.2852  551.894   9.0079  561.037   10.813 -9.143066 14.07318 
1 1 1    2    5   42 o  211.067   11.772   34.292   3.7881   31.844   5.3092   36.830   5.4064  202.671   17.280  218.208   16.305 -15.53773 23.75778 
1 1 1    2    5   43 o   58.374   23.998   0.8561   3.4456  -7.0575   4.8155   9.1585   4.9323   47.345   22.755  106.691   29.305 -59.34524 37.10230 
1 1 1    2    5   44 o  639.916   6.6222  313.744   6.4863  333.669   10.275  300.545   8.3631  659.417   10.181  626.052   8.7274 33.36560 13.40940 
1 1 1    2    5   45 o  212.133   12.741   34.726   4.1178   31.450   6.7406   36.676   5.2012  200.066   22.396  217.572   15.724 -17.50624 27.36461 
1 1 1    2    5   46 o  136.059   21.291   14.706   4.2887   18.503   6.0048   10.753   6.1274  151.605   26.860  115.052   33.049 36.55269 42.58755 
1 1 1    2    5   47 o  124.551   19.927   12.332   3.6709   14.602   5.7897   10.806   4.7470  133.622   29.130  115.028   27.360 18.59439 39.96404 
1 1 1    2    5   48 o  368.194   7.5677  103.997   4.2649  102.807   6.0907  105.141   5.9741  365.623   10.883  369.803   10.554 -4.179718 15.16046 
1 1 1    2    5   49 o  161.485   14.749   20.320   3.6052   13.988   5.3994   25.415   4.8430  130.562   27.867  180.080   17.804 -49.51735 33.06843 
1 1 1    2    5   50 o   71.359   26.220   3.3059   3.7586   8.3255   5.3535  -1.5736   5.2783  101.451   31.327   62.232   27.655 39.21926 41.78691 
1 1 1    2    5   51 o   46.992   22.118  -4.2223   4.0947   12.002   7.7295 -10.5519   4.8279  120.025   37.738   41.745   20.631 78.28072 43.00920 
1 1 1    2    5   52 o  392.409   8.3589  118.374   5.0206  119.151   6.5662  117.280   7.7901  393.080   10.913  389.341   13.072 3.738403 17.02882 
1 1 1    2    5   53 o  315.180   8.9642   76.444   4.3246   77.108   6.2186   75.822   6.0180  315.629   12.872  313.069   12.559 2.559448 17.98356 
1 1 1    2    5   54 o  340.393   8.4599   89.148   4.4077   90.459   6.2885   87.881   6.1798  341.966   12.014  337.070   11.978 4.896057 16.96510 
1 1 1    2    5   55 o  153.708   16.288   18.659   3.7737   19.393   5.3019   17.905   5.3725  154.418   23.145  147.700   24.632 6.717438 33.79931 
1 1 1    2    5   56 o  267.453   10.921   55.311   4.4707   55.848   6.5011   54.828   6.1580  266.744   15.997  264.579   15.271 2.164307 22.11554 
1 1 1    2    5   57 f  214.831   13.548   36.064   4.4322   37.087   5.6710   34.458   7.1046  216.501   17.257  206.099   22.909 10.40192 28.68113 
1 1 1    2    5   58 o  189.785   14.520   28.307   4.1860   23.274   5.8147   33.722   6.0312  168.569   23.147  205.213   19.433 -36.64406 30.22281 
1 1 1    2    5   59 o  179.494   16.231   25.566   4.4110   28.497   6.6454   23.258   5.8976  185.920   23.906  167.877   23.604 18.04259 33.59511 
1 1 1    2    5   60 o  274.455   11.094   58.526   4.6605   58.939   6.3268   58.037   6.8912  273.250   15.187  270.266   16.741 2.983826 22.60313 
1 1 1    2    5   61 o  104.364   29.101   9.6298   4.8236  -0.7045   6.5177   22.145   7.1725   68.878   30.662  158.159   30.736 -89.28103 43.41499 
1 1 1    2    5   62 o   58.482   25.673  -0.2239   4.4189 -11.3706   7.8027   5.0393   5.3616   56.758   27.672   81.930   31.068 -25.17131 41.60533 
1 1 1    2    5   63 o   81.217   27.160   5.6166   3.9686   6.2567   4.9928   4.5180   6.5404   85.829   30.389   82.541   33.389 3.288475 45.14738 
1 1 1    2    5   64 o   78.163   25.975   5.2739   3.6313   6.8337   5.0663   3.6260   5.2074   87.515   30.644   74.275   29.881 13.23991 42.80116 
1 1 1    2    5   65 o  151.559   20.949   19.571   4.7299   24.481   6.1435   12.424   7.4118  166.502   24.868  109.056   37.113 57.44539 44.67434 
1 1 1    2    5   66 o   86.957   25.530   6.9438   3.6210   5.4384   5.3470   8.2190   4.9213   79.910   30.846   92.352   30.217 -12.44205 43.18042 
1 1 1    2    6    1 o  1059.49   10.333  859.503   16.757  857.396   23.641  861.631   23.757  1057.94   14.599  1060.55   14.635 -2.607178 20.67151 
1 1 1    2    6    2 o  1018.81   10.032  794.735   15.644  789.538   21.972  800.079   22.280  1015.24   14.140  1021.99   14.243 -6.747864 20.06950 
1 1 1    2    6    3 o  797.044   6.9413  486.295   8.4682  486.770   10.392  485.356   14.610  797.390   8.5144  796.102   11.990 1.288269 14.70542 
1 1 1    2    6    4 o  475.409   5.4397  172.995   3.9583  174.917   4.8838  169.314   6.7579  478.027   6.6747  470.262   9.3886 7.764282 11.51945 
1 1 1    2    6    5 o  591.562   10.334  267.948   9.3574  267.948   9.3574   0.0000   0.0000  591.562   10.334  ?   ?  0.000000 10.33442 
1 1 1    2    6    6 o  363.514   5.2779  101.143   2.9367   97.316   5.0333  103.118   3.6159  356.523   9.2234  367.035   6.4364 -10.51181 11.24714 
1 1 1    2    6    7 o  811.070   6.1778  503.537   7.6694  518.930   11.143  489.681   10.572  823.299   8.8425  799.767   8.6360 23.53210 12.36008 
1 1 1    2    6    8 o  884.337   6.5587  598.633   8.8778  589.213   12.352  608.698   12.768  877.269   9.1991  891.650   9.3556 -14.38141 13.12060 
1 1 1    2    6    9 o  1510.70   9.8868  1747.39   22.861  1725.09   31.825  1771.17   32.862  1500.70   13.855  1520.58   14.119 -19.88416 19.78170 
1 1 1    2    6   10 o  1317.94   8.8502  1329.82   17.853  1346.96   25.617  1313.64   24.895  1326.14   12.620  1309.65   12.419 16.49048 17.70609 
1 1 1    2    6   11 o  108.287   7.0097   9.0140   1.1556   9.5503   1.4482   8.0738   1.9174  111.360   8.5618  101.902   12.559 9.457596 15.19949 
1 1 1    2    6   12 o  595.579   5.4968  271.512   5.0109  272.956   7.1853  270.146   6.9917  597.110   7.8618  594.033   7.6896 3.077026 10.99719 
1 1 1    2    6   13 o  1761.75   11.342  2377.11   30.583  2419.66   44.197  2338.01   42.364  1776.75   16.252  1746.58   15.847 30.16711 22.69872 
1 1 1    2    6   14 o  251.309   4.1218   48.339   1.5855   47.601   2.4234   48.892   2.0964  249.364   6.3493  252.731   5.4194 -3.367767 8.347713 
1 1 1    2    6   15 o  558.291   4.2005  238.569   3.5895  234.909   4.6818  243.789   5.5911  553.967   5.5215  564.318   6.4730 -10.35132 8.508016 
1 1 1    2    6   16 f  762.661   4.4560  445.214   5.2017  446.994   7.3866  443.463   7.3264  764.124   6.3156  761.102   6.2889 3.022644 8.912756 
1 1 1    2    6   17 o  196.429   4.6393   29.535   1.3948   29.401   1.9806   29.666   1.9646  195.966   6.6032  196.847   6.5206 -0.8809814 9.280119 
1 1 1    2    6   18 o  442.434   3.9286  149.830   2.6605  152.811   3.8072  146.984   3.7193  446.782   5.5672  438.182   5.5455 8.600403 7.857862 
1 1 1    2    6   19 o  508.102   4.0505  197.611   3.1501  195.959   4.4266  199.305   4.4839  505.934   5.7161  510.234   5.7413 -4.300629 8.101664 
1 1 1    2    6   20 o  558.297   4.8057  238.598   4.1067  247.297   5.8843  230.337   5.7341  568.322   6.7644  548.486   6.8301 19.83594 9.612907 
1 1 1    2    6   21 o  275.106   4.8469   57.934   2.0409   59.965   2.7566   55.469   3.0363  279.865   6.4352  269.152   7.3700 10.71243 9.784115 
1 1 1    2    6   22 o  588.084   4.6542  264.727   4.1894  269.587   6.5230  261.314   5.4657  593.383   7.1819  584.243   6.1120 9.140442 9.430589 
1 1 1    2    6   23 o  599.140   4.7602  274.771   4.3654  273.276   6.7132  275.866   5.7462  597.437   7.3412  600.295   6.2538 -2.857910 9.643830 
1 1 1    2    6   24 o  787.644   4.8633  474.864   5.8632  469.422   8.2293  480.475   8.3558  783.055   6.8659  792.220   6.8908 -9.164551 9.727503 
1 1 1    2    6   25 o  738.557   4.7869  417.511   5.4114  409.262   7.5502  426.225   7.7600  731.174   6.7463  746.172   6.7944 -14.99823 9.574768 
1 1 1    2    6   26 o  478.789   5.2944  175.467   3.8800  170.591   5.6578  179.796   5.3310  472.046   7.8306  484.628   7.1867 -12.58136 10.62863 
1 1 1    2    6   27 o  761.632   5.2562  444.010   6.1276  447.471   9.3763  441.431   8.0955  764.522   8.0125  759.375   6.9649 5.146790 10.61654 
1 1 1    2    6   28 f  298.381   6.2370   68.150   2.8485   66.094   3.7424   70.982   4.3918  293.822   8.3214  304.476   9.4236 -10.65375 12.57179 
1 1 1    2    6   29 o  955.600   5.9506  698.995   8.7038  690.770   11.365  710.663   13.536  949.896   7.8166  963.418   9.1793 -13.52130 12.05644 
1 1 1    2    6   30 o  503.411   5.1531  193.977   3.9706  196.053   5.6595  191.964   5.5721  506.060   7.3065  500.756   7.2698 5.304077 10.30703 
1 1 1    2    6   31 o  806.743   5.3646  498.180   6.6244  502.566   9.4607  493.961   9.2785  810.216   7.6288  803.252   7.5467 6.963684 10.73081 
1 1 1    2    6   32 f  543.296   5.8174  225.948   4.8377  223.060   6.2976  230.105   7.5561  539.770   7.6225  548.187   9.0053 -8.417053 11.79819 
1 1 1    2    6   33 o  554.732   7.1128  235.593   6.0394  237.535   7.4109  231.753   10.421  556.965   8.6930  549.994   12.379 6.971069 15.12623 
1 1 1    2    6   34 f  1006.68   6.8565  775.845   10.565  805.804   13.483  728.203   17.003  1025.82   8.5874  974.971   11.394 50.85291 14.26760 
1 1 1    2    6   35 o  787.925   6.2208  475.279   7.5024  478.030   11.499  473.239   9.8999  790.032   9.5090  786.138   8.2274 3.894653 12.57420 
1 1 1    2    6   36 o  735.892   5.7859  414.572   6.5171  400.394   8.9929  430.253   9.4578  723.093   8.1252  749.565   8.2435 -26.47119 11.57473 
1 1 1    2    6   37 o  457.353   6.5361  160.150   4.5755  160.390   6.4929  159.913   6.4488  457.597   9.2702  456.919   9.2209 0.6784058 13.07521 
1 1 1    2    6   38 o  156.214   15.512   18.909   3.6599   18.189   5.0113   19.732   5.3579  152.184   22.164  158.529   22.732 -6.345825 31.74882 
1 1 1    2    6   39 o  885.071   6.9936  599.885   9.4744  593.247   16.336  603.249   11.630  879.610   12.133  887.412   8.5623 -7.802063 14.85035 
1 1 1    2    6   40 o  283.185   9.4279   61.455   4.0865   66.705   5.6334   55.623   5.9370  294.888   12.481  268.785   14.484 26.10358 19.11974 
1 1 1    2    6   41 o  546.293   6.9037  228.587   5.7727  228.268   7.4754  229.056   9.0859  545.759   8.9488  546.520   10.862 -0.7612305 14.07320 
1 1 1    2    6   42 o  330.443   8.1597   83.679   4.1270   85.806   5.7083   81.348   5.9737  334.423   11.152  325.557   11.988 8.866119 16.37297 
1 1 1    2    6   43 o  158.511   15.766   19.527   3.7744   22.850   5.7981   17.084   4.9722  170.311   22.815  146.845   22.866 23.46581 32.30161 
1 1 1    2    6   44 o  413.874   7.5352  131.289   4.7734  127.672   7.3849  133.885   6.2560  407.684   11.835  417.731   9.7843 -10.04706 15.35543 
1 1 1    2    6   45 o  162.820   16.210   20.646   3.9862   20.458   5.4299   20.865   5.8706  160.753   22.699  161.965   24.441 -1.211548 33.35617 
1 1 1    2    6   46 o  206.436   11.472   32.858   3.6105   30.761   4.8768   35.402   5.3710  198.978   16.152  213.473   16.568 -14.49480 23.13798 
1 1 1    2    6   47 o  118.460   20.401   11.203   3.5656   8.7764   5.4845   12.979   4.6927  104.541   31.598  126.640   25.096 -22.09912 40.35192 
1 1 1    2    6   48 o  241.980   10.147   45.007   3.7583   45.592   5.3313   44.429   5.2989  242.596   14.422  239.453   14.526 3.143402 20.47000 
1 1 1    2    6   49 o  478.766   6.7582  175.802   4.9525  170.825   6.9684  180.882   7.0400  471.412   9.6574  485.128   9.4808 -13.71570 13.53334 
1 1 1    2    6   50 o  245.001   10.788   46.221   4.0456   42.365   5.3904   51.194   6.1217  233.388   15.172  256.518   15.667 -23.13004 21.80874 
1 1 1    2    6   51 o  264.075   11.386   53.780   4.6021   51.923   8.4596   54.560   5.4847  256.043   21.793  265.228   13.556 -9.184937 25.66498 
1 1 1    2    6   52 o   57.920   24.805   0.0686   3.9219   0.6788   5.1314  -0.7886   6.0819   67.728   28.666   68.852   30.175 -1.124039 41.62019 
1 1 1    2    6   53 o  206.647   11.780   33.100   3.7105   34.044   5.2424   32.153   5.2526  208.311   16.579  202.240   17.129 6.070679 23.83850 
1 1 1    2    6   54 o  232.377   11.093   41.709   3.9457   46.193   5.6138   37.332   5.5469  243.137   15.160  217.967   16.754 25.17024 22.59509 
1 1 1    2    6   55 o   85.022   25.518   5.9177   3.5862   5.8953   5.1420   5.9389   5.0042   87.979   30.868   87.841   30.473 0.1389694 43.37532 
1 1 1    2    6   56 o  303.131   9.6193   70.896   4.4632   70.850   6.5004   70.937   6.1389  301.644   14.079  302.116   13.275 -0.4723511 19.35088 
1 1 1    2    6   57 o  133.878   21.717   14.643   4.2978   16.433   5.4324   11.648   7.0265  140.115   26.296  115.476   35.928 24.63935 44.52311 
1 1 1    2    6   58 o  102.428   25.948   8.8954   4.0727  -0.0921   6.0065   16.544   5.5410   69.111   30.145  140.051   26.825 -70.94008 40.35252 
1 1 1    2    6   59 o  138.917   22.974   15.982   4.7142   18.180   7.8597   14.747   5.8917  141.461   36.161  130.053   30.180 11.40799 47.10037 
1 1 1    2    6   60 o  199.924   15.080   31.627   4.5806   32.347   7.5830   31.213   5.7478  196.227   25.878  196.554   19.356 -0.3270111 32.31662 
1 1 1    2    6   61 o   86.449   30.006   6.1955   4.8526  -0.5878   6.7908   13.273   6.9366   70.356   31.311  119.382   35.413 -49.02590 47.26992 
1 1 1    2    6   62 o   85.466   27.776   6.2666   4.1609  -2.6338   5.8399   15.444   5.9300   60.419   27.733  130.941   30.203 -70.52235 41.00431 
1 1 1    2    6   63 o  101.155   26.025   9.0724   4.0527   6.6972   5.1127   13.088   6.6474   87.875   30.783  116.711   34.678 -28.83651 46.36942 
1 1 1    2    6   64 o  139.805   17.529   16.093   3.6686   18.130   5.1626   14.015   5.2141  144.195   24.252  123.791   28.154 20.40462 37.15923 
1 1 1    2    6   65 o   88.471   25.088   7.0885   3.5538   2.1871   4.9587   12.265   5.0957   67.325   28.320  113.917   29.115 -46.59126 40.61642 
1 1 1    2    7    1 o  218.287   8.7491   36.479   2.9232   0.0000   0.0000   36.479   2.9232  ?   ?   218.287   8.7491 0.000000 8.749088 
1 1 1    2    7    2 f  346.125   6.2472   91.703   3.3097   86.643   4.6011   97.128   4.7644  336.410   8.9356  356.186   8.7390 -19.77582 12.49855 
1 1 1    2    7    3 o  786.115   8.5186  473.102   10.250  461.544   14.236  485.544   14.771  776.329   11.980  796.251   12.119 -19.92206 17.04119 
1 1 1    2    7    4 o  1025.60   8.3280  805.260   13.073  793.209   22.311  811.562   16.133  1017.59   14.324  1029.53   10.238 -11.93939 17.60704 
1 1 1    2    7    5 o  174.852   5.0664   23.401   1.3559   22.662   1.8994   24.168   1.9362  172.060   7.2123  177.685   7.1193 -5.625336 10.13415 
1 1 1    2    7    6 o  567.964   5.1673  246.907   4.4921  244.842   6.3091  249.030   6.3975  565.550   7.2883  570.366   7.3281 -4.815674 10.33537 
1 1 1    2    7    7 o  347.400   4.7005   92.373   2.4994   94.481   3.5776   90.362   3.4934  351.325   6.6529  343.582   6.6428 7.742615 9.401446 
1 1 1    2    7    8 o  1019.71   7.2537  795.977   11.322  810.441   16.324  782.571   15.715  1028.80   10.366  1010.97   10.156 17.83429 14.51221 
1 1 1    2    7    9 o  713.670   5.8661  389.859   6.4080  391.804   9.1036  387.948   9.0214  715.387   8.3138  711.860   8.2797 3.527588 11.73337 
1 1 1    2    7   10 o  836.560   6.4397  535.705   8.2458  537.175   11.700  534.254   11.623  837.618   9.1262  835.339   9.0901 2.279236 12.88084 
1 1 1    2    7   11 o  1113.61   9.0502  949.515   15.426  935.888   26.236  956.715   19.072  1105.12   15.510  1117.70   11.148 -12.57837 19.10084 
1 1 1    2    7   12 o  366.187   7.2098  102.654   4.0411  105.127   5.8675  100.422   5.5736  370.514   10.346  362.132   10.055 8.381317 14.42762 
1 1 1    2    7   13 o  539.822   4.8571  223.051   4.0133  224.027   5.1431  221.532   6.4174  540.976   6.2113  537.919   7.7942 3.057556 9.966387 
1 1 1    2    7   14 o  855.560   5.9509  560.333   7.7929  562.407   10.056  557.214   12.330  857.074   7.6655  853.019   9.4435 4.055176 12.16305 
1 1 1    2    7   15 o  527.543   4.5108  213.021   3.6423  216.782   5.2110  209.428   5.0931  532.139   6.3977  523.036   6.3618 9.102661 9.022360 
1 1 1    2    7   16 o  1534.38   8.3007  1802.84   19.495  1802.53   27.532  1803.16   27.607  1533.79   11.728  1534.06   11.757 -0.2668457 16.60636 
1 1 1    2    7   17 o  204.181   4.9495   31.913   1.5469   27.942   2.3701   34.860   2.0416  191.019   8.1063  213.386   6.2509 -22.36681 10.23651 
1 1 1    2    7   18 o   87.236   8.5236   5.8838   1.1236   4.9109   1.6186   6.7885   1.5609   78.872   13.916   93.468   11.129 -14.59571 17.81922 
1 1 1    2    7   19 o  1157.44   6.2307  1025.64   11.038  1039.83   17.039  1015.39   14.490  1165.12   9.5542  1151.48   8.2215 13.64307 12.60464 
1 1 1    2    7   20 o  689.907   5.5618  364.374   5.8732  366.228   7.5845  361.597   9.2823  691.594   7.1648  687.123   8.8258 4.471802 11.36790 
1 1 1    2    7   21 o  583.756   4.2777  260.839   3.8222  259.618   5.3948  262.069   5.4160  582.342   6.0524  585.086   6.0477 -2.743530 8.556013 
1 1 1    2    7   22 o  616.971   4.7189  291.371   4.4563  290.260   6.8443  292.188   5.8714  615.719   7.2623  617.795   6.2091 -2.076721 9.554805 
1 1 1    2    7   23 f  484.564   4.3169  179.721   3.2018  177.841   4.5192  181.617   4.5368  481.990   6.1257  487.081   6.0853 -5.090942 8.634484 
1 1 1    2    7   24 o  1159.87   5.9611  1029.80   10.583  1025.07   14.901  1034.61   15.033  1157.07   8.4134  1162.44   8.4492 -5.368286 11.92372 
1 1 1    2    7   25 o  392.800   4.8225  118.097   2.8994  118.460   3.9343  117.667   4.2895  393.380   6.5342  392.052   7.1481 1.327911 9.684587 
1 1 1    2    7   26 o  205.364   7.3866   32.286   2.3219   36.873   4.0671   30.069   2.8280  219.074   12.177  198.169   9.3235 20.90454 15.33656 
1 1 1    2    7   27 o  1468.68   7.1479  1651.22   16.068  1645.81   22.648  1656.71   22.802  1466.07   10.092  1470.92   10.128 -4.841187 14.29780 
1 1 1    2    7   28 o  239.355   6.8782   43.856   2.5199   45.789   3.2390   40.893   4.0108  244.554   8.6530  231.079   11.340 13.47548 14.26403 
1 1 1    2    7   29 o  960.485   5.5838  706.146   8.2090  693.811   11.444  719.218   11.782  951.981   7.8540  969.252   7.9414 -17.27020 11.16916 
1 1 1    2    7   30 o  896.553   5.4940  615.272   7.5393  611.810   10.579  618.846   10.748  893.951   7.7314  899.073   7.8099 -5.122253 10.98948 
1 1 1    2    7   31 f  401.539   6.1691  123.424   3.7916  122.590   4.9331  124.626   5.9268  400.148   8.0543  403.423   9.5983 -3.274109 12.52991 
1 1 1    2    7   32 o   69.261   22.847   3.5059   2.8113   7.6189   3.6960  -2.1405   4.3306   97.696   24.702   54.892   24.673 42.80421 34.91341 
1 1 1    2    7   33 o  845.510   6.5211  547.282   8.4394  554.179   10.475  534.526   14.246  850.753   8.0445  835.352   11.142 15.40057 13.74229 
1 1 1    2    7   34 f  572.672   5.6829  251.051   4.9814  258.814   7.0909  243.486   6.9994  581.388   7.9683  563.904   8.1094 17.48358 11.36906 
1 1 1    2    7   35 o  893.958   6.3430  611.819   8.6793  611.357   13.433  612.150   11.372  893.407   9.8229  894.091   8.3096 -0.6840210 12.86621 
1 1 1    2    7   36 o  1506.66   7.5982  1738.21   17.523  1743.54   24.871  1732.95   24.692  1508.56   10.771  1503.98   10.726 4.583862 15.20070 
1 1 1    2    7   37 o  1030.32   6.2565  812.754   9.8668  828.018   14.174  798.405   13.743  1039.74   8.9065  1020.98   8.7942 18.75165 12.51657 
1 1 1    2    7   38 o  740.808   6.8115  420.228   7.7235  434.846   11.539  408.361   10.396  753.349   10.007  730.104   9.3028 23.24524 13.66285 
1 1 1    2    7   39 o  274.478   10.469   57.742   4.3983   55.921   7.8399   58.578   5.3132  268.982   19.168  276.370   12.560 -7.387573 22.91619 
1 1 1    2    7   40 o  668.238   6.0655  341.941   6.2039  353.704   8.9527  331.074   8.6049  679.436   8.6087  657.348   8.5523 22.08868 12.13467 
1 1 1    2    7   41 f  690.917   7.2271  365.681   7.6429  355.452   10.629  376.631   10.998  680.866   10.199  700.849   10.252 -19.98340 14.46117 
1 1 1    2    7   42 o  380.260   8.0086  110.811   4.6613  122.705   7.5372  103.445   5.9317  399.780   12.317  367.223   10.553 32.55792 16.21994 
1 1 1    2    7   43 o  214.399   10.947   35.371   3.5803   29.451   5.0424   41.391   5.0845  194.757   17.088  231.540   14.418 -36.78352 22.35804 
1 1 1    2    7   44 o  121.306   18.320   11.613   3.2956   10.063   4.8210   12.973   4.5153  111.338   28.245  127.180   24.077 -15.84280 37.11463 
1 1 1    2    7   45 o   94.201   24.685   7.1697   3.6022   7.9331   4.4341   5.6881   6.1773   99.251   27.982   92.554   33.673 6.696838 43.78176 
1 1 1    2    7   46 o  465.114   6.8086  165.826   4.8472  166.460   6.6119  165.089   7.1269  465.684   9.2761  463.645   10.043 2.039673 13.67107 
1 1 1    2    7   47 o  215.670   11.578   35.884   3.8081   40.425   5.9643   32.758   4.9479  227.897   17.225  205.296   15.869 22.60083 23.42108 
1 1 1    2    7   48 o  168.098   13.080   21.914   3.3389   17.570   4.6920   26.371   4.7525  148.673   21.221  183.705   17.098 -35.03258 27.25185 
1 1 1    2    7   49 o  126.060   17.959   12.587   3.3673   21.329   4.8302   4.3224   4.6966  164.322   19.591   80.420   29.345 83.90192 35.28380 
1 1 1    2    7   50 o   67.883   26.522   2.3546   3.9902   5.3567   6.5100   0.5480   5.0500   91.192   34.314   67.109   28.423 24.08254 44.55660 
1 1 1    2    7   51 o  188.179   12.866   27.496   3.6836   23.119   5.3568   31.422   5.0734  170.371   20.986  200.283   16.702 -29.91193 26.82067 
1 1 1    2    7   52 o  153.415   17.496   18.596   4.0351   19.667   5.2725   17.083   6.2688  156.225   22.715  143.027   29.610 13.19803 37.31910 
1 1 1    2    7   53 o   40.590   19.363  -4.2566   3.3477  -6.8345   4.8809  -1.9667   4.6002   47.565   22.873   56.201   25.330 -8.635864 34.12864 
1 1 1    2    7   54 o  345.336   8.2091   91.738   4.3392   93.025   6.1559   90.466   6.1173  346.871   11.595  342.040   11.685 4.831604 16.46097 
1 1 1    2    7   55 o  159.299   15.436   19.975   3.7165   23.348   5.2645   16.625   5.2473  170.614   20.574  141.959   25.066 28.65492 32.42830 
1 1 1    2    7   56 o  265.219   10.617   54.375   4.3099   54.066   6.3400   54.641   5.8765  262.413   15.859  264.324   14.581 -1.910645 21.54364 
1 1 1    2    7   57 o  176.580   15.977   24.632   4.2715   18.391   5.3405   35.714   7.1166  149.285   24.200  209.954   22.496 -60.66937 33.04103 
1 1 1    2    7   58 o  183.594   18.147   26.910   5.0328   19.163   10.580   29.176   5.7216  142.127   44.065  190.450   19.922 -48.32274 48.35967 
1 1 1    2    7   59 o  159.947   18.701   20.604   4.4920   25.916   7.5896   17.740   5.5728  173.753   29.599  144.954   26.076 28.79904 39.44687 
1 1 1    2    7   60 o  100.431   24.498   8.6141   3.7322   13.970   5.2294   3.0541   5.3283  126.971   27.688   75.009   30.209 51.96204 40.97792 
1 1 1    2    7   61 f   81.547   27.560   5.5011   4.0869   1.2463   6.8069   7.8994   5.1105   74.960   32.396   94.981   30.777 -20.02090 44.68415 
1 1 1    2    7   62 o  103.718   24.534   9.3265   3.8338   9.8791   5.6421   8.8525   5.2255  104.001   32.168   99.156   31.005 4.845085 44.67759 
1 1 1    2    7   63 o  218.796   13.836   38.041   4.6099   37.727   5.5367   38.750   8.3233  215.966   16.884  211.153   26.325 4.812469 31.27388 
1 1 1    2    7   64 o  110.156   23.350   10.635   3.8147   10.915   5.0898   10.275   5.7621  107.750   29.840  103.190   32.601 4.559410 44.19537 
1 1 1    2    7   65 o   55.330   23.478   0.9327   3.4561   7.4506   4.9206  -5.4140   4.8555   89.116   30.240   47.669   22.894 41.44754 37.92875 
1 1 1    2    8    1 o  1024.32   14.419  803.750   22.608   0.0000   0.0000  803.750   22.608  ?   ?   1024.32   14.419 0.000000 14.41943 
1 1 1    2    8    2 o  1767.80   15.975  2394.45   43.227  2376.43   60.598  2413.13   61.680  1760.14   22.493  1773.64   22.720 -13.49988 31.97072 
1 1 1    2    8    3 o  717.674   6.6488  394.259   7.3037  404.849   9.1627  375.805   12.095  727.210   8.2318  700.546   11.280 26.66461 13.96443 
1 1 1    2    8    4 o  369.166   4.6417  104.310   2.6228  103.860   3.7018  104.763   3.7167  368.352   6.5656  369.950   6.5637 -1.598236 9.283851 
1 1 1    2    8    5 o  937.425   6.8163  672.676   9.7803  686.409   14.112  659.982   13.567  946.841   9.7374  928.444   9.5468 18.39789 13.63668 
1 1 1    2    8    6 o  220.726   4.9667   37.291   1.6780   37.187   2.3675   37.395   2.3786  220.407   7.0177  221.023   7.0311 -0.6156769 9.933994 
1 1 1    2    8    7 f  2233.66   14.016  3821.97   47.918  3827.22   67.878  3816.75   67.654  2234.13   19.850  2231.08   19.811 3.049805 28.04453 
1 1 1    2    8    8 o  1178.08   8.0957  1062.51   14.598  1070.44   20.815  1054.84   20.479  1182.27   11.502  1173.63   11.400 8.638672 16.19461 
1 1 1    2    8    9 o  651.380   5.6539  324.774   5.6370  317.137   7.8346  332.971   8.1168  643.624   7.9527  659.492   8.0409 -15.86853 11.30937 
1 1 1    2    8   10 f  1008.52   10.253  778.864   15.827  770.997   22.198  786.997   22.571  1003.13   14.457  1013.48   14.550 -10.34747 20.51161 
1 1 1    2    8   11 o  400.528   5.9011  122.799   3.6177  121.318   4.4608  125.645   6.1836  398.083   7.3210  405.066   9.9734 -6.982544 12.37200 
1 1 1    2    8   12 o  1223.72   8.4235  1146.57   15.778  1160.51   22.635  1133.41   22.005  1230.85   12.015  1216.42   11.818 14.43872 16.85305 
1 1 1    2    8   13 o  1203.20   8.3502  1108.47   15.378  1093.95   21.413  1123.93   22.100  1195.02   11.707  1211.26   11.920 -16.24268 16.70719 
1 1 1    2    8   14 o  488.046   4.8505  182.322   3.6234  184.035   4.6618  179.708   5.7589  490.306   6.2118  484.467   7.7661 5.838501 9.944766 
1 1 1    2    8   15 o  595.168   4.6795  271.143   4.2629  266.497   5.9129  276.172   6.1516  589.994   6.5476  600.604   6.6916 -10.60925 9.362102 
1 1 1    2    8   16 o  615.718   5.2832  290.210   4.9791  293.804   6.4262  284.812   7.8761  619.469   6.7774  609.846   8.4376 9.622803 10.82248 
1 1 1    2    8   17 o  271.583   6.4122   56.470   2.6655   56.783   3.8147   56.171   3.7261  272.281   9.1531  270.813   8.9890 1.468079 12.82895 
1 1 1    2    8   18 o  453.243   4.6805  157.251   3.2471  155.394   4.5745  159.136   4.6098  450.511   6.6339  455.904   6.6060 -5.392700 9.362050 
1 1 1    2    8   19 o  1350.93   9.2570  1397.82   19.141  1390.46   26.890  1405.38   27.253  1346.83   13.044  1354.02   13.150 -7.189575 18.52210 
1 1 1    2    8   20 o  980.294   5.6420  735.655   8.4656  731.104   12.889  739.107   11.227  977.074   8.6182  982.487   7.4655 -5.413574 11.40210 
1 1 1    2    8   21 o  697.729   4.8431  372.646   5.1723  377.188   8.0270  369.422   6.7636  701.875   7.4717  694.656   6.3612 7.219116 9.812849 
1 1 1    2    8   22 o  1424.74   7.3538  1554.11   16.037  1544.07   24.363  1561.79   21.303  1419.76   11.211  1428.04   9.7462 -8.284668 14.85501 
1 1 1    2    8   23 o  340.087   4.5441   88.527   2.3654   87.949   3.3580   89.098   3.3326  338.950   6.4725  341.158   6.3820 -2.207977 9.089735 
1 1 1    2    8   24 o  1032.99   5.5596  816.799   8.7905  824.411   12.548  809.464   12.318  1037.70   7.9003  1028.25   7.8266 9.446655 11.12075 
1 1 1    2    8   25 o  1727.79   10.194  2285.95   26.959  2219.80   41.185  2335.54   35.661  1701.93   15.810  1746.07   13.343 -44.14709 20.68799 
1 1 1    2    8   26 o  877.854   5.9633  589.881   8.0127  592.746   13.896  588.454   9.8073  879.821   10.319  876.751   7.3081 3.070435 12.64451 
1 1 1    2    8   27 o  375.080   4.9824  107.682   2.8604  104.753   4.0312  110.652   4.0595  369.920   7.1196  380.194   6.9758 -10.27390 9.967487 
1 1 1    2    8   28 f  452.350   5.3794  156.623   3.7246  159.235   4.8652  152.924   5.7891  456.083   6.9693  446.926   8.4627 9.157684 10.96303 
1 1 1    2    8   29 o  1156.79   6.6067  1024.36   11.698  1033.53   15.586  1012.53   17.702  1161.85   8.7643  1149.91   10.058 11.94324 13.34046 
1 1 1    2    8   30 o  404.722   5.8893  125.384   3.6483  124.369   4.7195  126.892   5.7511  403.052   7.6500  407.086   9.2298 -4.034546 11.98798 
1 1 1    2    8   31 o  1006.89   5.8200  776.066   8.9696  771.939   12.563  780.358   12.811  1004.10   8.1740  1009.56   8.2904 -5.454224 11.64236 
1 1 1    2    8   32 o  987.215   6.7513  746.105   10.202  739.794   14.129  752.979   14.745  982.886   9.3914  991.585   9.7153 -8.698425 13.51246 
1 1 1    2    8   33 o  962.393   6.7909  709.078   10.003  720.309   12.371  687.860   17.004  969.901   8.3329  947.563   11.724 22.33765 14.38352 
1 1 1    2    8   34 o  386.397   6.4358  114.301   3.8063  112.718   5.4010  115.864   5.3651  383.644   9.1976  388.966   9.0115 -5.321198 12.87649 
1 1 1    2    8   35 o  605.019   6.2776  280.239   5.8135  284.958   9.0959  276.979   7.5588  609.944   9.7429  601.416   8.2112 8.527649 12.74159 
1 1 1    2    8   36 f  367.237   7.0422  103.262   3.9584  109.122   5.6195   97.490   5.5769  377.432   9.7272  356.732   10.214 20.70074 14.10457 
1 1 1    2    8   37 o  638.081   6.2004  311.724   6.0557  308.140   8.1075  316.247   9.1077  634.296   8.3507  642.531   9.2607 -8.234924 12.46978 
1 1 1    2    8   38 o  603.191   7.3669  278.635   6.8016  254.020   10.679  295.438   8.8227  575.607   12.121  620.991   9.2821 -45.38458 15.26649 
1 1 1    2    8   39 o  524.108   6.2922  210.341   5.0477  205.325   7.1577  215.303   7.1194  517.668   9.0334  530.114   8.7742 -12.44623 12.59322 
1 1 1    2    8   40 o  184.139   15.313   26.228   4.2769   28.103   6.1175   24.435   5.9818  189.727   21.442  176.529   22.662 13.19843 31.19769 
1 1 1    2    8   41 o  973.676   6.7540  726.182   10.066  731.925   15.751  722.218   13.087  976.911   10.533  970.719   8.8080 6.191772 13.73076 
1 1 1    2    8   42 o  494.166   6.4363  187.060   4.8683  190.797   6.8790  183.310   6.8906  498.861   9.0090  488.957   9.2069 9.904510 12.88139 
1 1 1    2    8   43 o  297.123   8.1639   67.676   3.7128   68.992   5.2678   66.377   5.2337  299.754   11.481  294.006   11.630 5.747833 16.34275 
1 1 1    2    8   44 o  187.053   11.920   26.993   3.3951   27.244   5.0160   26.781   4.6122  187.026   17.734  185.649   16.400 1.376907 24.15456 
1 1 1    2    8   45 f  115.195   21.128   10.611   3.5880   12.102   4.4521   7.8493   6.0605  122.489   24.601  101.453   33.549 21.03546 41.60185 
1 1 1    2    8   46 o  247.104   9.4590   46.880   3.5776   45.641   5.0444   48.133   5.0748  243.032   13.615  249.646   13.329 -6.613983 19.05367 
1 1 1    2    8   47 o  488.128   7.0930  182.717   5.2995  192.063   8.5369  176.857   6.7597  499.718   11.161  479.908   9.2023 19.81024 14.46558 
1 1 1    2    8   48 o  161.840   13.489   20.344   3.3111   21.292   4.5982   19.324   4.7718  164.538   18.584  156.197   20.450 8.341278 27.63270 
1 1 1    2    8   49 o  370.635   7.7898  105.450   4.4192  103.365   6.0340  107.864   6.4902  366.448   10.758  374.221   11.331 -7.772552 15.62430 
1 1 1    2    8   50 o  182.652   14.590   25.995   4.0451   26.563   7.4120   25.753   4.8273  180.664   27.686  181.059   17.643 -0.3952942 32.82976 
1 1 1    2    8   51 o  289.888   8.7971   64.622   3.9034   66.807   5.5300   62.453   5.5104  294.081   12.285  284.253   12.665 9.828156 17.64477 
1 1 1    2    8   52 o  201.012   13.003   31.397   3.9792   30.768   5.0103   32.471   6.5484  198.016   16.686  201.855   21.527 -3.839645 27.23657 
1 1 1    2    8   53 o  253.701   9.9244   49.609   3.8539   52.542   5.5679   46.911   5.3396  259.810   14.053  245.385   14.278 14.42575 20.03414 
1 1 1    2    8   54 o  280.353   9.6317   60.585   4.1331   67.393   6.3106   55.471   5.4695  294.518   13.999  267.378   13.364 27.13992 19.35383 
1 1 1    2    8   55 o  357.554   8.7955   98.475   4.8136   90.869   7.5103  103.778   6.2710  341.643   14.362  366.329   11.184 -24.68649 18.20297 
1 1 1    2    8   56 o  177.788   17.560   25.086   4.7162   14.820   7.4726   31.882   6.0801  129.404   36.270  199.549   20.184 -70.14462 41.50774 
1 1 1    2    8   57 o  224.762   13.949   39.539   4.7752   35.894   7.5763   41.942   6.1507  209.590   24.052  230.032   17.603 -20.44153 29.80528 
1 1 1    2    8   58 o   93.841   27.005   7.4638   4.0880   13.061   6.3210   3.4395   5.3597  121.560   33.086   77.357   30.580 44.20325 45.05406 
1 1 1    2    8   59 o  117.340   21.713   11.417   3.7561   14.993   5.3388   7.9120   5.2855  132.335   27.265   96.328   31.305 36.00635 41.51366 
1 1 1    2    8   60 o   41.151   19.845  -5.2950   3.7374  -4.6384   5.1015  -6.0557   5.4909   52.255   24.623   52.081   24.832 0.1739655 34.97003 
1 1 1    2    8   61 o   87.016   28.056   6.4837   4.2509   4.5092   7.9037   7.2873   5.0422   87.670   36.227   91.805   30.613 -4.134697 47.42898 
1 1 1    2    8   62 o   62.440   25.127   2.0224   3.6835   1.6511   5.1896   2.3993   5.2290   68.450   28.892   71.155   29.439 -2.705009 41.24810 
1 1 1    2    8   63 o   80.501   26.948   5.5763   3.9070   4.6577   4.9423   7.1068   6.3795   78.041   29.772   90.688   33.999 -12.64768 45.19193 
1 1 1    2    8   64 o  180.516   14.673   26.232   4.0192   26.510   5.4566   25.903   5.9425  177.489   20.460  173.481   22.942 4.007263 30.74008 
1 1 1    2    8   65 o   63.748   25.139   2.7111   3.6139   3.7043   4.8401   1.4598   5.4327   72.226   28.896   66.720   28.888 5.505928 40.85921 
1 1 1    2    9    1 o  698.161   11.436  373.264   12.220   0.0000   0.0000  373.264   12.220  ?   ?   698.161   11.436 0.000000 11.43563 
1 1 1    2    9    2 o  1628.21   14.899  2031.02   37.131  2032.90   52.578  2029.14   52.445  1628.11   21.098  1626.61   21.064 1.502808 29.81367 
1 1 1    2    9    3 o  689.917   6.6029  364.354   6.9727  370.300   8.6749  353.499   11.720  695.487   8.1490  679.428   11.270 16.05853 13.90739 
1 1 1    2    9    4 o  256.207   4.8548   50.243   1.9039   51.147   2.7257   49.381   2.6604  258.489   6.8892  253.986   6.8433 4.502930 9.710382 
1 1 1    2    9    5 o  884.131   6.6013  598.365   8.9334  600.623   12.680  596.138   12.588  885.702   9.3534  882.391   9.3201 3.311707 13.20413 
1 1 1    2    9    6 o  1035.75   7.3510  821.231   11.654  818.008   16.423  824.501   16.540  1033.57   10.381  1037.66   10.414 -4.091919 14.70417 
1 1 1    2    9    7 o  1709.37   12.729  2238.08   33.304  2298.31   59.566  2210.70   40.169  1730.66   22.486  1698.54   15.451 32.12720 27.28306 
1 1 1    2    9    8 o  1160.47   9.2628  1031.12   16.453  1036.22   28.620  1028.61   20.108  1162.79   16.080  1158.92   11.336 3.868042 19.67411 
1 1 1    2    9    9 o  484.821   5.9975  179.925   4.4506  183.739   5.5675  173.173   7.4078  489.905   7.4247  475.546   10.177 14.35971 12.59758 
1 1 1    2    9   10 f  162.701   6.4583   20.264   1.6083   20.134   2.2307   20.405   2.3211  161.904   9.0376  162.977   9.3435 -1.072891 12.99914 
1 1 1    2    9   11 o  899.464   6.7989  619.353   9.3603  614.528   13.138  624.326   13.339  895.821   9.5818  902.930   9.6516 -7.109009 13.60016 
1 1 1    2    9   12 f  180.122   6.5814   24.837   1.8145   22.540   2.5171   27.323   2.6181  171.288   9.6397  188.894   9.0551 -17.60596 13.22565 
1 1 1    2    9   13 o  1164.10   8.1683  1037.63   14.554  1058.87   21.058  1018.20   20.139  1175.64   11.702  1152.87   11.413 22.76758 16.34583 
1 1 1    2    9   14 o  399.705   5.5181  122.302   3.3760  123.174   4.8215  121.463   4.7286  401.075   7.8540  398.281   7.7567 2.793945 11.03859 
1 1 1    2    9   15 o  940.636   7.1663  677.460   10.318  669.143   14.416  686.194   14.773  934.634   10.077  946.456   10.198 -11.82257 14.33688 
1 1 1    2    9   16 f  911.714   6.2865  636.384   8.7728  628.291   11.175  649.378   14.161  905.791   8.0605  920.709   10.049 -14.91852 12.88219 
1 1 1    2    9   17 o  609.678   4.8451  284.536   4.5214  285.740   6.3899  283.329   6.3986  610.899   6.8336  608.315   6.8721 2.584290 9.691434 
1 1 1    2    9   18 o   83.262   16.572   5.5070   2.0378   4.4842   2.2902   9.3946   4.4651   75.055   19.690  108.317   27.021 -33.26250 33.43392 
1 1 1    2    9   19 o  601.488   4.9427  276.941   4.5505  280.253   6.4973  273.753   6.3752  605.007   7.0162  597.951   6.9656 7.055725 9.886697 
1 1 1    2    9   20 o  973.172   6.0957  725.023   9.0800  732.614   12.947  717.677   12.737  978.101   8.6483  968.082   8.5960 10.01904 12.19359 
1 1 1    2    9   21 o  474.444   5.5470  172.310   4.0282  158.524   6.2727  181.985   5.2550  454.984   9.0072  487.549   7.0418 -32.56454 11.43313 
1 1 1    2    9   22 o  628.704   4.7708  302.551   4.5910  298.673   7.0202  305.448   6.0685  624.597   7.3431  631.672   6.2766 -7.074951 9.660048 
1 1 1    2    9   23 o  538.776   4.7069  222.185   3.8816  217.529   5.9475  225.639   5.1231  533.051   7.2895  542.922   6.1649 -9.870911 9.546875 
1 1 1    2    9   24 o  899.532   5.4772  619.362   7.5413  604.005   9.8279  641.354   11.761  888.254   7.2286  915.260   8.3949 -27.00519 11.07817 
1 1 1    2    9   25 f  507.998   5.1655  197.526   4.0164  195.870   6.8752  198.384   4.9487  505.795   8.8806  509.082   6.3508 -3.286652 10.91782 
1 1 1    2    9   26 o  290.579   5.2975   64.630   2.3561   64.662   3.3852   64.600   3.2814  290.629   7.6098  290.493   7.3800 0.1362610 10.60065 
1 1 1    2    9   27 o  1344.78   7.2028  1384.39   14.826  1377.84   19.469  1393.44   22.875  1341.46   9.4818  1348.92   11.079 -7.453613 14.58252 
1 1 1    2    9   28 o  696.771   5.4087  371.611   5.7683  371.832   7.5419  371.299   8.9540  696.940   7.0699  696.402   8.4002 0.5380859 10.97938 
1 1 1    2    9   29 o  475.423   5.1285  173.008   3.7320  174.288   5.1974  171.646   5.3620  477.146   7.1165  473.509   7.3982 3.636444 10.26541 
1 1 1    2    9   30 o  178.656   8.8849   24.439   2.4296   21.220   3.3962   27.813   3.4772  165.875   13.494  190.174   12.007 -24.29848 18.06246 
1 1 1    2    9   31 o  691.224   5.5593  365.735   5.8818  370.600   8.9366  362.016   7.8126  695.715   8.3921  687.646   7.4226 8.069458 11.20368 
1 1 1    2    9   32 o  656.511   6.2716  329.948   6.3022  329.478   7.6728  330.922   11.049  655.998   7.6416  657.288   10.982 -1.289307 13.37898 
1 1 1    2    9   33 o  729.194   5.5370  407.032   6.1800  419.574   8.9249  395.478   8.5659  740.253   7.8768  718.687   7.7869 21.56659 11.07610 
1 1 1    2    9   34 o  523.617   6.3863  209.901   5.1184  197.111   7.9647  218.899   6.6804  507.276   10.258  534.664   8.1630 -27.38770 13.10948 
1 1 1    2    9   35 o  283.847   8.1384   61.698   3.5359   61.385   4.9792   62.016   5.0220  283.042   11.493  284.492   11.533 -1.450043 16.28189 
1 1 1    2    9   36 o  404.953   6.6544  125.557   4.1246  126.209   5.8100  124.895   5.8564  405.915   9.3513  403.792   9.4755 2.123260 13.31288 
1 1 1    2    9   37 o  579.130   6.2374  256.792   5.5290  264.576   7.6246  248.158   8.0295  587.733   8.4755  569.164   9.2169 18.56946 12.52140 
1 1 1    2    9   38 o  957.917   7.7963  702.807   11.431  662.105   25.811  712.738   12.750  928.155   18.168  964.575   8.6355 -36.42059 20.11600 
1 1 1    2    9   39 o  270.716   9.4081   56.162   3.8984   62.493   6.3477   52.329   4.9397  284.930   14.604  261.188   12.356 23.74210 19.12973 
1 1 1    2    9   40 o   67.976   25.145   2.7933   3.4665   3.5818   4.3810   1.4733   5.6688   76.553   28.278   74.960   30.795 1.593208 41.80865 
1 1 1    2    9   41 o   57.228   22.845   1.2729   3.0182  -0.7537   4.2032   3.4302   4.3366   57.937   25.246   75.550   28.089 -17.61303 37.76688 
1 1 1    2    9   42 o  447.306   6.5099  153.275   4.4571  152.246   6.2422  154.345   6.3661  445.591   9.1523  448.641   9.2706 -3.049927 13.02721 
1 1 1    2    9   43 o  462.969   6.3589  164.211   4.5061  158.738   6.2961  169.959   6.4520  454.942   9.0416  470.757   8.9542 -15.81494 12.72511 
1 1 1    2    9   44 f  516.644   6.5529  204.538   5.1820  221.381   7.8521  191.541   6.8973  537.114   9.5511  499.678   9.0182 37.43564 13.13584 
1 1 1    2    9   45 o  523.341   7.1016  209.957   5.6887  209.484   6.9720  210.901   9.8396  522.531   8.7171  523.652   12.276 -1.121521 15.05636 
1 1 1    2    9   46 o   68.208   23.580   3.3052   2.9952  -1.4133   4.1680   8.3437   4.3070   55.276   24.568  101.297   27.203 -46.02114 36.65558 
1 1 1    2    9   47 o  155.656   14.461   18.859   3.4060   21.563   5.3926   17.065   4.3932  164.873   21.911  146.816   20.076 18.05670 29.71763 
1 1 1    2    9   48 o  220.692   10.017   37.447   3.3839   36.732   4.7391   38.192   4.8333  217.596   14.309  221.894   14.307 -4.298615 20.23457 
1 1 1    2    9   49 o  176.956   13.114   24.306   3.5267   26.920   4.6988   20.934   5.3370  185.495   16.730  161.981   22.103 23.51387 27.72039 
1 1 1    2    9   50 f  402.780   8.3880  124.663   5.1712  108.936   8.7723  133.038   6.4018  374.758   15.293  415.721   10.061 -40.96326 18.30569 
1 1 1    2    9   51 o  321.478   8.0686   79.420   3.9703   78.727   5.5808   80.129   5.6494  319.418   11.415  322.241   11.454 -2.822845 16.17065 
1 1 1    2    9   52 o  113.473   21.914   10.489   3.6683   12.076   4.5561   7.5648   6.1850  120.930   25.421   98.516   33.894 22.41422 42.36831 
1 1 1    2    9   53 o  373.091   7.6557  106.988   4.3719  104.945   6.1527  109.072   6.2134  368.701   10.902  375.910   10.799 -7.209137 15.34523 
1 1 1    2    9   54 o  122.305   19.211   12.039   3.4778   9.7807   4.9317   14.273   4.9051  107.610   29.198  131.333   25.319 -23.72305 38.64668 
1 1 1    2    9   55 o   68.950   27.386   2.3739   4.3175  -0.2678   9.5517   3.0522   4.8402   85.544   37.644   74.289   29.158 11.25498 47.61604 
1 1 1    2    9   56 o  162.320   22.439   21.435   5.4259   18.459   8.5414   23.449   7.0256  143.298   38.234  167.065   28.497 -23.76668 47.68498 
1 1 1    2    9   57 o   60.515   24.434   1.5657   3.4957   2.7376   4.9447   0.3947   4.9426   73.082   29.218   64.779   27.797 8.303116 40.32758 
1 1 1    2    9   58 o  115.898   23.101   11.203   3.9543   16.048   6.1862   7.8550   5.1418  135.846   30.499   96.314   30.836 39.53192 43.37069 
1 1 1    2    9   59 o  158.701   16.154   20.066   3.8693   19.021   5.4076   21.162   5.5387  150.902   24.232  159.781   23.335 -8.879150 33.64127 
1 1 1    2    9   60 o  185.831   14.226   27.299   4.0156   27.717   5.3543   26.760   6.0706  184.899   19.199  179.787   22.556 5.112137 29.62085 
1 1 1    2    9   61 o  142.352   20.974   16.807   4.4329   10.247   7.7000   20.059   5.4215  106.015   37.717  154.172   23.736 -48.15747 44.56382 
1 1 1    2    9   62 o   95.531   25.153   7.9936   3.7285   3.8504   4.9958   13.203   5.6021   75.534   29.630  120.235   30.418 -44.70117 42.46397 
1 1 1    2    9   63 o   88.119   26.912   6.9397   3.9634   4.2002   4.9182   12.015   6.6939   75.850   29.498  110.693   35.156 -34.84315 45.89184 
1 1 1    2    9   64 o  118.137   20.574   11.914   3.5851   14.734   5.0324   9.0079   5.1087  127.541   26.638   97.345   30.691 30.19607 40.63878 
1 1 1    2    9   65 o  116.296   23.394   12.002   4.0201   10.883   5.4321   13.357   5.9774  105.159   31.371  115.741   32.438 -10.58199 45.12632 
1 1 1    2   10    1 o  990.560   14.239  751.704   21.588   0.0000   0.0000  751.704   21.588  ?   ?   990.560   14.239 0.000000 14.23862 
1 1 1    2   10    2 o  1384.77   18.418  1470.09   39.037   0.0000   0.0000  1470.09   39.037  ?   ?   1384.77   18.418 0.000000 18.41765 
1 1 1    2   10    3 o  908.830   9.5085  632.422   13.227  652.129   19.268  614.859   18.190  922.653   13.644  895.924   13.265 26.72968 19.02900 
1 1 1    2   10    4 o  1729.62   15.759  2292.48   41.719  2325.60   60.065  2261.60   57.990  1740.88   22.541  1716.86   22.067 24.02588 31.54487 
1 1 1    2   10    5 o  687.723   6.6607  362.052   7.0114  366.111   12.259  360.079   8.5474  691.400   11.584  685.806   8.1426 5.594116 14.15947 
1 1 1    2   10    6 o  673.225   6.6012  346.949   6.8022  340.794   11.585  350.187   8.4034  667.069   11.346  676.318   8.1177 -9.249146 13.95092 
1 1 1    2   10    7 o  371.954   5.7160  105.901   3.2542  107.219   4.0052  103.339   5.5823  374.245   6.9919  367.358   9.9278 6.886993 12.14284 
1 1 1    2   10    8 o  938.469   8.0110  674.292   11.507  672.239   14.047  678.481   20.065  936.948   9.7950  941.009   13.930 -4.060669 17.02939 
1 1 1    2   10    9 f  761.628   6.1610  444.049   7.1823  440.121   10.057  448.138   10.260  758.161   8.6668  765.031   8.7620 -6.869995 12.32419 
1 1 1    2   10   10 o   58.400   14.703   2.7162   1.3134   0.8252   1.8071   4.8332   1.9121   44.883   17.752   77.925   16.542 -33.04161 24.26529 
1 1 1    2   10   11 o  1487.59   9.8606  1694.80   22.452  1695.99   31.753  1693.60   31.751  1487.58   13.945  1486.53   13.955 1.048706 19.72826 
1 1 1    2   10   12 o  900.765   6.8779  621.195   9.4827  631.079   13.604  611.854   13.225  907.726   9.7914  893.802   9.6670 13.92432 13.75944 
1 1 1    2   10   13 o  904.198   6.9337  625.963   9.5962  616.636   13.382  635.835   13.768  897.254   9.7442  911.104   9.8728 -13.85065 13.87155 
1 1 1    2   10   14 o  462.718   5.5567  163.906   3.9355  162.758   5.5731  165.048   5.5583  461.030   7.8977  464.263   7.8218 -3.233765 11.11548 
1 1 1    2   10   15 o  661.291   6.0699  334.793   6.1439  331.618   8.6517  338.023   8.7263  658.033   8.5898  664.358   8.5814 -6.325378 12.14184 
1 1 1    2   10   16 o  627.771   8.5126  301.814   8.1796  301.814   8.1796   0.0000   0.0000  627.771   8.5126  ?   ?  0.000000 8.512595 
1 1 1    2   10   17 o  724.986   7.3393  402.453   8.1443  413.184   10.082  382.299   13.817  734.497   8.9679  706.242   12.781 28.25562 15.61373 
1 1 1    2   10   18 o  850.154   6.1636  553.325   8.0206  577.974   10.702  521.738   12.115  868.781   8.0478  825.335   9.5899 43.44617 12.51931 
1 1 1    2   10   19 o  864.166   5.6895  571.675   7.5256  571.202   10.619  572.152   10.667  863.694   8.0323  864.410   8.0622 -0.7156372 11.38053 
1 1 1    2   10   20 o  1620.08   9.6441  2010.09   23.915  2024.28   38.231  2000.97   30.652  1624.92   15.371  1616.04   12.392 8.883057 19.74452 
1 1 1    2   10   21 o  955.798   6.0840  699.327   8.9007  695.927   12.526  702.795   12.649  953.353   8.5842  958.044   8.6261 -4.690857 12.16958 
1 1 1    2   10   22 o  249.727   5.9851   47.738   2.2878   48.706   3.2779   46.820   3.1945  252.217   8.4909  247.286   8.4397 4.930603 11.97179 
1 1 1    2   10   23 o  804.231   6.1565  495.100   7.5785  491.906   9.8164  499.813   11.924  801.573   8.0009  807.925   9.6420 -6.351624 12.52924 
1 1 1    2   10   24 o  408.405   6.2210  127.676   3.8888  122.979   5.5020  132.365   5.4973  400.779   8.9691  415.798   8.6377 -15.01923 12.45204 
1 1 1    2   10   25 o  2027.27   10.712  3147.16   33.238  3123.49   46.560  3171.75   47.464  2019.06   15.066  2034.57   15.241 -15.51099 21.43087 
1 1 1    2   10   26 o  1383.42   7.9253  1465.17   16.782  1443.56   23.343  1488.28   24.144  1372.97   11.108  1394.06   11.315 -21.08716 15.85594 
1 1 1    2   10   27 o  931.408   5.8255  664.044   8.3051  674.923   11.066  650.015   12.567  938.943   7.7000  921.406   8.9105 17.53772 11.77650 
1 1 1    2   10   28 o  896.969   5.3799  615.835   7.3862  628.168   10.645  604.386   10.257  905.830   7.6778  888.522   7.5418 17.30743 10.76232 
1 1 1    2   10   29 o  560.838   4.9818  240.757   4.2765  237.752   6.0367  243.785   6.0592  557.285   7.0771  564.312   7.0150 -7.027466 9.964714 
1 1 1    2   10   30 o  624.414   5.1161  298.440   4.8897  295.099   6.8673  301.876   6.9638  620.857   7.2265  627.945   7.2452 -7.088440 10.23306 
1 1 1    2   10   31 o  186.107   10.929   26.620   3.0995   26.757   3.8943   26.384   5.1195  186.355   13.750  184.553   18.367 1.801727 22.94367 
1 1 1    2   10   32 o  710.721   5.9113  386.679   6.4306  387.485   8.3482  385.503   10.084  711.398   7.6667  709.505   9.2860 1.893738 12.04189 
1 1 1    2   10   33 o  227.763   8.6761   39.726   3.0247   39.693   4.2852   39.758   4.2699  227.262   12.366  227.456   12.310 -0.1935730 17.44855 
1 1 1    2   10   34 o  540.645   6.3189  223.777   5.2290  214.019   7.9746  231.136   6.9257  528.595   9.8564  549.396   8.2358 -20.80151 12.84437 
1 1 1    2   10   35 o  540.063   5.8802  223.291   4.8608  209.538   6.7533  238.075   7.0017  523.075   8.4350  557.568   8.2042 -34.49323 11.76682 
1 1 1    2   10   36 o  1062.72   6.6425  864.735   10.805  863.721   14.477  866.010   16.235  1061.90   8.9065  1063.20   9.9764 -1.292725 13.37368 
1 1 1    2   10   37 f  362.135   9.6231  100.476   5.3340  106.633   14.091   99.446   5.7629  371.073   24.954  360.238   10.452 10.83514 27.05409 
1 1 1    2   10   38 o  302.963   8.7514   70.320   4.0583   68.809   6.6787   71.205   5.1098  299.410   14.573  304.772   10.954 -5.361206 18.23073 
1 1 1    2   10   39 o  220.019   9.8898   37.106   3.3305   35.298   4.7216   38.896   4.6987  213.912   14.506  224.684   13.729 -10.77171 19.97267 
1 1 1    2   10   40 o  359.930   7.8402   99.259   4.3193  104.610   5.6003   91.403   6.7858  369.379   9.9054  345.062   12.848 24.31741 16.22305 
1 1 1    2   10   41 o  374.543   7.7346  107.497   4.4341  114.717   7.5161  103.643   5.4916  386.499   12.705  367.629   9.7593 18.87024 16.02065 
1 1 1    2   10   42 f  591.582   6.0144  268.071   5.4460  267.600   7.7972  268.520   7.6097  590.789   8.6226  591.830   8.4004 -1.041199 12.03812 
1 1 1    2   10   43 o   84.414   22.447   5.7230   2.9504   5.7838   4.3627   5.6718   4.0052   87.343   28.444   85.809   27.188 1.534065 39.34792 
1 1 1    2   10   44 o  483.034   7.1510  178.845   5.2871  176.186   6.5130  183.984   9.0537  479.225   8.8791  489.211   12.091 -9.986145 15.00099 
1 1 1    2   10   45 o  105.411   18.905   8.8611   2.9382   5.2251   4.1862   12.392   4.1251   83.608   27.894  124.343   22.502 -40.73489 35.83899 
1 1 1    2   10   46 o  679.816   6.5412  354.272   6.8064  345.562   10.643  360.298   8.8534  670.574   10.370  685.198   8.4416 -14.62482 13.37125 
1 1 1    2   10   47 o  348.760   7.2483   93.298   3.8693   92.897   5.4689   93.700   5.4751  347.616   10.279  349.119   10.246 -1.503265 14.51298 
1 1 1    2   10   48 o  774.164   6.4533  459.594   7.6469  458.345   10.294  461.132   11.423  772.478   8.7060  774.507   9.6356 -2.028381 12.98612 
1 1 1    2   10   49 f   64.266   23.602   2.6534   3.0450   6.2275   4.5205  -0.3151   4.1198   89.192   28.950   58.175   25.172 31.01688 38.36291 
1 1 1    2   10   50 o  151.213   16.078   17.959   3.6642   19.159   6.4828   17.396   4.4418  152.288   28.868  147.722   20.172 4.566238 35.21740 
1 1 1    2   10   51 o   80.893   23.315   5.3084   3.0449   7.6727   4.2765   2.8774   4.3364   96.472   27.579   71.769   27.758 24.70273 39.12878 
1 1 1    2   10   52 o  154.860   15.768   18.852   3.6854   17.901   4.5778   20.605   6.2130  149.493   20.550  158.410   26.564 -8.916458 33.58516 
1 1 1    2   10   53 o  277.374   10.289   59.347   4.3681   61.762   7.4318   58.072   5.3992  280.421   17.401  273.769   12.885 6.652069 21.65169 
1 1 1    2   10   54 o   90.171   25.975   6.7307   3.7803   9.2829   6.8206   5.5990   4.5417  106.149   35.605   85.034   29.051 21.11421 45.95294 
1 1 1    2   10   55 o  224.498   11.063   38.984   3.8015   39.525   5.5024   38.489   5.2583  224.178   16.144  221.396   15.617 2.782349 22.46139 
1 1 1    2   10   56 o  105.659   24.922   9.3727   3.9651   6.9322   4.9292   13.847   6.6746   92.059   30.247  125.621   33.919 -33.56205 45.44658 
1 1 1    2   10   57 o  230.577   11.683   41.352   4.1096   39.458   5.9121   43.123   5.7166  223.028   17.458  233.826   16.070 -10.79782 23.72836 
1 1 1    2   10   58 o   60.135   25.248   0.8857   3.9291   7.8831   6.1427  -3.9594   5.1114   97.463   33.764   54.079   25.212 43.38353 42.13837 
1 1 1    2   10   59 o  160.572   15.117   20.456   3.6717   23.827   5.2044   17.115   5.1807  171.123   20.263  142.669   24.614 28.45430 31.88147 
1 1 1    2   10   60 o   59.791   24.558   1.4205   3.6039   6.0021   5.0097  -3.4939   5.1884   85.877   30.436   55.043   25.574 30.83435 39.75403 
1 1 1    2   10   61 o   74.758   27.863   4.1252   4.2724   8.0739   8.1911   2.6495   5.0075   98.705   38.157   71.368   29.088 27.33681 47.97934 
1 1 1    2   10   62 o  259.077   11.645   52.575   4.6178   54.012   7.3944   51.656   5.9126  257.246   18.912  254.322   15.259 2.924301 24.30054 
1 1 1    2   10   63 o   50.795   23.536  -2.5597   4.3501  -4.5466   5.0065   3.5626   8.7882   50.700   24.040   84.517   36.667 -33.81677 43.84552 
1 1 1    2   10   64 o   55.731   24.060   0.5479   3.7465  -0.8804   4.9406   2.4807   5.7473   58.137   26.222   71.401   30.285 -13.26418 40.05963 
1 1 1    2   11    1 o  122.081   14.732   11.586   2.6973   0.0000   0.0000   11.586   2.6973  ?   ?   122.081   14.732 0.000000 14.73232 
1 1 1    2   11    2 o  1197.05   16.448  1098.33   30.136   0.0000   0.0000  1098.33   30.136  ?   ?   1197.05   16.448 0.000000 16.44785 
1 1 1    2   11    3 o  893.476   7.7462  611.161   10.594  622.822   13.226  590.295   17.693  901.876   9.5813  877.804   13.168 24.07294 16.28510 
1 1 1    2   11    4 o  401.439   7.0357  123.369   4.3231  123.369   4.3231   0.0000   0.0000  401.439   7.0357  ?   ?  0.000000 7.035666 
1 1 1    2   11    5 o  394.883   5.8127  119.362   3.5133  119.467   4.2974  119.151   6.1011  395.036   7.1071  394.452   10.105 0.5846252 12.35422 
1 1 1    2   11    6 o  1920.86   14.162  2827.35   41.638  2840.54   51.285  2801.83   71.321  1924.71   17.408  1909.80   24.398 14.91431 29.97217 
1 1 1    2   11    7 o  139.954   6.9237   14.995   1.4832   14.325   2.0964   15.667   2.0987  136.393   10.114  142.706   9.6652 -6.312927 13.98949 
1 1 1    2   11    8 o  978.475   7.1784  732.984   10.751  722.359   14.967  744.308   15.452  971.190   10.069  985.823   10.241 -14.63257 14.36135 
1 1 1    2   11    9 o  792.433   6.3487  480.722   7.7005  484.228   10.954  477.298   10.827  795.198   9.0000  789.490   8.9598 5.708374 12.69949 
1 1 1    2   11   10 o  295.553   5.4005   66.867   2.4431   68.871   3.4623   64.879   3.4479  299.917   7.5421  291.091   7.7384 8.825500 10.80585 
1 1 1    2   11   11 o  1353.68   9.1542  1403.42   18.967  1411.02   26.989  1395.99   26.662  1356.85   12.995  1349.62   12.906 7.231567 18.31537 
1 1 1    2   11   12 o  679.306   6.0305  353.273   6.2703  349.298   8.7820  357.407   8.9555  675.366   8.4954  683.157   8.5645 -7.791016 12.06326 
1 1 1    2   11   13 o  1036.21   7.5655  822.168   11.999  810.732   16.726  834.295   17.224  1028.71   10.623  1043.54   10.783 -14.82581 15.13679 
1 1 1    2   11   14 o  456.671   5.5811  159.652   3.9012  158.064   5.5111  161.247   5.5231  454.325   7.9250  458.879   7.8635 -4.554108 11.16426 
1 1 1    2   11   15 o  489.048   6.6951  183.115   5.0116  185.540   6.1359  178.255   8.6863  492.227   8.1441  482.305   11.766 9.921906 14.30992 
1 1 1    2   11   16 o  656.706   8.8107  330.286   8.8562  329.311   12.438  331.288   12.613  655.508   12.396  657.462   12.534 -1.953857 17.62867 
1 1 1    2   11   17 o  337.906   8.7318   87.441   4.5161   87.441   4.5161   0.0000   0.0000  337.906   8.7318  ?   ?  0.000000 8.731772 
1 1 1    2   11   18 o  1071.63   7.9429  879.325   13.028  878.703   18.413  879.949   18.437  1070.97   11.233  1071.73   11.239 -0.7581787 15.88979 
1 1 1    2   11   19 o  196.524   8.4172   29.573   2.5319   31.346   3.6312   27.896   3.5323  201.934   11.800  190.426   12.183 11.50749 16.96012 
1 1 1    2   11   20 o  1010.67   6.2568  781.941   9.6791  767.694   13.422  797.378   13.971  1001.30   8.7576  1020.46   8.9447 -19.16327 12.51808 
1 1 1    2   11   21 o  604.128   5.1181  279.362   4.7327  277.231   6.6771  281.513   6.7091  601.771   7.2491  606.402   7.2282 -4.630615 10.23707 
1 1 1    2   11   22 o  468.609   5.4608  168.087   3.9169  165.075   5.1066  172.392   6.1047  464.363   7.1846  474.518   8.4050 -10.15521 11.05727 
1 1 1    2   11   23 o  127.588   11.021   12.559   2.1312   13.049   2.9890   12.052   3.0396  129.592   15.368  124.336   16.370 5.256706 22.45336 
1 1 1    2   11   24 o  1183.16   7.0491  1071.61   12.766  1049.68   17.662  1095.59   18.472  1170.85   9.8553  1196.17   10.089 -25.31860 14.10395 
1 1 1    2   11   25 o  1173.42   7.0613  1054.04   12.683  1062.47   18.095  1045.90   17.781  1177.95   10.036  1168.74   9.9396 9.214233 14.12513 
1 1 1    2   11   26 o  788.812   5.9295  476.284   7.1591  466.698   9.9272  486.672   10.334  780.765   8.3069  797.292   8.4681 -16.52704 11.86228 
1 1 1    2   11   27 o  781.141   5.9832  467.071   7.1537  463.236   10.064  470.988   10.171  777.851   8.4530  784.332   8.4718 -6.480652 11.96763 
1 1 1    2   11   28 o  1006.55   6.6641  775.567   10.267  778.849   14.536  772.299   14.504  1008.54   9.4163  1004.29   9.4350 4.250854 13.32989 
1 1 1    2   11   29 o  594.199   5.4996  270.263   5.0018  266.810   7.7494  272.728   6.5486  590.312   8.5766  596.864   7.1681 -6.551941 11.17765 
1 1 1    2   11   30 o  240.186   9.0463   44.175   3.3257   49.173   5.5879   41.433   4.1385  252.887   14.497  232.572   11.626 20.31557 18.58259 
1 1 1    2   11   31 o  298.956   7.8645   68.430   3.5987   68.729   4.3925   67.820   6.2764  299.575   9.5793  297.484   13.784 2.091309 16.78579 
1 1 1    2   11   32 o  697.776   5.4457  372.711   5.8162  370.639   8.2476  374.760   8.2032  695.752   7.7447  699.613   7.6605 -3.860962 10.89329 
1 1 1    2   11   33 o  417.499   6.6557  133.448   4.2533  133.541   6.7180  133.386   5.4947  417.528   10.512  417.350   8.6016 0.1786194 13.58268 
1 1 1    2   11   34 o  232.134   9.6094   41.275   3.4143   42.624   5.5670   40.461   4.3229  235.228   15.550  229.439   12.355 5.788910 19.86028 
1 1 1    2   11   35 o  374.725   7.2685  107.521   4.1690  116.061   6.6509  101.994   5.3506  389.182   11.165  364.895   9.5801 24.28690 14.71169 
1 1 1    2   11   36 o  1200.93   7.6681  1104.49   14.095  1094.15   20.288  1114.14   19.598  1194.86   11.093  1205.80   10.619 -10.93506 15.35596 
1 1 1    2   11   37 o  325.602   8.3875   81.210   4.1802   87.083   7.4543   78.515   5.0487  336.872   14.457  320.081   10.305 16.79071 17.75360 
1 1 1    2   11   38 o  1066.62   6.3345  871.204   10.342  871.936   14.660  870.480   14.591  1066.75   8.9786  1065.86   8.9434 0.8859863 12.67279 
1 1 1    2   11   39 o  1056.31   6.8636  854.619   11.097  850.360   14.440  860.764   17.344  1053.37   8.9560  1059.48   10.695 -6.113159 13.94954 
1 1 1    2   11   40 o  368.172   7.0096  103.840   3.9502  101.814   5.5150  105.974   5.6606  364.389   9.8880  371.753   9.9481 -7.364044 14.02629 
1 1 1    2   11   41 o  223.149   9.4080   38.185   3.2134   40.641   4.4953   35.619   4.5952  229.661   12.839  214.804   14.054 14.85693 19.03566 
1 1 1    2   11   42 o  227.862   9.3258   39.825   3.2526   45.736   4.5815   33.817   4.6184  243.679   12.323  209.147   14.517 34.53186 19.04206 
1 1 1    2   11   43 o  267.675   8.7929   54.958   3.6026   48.621   5.0472   61.539   5.1438  251.081   13.179  282.991   11.875 -31.90965 17.74002 
1 1 1    2   11   44 o   53.015   22.590   0.0242   3.2232   0.3149   4.0546  -0.4748   5.3131   60.375   25.513   66.118   28.598 -5.743034 38.32435 
1 1 1    2   11   46 o   67.630   24.145   3.0952   3.1582  -2.9888   5.1962   6.6590   3.9770   58.302   26.532   91.108   26.758 -32.80635 37.68184 
1 1 1    2   11   47 o  380.451   6.9482  111.013   4.0462  109.309   5.6864  112.761   5.7586  377.108   9.8514  383.021   9.8225 -5.912964 13.91161 
1 1 1    2   11   48 o  571.011   6.4848  250.058   5.6678  242.359   7.5779  259.833   8.5387  561.652   8.8148  581.339   9.5960 -19.68713 13.03012 
1 1 1    2   11   49 o  261.126   10.319   52.495   4.1242   58.168   7.3712   49.910   4.9760  272.751   17.753  253.887   12.847 18.86459 21.91362 
1 1 1    2   11   50 o  159.042   12.664   19.669   3.0572   20.674   4.3452   18.684   4.3022  161.860   17.835  153.551   18.691 8.309158 25.83452 
1 1 1    2   11   51 o   92.613   24.643   7.0661   3.5545   2.9467   4.4081   14.723   6.0099   72.391   27.989  132.353   30.318 -59.96197 41.26227 
1 1 1    2   11   52 o  222.547   11.845   38.389   4.0202   28.094   6.9920   43.472   4.9136  185.968   25.214  236.391   13.638 -50.42314 28.66585 
1 1 1    2   11   53 o  275.303   10.218   58.468   4.3056   58.977   7.4211   58.211   5.2862  273.758   17.808  274.130   12.598 -0.3727417 21.81344 
1 1 1    2   11   54 o  133.281   16.766   14.112   3.3446   14.068   4.8649   14.151   4.6056  130.242   25.315  131.171   23.817 -0.9287720 34.75764 
1 1 1    2   11   55 o  109.104   21.007   9.7538   3.3808   9.6256   4.6832   9.8934   4.8856  106.492   28.262  107.812   28.981 -1.320206 40.48034 
1 1 1    2   11   56 o   71.235   26.110   3.5130   3.7242   4.2581   4.7738   2.3544   5.9528   78.831   29.439   76.436   31.498 2.394791 43.11301 
1 1 1    2   11   57 o   61.638   24.568   1.8444   3.4856   4.6211   4.9058  -0.9864   4.9534   80.619   29.895   60.560   26.857 20.05862 40.18661 
1 1 1    2   11   58 o  139.312   17.958   15.626   3.7401   19.112   5.6485   12.904   4.9910  150.934   25.349  122.639   27.291 28.29414 37.24739 
1 1 1    2   11   59 o  165.440   15.594   21.773   3.9023   19.772   5.4125   23.938   5.6315  153.858   23.747  170.443   22.107 -16.58482 32.44460 
1 1 1    2   11   60 f  215.040   16.666   36.995   5.4428   0.0000   0.0000   36.995   5.4428  ?   ?   215.040   16.666 0.000000 16.66621 
1 1 1    2   11   61 o  244.095   10.865   46.449   4.0592   48.540   5.8499   44.507   5.6371  246.734   15.570  236.153   15.685 10.58089 22.10038 
1 1 1    2   11   62 o   64.759   26.720   1.9514   4.2906   0.1313   4.8255   8.8222   9.3756   61.327   26.877  100.444   40.205 -39.11743 48.36183 
1 1 1    2   11   63 o  203.294   13.308   32.915   4.1182   40.401   5.3864   22.383   6.3892  223.535   15.846  157.810   27.448 65.72481 31.69322 
1 1 1    2   11   64 o  208.259   11.684   34.338   3.7093   26.380   5.1196   43.133   5.3819  177.517   19.145  230.788   15.322 -53.27101 24.52140 
1 1 1    2   12    3 o  1145.09   9.2648  1004.08   16.239  1055.67   20.952  926.477   25.698  1173.95   11.660  1099.41   15.271 74.53516 19.21346 
1 1 1    2   12    4 o  361.068   5.8429   99.798   3.2291   99.721   3.9532   99.951   5.5977  360.909   7.1562  361.262   10.123 -0.3530579 12.39721 
1 1 1    2   12    5 o  483.216   5.2659  178.734   3.8948  178.642   5.4712  178.828   5.5456  483.046   7.3999  483.295   7.4966 -0.2484436 10.53366 
1 1 1    2   12    6 f  1086.75   7.7357  904.251   12.868  897.588   18.035  911.160   18.365  1082.51   10.885  1090.65   11.001 -8.142822 15.47562 
1 1 1    2   12    7 f  807.849   6.4332  499.618   7.9548  503.375   11.311  495.942   11.189  810.751   9.1151  804.744   9.0839 6.006836 12.86862 
1 1 1    2   12    8 o  738.801   6.1727  417.858   6.9802  414.952   9.7966  420.855   9.9481  736.115   8.6949  741.328   8.7672 -5.213379 12.34765 
1 1 1    2   12    9 o  966.457   7.1822  715.150   10.625  706.064   14.829  724.734   15.230  960.091   10.091  972.690   10.229 -12.59882 14.36896 
1 1 1    2   12   10 o  918.755   6.9798  646.288   9.8155  642.397   13.785  650.289   13.980  915.792   9.8340  921.394   9.9125 -5.601624 13.96300 
1 1 1    2   12   11 o  1020.28   7.4779  797.071   11.678  786.081   16.267  808.759   16.775  1012.97   10.492  1027.46   10.667 -14.49030 14.96169 
1 1 1    2   12   12 o  1093.45   7.8503  915.575   13.139  935.810   19.002  897.039   18.187  1105.14   11.234  1082.03   10.981 23.10669 15.70930 
1 1 1    2   12   13 o  403.608   6.4479  124.717   3.9834  122.835   4.8065  128.845   7.1180  400.514   7.8404  410.065   11.341 -9.551941 13.78696 
1 1 1    2   12   14 o  558.406   8.2801  238.788   7.0771  235.760   9.8855  241.972   10.136  554.684   11.643  561.935   11.785 -7.251160 16.56669 
1 1 1    2   12   15 o  509.914   6.7728  199.072   5.2861  201.596   9.1706  197.817   6.4688  512.929   11.681  508.250   8.3153 4.678650 14.33826 
1 1 1    2   12   16 o  511.854   5.9240  200.567   4.6412  202.359   6.5794  198.791   6.5480  514.061   8.3619  509.507   8.3963 4.553925 11.84986 
1 1 1    2   12   17 o  190.653   8.2283   27.833   2.4012   26.505   3.4487   29.083   3.3453  185.589   12.208  194.514   11.285 -8.925354 16.62484 
1 1 1    2   12   18 o  652.918   6.3346  326.348   6.3306  322.000   8.8940  330.814   9.0128  648.460   8.9607  657.274   8.9587 -8.814331 12.67094 
1 1 1    2   12   19 o  609.157   6.3392  284.061   5.9106  290.560   8.5089  278.001   8.2165  616.002   9.0244  602.546   8.9090 13.45612 12.68109 
1 1 1    2   12   20 o  627.965   5.6778  301.852   5.4574  305.709   7.0468  296.073   8.6266  631.924   7.2854  621.831   9.0636 10.09326 11.62867 
1 1 1    2   12   21 o  414.451   5.5144  131.480   3.4982  131.139   5.2969  131.743   4.6586  413.868   8.3616  414.839   7.3369 -0.9715271 11.12412 
1 1 1    2   12   23 o  1124.52   6.8087  968.006   11.719  966.398   16.536  969.629   16.611  1123.46   9.6162  1125.33   9.6439 -1.874512 13.61896 
1 1 1    2   12   24 o  375.351   5.5618  107.840   3.1954  108.400   4.5237  107.283   4.5143  376.295   7.8540  374.350   7.8785 1.944672 11.12457 
1 1 1    2   12   25 o  157.214   9.3961   18.992   2.2507   18.387   3.1321   19.637   3.2364  154.352   13.390  159.552   13.376 -5.199570 18.92599 
1 1 1    2   12   26 o  417.570   5.8878  133.469   3.7631  131.307   5.2887  135.686   5.3557  414.136   8.3432  420.986   8.3115 -6.849976 11.77673 
1 1 1    2   12   27 o  321.690   6.6639   79.218   3.2812   81.411   4.6350   77.015   4.6457  326.073   9.2868  317.143   9.5704 8.929993 13.33553 
1 1 1    2   12   28 o  491.228   6.9013  184.728   5.1890  174.002   8.3049  191.596   6.6459  476.634   11.384  500.235   8.6799 -23.60043 14.31521 
1 1 1    2   12   29 f  367.957   7.3903  103.655   4.1622  114.505   6.6101   96.526   5.3578  386.647   11.169  355.029   9.8595 31.61813 14.89831 
1 1 1    2   12   30 o  978.915   10.015  733.898   15.005  743.380   18.483  715.563   25.701  985.046   12.259  965.925   17.383 19.12079 21.27086 
1 1 1    2   12   31 o  608.440   7.0287  283.424   6.5458  296.188   8.6887  266.672   9.9539  621.910   9.1277  590.024   11.022 31.88580 14.31068 
1 1 1    2   12   32 o  921.432   6.8333  650.027   9.6375  653.872   13.737  646.300   13.524  923.973   9.7133  918.615   9.6186 5.358154 13.66994 
1 1 1    2   12   33 o  1321.65   8.0879  1337.59   16.361  1384.62   30.084  1317.84   19.497  1343.81   14.626  1311.69   9.7111 32.11597 17.55640 
1 1 1    2   12   34 o  852.802   6.8824  556.844   8.9837  567.641   16.933  552.615   10.598  860.541   12.856  849.479   8.1510 11.06238 15.22217 
1 1 1    2   12   35 o  439.339   6.4243  147.785   4.3201  144.008   5.9224  152.081   6.3158  433.599   8.9235  445.573   9.2606 -11.97333 12.86032 
1 1 1    2   12   36 o  739.119   6.6114  418.311   7.4796  412.121   12.932  421.422   9.1689  733.235   11.522  741.767   8.0757 -8.531616 14.07058 
1 1 1    2   12   37 o  216.810   9.3849   36.019   3.1144   35.820   4.5045   36.201   4.3109  215.627   13.719  216.844   13.049 -1.216766 18.93402 
1 1 1    2   12   38 o  288.711   7.7581   63.854   3.4284   67.208   4.8931   60.620   4.8051  296.060   10.798  281.159   11.166 14.90198 15.53256 
1 1 1    2   12   39 o  417.259   7.2146  133.374   4.6078  132.492   5.8745  134.784   7.4283  415.749   9.2314  419.140   11.579 -3.390503 14.80835 
1 1 1    2   12   40 o  306.291   7.4091   71.881   3.4735   71.639   4.8300   72.140   4.9989  305.608   10.326  306.653   10.650 -1.045563 14.83399 
1 1 1    2   12   41 o  497.255   6.1348  189.405   4.6692  191.201   6.6033  187.610   6.6033  499.384   8.6388  494.664   8.7213 4.720764 12.27562 
1 1 1    2   12   42 o  353.872   7.0671   95.967   3.8279   99.947   5.6323   92.551   5.2183  360.871   10.197  347.298   9.8165 13.57260 14.15409 
1 1 1    2   12   43 o  210.712   10.931   34.194   3.5132   31.833   4.2740   39.111   6.1689  202.894   13.845  224.236   18.129 -21.34279 22.81092 
1 1 1    2   12   44 o  554.094   5.9925  235.253   5.0823  241.272   7.1837  229.221   7.1914  560.813   8.3687  546.593   8.5956 14.22070 11.99669 
1 1 1    2   12   45 o   76.283   21.835   4.6433   2.6789   0.3074   3.8058   8.9017   3.7716   58.475   24.715  104.691   24.044 -46.21651 34.48077 
1 1 1    2   12   46 o  489.746   6.7779  183.916   5.0808  185.784   8.0877  182.698   6.5303  491.509   10.750  487.808   8.7461 3.701019 13.85877 
1 1 1    2   12   47 o   56.448   22.104   1.5286   2.7761   1.8791   3.6707   1.0602   4.2432   64.018   25.307   64.140   26.527 -0.1221619 36.66262 
1 1 1    2   12   48 o  202.980   10.638   31.804   3.2935   33.192   4.5188   30.230   4.8103  206.658   14.375  196.786   16.111 9.872314 21.59204 
1 1 1    2   12   49 o  275.025   9.6505   58.201   4.0625   52.725   6.8082   61.230   5.0626  259.699   17.225  281.725   11.740 -22.02548 20.84563 
1 1 1    2   12   50 o  306.433   8.9714   72.229   4.2079   77.663   7.0804   69.262   5.2322  316.430   14.619  299.605   11.409 16.82501 18.54405 
1 1 1    2   12   51 o  152.030   18.374   18.335   4.1889   13.790   6.0101   22.629   5.8415  127.746   31.042  167.438   23.435 -39.69179 38.89497 
1 1 1    2   12   52 o  192.666   11.115   28.758   3.2640   25.355   4.4980   32.543   4.7438  179.512   16.557  203.926   15.310 -24.41443 22.55017 
1 1 1    2   12   53 o   53.824   22.275   0.7704   2.9947  -2.4411   4.1639   4.2113   4.3101   51.624   23.593   77.469   28.136 -25.84532 36.71831 
1 1 1    2   12   54 o  112.575   20.023   10.298   3.3238   7.4819   4.9503   12.609   4.4852   95.246   30.231  123.303   24.627 -28.05752 38.99218 
1 1 1    2   12   55 f   58.622   24.278   1.0029   3.5611  -1.8013   4.4520   5.9843   5.9337   55.245   24.907   90.044   32.965 -34.79918 41.31641 
1 1 1    2   12   56 o   95.872   23.452   7.6904   3.4131   6.1568   4.6642   9.4583   5.0078   87.526   29.443  105.036   29.780 -17.51018 41.87764 
1 1 1    2   12   57 o   77.982   26.229   4.8161   3.7016   2.6126   5.5876   6.5395   4.9414   75.254   30.705   89.581   30.304 -14.32718 43.14088 
1 1 1    2   12   58 o  274.053   9.7326   58.130   4.0826   53.927   5.6510   62.718   5.9046  261.982   14.145  283.147   13.624 -21.16583 19.63913 
1 1 1    2   12   59 o   92.823   24.985   7.3920   3.6283   9.3598   4.9580   5.1231   5.3239  103.008   29.769   82.961   31.067 20.04692 43.02740 
1 1 1    2   12   60 o  203.603   16.610   33.209   5.1312   36.638   8.0191   30.831   6.6771  207.726   25.775  192.187   23.165 15.53894 34.65526 
1 1 1    2   12   61 o  152.144   17.656   18.827   4.0353   22.898   5.2643   13.026   6.2837  165.920   21.214  117.909   33.334 48.01076 39.51223 
1 1 1    2   12   62 o   60.595   25.399   1.3479   3.9659   6.4748   4.8906  -8.4981   6.7774   86.058   30.109   54.490   26.387 31.56755 40.03519 
1 1 1    2   12   63 o   77.180   25.475   5.1872   3.4950   8.2786   4.8646   1.8888   5.0248   94.069   29.980   67.010   28.365 27.05933 41.27135 
1 1 1    2   12   64 o  123.611   20.741   13.123   3.7852   9.0440   5.5635   16.639   5.1649   96.223   32.157  135.742   25.802 -39.51924 41.22865 
1 1 1    2   13    1 o  900.133   13.660  620.977   18.820   0.0000   0.0000  620.977   18.820  ?   ?   900.133   13.660 0.000000 13.65985 
1 1 1    2   13    2 o  384.794   10.250  113.410   6.0367   0.0000   0.0000  113.410   6.0367  ?   ?   384.794   10.250 0.000000 10.24950 
1 1 1    2   13    3 o  357.397   7.3966   97.798   4.0462  101.363   5.8778   94.586   5.5785  363.771   10.556  351.406   10.371 12.36441 14.79872 
1 1 1    2   13    4 o  591.201   6.5026  267.584   5.8843  268.169   7.2371  266.442   10.108  591.796   7.9896  589.739   11.197 2.056946 13.75559 
1 1 1    2   13    5 o  705.481   6.9769  381.056   7.5339  386.345   9.3379  371.193   12.752  710.285   8.5891  696.013   11.970 14.27185 14.73242 
1 1 1    2   13    6 o  416.188   5.3486  132.594   3.4072  132.408   4.7821  132.787   4.8558  415.845   7.5130  416.437   7.6181 -0.5923767 10.69955 
1 1 1    2   13    7 f  425.020   5.3458  138.282   3.4777  138.352   4.9104  138.212   4.9261  425.074   7.5472  424.859   7.5750 0.2147827 10.69305 
1 1 1    2   13    8 o  467.145   5.4547  167.055   3.9002  165.999   5.4887  168.131   5.5432  465.606   7.7017  468.585   7.7287 -2.979340 10.91091 
1 1 1    2   13    9 o  471.123   5.5020  169.914   3.9676  171.445   5.6210  168.393   5.6012  473.176   7.7610  468.944   7.8035 4.231171 11.00579 
1 1 1    2   13   10 o  519.792   5.6027  206.836   4.4576  197.461   6.1364  217.310   6.4860  507.801   7.8950  532.710   7.9545 -24.90894 11.20737 
1 1 1    2   13   11 o  634.455   6.8292  308.197   6.6319  310.072   8.1638  304.559   11.372  636.313   8.3821  630.431   11.785 5.882019 14.46222 
1 1 1    2   13   12 o  515.919   11.463  203.949   9.0521   0.0000   0.0000  203.949   9.0521  ?   ?   515.919   11.463 0.000000 11.46303 
1 1 1    2   13   13 o  248.540   7.3820   47.298   2.8083   49.514   4.9261   46.231   3.4181  254.175   12.662  245.690   9.0892 8.485428 15.58645 
1 1 1    2   13   14 o  358.777   5.8577   98.540   3.2168   97.300   4.4951   99.843   4.6053  356.460   8.2386  361.086   8.3325 -4.626068 11.71779 
1 1 1    2   13   15 o  484.462   5.9091  179.673   4.3818  184.696   6.2950  174.951   6.1031  491.118   8.3741  477.988   8.3419 13.13071 11.82002 
1 1 1    2   13   16 o  849.067   6.9086  551.922   8.9785  559.950   12.854  544.274   12.547  855.063   9.8212  843.015   9.7236 12.04761 13.82042 
1 1 1    2   13   17 o  479.287   6.1081  175.850   4.4810  179.827   6.3746  171.964   6.3001  484.617   8.5938  473.900   8.6855 10.71661 12.21844 
1 1 1    2   13   18 o  1256.46   8.8693  1208.79   17.057  1208.02   24.133  1209.55   24.112  1255.74   12.555  1256.54   12.537 -0.7966309 17.74302 
1 1 1    2   13   19 o  222.376   7.9894   37.860   2.7194   34.351   3.8197   41.466   3.8725  211.443   11.850  232.690   10.873 -21.24632 16.08218 
1 1 1    2   13   20 o  798.919   9.6396  488.724   11.788  477.262   16.460  500.791   16.889  789.296   13.625  808.517   13.647 -19.22070 19.28406 
1 1 1    2   13   21 o  199.490   12.420   30.598   3.7734   36.828   5.6883   25.703   5.0427  218.530   17.143  182.189   18.332 36.34077 25.09898 
1 1 1    2   13   22 o  621.500   5.8905  295.664   5.6035  304.202   7.2430  282.934   8.8438  630.376   7.5067  607.889   9.5049 22.48694 12.11167 
1 1 1    2   13   23 o  534.351   5.3127  218.552   4.3452  221.744   6.1648  215.400   6.1254  538.203   7.4835  530.446   7.5444 7.756042 10.62641 
1 1 1    2   13   24 o  566.032   5.8410  245.243   5.0606  241.179   7.7120  248.317   6.7064  561.255   8.9771  569.532   7.6931 -8.276489 11.82251 
1 1 1    2   13   25 o  831.755   5.9856  529.558   7.6204  531.192   10.766  527.917   10.787  832.959   8.4446  830.385   8.4872 2.573608 11.97256 
1 1 1    2   13   26 o  1255.52   7.4680  1206.77   14.352  1207.94   20.313  1205.60   20.280  1255.93   10.566  1254.72   10.560 1.215820 14.93845 
1 1 1    2   13   27 o  419.022   6.0370  134.403   3.8720  137.115   5.5103  131.758   5.4419  423.182   8.5070  414.832   8.5705 8.350372 12.07574 
1 1 1    2   13   28 o  191.945   10.389   28.299   3.0408   29.178   4.5792   27.605   4.0669  194.491   15.511  189.273   14.140 5.218475 20.98920 
1 1 1    2   13   29 o  367.025   10.190  103.167   5.7243   99.032   6.4591  118.304   12.357  359.551   11.737  392.051   20.665 -32.49954 23.76569 
1 1 1    2   13   30 o  941.862   7.4555  679.193   10.748  692.212   13.870  659.627   17.004  950.722   9.5317  927.896   11.973 22.82684 15.30343 
1 1 1    2   13   31 f  1173.10   8.2432  1053.77   14.801  1079.76   24.288  1038.42   18.669  1186.95   13.369  1164.33   10.475 22.61926 16.98390 
1 1 1    2   13   32 o  418.311   8.4484  134.000   5.4094  127.397   9.3394  137.333   6.6357  407.608   14.969  423.421   10.239 -15.81305 18.13601 
1 1 1    2   13   33 o  730.753   7.6640  408.902   8.5722  387.717   13.943  421.776   10.869  711.223   12.808  742.055   9.5696 -30.83160 15.98800 
1 1 1    2   13   34 o  620.580   6.9471  294.883   6.5989  302.222   9.3079  287.468   9.3568  628.107   9.6816  612.565   9.9794 15.54187 13.90402 
1 1 1    2   13   35 o  832.332   8.0398  530.589   10.243  532.163   14.728  529.114   14.254  833.235   11.548  830.881   11.208 2.353821 16.09273 
1 1 1    2   13   36 o  392.800   8.2340  118.188   4.9505  126.191   7.3044  111.389   6.7327  405.693   11.763  381.169   11.540 24.52325 16.47841 
1 1 1    2   13   37 o  629.358   6.3234  303.319   6.0914  314.299   9.8785  296.583   7.7376  640.347   10.079  622.206   8.1246 18.14001 12.94564 
1 1 1    2   13   38 o  275.720   10.544   58.294   4.4498   59.058   6.4176   57.586   6.1752  276.818   15.205  273.387   14.813 3.431549 21.22709 
1 1 1    2   13   39 o  561.088   5.9024  241.104   5.0691  240.934   7.2203  241.270   7.1182  560.688   8.4133  561.091   8.2883 -0.4032593 11.81017 
1 1 1    2   13   40 o  101.845   18.354   8.2394   2.7559   8.9352   3.8070   7.4734   3.9945  105.299   24.137   96.502   26.317 8.796349 35.70956 
1 1 1    2   13   41 f  547.945   5.9336  229.990   4.9765  226.974   7.1181  232.873   6.9602  544.076   8.5474  551.136   8.2508 -7.060059 11.87993 
1 1 1    2   13   42 o  665.614   6.4570  339.475   6.5785  341.619   9.4286  337.440   9.1830  667.294   9.2312  663.233   9.0458 4.061340 12.92446 
1 1 1    2   13   43 o  142.977   14.241   15.899   3.0751   14.161   3.9530   18.564   4.8939  133.777   19.912  153.197   21.459 -19.41972 29.27457 
1 1 1    2   13   44 o   85.552   20.272   5.9081   2.6139   4.2487   3.6656   7.6247   3.7283   76.462   26.099   96.929   24.975 -20.46664 36.12359 
1 1 1    2   13   45 o  134.029   14.998   14.039   3.0240   16.415   4.9767   12.649   3.8075  143.129   23.535  125.982   20.446 17.14737 31.17603 
1 1 1    2   13   46 o  126.904   13.996   12.579   2.6735   9.9420   3.7478   15.311   3.8147  110.767   22.863  139.262   18.342 -28.49521 29.31177 
1 1 1    2   13   47 o  284.108   7.9055   61.965   3.4378   61.435   4.7219   62.562   5.0150  282.497   10.920  284.986   11.497 -2.488617 15.85641 
1 1 1    2   13   48 o  419.472   7.5786  135.087   4.8659  135.501   8.6055  134.893   5.8996  418.706   13.427  418.858   9.2020 -0.1515808 16.27804 
1 1 1    2   13   49 o  203.583   11.496   32.072   3.5678   40.923   6.1904   27.670   4.3658  228.394   17.850  188.224   15.286 40.17020 23.50020 
1 1 1    2   13   50 o  167.478   11.713   21.760   2.9837   21.339   4.1252   22.221   4.3207  164.735   16.586  168.011   17.037 -3.276047 23.77711 
1 1 1    2   13   51 o  233.515   10.668   42.064   3.8130   40.054   4.7072   45.900   6.5026  226.914   13.616  241.658   17.703 -14.74403 22.33350 
1 1 1    2   13   52 o  172.072   11.912   23.007   3.1181   23.979   4.3089   21.938   4.5178  174.559   16.316  166.393   18.027 8.165802 24.31474 
1 1 1    2   13   53 o   63.986   23.051   2.8207   2.8846   2.9821   4.0800   2.6594   4.0789   70.579   27.021   69.097   26.866 1.481583 38.10382 
1 1 1    2   13   54 o   94.213   21.719   7.3350   3.0677   7.6875   4.2323   6.9447   4.4531   95.775   27.454   91.750   28.611 4.025124 39.65192 
1 1 1    2   13   55 f  111.216   20.646   10.122   3.3852   12.304   4.2629   6.3989   5.5697  121.805   23.718   90.789   32.101 31.01566 39.91288 
1 1 1    2   13   56 o  115.524   21.866   11.013   3.7249   12.012   5.7339   10.283   4.8996  117.445   31.322  109.397   28.848 8.047844 42.58230 
1 1 1    2   13   57 o   88.640   25.393   6.6259   3.6217   7.7273   5.3678   5.7055   4.9069   95.790   31.569   85.349   30.136 10.44095 43.64347 
1 1 1    2   13   58 o  100.292   23.704   8.5302   3.5812   9.5198   4.8387   7.3315   5.3255  104.372   29.162   93.278   31.460 11.09444 42.89725 
1 1 1    2   13   59 o  297.581   10.240   68.762   4.6641   62.971   5.9833   77.731   7.4460  283.110   13.808  313.479   15.518 -30.36945 20.77182 
1 1 1    2   13   60 o  145.304   21.560   17.586   4.6496   14.510   6.8785   20.175   6.3093  124.333   34.780  151.758   28.200 -27.42571 44.77620 
1 1 1    2   13   61 f  100.736   23.877   8.8219   3.6254   7.8383   4.9999   9.9124   5.2646   93.483   30.451  103.847   30.862 -10.36462 43.35580 
1 1 1    2   13   62 o  352.681   11.576   97.730   6.2490  113.662   7.9454   71.892   10.118  378.361   13.719  291.067   22.896 87.29370 26.69194 
1 1 1    2   13   63 o  151.882   15.540   18.762   3.5617   21.558   4.9679   15.805   5.1091  159.336   20.872  132.489   26.122 26.84711 33.43644 
1 1 1    2   14    1 o  880.609   13.572  594.436   18.293   0.0000   0.0000  594.436   18.293  ?   ?   880.609   13.572 0.000000 13.57184 
1 1 1    2   14    2 o  921.975   13.955  651.658   19.693   0.0000   0.0000  651.658   19.693  ?   ?   921.975   13.955 0.000000 13.95498 
1 1 1    2   14    3 o  1178.62   11.677  1064.42   21.066  1059.74   29.709  1069.16   29.876  1175.32   16.514  1180.53   16.534 -5.204224 23.36852 
1 1 1    2   14    4 o  335.913   6.2635   86.386   3.2204   84.496   3.9516   90.125   5.5574  332.186   7.7717  342.994   10.586 -10.80826 13.13220 
1 1 1    2   14    5 o  523.302   6.4120  209.656   5.1359  209.591   6.2878  209.784   8.9022  523.174   7.8521  523.268   11.115 -0.9405518E-01 13.60865 
1 1 1    2   14    6 o  166.652   7.3567   21.266   1.8766   21.311   2.5929   21.216   2.7194  166.478   10.225  166.063   10.756 0.4155884 14.84089 
1 1 1    2   14    7 o  611.859   5.8213  286.601   5.4518  291.149   7.7927  282.242   7.6299  616.595   8.2569  607.093   8.2110 9.502502 11.64464 
1 1 1    2   14    8 o  942.587   8.2353  680.382   11.881  682.796   14.604  675.658   20.433  944.108   10.106  938.730   14.221 5.378723 17.44626 
1 1 1    2   14    9 o  709.883   7.1344  385.846   7.7520  388.301   9.5401  381.075   13.300  712.055   8.7532  705.157   12.323 6.897278 15.11499 
1 1 1    2   14   10 o  421.631   6.4514  136.103   4.1635  132.609   5.0291  143.715   7.4226  416.145   7.8955  433.098   11.197 -16.95383 13.70072 
1 1 1    2   14   11 o  790.453   7.5995  478.423   9.1945  476.791   15.917  479.240   11.264  788.701   13.185  791.027   9.3031 -2.326416 16.13674 
1 1 1    2   14   12 o  471.416   6.6471  170.141   4.7963  169.314   8.3043  170.555   5.8753  470.094   11.541  471.945   8.1334 -1.851715 14.11907 
1 1 1    2   14   13 o  671.854   6.2204  345.561   6.3968  347.707   9.0678  343.434   9.0253  673.833   8.7918  669.680   8.8049 4.153748 12.44276 
1 1 1    2   14   14 o  783.038   6.6302  469.407   7.9465  474.332   11.323  464.627   11.155  787.003   9.4000  778.913   9.3562 8.089905 13.26273 
1 1 1    2   14   15 o  428.240   5.9905  140.386   3.9266  137.927   5.5135  142.917   5.5935  424.419   8.4871  432.030   8.4586 -7.610107 11.98247 
1 1 1    2   14   16 o  989.526   7.5671  749.644   11.461  751.139   16.218  748.152   16.199  990.328   10.699  988.356   10.708 1.971802 15.13698 
1 1 1    2   14   17 o  608.702   6.2237  283.629   5.7986  292.719   8.3745  275.257   8.0369  618.306   8.8488  599.583   8.7573 18.72314 12.44952 
1 1 1    2   14   18 o  140.666   11.250   15.251   2.4019   14.271   3.3480   16.290   3.4480  135.457   16.488  144.939   15.798 -9.481781 22.83472 
1 1 1    2   14   19 o  1361.83   13.279  1420.65   27.680  1423.97   39.302  1417.39   38.992  1362.78   18.841  1359.64   18.736 3.142090 26.57169 
1 1 1    2   14   20 o  730.067   7.7347  408.033   8.6432  401.930   10.574  420.322   15.003  724.530   9.5349  740.764   13.232 -16.23474 16.30993 
1 1 1    2   14   21 o  732.622   6.9091  410.868   7.7476  399.404   10.726  423.374   11.203  722.246   9.7025  743.598   9.8431 -21.35187 13.82121 
1 1 1    2   14   22 o  619.283   6.8521  293.575   6.4951  290.018   9.1070  297.257   9.2659  615.449   9.6675  623.081   9.7157 -7.632141 13.70602 
1 1 1    2   14   23 o  679.094   6.1957  353.008   6.4400  350.625   8.1403  356.994   10.529  676.758   7.8585  682.808   10.074 -6.049194 12.77680 
1 1 1    2   14   24 o  962.821   6.3554  709.617   9.3661  701.953   13.092  717.651   13.405  957.507   8.9330  968.149   9.0459 -10.64178 12.71323 
1 1 1    2   14   25 o  331.542   6.2074   84.142   3.1501   82.599   4.3906   85.778   4.5221  328.454   8.7333  334.713   8.8266 -6.258087 12.41691 
1 1 1    2   14   26 o  888.816   6.2328  604.734   8.4794  608.010   12.016  601.484   11.968  891.117   8.8094  886.321   8.8216 4.795959 12.46700 
1 1 1    2   14   27 o  163.112   11.304   20.476   2.8048   20.254   4.3098   20.638   3.6942  161.557   17.719  163.422   14.934 -1.864517 23.17305 
1 1 1    2   14   28 o  309.765   10.574   73.491   5.0133   76.595   5.7214   63.227   10.404  316.209   11.821  285.872   23.999 30.33646 26.75250 
1 1 1    2   14   29 o  101.141   23.251   8.1738   3.5241   6.2313   4.1536   13.165   6.6581   89.968   27.563  128.294   33.532 -38.32556 43.40618 
1 1 1    2   14   30 o  798.034   8.3587  487.663   10.210  506.161   14.804  470.882   14.100  812.801   11.900  783.974   11.750 28.82684 16.72340 
1 1 1    2   14   31 o  451.658   9.0808  156.228   6.2777  133.611   9.4059  174.397   8.4301  417.451   14.721  477.096   11.544 -59.64532 18.70727 
1 1 1    2   14   32 o  518.910   7.8194  206.189   6.2106  202.422   10.764  208.069   7.6041  513.853   13.685  521.200   9.5318 -7.346924 16.67745 
1 1 1    2   14   33 o  555.733   7.8542  236.505   6.6810  245.792   8.3230  219.679   11.203  566.453   9.5994  535.265   13.674 31.18854 16.70704 
1 1 1    2   14   34 o  510.749   7.8420  199.781   6.1306  203.508   8.8094  196.280   8.5371  515.310   11.169  506.086   11.021 9.223480 15.69080 
1 1 1    2   14   35 o  612.026   6.8852  286.840   6.4499  290.052   9.2749  283.833   8.9756  615.248   9.8489  608.633   9.6347 6.614990 13.77778 
1 1 1    2   14   36 o  475.881   7.4201  173.454   5.4048  166.579   7.6469  180.316   7.6401  466.151   10.717  485.024   10.291 -18.87231 14.85841 
1 1 1    2   14   37 o  297.862   9.5672   68.004   4.3618   71.005   6.2976   65.237   6.0472  304.132   13.528  291.514   13.553 12.61725 19.14901 
1 1 1    2   14   38 o  575.408   7.2766  253.648   6.4088  251.409   8.9950  255.956   9.1333  572.577   10.264  577.724   10.328 -5.147095 14.56082 
1 1 1    2   14   39 o  194.783   13.286   29.282   3.9374   26.565   5.6277   31.887   5.5108  184.406   20.273  202.635   17.954 -18.22830 27.07992 
1 1 1    2   14   40 o  363.697   8.5432  101.414   4.7559  104.887   6.7121   97.912   6.7397  369.565   11.866  357.018   12.333 12.54733 17.11453 
1 1 1    2   14   41 o  337.932   8.2835   87.563   4.2846   92.140   7.3258   85.183   5.2823  346.068   13.830  333.131   10.359 12.93729 17.27971 
1 1 1    2   14   42 o  247.092   11.116   46.903   4.2041   51.856   5.8001   41.419   6.1023  259.041   14.689  230.936   17.391 28.10475 22.76442 
1 1 1    2   14   43 o  373.762   7.3543  107.110   4.2073  111.691   7.1029  104.634   5.2220  381.062   12.178  369.220   9.2402 11.84167 15.28668 
1 1 1    2   14   44 o   62.993   21.748   2.8126   2.5474  -0.5185   3.5938   6.1767   3.6115   53.807   23.396   87.796   25.417 -33.98854 34.54545 
1 1 1    2   14   45 o  443.557   6.8762  150.869   4.6684  152.768   7.6225  149.730   5.9055  445.615   11.176  441.610   8.7367 4.004852 14.18531 
1 1 1    2   14   46 o  356.330   6.9721   97.395   3.8027   99.293   5.2311   95.267   5.5375  359.436   9.5084  351.947   10.279 7.489044 14.00260 
1 1 1    2   14   47 o   69.186   23.790   3.4739   3.0468   6.6671   5.5957   2.1282   3.6325   93.963   32.244   64.854   25.315 29.10971 40.99425 
1 1 1    2   14   48 o  393.485   7.5098  118.879   4.5230  111.006   7.4933  123.392   5.6730  379.031   12.916  400.548   9.2532 -21.51678 15.88856 
1 1 1    2   14   49 o  265.596   8.1817   54.212   3.3261   57.607   4.7616   50.976   4.6481  273.257   11.384  256.968   11.818 16.28909 16.40912 
1 1 1    2   14   50 o  300.972   8.6152   69.669   3.9688   71.335   4.9469   66.658   6.6486  304.161   10.626  292.605   14.894 11.55624 18.29596 
1 1 1    2   14   51 o  100.834   19.097   8.2297   2.8396   12.871   4.2183   4.3839   3.8399  125.619   22.778   76.898   26.692 48.72099 35.08966 
1 1 1    2   14   52 o  316.388   7.8461   76.974   3.7997   78.430   5.4105   75.558   5.3373  318.612   11.094  312.709   11.151 5.903503 15.72994 
1 1 1    2   14   53 o  204.199   10.587   32.293   3.2976   30.284   4.7659   34.139   4.5675  196.228   16.007  208.947   14.369 -12.71881 21.51028 
1 1 1    2   14   54 o  115.394   19.442   10.793   3.3119   11.641   4.1510   9.3067   5.4938  118.527   23.709  104.643   31.624 13.88395 39.52437 
1 1 1    2   14   55 o  215.869   10.487   36.041   3.4651   31.064   4.7104   41.910   5.1153  198.578   15.624  231.247   14.526 -32.66930 21.33284 
1 1 1    2   14   56 o  163.878   13.384   21.071   3.3280   21.130   4.6621   21.010   4.7521  162.067   19.165  161.406   19.640 0.6608887 27.44117 
1 1 1    2   14   57 o  176.796   13.961   24.604   3.7472   23.298   4.8275   26.584   5.9438  170.087   18.861  180.271   21.997 -10.18420 28.97599 
1 1 1    2   14   58 o   65.717   25.552   2.5864   3.6900  -0.8673   4.5389   9.3187   6.3370   57.758   25.656  102.879   34.319 -45.12045 42.84933 
1 1 1    2   14   59 o  182.113   15.366   26.409   4.2431   38.546   8.1128   21.839   4.9783  213.739   25.288  163.088   20.388 50.65070 32.48339 
1 1 1    2   14   60 o  122.166   18.742   12.284   3.3927   9.7219   4.7082   15.052   4.8931  104.244   28.631  132.147   25.109 -27.90324 38.08127 
1 1 1    2   14   61 o  283.268   10.718   62.698   4.6469   62.577   5.9599   62.885   7.4212  281.063   13.854  278.512   17.497 2.551270 22.31767 
1 1 1    2   14   62 o   87.757   25.019   6.8750   3.5244   13.916   5.2347   1.0371   4.7666  123.069   28.370   63.228   27.218 59.84159 39.31504 
1 1 1    2   14   63 o  304.996   9.6204   72.706   4.4911   75.592   7.1068   70.787   5.7949  306.295   15.159  298.662   12.676 7.632294 19.76068 
1 1 1    2   15    1 o  986.548   14.724  746.339   22.233   0.0000   0.0000  746.339   22.233  ?   ?   986.548   14.724 0.000000 14.72365 
1 1 1    2   15    2 o  399.777   10.834  122.445   6.6297   0.0000   0.0000  122.445   6.6297  ?   ?   399.777   10.834 0.000000 10.83440 
1 1 1    2   15    3 o  901.799   9.8787  622.937   13.636  619.282   19.242  626.623   19.326  898.749   13.988  904.063   13.966 -5.313660 19.76628 
1 1 1    2   15    4 o  340.621   7.9208   88.844   4.1296   88.252   5.8582   89.429   5.8223  339.386   11.277  341.645   11.134 -2.259583 15.84743 
1 1 1    2   15    5 o  357.837   6.4616   98.033   3.5391   99.025   4.3871   96.186   5.9887  359.607   7.9704  354.323   11.042 5.284149 13.61855 
1 1 1    2   15    6 o  241.046   7.0492   44.487   2.6008   45.600   3.2081   42.352   4.4424  244.017   8.5893  234.755   12.407 9.262024 15.09021 
1 1 1    2   15    7 f  276.233   6.0695   58.416   2.5663   59.805   3.5608   56.915   3.7018  279.457   8.3246  272.610   8.8715 6.847168 12.16565 
1 1 1    2   15    8 o  661.926   7.0493  335.465   7.1421  336.182   12.388  335.108   8.7412  662.346   12.219  661.503   8.6331 0.8435059 14.96108 
1 1 1    2   15    9 o  228.315   7.7236   39.914   2.6991   39.990   4.8849   39.881   3.2384  227.967   14.068  228.195   9.2715 -0.2279816 16.84867 
1 1 1    2   15   10 o  402.382   5.7530  123.946   3.5433  118.668   4.9417  129.530   5.0831  393.667   8.2012  411.292   8.0744 -17.62482 11.50894 
1 1 1    2   15   11 o  468.347   5.8130  167.915   4.1671  174.717   6.0239  161.674   5.7707  477.674   8.2390  459.500   8.2049 18.17395 11.62761 
1 1 1    2   15   12 o  949.024   7.3200  689.550   10.633  695.461   15.140  683.796   14.937  952.893   10.380  944.871   10.328 8.021667 14.64307 
1 1 1    2   15   13 o  686.846   6.3607  361.143   6.6871  354.009   9.2687  368.888   9.6571  679.936   8.9060  694.070   9.0902 -14.13428 12.72589 
1 1 1    2   15   14 o  674.258   6.3557  348.021   6.5594  348.244   9.2672  347.797   9.2855  674.386   8.9778  673.952   9.0013 0.4342041 12.71317 
1 1 1    2   15   15 o  850.221   6.9688  553.389   9.0690  558.085   12.904  548.805   12.748  853.695   9.8753  846.568   9.8384 7.126282 13.93971 
1 1 1    2   15   16 o  399.858   6.2149  122.390   3.8037  117.774   5.3313  127.176   5.4285  392.201   8.8808  407.558   8.7021 -15.35785 12.43366 
1 1 1    2   15   17 o  798.620   7.8845  488.275   9.6379  505.026   16.981  480.314   11.706  811.934   13.664  792.018   9.6561 19.91626 16.73166 
1 1 1    2   15   18 o  498.618   8.6978  190.345   6.6381  189.267   9.3697  191.432   9.4059  497.107   12.314  499.943   12.292 -2.835388 17.39894 
1 1 1    2   15   19 o  674.348   6.6281  348.099   6.8414  349.831   9.6948  346.380   9.6556  675.951   9.3703  672.608   9.3788 3.343079 13.25767 
1 1 1    2   15   20 o  820.887   7.1681  515.841   9.0066  504.875   12.476  527.778   13.016  812.016   10.038  830.222   10.243 -18.20526 14.34099 
1 1 1    2   15   21 o  477.695   6.8101  174.679   4.9794  173.981   7.0264  175.384   7.0576  476.685   9.6301  478.603   9.6341 -1.918488 13.62185 
1 1 1    2   15   22 o  425.055   7.1019  138.306   4.6205  143.725   6.5960  133.085   6.4745  433.249   9.9465  416.899   10.146 16.34995 14.20848 
1 1 1    2   15   23 o  1411.00   9.9181  1524.48   21.420  1510.58   29.964  1539.01   30.632  1404.19   13.941  1417.32   14.120 -13.12842 19.84295 
1 1 1    2   15   24 o  1269.83   9.2734  1234.65   18.024  1225.84   25.268  1243.77   25.718  1265.00   13.050  1274.20   13.186 -9.202026 18.55233 
1 1 1    2   15   25 o  1027.68   6.6483  808.477   10.458  813.678   14.820  803.318   14.759  1030.84   9.3928  1024.26   9.4141 6.584839 13.29849 
1 1 1    2   15   26 o  1177.52   8.8120  1061.67   15.882  1074.21   22.656  1049.56   22.271  1184.15   12.500  1170.50   12.431 13.65820 17.62870 
1 1 1    2   15   27 o  542.351   8.5300  225.224   7.0811  228.552   8.2941  216.278   13.600  546.296   9.9191  531.098   16.729 15.19763 19.44898 
1 1 1    2   15   28 o  632.726   8.0242  306.530   7.7712  300.512   10.876  312.810   11.108  626.338   11.344  639.025   11.357 -12.68640 16.05208 
1 1 1    2   15   29 o  904.871   7.3256  626.894   10.146  627.741   16.512  626.380   12.860  905.172   11.918  904.386   9.2903 0.7861328 15.11135 
1 1 1    2   15   30 o  479.099   9.2774  175.793   6.8033  186.985   9.7774  165.287   9.4725  493.949   12.932  464.386   13.326 29.56265 18.56981 
1 1 1    2   15   31 o  249.453   11.434   47.679   4.3656   37.224   8.0671   52.009   5.1914  218.604   24.533  260.488   13.021 -41.88383 27.77411 
1 1 1    2   15   32 o  256.173   9.6540   50.269   3.7854   47.714   5.4090   52.723   5.2994  249.037   14.249  261.909   13.263 -12.87112 19.46620 
1 1 1    2   15   33 o  616.313   7.5806  290.880   7.1511  292.693   10.323  289.208   9.9160  618.023   10.912  614.359   10.545 3.663635 15.17488 
1 1 1    2   15   34 o  679.682   6.7150  353.747   6.9859  350.348   9.9073  357.108   9.8521  676.215   9.5720  682.720   9.4279 -6.504883 13.43534 
1 1 1    2   15   35 o  235.580   10.601   42.541   3.8226   45.602   5.5311   39.741   5.2891  243.268   14.927  226.991   15.313 16.27745 21.38411 
1 1 1    2   15   36 o  858.745   7.0129  564.824   9.2179  563.967   13.141  565.653   12.934  857.740   10.009  859.046   9.8366 -1.305115 14.03347 
1 1 1    2   15   37 o  133.745   17.642   14.003   3.5234   22.081   5.2940   7.5787   4.7209  167.892   21.064   98.112   29.240 69.77993 36.03745 
1 1 1    2   15   38 o  730.574   6.8897  408.882   7.7043  422.321   11.145  396.582   10.662  742.106   9.8116  719.154   9.6861 22.95160 13.78729 
1 1 1    2   15   39 o  250.676   10.195   48.209   3.9119   51.973   5.6618   44.770   5.4112  259.583   14.305  240.804   14.752 18.77921 20.54902 
1 1 1    2   15   40 o  355.285   8.9855   96.810   4.8864  105.964   7.5555   90.228   6.4066  371.232   13.297  342.686   12.214 28.54648 18.05522 
1 1 1    2   15   41 o  381.123   8.9424  111.427   5.2166  112.646   6.8800  109.778   8.0010  382.878   11.740  377.676   13.841 5.202515 18.14892 
1 1 1    2   15   42 o  110.961   26.646   10.016   4.4685   8.3611   5.0957   15.524   9.2969  102.184   30.361  137.463   41.048 -35.27876 51.05657 
1 1 1    2   15   43 o   53.120   23.096  -0.5143   3.5020  -5.1484   5.0168   3.8896   4.8906   52.254   24.559   79.687   29.789 -27.43299 38.60745 
1 1 1    2   15   44 o  181.356   16.696   25.660   4.5827   13.548   9.4206   29.415   5.2451  129.319   41.773  194.021   17.862 -64.70244 45.43222 
1 1 1    2   15   45 o  262.848   10.358   53.128   4.1672   61.804   6.0163   45.126   5.7775  282.962   13.891  240.998   15.749 41.96387 20.99980 
1 1 1    2   15   46 o  355.563   9.8904   97.223   5.3827  110.671   7.8523   85.302   7.3930  378.558   13.552  332.124   14.543 46.43408 19.87827 
1 1 1    2   15   47 o  303.167   8.4003   70.613   3.8980   69.022   6.3968   71.553   4.9162  298.707   13.991  304.840   10.536 -6.133240 17.51460 
1 1 1    2   15   48 o  228.278   10.343   40.138   3.6141   40.581   6.1079   39.899   4.4831  227.496   17.680  226.825   12.966 0.6706696 21.92485 
1 1 1    2   15   49 o  364.634   6.9400  102.069   3.8734  104.674   5.4724   99.454   5.4831  368.718   9.6965  359.345   9.9689 9.373260 13.90684 
1 1 1    2   15   50 o  125.918   16.877   12.580   3.1710   11.852   3.8953   14.010   5.4598  120.760   21.880  129.478   28.336 -8.717773 35.80004 
1 1 1    2   15   51 o  409.429   6.7835  128.729   4.2511  126.348   6.1040  130.972   5.9240  404.862   9.8500  412.339   9.3862 -7.476868 13.60599 
1 1 1    2   15   52 o  144.167   13.525   16.273   2.9497   12.232   4.2384   20.070   4.1077  121.911   23.566  159.237   17.122 -37.32542 29.12978 
1 1 1    2   15   53 o  204.546   10.799   32.429   3.3690   31.870   4.6747   33.032   4.8597  201.513   15.269  205.059   15.600 -3.546555 21.82924 
1 1 1    2   15   54 o  208.341   11.521   33.725   3.6598   35.689   4.7768   30.933   5.6950  213.347   14.718  196.911   19.137 16.43649 24.14223 
1 1 1    2   15   55 o   73.027   23.705   4.2339   3.0309   2.4194   4.1007   6.4187   4.4998   67.681   26.751   88.548   28.890 -20.86699 39.37312 
1 1 1    2   15   56 o  138.820   18.919   15.570   3.9153   12.532   5.3403   19.100   5.7574  120.258   29.285  150.878   25.861 -30.61932 39.06932 
1 1 1    2   15   57 o  203.704   12.516   32.477   3.8835   37.212   4.8620   24.132   6.4545  217.203   14.711  169.451   25.691 47.75197 29.60493 
1 1 1    2   15   58 o   87.538   23.779   6.5316   3.2688   4.6729   4.6984   8.2752   4.5507   79.116   29.272   97.291   28.636 -18.17503 40.95002 
1 1 1    2   15   59 o  270.917   11.176   57.215   4.6343   52.526   8.4738   59.216   5.5354  252.149   22.182  274.642   13.168 -22.49265 25.79563 
1 1 1    2   15   60 o  262.221   10.302   53.560   4.1349   62.545   6.1571   46.178   5.5807  280.720   14.378  240.575   15.234 40.14471 20.94750 
1 1 1    2   15   61 o  187.372   14.011   28.024   3.9892   28.322   5.0294   27.519   6.5504  186.010   17.886  178.361   24.653 7.648941 30.45756 
1 1 1    2   15   62 o  256.271   10.073   51.366   3.9512   54.020   5.3431   48.162   5.8696  260.319   13.456  243.922   15.806 16.39778 20.75808 
1 1 1    2   16    1 o   43.426   19.895  -2.1383   2.9860   0.0000   0.0000  -2.1383   2.9860  ?   ?    43.426   19.895 0.000000 19.89526 
1 1 1    2   16    2 o  339.897   11.435   88.516   5.9489   0.0000   0.0000   88.516   5.9489  ?   ?   339.897   11.435 0.000000 11.43468 
1 1 1    2   16    3 o  1442.15   13.770  1594.26   30.396  1573.62   42.454  1615.97   43.540  1431.65   19.374  1450.73   19.608 -19.08130 27.56470 
1 1 1    2   16    4 o  466.295   8.0263  166.493   5.7286  165.644   8.1114  167.338   8.0916  464.977   11.397  467.352   11.312 -2.375519 16.05750 
1 1 1    2   16    5 o  181.014   10.468   25.183   2.8880   25.101   4.1404   25.261   4.0304  180.298   15.143  180.924   14.680 -0.6260223 21.09112 
1 1 1    2   16    6 o  431.578   7.9800  142.620   5.2715  145.503   7.6022  139.950   7.3161  435.802   11.397  427.413   11.183 8.388336 15.96704 
1 1 1    2   16    7 o  435.679   6.5811  145.319   4.3887  136.280   7.4333  150.156   5.4376  421.763   11.514  442.834   8.0223 -21.07040 14.03349 
1 1 1    2   16    8 o  661.267   6.1717  334.750   6.2467  335.282   8.8716  334.227   8.7971  661.695   8.7594  660.655   8.6996 1.039612 12.34544 
1 1 1    2   16    9 o  1305.55   9.0533  1305.24   18.091  1313.38   25.777  1297.34   25.397  1309.22   12.863  1301.21   12.752 8.005249 18.11273 
1 1 1    2   16   10 o  552.304   6.0005  233.510   5.0727  227.966   7.0562  239.439   7.2975  545.641   8.4488  559.201   8.5259 -13.56036 12.00305 
1 1 1    2   16   11 o  972.607   7.4501  724.225   11.091  723.378   15.650  725.080   15.720  971.860   10.521  973.001   10.555 -1.140564 14.90295 
1 1 1    2   16   12 o  294.789   6.4672   66.524   2.9181   70.925   4.2114   62.460   4.0471  304.346   9.0404  285.603   9.2579 18.74249 12.93978 
1 1 1    2   16   13 f  617.641   6.1871  292.019   5.8491  294.979   8.2969  289.094   8.2471  620.695   8.7331  614.470   8.7686 6.224548 12.37562 
1 1 1    2   16   14 o  362.714   6.1992  100.707   3.4417   99.599   4.8299  101.851   4.9056  360.673   8.7489  364.728   8.7872 -4.054291 12.39990 
1 1 1    2   16   15 o  1174.03   9.7615  1055.39   17.541  1051.27   30.182  1057.49   21.556  1171.15   16.837  1175.04   11.985 -3.894653 20.66699 
1 1 1    2   16   16 o  575.743   8.6612  253.783   7.6327  253.078   10.790  254.489   10.799  574.832   12.263  576.434   12.239 -1.601929 17.32578 
1 1 1    2   16   17 o  1134.62   9.6033  985.678   16.678  991.278   20.605  975.041   28.400  1137.70   11.832  1127.98   16.449 9.718018 20.26266 
1 1 1    2   16   18 o  1409.45   9.7445  1521.04   21.022  1510.50   29.497  1531.91   29.968  1404.24   13.724  1414.15   13.845 -9.904663 19.49435 
1 1 1    2   16   19 o  469.387   6.6396  168.653   4.7703  170.212   6.6973  167.048   6.7962  471.504   9.2800  467.095   9.5058 4.408600 13.28452 
1 1 1    2   16   20 f  742.695   7.0119  422.247   7.9710  427.793   11.346  416.843   11.201  747.465   9.9170  737.836   9.9180 9.628601 14.02545 
1 1 1    2   16   21 o  993.974   7.9253  756.362   12.058  750.443   16.855  762.567   17.256  989.922   11.124  997.876   11.298 -7.953857 15.85504 
1 1 1    2   16   22 o  1354.63   13.571  1405.77   28.138  1405.77   28.138   0.0000   0.0000  1354.63   13.571  ?   ?  0.000000 13.57084 
1 1 1    2   16   23 o  625.184   7.0881  299.212   6.7828  288.346   9.3516  311.273   9.8526  613.642   9.9564  637.566   10.096 -23.92365 14.17968 
1 1 1    2   16   24 o  1710.67   11.505  2241.38   30.124  2255.23   42.898  2227.92   42.312  1715.24   16.339  1704.85   16.215 10.39612 23.01950 
1 1 1    2   16   25 o  690.082   10.875  364.728   11.487  364.228   15.966  365.264   16.540  689.366   15.132  690.309   15.654 -0.9436035 21.77144 
1 1 1    2   16   26 o  590.767   16.145  267.571   14.599   0.0000   0.0000  267.571   14.599  ?   ?   590.767   16.145 0.000000 16.14487 
1 1 1    2   16   27 o  976.925   8.4166  730.776   12.585  732.374   17.889  729.210   17.709  977.738   11.954  975.632   11.859 2.106201 16.83795 
1 1 1    2   16   28 o  966.987   7.4512  715.925   11.029  720.742   17.925  712.991   13.990  969.897   12.074  964.877   9.4726 5.020508 15.34676 
1 1 1    2   16   29 o  776.503   6.3991  461.608   7.6056  457.782   10.841  465.317   10.673  773.141   9.1610  779.490   8.9454 -6.349365 12.80408 
1 1 1    2   16   30 o  652.461   7.2287  325.950   7.2191  331.957   12.302  322.794   8.9157  658.162   12.212  649.214   8.9721 8.948730 15.15335 
1 1 1    2   16   31 o  589.114   8.9121  265.811   8.0361  261.537   11.321  270.152   11.409  584.130   12.662  593.680   12.555 -9.550354 17.83164 
1 1 1    2   16   32 o  742.373   7.5650  422.037   8.5961  425.228   12.189  418.879   12.125  744.947   10.690  739.362   10.714 5.585022 15.13471 
1 1 1    2   16   33 o  168.932   13.281   22.022   3.4063   22.993   4.7336   20.978   4.9054  172.031   18.256  163.977   19.956 8.054230 27.04673 
1 1 1    2   16   34 o  854.690   6.8584  559.419   8.9723  548.218   12.542  571.159   12.840  845.818   9.6879  863.331   9.7170 -17.51294 13.72133 
1 1 1    2   16   35 o  353.073   8.2311   95.506   4.4483   94.837   6.3233   96.162   6.2589  351.639   11.748  354.100   11.548 -2.460541 16.47348 
1 1 1    2   16   36 o  457.713   7.2703  160.486   5.0935  163.139   7.2227  157.861   7.1839  461.269   10.230  453.735   10.344 7.533722 14.54826 
1 1 1    2   16   37 o  524.834   7.0735  211.020   5.6823  211.829   8.0738  210.226   7.9988  525.570   10.036  523.584   9.9809 1.986206 14.15442 
1 1 1    2   16   38 o  391.185   7.8091  117.275   4.6757  117.195   6.5621  117.359   6.6641  390.786   10.971  391.044   11.134 -0.2574463 15.63067 
1 1 1    2   16   39 o  601.302   7.5093  277.109   6.9113  284.501   10.881  272.110   8.9483  608.648   11.679  595.549   9.8164 13.09863 15.25691 
1 1 1    2   16   40 o  350.041   9.5098   94.014   5.0952   99.011   7.2884   89.238   7.1257  358.787   13.272  340.568   13.670 18.21860 19.05245 
1 1 1    2   16   41 o  324.759   10.830   81.014   5.3835   82.896   6.4472   76.679   9.7843  328.267   12.831  313.828   20.481 14.43951 24.16869 
1 1 1    2   16   42 o  130.179   17.122   13.320   3.3288   18.925   4.7867   8.0713   4.6323  154.785   20.724  100.042   28.735 54.74373 35.42880 
1 1 1    2   16   43 o  177.288   16.786   24.526   4.5009   17.665   9.4589   26.535   5.1174  145.092   40.856  184.120   18.405 -39.02798 44.81009 
1 1 1    2   16   44 o  257.475   12.642   51.082   4.9822   52.420   10.125   50.655   5.7230  256.784   26.125  255.684   14.685 1.099503 29.96943 
1 1 1    2   16   45 o  138.997   17.879   15.245   3.7156   15.055   5.1955   15.445   5.3160  136.029   25.899  137.745   26.171 -1.715836 36.81941 
1 1 1    2   16   46 o  153.701   16.326   18.530   3.7821   19.377   5.7031   17.865   5.0530  154.858   24.905  149.175   22.859 5.682892 33.80507 
1 1 1    2   16   47 o  193.934   13.332   29.213   3.9333   30.500   5.4465   27.811   5.6864  196.937   18.277  187.436   20.136 9.500870 27.19381 
1 1 1    2   16   48 o  262.542   11.034   53.151   4.4341   55.369   6.4654   51.181   6.0926  266.430   15.927  256.216   15.610 10.21399 22.30124 
1 1 1    2   16   49 o  111.489   22.495   10.156   3.7064   14.361   5.2617   6.0151   5.2217  131.674   27.013   89.351   31.120 42.32232 41.20889 
1 1 1    2   16   50 o  367.755   9.2288  104.133   5.1949   98.348   7.2053  110.396   7.4966  356.265   13.213  377.539   12.973 -21.27457 18.51717 
1 1 1    2   16   51 o   48.493   22.216  -2.3472   3.7225   3.0666   5.2253  -7.9264   5.3045   76.384   30.195   48.598   23.487 27.78645 38.25438 
1 1 1    2   16   52 o  359.233   8.8219   99.398   4.8507  102.133   8.4245   98.042   5.9329  361.867   15.210  356.179   10.882 5.687408 18.70203 
1 1 1    2   16   53 o  179.074   15.571   25.245   4.2254   28.715   6.2683   22.355   5.7205  188.529   22.144  165.634   23.201 22.89528 32.07198 
1 1 1    2   16   54 o  241.203   16.389   45.856   6.0149   50.425   6.9789   32.659   11.860  252.148   18.205  188.534   42.156 63.61433 45.91942 
1 1 1    2   16   55 o   77.145   24.770   4.8010   3.3160   3.7727   4.1524   6.6114   5.5094   74.023   27.493   91.137   31.953 -17.11428 42.15286 
1 1 1    2   16   56 o  312.080   11.629   75.695   5.5550   26.477   11.443   90.868   6.3538  165.071   44.347  341.691   12.149 -176.6204 45.98072 
1 1 1    2   16   57 f  154.412   15.012   18.934   3.5031   17.561   4.8800   20.394   5.0318  145.385   22.669  157.494   21.430 -12.10872 31.19486 
1 1 1    2   16   58 o  407.958   9.8939  129.135   6.1781   86.874   11.521  146.194   7.3195  323.960   23.391  433.346   11.035 -109.3865 25.86333 
1 1 1    2   16   59 o  119.384   19.142   11.764   3.3798   8.6914   4.6294   15.271   4.9457   98.795   28.827  133.185   25.183 -34.39003 38.27803 
1 1 1    2   16   60 o  172.395   13.282   23.588   3.4777   25.836   4.8070   21.119   5.0375  177.969   17.889  158.760   21.264 19.20888 27.78812 
1 1 1    2   16   61 o  150.028   16.812   18.397   3.7942   22.208   4.8515   12.396   6.0883  163.043   19.850  113.021   33.082 50.02263 38.58055 
1 1 1    2   16   62 o  239.874   11.028   45.240   4.0490   55.747   6.7117   39.229   5.0769  261.214   16.877  220.349   15.145 40.86432 22.67593 
1 1 1    2   17    1 o  134.245   18.559   14.089   3.7115   0.0000   0.0000   14.089   3.7115  ?   ?   134.245   18.559 0.000000 18.55913 
1 1 1    2   17    2 o  1016.34   15.156  791.891   23.578   0.0000   0.0000  791.891   23.578  ?   ?   1016.34   15.156 0.000000 15.15620 
1 1 1    2   17    3 o  1166.39   11.808  1042.26   21.080  1063.51   30.587  1023.04   29.093  1177.57   16.970  1155.02   16.456 22.54907 23.63857 
1 1 1    2   17    4 o  496.631   8.2850  188.853   6.2979  184.749   8.8664  193.032   8.9474  491.080   11.796  501.973   11.645 -10.89319 16.57550 
1 1 1    2   17    5 o  1155.76   11.734  1023.29   20.758  1032.45   29.729  1014.57   28.997  1160.34   16.739  1150.28   16.470 10.05603 23.48265 
1 1 1    2   17    6 o  924.539   8.3352  654.483   11.795  655.920   14.489  651.658   20.310  925.442   10.229  922.106   14.390 3.335999 17.65517 
1 1 1    2   17    7 o  357.786   6.9357   98.000   3.7982   98.144   4.6058   97.692   6.7152  358.023   8.4047  357.102   12.286 0.9210205 14.88535 
1 1 1    2   17    8 o  721.497   6.4508  398.497   7.1239  404.855   10.198  392.438   9.9555  727.131   9.1632  715.897   9.0854 11.23480 12.90380 
1 1 1    2   17    9 o  852.545   6.9643  556.422   9.0879  551.118   12.744  561.911   12.963  848.347   9.8145  856.610   9.8868 -8.262939 13.93100 
1 1 1    2   17   10 o  1086.73   8.0193  904.158   13.339  914.642   19.078  894.130   18.658  1092.80   11.406  1080.48   11.282 12.31433 16.04254 
1 1 1    2   17   11 o  825.105   6.8841  521.163   8.6941  526.560   12.416  515.972   12.178  829.253   9.7822  820.878   9.6922 8.375366 13.77062 
1 1 1    2   17   12 o  1061.81   9.1354  863.238   14.847  862.101   25.685  863.808   18.195  1060.64   15.821  1062.04   11.193 -1.406372 19.38025 
1 1 1    2   17   13 o  1648.52   12.641  2081.54   31.895  2062.08   54.610  2091.62   39.294  1639.46   21.762  1652.15   15.538 -12.69373 26.74003 
1 1 1    2   17   14 o   84.210   22.706   5.6234   2.9935   5.5462   4.1273   5.7091   4.3482   86.113   27.632   87.649   28.387 -1.535873 39.61553 
1 1 1    2   17   15 o  858.611   8.2137  564.385   10.795  566.314   13.292  560.648   18.499  860.005   10.098  855.490   14.127 4.515747 17.36502 
1 1 1    2   17   16 o  566.810   6.4260  245.924   5.5751  240.347   7.7419  251.931   8.0349  560.292   9.0274  573.632   9.1512 -13.34027 12.85455 
1 1 1    2   17   17 o  579.198   6.5249  256.792   5.7846  248.037   7.9884  266.444   8.3874  569.182   9.1694  589.920   9.2889 -20.73853 13.05222 
1 1 1    2   17   18 o  2123.96   13.676  3455.64   44.462  3424.30   62.133  3488.54   63.653  2113.36   19.208  2133.04   19.496 -19.67236 27.36852 
1 1 1    2   17   19 o  1005.32   7.9213  773.714   12.189  766.161   17.025  781.655   17.459  1000.24   11.120  1010.30   11.290 -10.05365 15.84698 
1 1 1    2   17   20 o  1004.42   7.9581  772.355   12.235  768.402   17.143  776.459   17.467  1001.69   11.181  1006.92   11.333 -5.228577 15.92030 
1 1 1    2   17   21 o  597.704   6.9981  273.482   6.4023  279.666   9.0822  267.374   9.0266  604.345   9.8183  590.910   9.9801 13.43536 14.00003 
1 1 1    2   17   22 o  1659.24   11.191  2108.50   28.420  2093.12   39.793  2124.51   40.605  1652.60   15.731  1664.92   15.934 -12.31531 22.39099 
1 1 1    2   17   23 o  527.521   7.3381  213.040   5.9251  218.982   8.4468  207.285   8.3135  534.741   10.320  520.259   10.440 14.48230 14.67965 
1 1 1    2   17   24 o  139.963   27.609   15.588   5.7045   37.590   8.4290  -3.0051   7.7487  219.699   25.542   75.110   33.435 144.5891 42.07512 
1 1 1    2   17   25 o  1301.95   11.058  1298.35   22.035  1327.03   39.281  1285.18   26.618  1315.09   19.514  1295.07   13.428 20.02209 23.68815 
1 1 1    2   17   26 o  719.171   7.7832  395.999   8.5676  397.051   12.161  394.963   12.072  719.965   11.035  718.072   10.984 1.893066 15.56997 
1 1 1    2   17   27 o  297.442   11.239   67.775   5.1169   61.129   7.2074   74.529   7.2658  281.815   16.785  311.784   15.225 -29.96854 22.66136 
1 1 1    2   17   28 o  539.284   7.1065  222.667   5.8660  209.836   9.6899  230.090   7.3699  523.309   12.097  548.138   8.7841 -24.82990 14.95015 
1 1 1    2   17   29 f  532.781   7.4034  217.344   6.0374  222.521   10.326  214.656   7.4418  538.845   12.520  529.406   9.1838 9.438904 15.52731 
1 1 1    2   17   30 o  886.357   6.7004  601.514   9.0904  616.880   13.114  587.303   12.612  897.406   9.5474  875.640   9.4099 21.76642 13.40521 
1 1 1    2   17   31 o  686.725   7.4422  361.128   7.8226  370.243   11.320  352.798   10.822  695.123   10.640  678.566   10.420 16.55658 14.89198 
1 1 1    2   17   32 o  547.019   7.6903  229.167   6.4389  218.818   11.010  234.546   7.9380  534.136   13.467  553.307   9.3729 -19.17090 16.40741 
1 1 1    2   17   33 o  454.015   6.9963  157.859   4.8620  159.490   6.8016  156.154   6.9526  456.213   9.7403  451.397   10.063 4.816254 14.00476 
1 1 1    2   17   34 o  417.098   7.2688  133.251   4.6406  136.265   6.6253  130.348   6.5019  421.618   10.266  412.360   10.301 9.257324 14.54363 
1 1 1    2   17   35 o  563.472   6.7829  243.184   5.8500  235.238   8.0826  251.926   8.4778  553.972   9.5322  573.274   9.6616 -19.30133 13.57241 
1 1 1    2   17   36 o  365.142   7.8740  102.163   4.4008  101.688   6.2587  102.629   6.1891  364.060   11.232  365.755   11.055 -1.695068 15.75971 
1 1 1    2   17   37 o  614.620   7.8311  289.497   7.3671  266.351   12.245  302.629   9.2233  588.733   13.588  628.192   9.5923 -39.45892 16.63282 
1 1 1    2   17   38 o  588.884   7.4381  265.765   6.7044  271.233   10.482  261.978   8.7220  594.340   11.522  584.385   9.7509 9.954590 15.09435 
1 1 1    2   17   39 o  492.424   8.3710  185.934   6.3094  186.065   8.9698  185.806   8.8766  492.109   11.908  491.785   11.792 0.3242798 16.75910 
1 1 1    2   17   40 o  134.480   20.302   14.316   4.0488   16.194   4.6381   8.3026   8.3000  142.844   21.913  109.008   39.118 33.83544 44.83779 
1 1 1    2   17   41 o   48.911   21.405  -0.6464   3.0506  -2.3755   4.3740   0.9914   4.2569   54.101   24.512   64.263   26.573 -10.16198 36.15173 
1 1 1    2   17   42 o  130.658   16.567   13.403   3.2388   10.172   4.5952   16.593   4.5655  111.594   27.159  144.564   21.269 -32.97023 34.49620 
1 1 1    2   17   43 o  229.883   13.909   40.912   4.8710   31.191   9.5942   44.288   5.6539  195.091   33.326  238.881   15.548 -43.78918 36.77441 
1 1 1    2   17   44 o  220.033   11.979   37.405   4.0192   35.641   5.5260   39.386   5.8565  213.732   17.033  224.715   17.157 -10.98270 24.17595 
1 1 1    2   17   45 o   87.600   25.407   6.2005   3.6056  -0.5562   5.0551   13.198   5.1444   63.741   27.732  126.691   27.331 -62.95070 38.93644 
1 1 1    2   17   46 o  162.869   15.168   20.733   3.7379   21.079   5.3744   20.408   5.2020  162.361   22.208  159.828   21.836 2.533508 31.14497 
1 1 1    2   17   47 o  140.509   16.997   15.584   3.5812   19.893   5.1196   11.455   5.0112  157.621   21.804  117.322   28.245 40.29851 35.68189 
1 1 1    2   17   48 o  132.833   18.732   14.059   3.7029   16.712   5.2358   11.404   5.2374  143.155   24.793  116.686   29.351 26.46927 38.42144 
1 1 1    2   17   49 o   98.020   24.430   7.9455   3.6522  -0.5360   5.0986   16.884   5.2342   63.607   27.758  143.752   24.677 -80.14494 37.14138 
1 1 1    2   17   50 o  294.296   10.536   66.830   4.7461   74.893   6.9093   59.627   6.5307  310.397   14.543  276.259   15.507 34.13748 21.25945 
1 1 1    2   17   51 o  279.655   11.607   60.494   4.9682   60.168   7.4123   60.760   6.6945  276.483   17.607  278.607   15.763 -2.124481 23.63212 
1 1 1    2   17   52 o   58.875   25.412  -0.0461   4.1779  -7.1042   5.5195   9.4230   6.3931   51.237   24.556  105.969   34.429 -54.73112 42.28871 
1 1 1    2   17   53 o  304.010   13.522   71.919   6.2920   78.998   7.3371   52.244   12.232  317.984   15.075  247.607   33.103 70.37708 36.37396 
1 1 1    2   17   54 o  161.257   22.791   21.267   5.4686   15.279   6.1286   44.667   12.114  132.885   30.742  225.495   36.333 -92.61014 47.59375 
1 1 1    2   17   55 o   62.878   27.992  -1.1493   5.4321  -9.2046   11.151   1.3568   6.2200   75.868   35.946   74.064   31.465 1.803848 47.77224 
1 1 1    2   17   56 o  120.461   24.769   12.286   4.4144   18.012   6.0040   5.5493   6.5127  144.746   28.113   88.483   34.074 56.26314 44.17458 
1 1 1    2   17   57 o  347.914   14.340   95.209   7.6364   0.0000   0.0000   95.209   7.6364  ?   ?   347.914   14.340 0.000000 14.33993 
1 1 1    2   17   58 o   83.221   28.691   5.7234   4.4329   8.7492   6.2583   2.6767   6.2798   99.395   34.100   76.847   32.066 22.54822 46.80905 
1 1 1    2   17   59 o  214.900   18.007   37.462   5.8684   39.250   7.1330   33.717   10.324  217.264   21.741  187.745   37.239 29.51830 43.12146 
1 1 1    2   17   60 o  148.452   20.849   18.521   4.6068   14.628   6.4599   22.550   6.5715  123.340   33.397  158.723   28.076 -35.38387 43.63049 
1 1 1    2   17   61 o  138.097   17.737   15.770   3.6624   12.155   5.8575   18.090   4.6929  111.861   32.365  145.483   21.742 -33.62179 38.98979 
1 1 1    2   18    1 o  1207.59   17.177  1118.10   31.749   0.0000   0.0000  1118.10   31.749  ?   ?   1207.59   17.177 0.000000 17.17698 
1 1 1    2   18    2 o  1349.46   18.653  1396.68   38.528   0.0000   0.0000  1396.68   38.528  ?   ?   1349.46   18.653 0.000000 18.65298 
1 1 1    2   18    3 o  233.558   9.8725   41.772   3.5293   42.522   5.1322   41.100   4.8612  235.130   14.329  231.195   13.800 3.935181 19.89363 
1 1 1    2   18    4 o  1030.27   10.959  812.932   17.282  809.396   24.459  816.455   24.421  1027.65   15.550  1032.13   15.458 -4.480103 21.92624 
1 1 1    2   18    5 o  255.512   9.4537   49.991   3.6973   52.903   5.3217   47.274   5.1405  262.444   13.291  248.031   13.592 14.41226 19.01050 
1 1 1    2   18    6 o  216.661   8.5404   35.941   2.8322   34.482   3.4574   38.917   4.9383  211.924   10.693  224.906   14.421 -12.98186 17.95302 
1 1 1    2   18    7 f  666.977   7.3167  340.559   7.4696  343.068   9.1715  335.617   12.873  669.380   8.9516  661.920   12.705 7.459290 15.54222 
1 1 1    2   18    8 f  980.189   7.5437  735.519   11.318  737.166   16.022  733.880   15.990  981.134   10.669  978.945   10.671 2.189331 15.08977 
1 1 1    2   18    9 o  1485.06   11.603  1689.04   26.375  1695.97   45.872  1685.61   32.237  1487.05   20.153  1483.30   14.199 3.748047 24.65292 
1 1 1    2   18   10 o  1571.54   12.157  1891.56   29.242  1908.67   51.128  1883.23   35.648  1577.42   21.176  1567.79   14.855 9.632568 25.86680 
1 1 1    2   18   11 o  541.736   7.1466  224.660   5.9259  232.937   10.443  220.728   7.1969  551.485   12.371  536.941   8.7568 14.54419 15.15684 
1 1 1    2   18   12 o  626.601   7.3040  300.562   7.0052  306.515   8.7144  289.689   11.777  632.734   8.9980  615.009   12.511 17.72534 15.41082 
1 1 1    2   18   13 o  1001.71   8.9132  768.219   13.666  761.709   16.655  781.632   23.909  997.358   10.910  1010.03   15.465 -12.66864 18.92603 
1 1 1    2   18   14 o  440.970   6.4341  148.848   4.3428  144.179   6.0974  153.655   6.1868  433.954   9.1797  447.991   9.0225 -14.03680 12.87136 
1 1 1    2   18   15 f  648.064   6.5971  321.488   6.5440  315.486   9.0979  327.922   9.4197  641.922   9.2596  654.446   9.4036 -12.52466 13.19723 
1 1 1    2   18   16 o  2118.65   13.648  3438.35   44.259  3457.57   62.959  3419.58   62.230  2123.59   19.370  2111.92   19.251 11.67554 27.30887 
1 1 1    2   18   17 o  1417.37   9.8588  1538.20   21.388  1521.70   29.818  1555.69   30.696  1409.42   13.822  1425.05   14.073 -15.63037 19.72545 
1 1 1    2   18   18 o  457.795   6.9306  160.431   4.8564  150.321   6.6146  172.253   7.1527  443.082   9.7533  474.303   9.8525 -31.22043 13.86357 
1 1 1    2   18   19 o  209.381   10.058   33.570   3.2234   31.164   4.4606   36.199   4.6633  201.151   14.587  216.911   14.123 -15.75929 20.30343 
1 1 1    2   18   20 o  654.411   6.9605  327.838   6.9721  324.115   9.7439  331.744   9.9803  650.598   9.7847  658.207   9.9063 -7.608582 13.92394 
1 1 1    2   18   21 f  1622.58   11.002  2016.32   27.325  2036.88   39.058  1996.61   38.242  1630.23   15.653  1614.06   15.479 16.16931 22.01390 
1 1 1    2   18   22 o  1456.51   11.785  1624.96   26.273  1632.43   32.285  1610.32   45.211  1459.54   14.451  1448.69   20.389 10.84680 24.99117 
1 1 1    2   18   23 o  987.728   11.664  747.312   17.634  749.633   25.024  745.021   24.854  988.816   16.534  985.777   16.472 3.039673 23.33842 
1 1 1    2   18   24 o  724.796   7.5346  402.199   8.3588  393.642   11.720  411.058   11.925  716.902   10.681  732.592   10.635 -15.69000 15.07225 
1 1 1    2   18   25 o  888.285   8.0241  604.156   10.910  605.867   15.494  602.474   15.364  889.329   11.383  886.840   11.319 2.488770 16.05223 
1 1 1    2   18   26 o  1008.18   8.5684  778.329   13.222  784.647   18.949  772.334   18.459  1011.96   12.233  1004.01   12.012 7.950256 17.14461 
1 1 1    2   18   27 o   41.671   20.438  -8.9388   4.4470   0.2524   6.3990 -17.5240   6.1845   75.600   32.005   43.586   21.828 32.01366 38.74029 
1 1 1    2   18   28 o  412.492   9.5661  130.324   6.0398  126.617   8.4650  134.169   8.6202  406.413   13.608  418.365   13.462 -11.95209 19.14119 
1 1 1    2   18   29 o  391.165   7.0213  117.157   4.2038  113.155   5.8726  121.364   6.0204  384.332   9.9829  398.032   9.8818 -13.70093 14.04662 
1 1 1    2   18   31 o  412.533   6.8887  130.318   4.3498  129.148   6.1173  131.514   6.1863  410.562   9.7345  414.304   9.7553 -3.742188 13.78137 
1 1 1    2   18   32 o  897.909   6.7601  617.409   9.2908  624.942   13.280  610.187   13.003  903.086   9.6074  892.371   9.5196 10.71454 13.52496 
1 1 1    2   18   33 o   52.522   21.681   0.5985   2.8269   1.5774   4.0964  -0.2915   3.9060   66.026   26.524   57.392   24.671 8.633961 36.22366 
1 1 1    2   18   34 o  348.479   7.6995   93.034   4.1069   86.686   5.6899   99.937   5.9337  336.198   11.057  361.002   10.739 -24.80383 15.41352 
1 1 1    2   18   35 o  779.928   6.7175  465.941   8.0192  474.944   11.451  457.276   11.234  787.079   9.5051  772.302   9.5033 14.77747 13.44096 
1 1 1    2   18   36 o  376.559   7.5472  108.654   4.3500  104.559   6.1128  112.855   6.1916  369.152   10.819  383.543   10.547 -14.39099 15.10872 
1 1 1    2   18   37 o  188.795   11.415   27.465   3.2831   25.637   4.5627   29.427   4.7277  181.676   16.591  194.836   15.994 -13.15958 23.04499 
1 1 1    2   18   38 o  410.626   8.5649  129.299   5.3832  122.110   7.4512  137.149   7.7858  398.637   12.212  422.497   12.040 -23.85928 17.14868 
1 1 1    2   18   39 o  207.537   13.479   33.280   4.2587   36.371   4.8743   23.307   8.7550  216.801   14.777  168.557   35.076 48.24382 38.06128 
1 1 1    2   18   40 o  389.899   7.8399  116.580   4.6788  122.398   6.5351  110.462   6.7016  399.163   10.696  379.081   11.550 20.08157 15.74203 
1 1 1    2   18   41 o  230.533   10.294   40.830   3.6325   40.137   5.2074   41.486   5.0696  227.590   15.033  231.521   14.377 -3.930466 20.80109 
1 1 1    2   18   42 o  487.442   8.6841  182.388   6.4791  169.338   11.503  188.453   7.8414  467.976   16.058  495.166   10.346 -27.19049 19.10273 
1 1 1    2   18   43 o  151.568   15.247   17.936   3.4893   19.526   4.9499   16.366   4.9194  156.848   21.158  142.807   23.310 14.04149 31.48044 
1 1 1    2   18   44 o  336.056   9.4853   86.810   4.8790   86.425   7.0093   87.172   6.7957  334.518   13.689  336.065   13.211 -1.547241 19.02454 
1 1 1    2   18   45 o  307.602   9.3585   72.757   4.4062   67.858   6.3110   77.416   6.1546  296.220   13.919  316.670   12.698 -20.45081 18.84072 
1 1 1    2   18   46 o  272.667   10.083   57.239   4.2083   55.018   6.0002   59.389   5.9039  266.020   14.795  276.642   13.988 -10.62225 20.36053 
1 1 1    2   18   47 o   53.670   22.944   0.0541   3.3453   2.0630   4.8852  -1.7196   4.5904   71.317   28.854   56.975   25.521 14.34170 38.52052 
1 1 1    2   18   48 o  279.953   10.241   60.404   4.3884   59.850   6.1111   60.994   6.3059  277.345   14.446  279.885   14.772 -2.539948 20.66115 
1 1 1    2   18   49 o  285.085   10.174   62.662   4.4397   63.887   6.3644   61.502   6.1964  286.397   14.566  281.024   14.454 5.372375 20.52084 
1 1 1    2   18   50 o   90.624   26.795   6.7675   3.9762   12.378   5.8156   1.8422   5.4487  120.501   31.263   72.983   30.111 47.51867 43.40578 
1 1 1    2   18   51 o  295.566   14.599   68.038   6.6045   66.658   7.0212   78.643   19.460  291.727   15.783  295.648   44.373 -3.920837 47.09609 
1 1 1    2   18   52 o  290.977   13.740   65.882   6.1195   68.833   7.1243   57.579   11.951  296.260   15.768  262.506   30.300 33.75381 34.15737 
1 1 1    2   18   53 o  223.437   14.036   39.068   4.7758   33.222   6.4232   46.294   7.1419  203.210   20.951  240.906   19.537 -37.69669 28.64696 
1 1 1    2   18   54 o  271.634   14.850   57.926   6.1506   62.395   7.0723   44.053   12.460  281.123   16.508  221.941   38.048 59.18196 41.47521 
1 1 1    2   18   55 o  134.461   29.881   15.737   5.9901   0.1390   10.537   23.184   7.2810   88.007   39.093  163.797   30.152 -75.79012 49.37002 
1 1 1    2   18   56 o  135.384   22.959   15.302   4.5877   17.723   6.6704   13.129   6.3198  141.148   31.656  120.510   33.201 20.63824 45.87356 
1 1 1    2   18   57 o  166.807   18.331   22.527   4.6032   21.850   6.5195   23.201   6.5003  158.908   27.817  164.544   26.727 -5.636902 38.57620 
1 1 1    2   18   58 o  280.913   15.031   62.672   6.4396   43.520   10.664   73.662   8.0787  219.672   32.715  302.675   17.513 -83.00314 37.10751 
1 1 1    2   18   59 o  176.650   17.365   25.367   4.6346   23.162   6.6524   27.447   6.4604  161.674   27.890  179.152   24.177 -17.47754 36.91041 
1 1 1    2   18   60 o  130.597   21.681   14.555   4.1820   11.806   5.8510   17.426   5.9797  110.801   32.431  137.717   29.269 -26.91583 43.68589 
1 1 1    2   18   61 o  110.924   25.077   11.049   4.1577   14.782   6.2660   8.1122   5.5572  122.747   32.746   92.632   32.113 30.11526 45.86469 
1 1 1    2   19    1 o  857.902   13.983  563.848   18.362   0.0000   0.0000  563.848   18.362  ?   ?   857.902   13.983 0.000000 13.98332 
1 1 1    2   19    2 o  1890.68   24.605  2744.42   71.205   0.0000   0.0000  2744.42   71.205  ?   ?   1890.68   24.605 0.000000 24.60488 
1 1 1    2   19    3 o  876.723   10.183  588.571   13.664  558.578   18.604  623.706   20.135  853.873   14.235  902.256   14.580 -48.38373 20.37657 
1 1 1    2   19    4 o  1024.17   15.540  803.750   24.361   0.0000   0.0000  803.750   24.361  ?   ?   1024.17   15.540 0.000000 15.53983 
1 1 1    2   19    5 o   43.607   20.668  -4.5129   3.6925   0.0000   0.0000  -4.5129   3.6925  ?   ?    43.607   20.668 0.000000 20.66799 
1 1 1    2   19    6 o  1352.46   18.739  1402.33   38.791   0.0000   0.0000  1402.33   38.791  ?   ?   1352.46   18.739 0.000000 18.73856 
1 1 1    2   19    7 o  566.218   8.7598  245.454   7.5919  245.454   10.728  245.454   10.745  566.111   12.381  566.110   12.401 0.6713867E-03 17.52297 
1 1 1    2   19    8 o  466.383   7.2250  166.508   5.1576  163.258   6.3362  172.891   8.8791  461.777   8.9645  475.127   12.209 -13.34970 15.14688 
1 1 1    2   19    9 o  1332.13   10.736  1358.85   21.892  1377.30   27.233  1325.15   36.804  1340.95   13.268  1314.82   18.287 26.12695 22.59377 
1 1 1    2   19   10 o  689.481   7.5697  363.917   7.9886  358.733   9.7112  374.769   14.050  684.506   9.2688  699.496   13.123 -14.99036 16.06586 
1 1 1    2   19   11 o  560.651   7.3119  240.622   6.2747  235.958   7.6566  250.160   10.949  555.155   9.0106  571.517   12.517 -16.36200 15.42263 
1 1 1    2   19   12 o  1871.02   12.228  2681.03   35.019  2664.91   49.159  2697.64   49.899  1864.75   17.223  1876.14   17.376 -11.39111 24.46562 
1 1 1    2   19   13 o  903.000   7.4076  624.206   10.239  614.369   14.304  634.542   14.662  895.741   10.433  910.324   10.523 -14.58258 14.81777 
1 1 1    2   19   14 o  559.551   6.5288  239.667   5.5917  244.255   7.9606  235.200   7.8561  564.823   9.2080  554.254   9.2604 10.56915 13.05921 
1 1 1    2   19   15 o  843.079   7.2783  544.113   9.3922  542.984   13.216  545.266   13.351  842.095   10.253  843.859   10.336 -1.763916 14.55901 
1 1 1    2   19   16 o  968.033   7.7808  717.389   11.529  714.850   16.229  719.976   16.381  966.171   10.974  969.625   11.037 -3.453918 15.56431 
1 1 1    2   19   17 f  1293.67   9.2688  1281.39   18.353  1271.95   25.681  1291.25   26.239  1288.61   13.021  1298.33   13.203 -9.721313 18.54364 
1 1 1    2   19   18 o  112.263   17.631   9.8951   2.9298   12.117   4.0100   7.3506   4.2910  123.834   21.960   96.670   27.622 27.16342 35.28773 
1 1 1    2   19   19 o  1122.31   8.5158  964.383   14.629  959.138   20.555  969.766   20.824  1119.03   12.001  1125.20   12.091 -6.175781 17.03556 
1 1 1    2   19   20 o  383.165   8.9711  112.415   5.2614  113.375   6.3454  110.304   9.4121  384.756   10.775  379.341   16.210 5.415405 19.46445 
1 1 1    2   19   21 o  428.077   11.213  140.356   7.3468  143.903   10.416  136.844   10.364  433.286   15.706  422.512   16.026 10.77396 22.43875 
1 1 1    2   19   22 o  509.529   8.6903  198.791   6.7776  198.208   12.112  199.057   8.1777  508.497   15.562  509.811   10.480 -1.313141 18.76192 
1 1 1    2   19   23 o  1036.43   8.4338  822.496   13.379  835.908   19.228  809.909   18.628  1044.57   12.026  1028.21   11.836 16.35620 16.87396 
1 1 1    2   19   24 o  1166.55   9.0095  1042.09   16.087  1033.50   22.591  1050.93   22.913  1161.38   12.709  1171.12   12.782 -9.745972 18.02480 
1 1 1    2   19   25 o  739.901   7.9118  419.181   8.9602  425.093   12.682  413.290   12.661  744.919   11.123  734.495   11.262 10.42395 15.82869 
1 1 1    2   19   26 o  252.648   12.551   48.916   4.8535   49.660   6.9284   48.199   6.8011  253.757   17.954  249.983   17.893 3.773666 25.34750 
1 1 1    2   19   27 o  611.586   8.3349  286.436   7.8023  287.939   11.191  285.015   10.884  612.986   11.928  609.882   11.659 3.103394 16.67931 
1 1 1    2   19   28 o  314.682   12.674   75.905   6.1048   74.935   9.9608   76.489   7.7258  311.536   21.012  315.332   16.060 -3.796082 26.44649 
1 1 1    2   19   29 o  242.626   17.881   45.452   6.5938   43.303   9.5668   47.397   9.1008  235.426   27.039  246.881   24.403 -11.45491 36.42314 
1 1 1    2   19   30 o  451.128   6.7121  155.839   4.6347  150.280   6.4845  161.646   6.6268  442.883   9.5658  459.333   9.4256 -16.45044 13.42928 
1 1 1    2   19   31 o  1015.58   7.0204  789.879   10.913  783.880   15.345  796.019   15.524  1011.38   9.9122  1019.17   9.9511 -7.795593 14.04556 
1 1 1    2   19   32 o  352.669   7.4485   95.268   4.0208   96.414   5.6528   94.094   5.7202  354.640   10.414  350.331   10.668 4.308746 14.90776 
1 1 1    2   19   33 o  333.907   7.6400   85.414   3.9047   81.702   5.4533   89.320   5.5936  326.399   10.915  341.289   10.708 -14.88950 15.29059 
1 1 1    2   19   34 o  247.471   8.8813   46.941   3.3641   46.318   4.7380   47.575   4.7774  245.304   12.662  248.628   12.595 -3.324051 17.85937 
1 1 1    2   19   35 o  540.276   7.9392  223.699   6.5654  214.285   11.153  228.692   8.1219  528.056   13.799  546.086   9.7168 -18.02960 16.87659 
1 1 1    2   19   36 o  548.893   7.9395  230.928   6.6704  201.939   11.294  246.457   8.2661  512.393   14.400  566.858   9.5270 -54.46545 17.26658 
1 1 1    2   19   37 o  592.693   7.9747  269.302   7.2346  266.011   10.124  272.736   10.342  588.567   11.237  595.942   11.338 -7.375183 15.96364 
1 1 1    2   19   38 o  172.406   15.489   23.089   4.0438   21.984   4.6605   26.456   8.1341  167.663   18.467  181.220   30.401 -13.55646 35.57049 
1 1 1    2   19   39 o  357.093   9.3283   97.865   5.0986   98.769   6.0502   95.649   9.4706  358.540   11.025  351.322   17.668 7.217316 20.82560 
1 1 1    2   19   40 o  315.836   8.5402   76.541   4.1286   68.485   5.8472   84.550   5.8302  298.270   12.808  331.601   11.487 -33.33105 17.20405 
1 1 1    2   19   41 o  424.716   9.0091  138.490   5.8566  128.000   10.601  143.098   7.0263  406.657   17.031  431.454   10.639 -24.79785 20.08124 
1 1 1    2   19   42 o  181.164   12.263   25.395   3.3804   20.584   4.5754   31.177   5.0161  161.723   18.837  199.995   16.534 -38.27269 25.06400 
1 1 1    2   19   43 o  258.470   10.368   51.390   4.1019   52.493   5.7975   50.284   5.8043  260.178   14.617  254.547   14.963 5.630615 20.91796 
1 1 1    2   19   44 o  206.172   11.139   32.837   3.5021   36.063   4.9830   29.689   4.9230  215.246   15.223  194.858   16.666 20.38754 22.57220 
1 1 1    2   19   45 f  101.965   21.329   8.4517   3.2219   9.7154   4.6247   7.2599   4.4912  108.276   27.771   94.588   28.595 13.68755 39.86081 
1 1 1    2   19   46 o   44.631   20.428  -2.0393   3.1379  -5.3257   4.5020   1.0658   4.3761   47.745   22.685   64.671   26.858 -16.92543 35.15655 
1 1 1    2   19   47 o   59.237   23.726   1.4767   3.2673   2.6005   4.6381   0.3697   4.6033   72.074   28.462   63.484   27.022 8.590271 39.24585 
1 1 1    2   19   48 o   69.205   24.978   3.2907   3.3892   6.6271   4.7373  -0.2077   4.8509   91.120   29.639   63.052   27.298 28.06783 40.29447 
1 1 1    2   19   49 o   62.305   26.783   0.0845   4.6035  -1.1840   5.1610   5.0218   10.182   61.994   27.457  100.889   41.340 -38.89486 49.62707 
1 1 1    2   19   50 o  282.046   15.705   62.268   6.7529   58.870   7.1996   87.132   19.475  273.577   17.282  314.826   41.419 -41.24857 44.87981 
1 1 1    2   19   51 o  190.230   15.189   28.412   4.3858   44.949   6.4666   14.326   5.9683  238.493   17.844  129.359   30.619 109.1338 35.43874 
1 1 1    2   19   52 o  151.863   23.693   18.926   5.3276   21.255   6.0118   10.405   11.499  160.381   25.331  116.472   45.157 43.90852 51.77676 
1 1 1    2   19   53 o   80.729   27.733   5.0830   4.1399  -2.9273   5.6933   14.070   6.0305   60.267   27.560  127.203   31.208 -66.93575 41.63537 
1 1 1    2   19   54 o  214.825   17.786   36.770   5.7956   27.168   11.899   39.756   6.6360  167.138   45.354  222.463   19.692 -55.32474 49.44458 
1 1 1    2   19   55 o  145.014   22.233   17.379   4.7776   22.539   7.0130   12.911   6.5262  161.445   29.466  119.597   34.027 41.84750 45.01207 
1 1 1    2   19   56 o  156.497   18.482   19.838   4.3417   18.020   6.1984   21.588   6.0835  143.442   29.224  159.437   25.811 -15.99469 38.98989 
1 1 1    2   19   57 o  169.469   17.537   23.184   4.4831   32.224   6.6200   15.527   6.0928  197.092   22.339  131.347   30.834 65.74431 38.07555 
1 1 1    2   19   58 o  200.654   15.307   32.187   4.6657   36.175   6.8741   28.782   6.3531  208.327   21.885  184.899   22.941 23.42877 31.70559 
1 1 1    2   19   59 o   63.274   25.885   2.0034   3.9843  -4.8153   5.6932   8.5486   5.5778   54.424   25.757   96.077   32.198 -41.65321 41.23246 
1 1 1    2   19   60 f  159.194   19.747   21.232   4.7085   10.282   8.0192   26.993   5.8166  101.719   38.122  178.123   21.789 -76.40421 43.90906 
1 1 1    2   20    1 o  898.493   14.419  618.435   19.830   0.0000   0.0000  618.435   19.830  ?   ?   898.493   14.419 0.000000 14.41875 
1 1 1    2   20    2 o  293.053   13.007   65.778   5.8344   0.0000   0.0000   65.778   5.8344  ?   ?   293.053   13.007 0.000000 13.00707 
1 1 1    2   20    3 o  961.818   10.678  708.366   15.720  714.528   22.584  702.575   21.895  965.721   15.279  957.633   14.938 8.088318 21.36758 
1 1 1    2   20    4 o  952.444   10.634  694.623   15.503  707.940   22.426  682.434   21.455  961.262   15.242  943.813   14.852 17.44885 21.28125 
1 1 1    2   20    5 o  1238.43   17.779  1175.51   33.701  1175.51   33.701   0.0000   0.0000  1238.43   17.779  ?   ?  0.000000 17.77873 
1 1 1    2   20    6 o  564.912   12.834  244.419   11.097  244.419   11.097   0.0000   0.0000  564.912   12.834  ?   ?  0.000000 12.83380 
1 1 1    2   20    7 o  675.034   9.2667  348.871   9.5746  348.871   9.5746   0.0000   0.0000  675.034   9.2667  ?   ?  0.000000 9.266653 
1 1 1    2   20    8 o  1759.61   16.427  2372.56   44.244  2372.56   44.244   0.0000   0.0000  1759.61   16.427  ?   ?  0.000000 16.42718 
1 1 1    2   20    9 o  630.177   6.5299  303.984   6.2985  296.689   8.7313  311.899   9.0946  622.509   9.1636  638.263   9.3093 -15.75409 13.06270 
1 1 1    2   20   10 o  559.633   6.4528  239.735   5.5274  241.953   7.8527  237.557   7.7815  562.161   9.1262  557.030   9.1268 5.130920 12.90682 
1 1 1    2   20   11 o  823.298   7.1495  518.871   9.0095  511.778   12.593  526.309   12.895  817.553   10.063  829.074   10.162 -11.52094 14.30144 
1 1 1    2   20   12 o  899.263   7.4477  619.057   10.251  622.647   14.547  615.515   14.448  901.745   10.540  896.566   10.529 5.178894 14.89744 
1 1 1    2   20   13 o  1154.14   8.5625  1019.79   15.126  1009.67   21.168  1030.35   21.622  1148.19   12.045  1159.88   12.179 -11.69153 17.12912 
1 1 1    2   20   14 o  593.602   6.6849  269.731   6.0738  263.740   8.4597  276.105   8.7258  586.907   9.4171  600.505   9.4933 -13.59790 13.37176 
1 1 1    2   20   15 o  609.993   6.7941  284.837   6.3434  282.634   8.9954  287.016   8.9468  607.553   9.6731  612.248   9.5471 -4.695374 13.59099 
1 1 1    2   20   16 o  982.995   7.8782  739.760   11.854  744.571   16.840  735.035   16.688  986.016   11.158  979.683   11.129 6.333069 15.75917 
1 1 1    2   20   17 o  348.684   7.6461   93.079   4.0808   93.238   5.8063   92.923   5.7365  348.922   10.872  348.334   10.759 0.5880737 15.29570 
1 1 1    2   20   18 o  213.975   12.477   35.192   4.0686   37.095   4.9536   31.246   7.1326  219.517   14.830  200.335   23.721 19.18161 27.97531 
1 1 1    2   20   19 o  1012.68   16.273  786.150   25.224   0.0000   0.0000  786.150   25.224  ?   ?   1012.68   16.273 0.000000 16.27293 
1 1 1    2   20   20 o  787.896   8.7283  475.330   10.526  453.074   17.664  487.585   13.108  768.853   15.010  797.886   10.733 -29.03333 18.45243 
1 1 1    2   20   21 o  471.508   7.7555  170.215   5.5972  170.216   7.8982  170.213   7.9331  471.413   10.946  471.407   10.995 0.6164551E-02 15.51444 
1 1 1    2   20   22 o  739.423   7.5914  418.608   8.5918  420.561   12.142  416.649   12.160  740.992   10.705  737.534   10.771 3.458008 15.18624 
1 1 1    2   20   23 o  515.351   7.9769  203.357   6.2923  211.333   8.9897  195.695   8.8102  525.237   11.182  505.423   11.388 19.81467 15.96039 
1 1 1    2   20   24 o  197.643   14.668   30.112   4.4057   23.055   6.0753   37.938   6.3984  171.563   23.774  221.510   19.057 -49.94691 30.46968 
1 1 1    2   20   25 o  608.353   8.0200  283.396   7.4679  276.535   10.387  290.736   10.744  600.780   11.296  616.008   11.395 -15.22729 16.04505 
1 1 1    2   20   26 o  185.140   16.284   26.499   4.5677   31.827   6.5210   21.366   6.4002  202.387   21.374  164.551   26.296 37.83687 33.88725 
1 1 1    2   20   27 o  1061.64   12.186  863.869   19.802  845.820   27.608  882.995   28.419  1049.72   17.183  1072.51   17.312 -22.79663 24.39151 
1 1 1    2   20   28 o  885.974   9.7161  601.366   13.176  606.412   16.523  592.554   21.835  889.422   12.137  878.631   16.236 10.79041 20.27127 
1 1 1    2   20   29 o  304.937   11.797   71.287   5.5063   76.052   7.7075   66.320   7.8693  314.324   16.074  293.288   17.611 21.03662 23.84373 
1 1 1    2   20   30 o  290.167   12.403   64.576   5.5085   67.872   7.7982   61.293   7.7822  296.689   17.246  281.776   18.140 14.91284 25.03013 
1 1 1    2   20   31 o  653.769   7.3339  327.382   7.3388  330.827   9.1575  321.198   12.270  657.050   9.1056  647.061   12.388 9.989014 15.37488 
1 1 1    2   20   32 o  755.425   6.5344  437.066   7.5556  441.545   10.730  432.660   10.641  759.003   9.2357  751.325   9.2535 7.677917 13.07380 
1 1 1    2   20   33 o  342.281   7.5177   89.760   3.9385   90.786   5.5224   88.699   5.6187  344.051   10.487  340.052   10.795 3.999176 15.04996 
1 1 1    2   20   34 o  478.057   6.7635  175.078   4.9490  172.766   6.9213  177.496   7.0793  474.659   9.5266  481.104   9.6136 -6.444611 13.53429 
1 1 1    2   20   35 o  556.899   7.8048  237.701   6.6528  220.181   11.296  247.006   8.2321  535.150   13.790  567.497   9.4771 -32.34662 16.73279 
1 1 1    2   20   36 o  106.232   21.503   9.0501   3.3765   10.377   4.7589   7.7054   4.7914  113.088   27.710   98.572   29.476 14.51505 40.45563 
1 1 1    2   20   37 o  217.844   12.252   36.592   4.0688   41.159   4.6493   21.654   8.4086  230.947   13.207  162.465   34.858 68.48132 37.27591 
1 1 1    2   20   38 o  963.972   8.1076  712.661   11.963  718.895   15.128  702.258   19.542  967.583   10.215  955.189   13.366 12.39386 16.82240 
1 1 1    2   20   39 o  321.300   8.1087   79.189   3.9878   83.152   5.7270   75.459   5.5561  328.874   11.377  313.264   11.587 15.60995 16.23895 
1 1 1    2   20   40 o  362.599   9.4388  100.969   5.2386   92.784   10.072  104.004   6.1335  345.249   19.134  367.800   10.895 -22.55157 22.01844 
1 1 1    2   20   41 o  293.752   10.728   66.362   4.8235   66.397   9.5319   66.351   5.5925  290.933   21.559  293.478   12.450 -2.544952 24.89506 
1 1 1    2   20   42 o  299.583   9.3118   68.966   4.2699   71.600   6.2437   66.651   5.8524  304.594   13.392  293.950   13.007 10.64462 18.66931 
1 1 1    2   20   43 o  155.017   13.785   18.713   3.2368   22.036   4.6848   15.678   4.4772  167.223   18.619  139.941   21.597 27.28122 28.51535 
1 1 1    2   20   44 o  215.466   10.968   35.861   3.6052   33.334   5.0534   38.481   5.1448  206.598   16.108  222.293   15.212 -15.69521 22.15563 
1 1 1    2   20   45 o  353.507   8.3243   96.035   4.5042   92.869   6.2684   99.415   6.4765  346.907   11.805  358.930   11.789 -12.02261 16.68331 
1 1 1    2   20   46 o   56.740   22.794   1.2934   3.0253  -0.4747   4.2478   3.1136   4.3099   58.332   25.400   72.720   27.788 -14.38726 37.64739 
1 1 1    2   20   47 o  170.577   13.742   22.694   3.5574   23.624   5.0484   21.778   5.0136  172.473   19.464  165.270   20.242 7.203415 28.08188 
1 1 1    2   20   48 o  393.881   10.587  119.705   6.3830  124.040   7.4811  108.105   12.238  400.414   12.206  368.927   21.768 31.48666 24.95719 
1 1 1    2   20   49 o  133.787   28.775   15.064   5.7175   15.777   6.0454   9.0238   17.599  136.616   29.753  126.664   53.320 9.951385 61.05956 
1 1 1    2   20   50 o  157.697   17.205   19.716   4.0856   24.281   5.6409   14.678   5.9253  173.544   21.711  131.263   30.129 42.28140 37.13689 
1 1 1    2   20   51 o  244.639   14.843   46.866   5.5316   52.270   6.3588   30.054   11.215  257.859   16.193  182.034   41.212 75.82549 44.27884 
1 1 1    2   20   52 o   54.605   24.308  -1.1261   4.0960   6.5512   5.7652  -8.9511   5.8204   91.760   32.637   50.084   24.300 41.67550 40.68983 
1 1 1    2   20   53 o  183.060   19.542   26.944   5.3910   26.243   12.148   27.116   6.0158  164.100   46.334  182.519   21.975 -18.41898 51.28103 
1 1 1    2   20   54 o   54.407   24.442  -1.4241   4.2431  -4.8499   5.7802   2.5793   6.2485   56.376   26.453   77.621   32.154 -21.24435 41.63679 
1 1 1    2   20   55 o  442.338   14.273  153.721   9.6637   0.0000   0.0000  153.721   9.6637  ?   ?   442.338   14.273 0.000000 14.27306 
1 1 1    2   20   56 o   50.906   23.476  -2.6014   4.2524  -1.4399   6.1017  -3.6983   5.9296   64.951   29.232   59.001   27.388 5.950840 40.05782 
1 1 1    2   20   57 o   70.565   27.587   3.1948   4.3190  -1.5934   6.2095   7.6824   6.0114   64.656   29.257   94.027   33.339 -29.37152 44.35624 
1 1 1    2   20   58 o  137.482   21.516   15.952   4.3793   17.274   6.2803   14.700   6.1098  136.991   30.710  125.326   31.799 11.66494 44.20750 
1 1 1    2   20   59 o   56.864   24.470   0.5876   3.8501  -6.9593   5.3394   8.7618   5.5568   48.507   23.473   96.523   32.134 -48.01651 39.79430 
1 1 1    2   20   60 o   86.181   27.189   6.7533   4.0089   4.8972   5.9709   8.2768   5.4094   80.213   32.093   93.464   31.706 -13.25089 45.11383 
1 1 1    2   21    3 o  248.520   15.998   47.519   6.0532   47.519   6.0532   0.0000   0.0000  248.520   15.998  ?   ?  0.000000 15.99798 
1 1 1    2   21    4 o  761.372   9.7320  443.839   11.341  465.874   16.735  425.121   15.424  779.858   14.020  744.992   13.526 34.86572 19.48080 
1 1 1    2   21    5 o  1242.73   12.662  1182.81   24.085  1170.80   33.756  1195.27   34.375  1235.94   17.844  1248.78   17.984 -12.83435 25.33427 
1 1 1    2   21    6 o  916.166   10.590  642.714   14.851  634.718   20.817  651.000   21.192  910.210   14.942  921.806   15.019 -11.59558 21.18617 
1 1 1    2   21    7 o  1024.06   11.247  803.060   17.629  800.079   24.803  806.102   25.060  1021.85   15.858  1025.68   15.963 -3.831116 22.50055 
1 1 1    2   21    8 o   60.831   22.671   2.1380   2.8283   3.6062   3.4015  -1.1510   5.0910   72.441   25.123   63.356   27.691 9.085197 37.38935 
1 1 1    2   21    9 o  749.827   8.0208  430.427   9.2055  430.723   11.253  429.827   16.007  750.027   9.8017  749.065   13.961 0.9613647 17.05816 
1 1 1    2   21   10 o  646.460   6.7026  319.905   6.6322  318.213   9.3452  321.622   9.4138  644.676   9.4706  648.120   9.4894 -3.443604 13.40674 
1 1 1    2   21   11 o  1111.29   8.3809  945.472   14.256  945.211   20.138  945.734   20.183  1110.94   11.843  1111.24   11.866 -0.3055420 16.76493 
1 1 1    2   21   12 o  1121.01   8.4555  962.103   14.508  947.525   20.216  977.588   20.834  1112.28   11.874  1129.78   12.048 -17.49475 16.91596 
1 1 1    2   21   13 f  538.536   6.7133  222.011   5.5337  211.717   7.5916  233.682   8.0833  525.840   9.4321  552.440   9.5594 -26.60034 13.42935 
1 1 1    2   21   14 o  410.881   7.0919  129.239   4.4601  129.447   6.3289  129.035   6.2865  411.152   10.057  410.498   10.005 0.6537476 14.18598 
1 1 1    2   21   15 o  792.415   7.2766  480.705   8.8257  491.315   12.654  470.655   12.316  800.988   10.321  783.969   10.263 17.01953 14.55564 
1 1 1    2   21   16 o   73.153   25.051   3.7519   3.3772   2.1531   4.0585   7.3514   6.0897   68.519   26.754  100.681   33.643 -32.16147 42.98472 
1 1 1    2   21   17 o  839.623   8.6788  539.775   11.154  539.739   13.628  539.849   19.411  839.497   10.606  839.277   15.110 0.2194824 18.46076 
1 1 1    2   21   18 o  605.204   8.2713  280.438   7.6621  300.606   13.792  271.436   9.2148  626.305   14.388  595.345   10.112 30.95953 17.58574 
1 1 1    2   21   19 o  1248.66   9.2648  1193.94   17.707  1167.55   24.640  1222.11   25.464  1234.43   13.041  1262.93   13.173 -28.49634 18.53604 
1 1 1    2   21   20 o  421.545   8.0052  136.059   5.1652  135.674   7.2723  136.450   7.3374  420.854   11.289  422.053   11.358 -1.198822 16.01434 
1 1 1    2   21   21 o  521.953   7.7822  208.593   6.2173  203.538   8.6767  213.927   8.9134  515.473   10.997  528.463   11.019 -12.98999 15.56805 
1 1 1    2   21   22 o  272.068   10.857   56.702   4.5210   54.617   6.2899   58.931   6.5028  266.441   15.490  276.805   15.409 -10.36435 21.84916 
1 1 1    2   21   23 o  1512.96   10.680  1753.53   24.732  1767.04   35.200  1740.35   34.756  1518.05   15.149  1506.56   15.072 11.49060 21.36994 
1 1 1    2   21   24 f  273.435   11.390   57.287   4.7670   56.693   6.6719   57.905   6.8135  271.381   16.135  274.260   16.304 -2.879089 22.93803 
1 1 1    2   21   25 o  756.940   9.1954  438.849   10.654  432.086   17.806  442.621   13.296  750.523   15.500  760.017   11.430 -9.494019 19.25840 
1 1 1    2   21   26 o  490.886   11.405  184.669   8.5695  176.185   11.999  193.502   12.243  479.133   16.361  502.164   15.929 -23.03192 22.83438 
1 1 1    2   21   27 o  416.298   9.4513  132.769   6.0223  134.081   8.3487  131.346   8.6957  418.155   13.044  413.823   13.728 4.330994 18.93712 
1 1 1    2   21   28 f  624.052   8.3395  298.311   7.9658  300.255   11.317  296.402   11.214  625.800   11.815  621.775   11.783 4.025208 16.68658 
1 1 1    2   21   29 o  159.645   20.307   19.931   4.8498   19.818   6.9319   20.040   6.7877  157.396   29.866  158.450   29.058 -1.053558 41.66958 
1 1 1    2   21   30 o  670.111   8.5416  344.065   8.7611  335.456   12.196  353.246   12.594  661.291   12.049  678.590   12.125 -17.29840 17.09358 
1 1 1    2   21   31 o  645.687   8.6823  319.497   8.5807  300.491   11.753  341.194   12.557  625.767   12.270  666.799   12.303 -41.03186 17.37630 
1 1 1    2   21   32 o  486.401   9.4156  181.381   7.0099  173.525   9.7834  189.668   10.049  475.319   13.447  496.967   13.211 -21.64862 18.85070 
1 1 1    2   21   33 o  476.280   6.6640  173.775   4.8581  174.289   6.8699  173.262   6.8710  476.752   9.4142  475.343   9.4438 1.409637 13.33465 
1 1 1    2   21   34 f  281.266   11.508   60.739   4.9545   60.739   4.9545   0.0000   0.0000  281.266   11.508  ?   ?  0.000000 11.50822 
1 1 1    2   21   35 o  398.711   8.2062  121.881   5.0080  127.471   7.0960  116.333   7.0690  407.416   11.379  389.151   11.868 18.26456 16.44159 
1 1 1    2   21   36 o  202.795   12.313   31.728   3.8038   30.623   4.3460   35.346   7.8646  198.928   14.370  211.670   24.741 -12.74223 28.61142 
1 1 1    2   21   37 o  579.213   7.8309  257.256   6.9425  262.642   8.5950  247.144   11.776  584.958   9.5996  566.606   13.579 18.35205 16.62920 
1 1 1    2   21   38 o  114.326   16.661   10.305   2.8298   10.251   3.9966   10.360   4.0072  112.561   23.934  113.182   23.881 -0.6208954 33.81056 
1 1 1    2   21   39 o  253.809   11.412   49.547   4.4335   43.176   8.7730   51.731   5.1378  233.531   24.929  259.160   12.952 -25.62885 28.09258 
1 1 1    2   21   40 o  176.840   14.684   24.312   3.9388   20.848   8.4121   25.284   4.4576  158.025   35.629  180.038   16.354 -22.01297 39.20327 
1 1 1    2   21   41 o  161.099   13.253   20.155   3.2389   20.309   4.7856   20.025   4.3997  160.273   19.939  159.522   18.354 0.7511902 27.10012 
1 1 1    2   21   42 o  329.731   10.285   83.653   5.1909   89.695   6.0903   67.607   9.9250  341.171   11.663  292.761   22.317 48.41046 25.18051 
1 1 1    2   21   43 f  226.563   10.255   39.513   3.5562   42.783   5.0715   36.349   4.9879  234.721   14.183  216.052   15.180 18.66975 20.77421 
1 1 1    2   21   44 o  482.580   7.4819  178.816   5.5265  179.301   7.7954  178.326   7.8361  482.450   10.556  481.112   10.641 1.337860 14.98892 
1 1 1    2   21   45 o  204.659   11.664   32.431   3.6387   31.440   5.0462   33.504   5.2517  200.310   16.608  206.785   16.736 -6.475006 23.57802 
1 1 1    2   21   46 o  328.440   10.781   83.199   5.4198   80.763   6.1833   91.275   11.259  323.168   12.500  339.364   21.790 -16.19592 25.12138 
1 1 1    2   21   47 o  168.513   17.973   22.466   4.5642   26.961   5.1526   6.0930   9.8351  184.596   18.485  102.980   41.194 81.61629 45.15077 
1 1 1    2   21   48 o  191.305   14.177   28.586   4.1217   29.449   5.9250   27.778   5.7375  192.134   20.462  186.565   20.426 5.569733 28.91211 
1 1 1    2   21   49 o  375.459   9.1887  108.632   5.2807  106.718   7.4966  110.517   7.4396  370.782   13.209  377.456   12.877 -6.673615 18.44727 
1 1 1    2   21   50 o  363.194   11.676  102.155   6.4909  112.927   7.7018   75.745   12.059  381.242   13.198  304.742   26.105 76.49966 29.25192 
1 1 1    2   21   51 o  157.269   17.823   19.717   4.2145   20.167   6.2637   19.346   5.6970  155.117   27.383  152.829   25.235 2.288040 37.23723 
1 1 1    2   21   52 o   67.302   26.120   2.6286   3.8500   0.5063   5.3097   4.9813   5.5906   67.116   28.805   84.429   31.793 -17.31367 42.90126 
1 1 1    2   21   53 o   56.863   26.089  -2.8522   5.1604 -14.1002   10.442   0.7829   5.9360   66.928   32.490   70.875   30.439 -3.947495 44.52069 
1 1 1    2   21   54 o   51.836   23.545  -1.8465   4.0677  -0.9819   5.8261  -2.6687   5.6817   65.075   28.978   60.176   27.523 4.899567 39.96564 
1 1 1    2   21   55 o  163.482   17.913   21.569   4.4089   14.383   6.0452   29.735   6.4441  126.575   31.363  189.504   22.666 -62.92881 38.69624 
1 1 1    2   21   56 o  177.468   16.177   25.234   4.3461   28.226   6.2223   22.385   6.0731  184.065   22.558  161.998   25.321 22.06647 33.91195 
1 1 1    2   21   57 o   42.065   20.383  -5.9301   4.0606  -9.6057   5.9650  -2.7558   5.5433   48.849   23.898   58.104   26.798 -9.254669 35.90594 
1 1 1    2   21   58 o   68.886   26.486   3.3484   3.9304   3.2685   5.7160   3.4200   5.4131   74.916   30.867   74.409   30.275 0.5065002 43.23635 
1 1 1    2   21   59 o  109.404   24.934   10.691   4.0824   11.208   6.2913   10.315   5.3653  106.479   34.111  103.817   31.225 2.662277 46.24397 
1 1 1    2   22    1 o  939.597   15.188  676.411   21.844   0.0000   0.0000  676.411   21.844  ?   ?   939.597   15.188 0.000000 15.18836 
1 1 1    2   22    2 o  427.735   13.175  140.139   8.6258   0.0000   0.0000  140.139   8.6258  ?   ?   427.735   13.175 0.000000 13.17512 
1 1 1    2   22    3 o  1024.54   11.270  803.830   17.673  794.809   24.847  813.067   25.142  1018.45   15.939  1030.08   15.946 -11.63104 22.54640 
1 1 1    2   22    4 o  1141.17   12.016  997.353   20.988  984.452   29.375  1010.80   29.996  1133.36   16.933  1148.42   17.065 -15.05652 24.04035 
1 1 1    2   22    5 o  1597.24   15.266  1954.72   37.322  1925.61   51.923  1985.84   53.685  1584.41   21.410  1608.93   21.800 -24.52234 30.55507 
1 1 1    2   22    6 o  1538.91   14.846  1814.48   34.970  1786.32   48.616  1844.67   50.341  1526.10   20.812  1550.77   21.208 -24.66052 29.71432 
1 1 1    2   22    7 o  673.076   9.6533  346.877   9.9451  344.652   13.959  349.170   14.172  670.757   13.597  675.133   13.714 -4.376160 19.31187 
1 1 1    2   22    8 o  337.181   8.4549   87.042   4.3636   83.433   5.3056   94.586   7.6709  330.083   10.501  351.369   14.263 -21.28629 17.71188 
1 1 1    2   22    9 o  1724.41   13.284  2277.87   35.063  2259.04   42.490  2318.07   62.078  1716.88   16.169  1737.86   23.337 -20.98022 28.39122 
1 1 1    2   22   10 o  1144.47   8.5831  1002.81   15.035  1012.60   21.448  993.358   21.083  1149.80   12.187  1138.83   12.095 10.97046 17.17018 
1 1 1    2   22   11 o  1313.74   9.3750  1321.51   18.852  1320.42   26.630  1322.61   26.690  1312.87   13.252  1313.96   13.271 -1.085327 18.75462 
1 1 1    2   22   12 o   72.684   22.656   4.0193   2.7926   5.5388   4.0510   2.6432   3.8551   85.829   27.358   69.629   26.359 16.20020 37.99029 
1 1 1    2   22   13 o  672.794   8.0275  346.554   8.2667  348.663   10.148  342.394   14.252  674.774   9.8256  668.487   13.929 6.287415 17.04593 
1 1 1    2   22   14 o  500.846   8.0015  192.052   6.1340  196.040   7.5933  184.561   10.407  505.970   9.8048  490.789   13.853 15.18042 16.97172 
1 1 1    2   22   15 o  609.315   8.2302  284.256   7.6758  296.183   13.395  278.425   9.3660  621.709   14.076  602.965   10.148 18.74341 17.35296 
1 1 1    2   22   16 o  763.537   8.5358  446.383   9.9757  437.733   17.182  450.781   12.252  755.736   14.853  767.198   10.434 -11.46277 18.15180 
1 1 1    2   22   17 o  523.667   7.3505  209.948   5.8918  205.187   8.3290  214.716   8.3354  517.596   10.513  529.487   10.285 -11.89038 14.70734 
1 1 1    2   22   18 o  239.961   10.883   44.105   3.9974   44.243   5.5854   43.960   5.7233  239.752   15.300  238.941   15.737 0.8109589 21.94894 
1 1 1    2   22   19 o  595.224   7.4902  271.258   6.8241  281.872   9.8032  261.280   9.5050  606.632   10.558  584.050   10.632 22.58173 14.98386 
1 1 1    2   22   20 o  572.730   7.6057  251.152   6.6675  252.446   9.4609  249.874   9.3978  574.073   10.767  571.143   10.750 2.930115 15.21494 
1 1 1    2   22   21 o  848.686   7.9666  551.520   10.349  549.498   14.552  553.590   14.721  846.910   11.226  850.052   11.314 -3.141174 15.93787 
1 1 1    2   22   22 o  379.980   9.0955  110.580   5.2900  112.756   7.4676  108.387   7.4950  383.569   12.719  376.052   13.021 7.517883 18.20258 
1 1 1    2   22   23 o  205.029   14.722   32.402   4.5894   27.364   6.6012   37.115   6.3848  187.151   23.567  219.007   19.242 -31.85562 30.42455 
1 1 1    2   22   24 o  210.492   18.518   34.286   5.9054   39.670   8.5236   29.317   8.1893  225.588   25.111  192.888   28.605 32.69968 38.06317 
1 1 1    2   22   25 o  459.873   9.9382  162.027   6.9954  162.671   8.8219  160.938   11.482  460.638   12.512  457.897   16.382 2.741150 20.61368 
1 1 1    2   22   26 o  487.863   8.6916  182.320   6.4903  170.199   8.9489  195.772   9.4272  471.142   12.409  505.316   12.188 -34.17453 17.39394 
1 1 1    2   22   27 f  489.812   8.8970  183.807   6.6702  186.145   9.2577  181.283   9.6189  492.680   12.276  486.150   12.927 6.529938 17.82717 
1 1 1    2   22   28 o  519.155   8.8770  206.513   7.0540  192.135   9.7697  222.171   10.196  500.443   12.754  538.178   12.377 -37.73456 17.77253 
1 1 1    2   22   29 o  574.140   8.5985  252.586   7.5563  250.215   10.669  254.972   10.704  571.084   12.205  576.496   12.130 -5.411438 17.20793 
1 1 1    2   22   30 o  201.254   16.501   31.359   5.0383   26.217   7.0648   36.680   7.1873  182.174   26.081  216.887   21.952 -34.71297 34.08974 
1 1 1    2   22   31 o  433.249   9.7688  143.931   6.4781  146.858   9.1388  140.974   9.1843  437.230   13.656  428.339   14.008 8.891388 19.56297 
1 1 1    2   22   32 o  297.345   12.238   67.891   5.5697   56.495   7.5679   81.359   8.2269  270.061   18.418  324.631   16.612 -54.56940 24.80318 
1 1 1    2   22   33 o  414.206   10.213  131.639   6.4751  133.216   7.2323  125.268   14.536  416.555   11.343  401.121   23.782 15.43402 26.34859 
1 1 1    2   22   34 o  704.135   8.4482  380.174   9.1052  412.491   12.440  342.890   13.362  732.946   11.089  667.828   13.072 65.11835 17.14199 
1 1 1    2   22   35 o  443.681   8.8378  150.998   6.0018  153.796   7.6253  146.443   9.7299  447.474   11.133  436.083   14.577 11.39120 18.34230 
1 1 1    2   22   36 o  427.647   6.9812  140.180   4.5697  145.324   6.4330  134.941   6.4924  435.113   9.6592  419.221   10.118 15.89227 13.98835 
1 1 1    2   22   37 o  101.916   17.893   8.2667   2.6893   4.7308   3.8323   11.697   3.7749   79.774   26.689  121.005   21.151 -41.23119 34.05420 
1 1 1    2   22   38 o  419.625   8.4977  135.132   5.4580  132.033   10.152  136.391   6.4730  413.332   16.047  421.348   10.037 -8.016357 18.92710 
1 1 1    2   22   39 o  398.852   8.9608  122.157   5.4705  116.546   10.364  124.324   6.4409  387.773   17.461  402.129   10.464 -14.35593 20.35662 
1 1 1    2   22   40 o  248.282   9.9360   47.390   3.7759   52.101   5.4011   42.887   5.2809  259.464   13.648  235.108   14.749 24.35558 20.09506 
1 1 1    2   22   41 o  167.441   12.267   21.732   3.1220   20.406   4.4832   22.980   4.3502  160.898   18.543  171.287   16.809 -10.38887 25.02789 
1 1 1    2   22   42 o  286.995   8.6676   63.294   3.8075   63.635   5.3901   62.955   5.3793  287.179   12.262  285.633   12.304 1.546356 17.37100 
1 1 1    2   22   43 o  263.076   9.2127   53.228   3.7097   52.042   5.1519   54.504   5.3461  259.507   12.970  265.538   13.154 -6.030243 18.47272 
1 1 1    2   22   44 o   45.711   20.414  -1.1041   2.9138  -0.4968   4.1978  -1.6688   4.0477   57.955   25.242   53.189   23.885 4.765457 34.75136 
1 1 1    2   22   45 o   81.386   26.812   5.1454   3.8722   9.0298   4.2487 -13.9031   9.4086  104.270   26.551   64.136   31.065 40.13437 40.86543 
1 1 1    2   22   46 o  308.141   9.4357   73.121   4.4503   75.517   6.1192   70.431   6.4841  312.333   12.800  301.279   14.061 11.05457 19.01436 
1 1 1    2   22   47 o  104.099   24.353   8.9840   3.8113   10.750   5.3919   7.2209   5.3881  112.691   30.511   95.045   31.643 17.64651 43.95645 
1 1 1    2   22   48 o  180.976   14.127   25.613   3.8823   18.942   5.3587   32.984   5.6324  152.354   23.754  204.159   18.215 -51.80469 29.93419 
1 1 1    2   22   49 o  295.602   13.068   67.849   5.9125   69.856   6.8339   61.875   11.791  299.290   14.918  273.798   28.555 25.49240 32.21649 
1 1 1    2   22   50 o  325.376   12.346   82.153   6.1485   65.694   12.760   87.129   7.0167  280.302   30.220  334.554   13.702 -54.25180 33.18135 
1 1 1    2   22   51 o  249.264   12.087   48.243   4.6116   42.359   6.5138   54.156   6.5297  230.646   18.609  262.074   16.360 -31.42880 24.77793 
1 1 1    2   22   52 o  100.241   32.184   8.5968   5.5982  -3.9128   11.404   12.568   6.4257   84.383   38.741  118.917   33.740 -34.53477 51.37362 
1 1 1    2   22   54 o  253.483   13.153   50.428   5.0855   49.488   7.6134   51.185   6.8336  246.913   20.325  252.824   17.772 -5.910950 26.99925 
1 1 1    2   22   55 o  207.002   15.167   34.049   4.7722   19.039   6.1897   56.048   7.4934  147.519   28.444  263.454   18.704 -115.9352 34.04247 
1 1 1    2   22   56 o   65.187   26.410   2.1955   4.0988   12.485   5.9746  -6.9525   5.6336  115.871   32.415   50.876   24.492 64.99454 40.62793 
1 1 1    2   22   57 o  131.537   21.418   14.641   4.1637   19.228   6.0134   10.416   5.7709  146.732   27.792  105.024   32.541 41.70808 42.79378 
1 1 1    2   22   58 o   66.073   26.162   2.7934   3.9287   9.8454   5.6268  -3.9146   5.4878  101.460   32.233   54.684   25.696 46.77592 41.22228 
1 1 1    2   23    1 o  319.357   14.778   78.144   7.2236   0.0000   0.0000   78.144   7.2236  ?   ?   319.357   14.778 0.000000 14.77766 
1 1 1    2   23    2 o  1120.23   16.841  961.864   28.877   0.0000   0.0000  961.864   28.877  ?   ?   1120.23   16.841 0.000000 16.84143 
1 1 1    2   23    3 o  683.076   9.6415  357.268   10.081  364.323   14.451  350.582   14.069  689.612   13.691  676.487   13.587 13.12476 19.28847 
1 1 1    2   23    4 o  1585.60   15.207  1926.51   36.907  1905.85   51.574  1948.20   52.839  1576.11   21.378  1593.47   21.664 -17.36304 30.43607 
1 1 1    2   23    5 o  805.960   10.086  497.404   12.442  502.579   17.758  492.414   17.439  809.912   14.325  801.687   14.211 8.224915 20.17845 
1 1 1    2   23    6 o  322.720   10.492   79.755   5.1824   72.930   7.1949   87.114   7.4711  308.499   15.237  337.187   14.476 -28.68732 21.01706 
1 1 1    2   23    7 o  1503.96   14.594  1733.13   33.596  1735.50   47.608  1730.79   47.417  1504.07   20.679  1502.04   20.624 2.030884 29.20616 
1 1 1    2   23    8 o  1998.53   18.415  3062.72   56.331  3081.35   80.280  3044.65   79.062  2002.60   26.191  1990.71   25.947 11.89087 36.86719 
1 1 1    2   23    9 o  799.026   8.3935  488.812   10.265  497.706   12.743  472.368   17.326  806.177   10.327  785.154   14.417 21.02289 17.73406 
1 1 1    2   23   10 f  436.919   8.1656  146.155   5.4608  150.524   6.7370  137.786   9.3247  443.358   9.9275  424.046   14.367 19.31226 17.46294 
1 1 1    2   23   11 o  523.386   8.0618  209.729   6.4584  212.751   7.9700  203.949   11.022  527.091   9.8788  515.918   13.957 11.17291 17.09965 
1 1 1    2   23   12 o  565.128   7.1329  244.497   6.1699  247.836   8.7733  241.230   8.6786  568.883   10.076  561.249   10.102 7.634338 14.26805 
1 1 1    2   23   13 o  786.384   8.5148  473.494   10.249  468.132   17.742  476.179   12.556  781.545   14.831  788.519   10.403 -6.974243 18.11591 
1 1 1    2   23   14 o   76.299   26.191   4.0734   3.6922   8.9645   6.5983   1.8438   4.4550  109.087   34.931   69.568   27.760 39.51852 44.61865 
1 1 1    2   23   15 o  888.369   7.7593  604.239   10.551  599.089   14.834  609.511   15.009  884.390   10.959  892.048   10.993 -7.657471 15.52195 
1 1 1    2   23   16 o  725.732   7.4658  403.244   8.2932  396.563   11.651  410.105   11.807  719.549   10.579  731.734   10.542 -12.18518 14.93465 
1 1 1    2   23   17 o  601.997   7.4260  277.465   6.8425  277.265   9.6972  277.663   9.6565  601.654   10.530  602.088   10.478 -0.4338989 14.85518 
1 1 1    2   23   18 o  1394.16   10.031  1488.71   21.405  1479.60   30.145  1497.97   30.398  1389.34   14.175  1397.94   14.207 -8.595459 20.06910 
1 1 1    2   23   19 o  338.600   9.2246   87.805   4.7809   77.549   6.5810   99.266   6.9570  318.085   13.517  359.911   12.629 -41.82684 18.49837 
1 1 1    2   23   20 o  499.366   7.9895  190.950   6.1067  196.408   8.7231  185.704   8.5518  506.316   11.256  492.320   11.349 13.99567 15.98388 
1 1 1    2   23   21 o  858.961   11.316  565.327   14.878   0.0000   0.0000  565.327   14.878  ?   ?   858.961   11.316 0.000000 11.31618 
1 1 1    2   23   22 o  452.335   9.7482  156.736   6.7492  152.562   11.027  159.236   8.5348  445.905   16.156  455.805   12.233 -9.900360 20.26493 
1 1 1    2   23   23 o  673.379   9.1489  347.336   9.4297  341.406   11.483  359.617   16.525  667.454   11.240  684.574   15.771 -17.12024 19.36631 
1 1 1    2   23   24 o  311.520   10.831   74.372   5.1646   75.308   7.2241   73.393   7.3864  313.273   15.066  308.836   15.677 4.436951 21.74264 
1 1 1    2   23   25 o   73.558   28.078   2.8860   4.3974   3.4446   6.0841   2.2750   6.3630   84.299   32.802   81.565   32.954 2.733635 46.49656 
1 1 1    2   23   26 o  731.482   8.2237  409.889   9.2074  411.180   12.911  408.554   13.135  732.292   11.518  729.921   11.757 2.370789 16.45875 
1 1 1    2   23   27 o  193.282   16.268   28.910   4.7681   27.108   6.6971   30.764   6.7900  185.845   24.112  198.417   22.770 -12.57182 33.16363 
1 1 1    2   23   28 o  475.124   9.0947  173.012   6.6140  170.673   9.1855  175.530   9.5314  471.579   12.726  478.210   13.022 -6.630981 18.20724 
1 1 1    2   23   29 o  299.967   11.498   69.037   5.2791   63.788   7.3068   74.768   7.6355  287.465   16.678  311.387   16.075 -23.92203 23.16382 
1 1 1    2   23   30 o  280.446   12.235   60.380   5.2521   56.260   7.2578   64.910   7.6099  269.685   17.680  289.827   17.232 -20.14188 24.68855 
1 1 1    2   23   31 o  279.233   12.559   59.889   5.3677   62.679   7.5906   57.098   7.5916  284.654   17.507  271.483   18.378 13.17044 25.38138 
1 1 1    2   23   32 o  140.337   38.179   16.141   8.4191   15.811   11.397   16.536   12.491  141.443   45.969  145.221   48.171 -3.778687 66.58559 
1 1 1    2   23   33 o  456.144   9.9161  159.663   6.9233  146.909   9.6457  173.216   9.9432  436.896   14.424  474.536   13.689 -37.63959 19.88600 
1 1 1    2   23   34 o  297.200   9.4016   67.776   4.2768   71.001   5.0289   59.347   8.1296  304.062   10.805  276.288   19.346 27.77414 22.15889 
1 1 1    2   23   35 o  131.183   13.331   13.380   2.6396   14.676   3.7024   12.041   3.7642  136.593   18.158  122.967   20.737 13.62618 27.56365 
1 1 1    2   23   36 o  435.857   6.8804  145.629   4.5902  142.610   6.4697  148.690   6.5135  430.945   9.8083  440.056   9.6702 -9.111786 13.77373 
1 1 1    2   23   37 o  195.703   12.521   29.605   3.7311   17.863   7.9672   32.904   4.2228  146.439   35.837  206.208   13.453 -59.76900 38.27862 
1 1 1    2   23   38 o  234.186   11.508   42.205   4.1251   28.795   8.6366   46.168   4.6952  188.011   31.099  244.485   12.590 -56.47447 33.55042 
1 1 1    2   23   39 o  485.432   7.6985  180.830   5.7201  180.663   8.2628  180.983   7.9267  484.493   11.142  485.035   10.677 -0.5417786 15.43192 
1 1 1    2   23   40 f   85.315   21.503   5.9169   2.8070   3.1124   4.0424   8.5285   3.9009   71.790   27.034  102.000   25.146 -30.21032 36.92104 
1 1 1    2   23   41 o  396.043   7.5662  120.412   4.5866  109.680   6.3840  131.861   6.5940  377.322   11.054  413.873   10.409 -36.55115 15.18340 
1 1 1    2   23   42 o  324.310   8.2602   80.809   4.1003   85.870   5.8889   76.046   5.7126  333.695   11.530  313.952   11.888 19.74255 16.56052 
1 1 1    2   23   43 o  200.791   13.484   31.332   4.1199   30.142   4.5925   36.239   9.3249  196.468   15.395  210.252   29.811 -13.78423 33.55126 
1 1 1    2   23   44 o   89.635   25.527   6.5818   3.6712   6.8436   4.0029   5.1961   9.2098   91.465   26.840   99.109   39.786 -7.644829 47.99228 
1 1 1    2   23   45 o  313.178   8.9720   75.480   4.3008   81.094   6.3415   70.700   5.8524  323.687   12.800  302.271   12.649 21.41537 17.99547 
1 1 1    2   23   46 o  238.991   11.657   44.150   4.2642   43.786   5.8797   44.553   6.1936  236.346   16.354  238.152   17.105 -1.805328 23.66481 
1 1 1    2   23   47 o  140.660   16.949   15.691   3.5756   16.527   4.9773   14.800   5.1399  142.178   23.706  133.526   26.084 8.652237 35.24716 
1 1 1    2   23   48 o  125.349   24.691   13.019   4.5687   17.425   5.0883  -5.3049   10.377  145.935   23.584   79.736   36.736 66.19819 43.65474 
1 1 1    2   23   49 o   90.769   29.056   6.7509   4.5655   7.5494   5.0386   3.0869   10.793   95.504   30.519   96.941   41.321 -1.436569 51.36993 
1 1 1    2   23   50 o  123.159   21.604   12.441   3.9241   14.559   5.5115   10.263   5.5883  130.748   28.356  109.022   31.633 21.72570 42.48199 
1 1 1    2   23   51 o   89.839   30.161   6.5992   4.8945   4.9027   11.474   6.9766   5.4116  101.369   42.882   92.507   31.711 8.861771 53.33382 
1 1 1    2   23   52 o   60.489   25.732   0.6121   4.1702   1.0793   6.4048   0.2683   5.4945   73.789   31.652   66.955   29.021 6.833893 42.94216 
1 1 1    2   23   53 o   95.811   26.734   7.9226   4.0693   9.5672   5.7454   6.2671   5.7644  103.937   32.513   89.044   32.508 14.89293 45.97648 
1 1 1    2   23   54 f  185.552   18.741   27.883   5.2496   13.812   9.5624   33.953   6.2807  119.844   42.092  203.921   20.396 -84.07743 46.77327 
1 1 1    2   23   55 o  116.415   24.120   11.654   4.1566   15.521   5.8436   7.6944   5.9136  131.437   29.741   93.959   33.093 37.47839 44.49363 
1 1 1    2   23   56 o   72.947   27.809   3.8669   4.3101   9.1425   6.0562  -1.5474   6.1353   99.292   33.549   63.776   28.949 35.51571 44.31208 
1 1 1    2   23   57 o   97.838   26.038   8.6068   3.9679  -2.0016   5.4975   20.143   5.7329   58.957   27.005  151.284   25.676 -92.32671 37.26292 
1 1 1    2   24    1 o  415.002   13.589  131.951   8.6320   0.0000   0.0000  131.951   8.6320  ?   ?   415.002   13.589 0.000000 13.58921 
1 1 1    2   24    2 o  409.327   13.924  128.374   8.7237   0.0000   0.0000  128.374   8.7237  ?   ?   409.327   13.924 0.000000 13.92390 
1 1 1    2   24    3 o  528.558   9.4502  213.922   7.6455  219.572   10.957  208.561   10.673  535.351   13.372  521.755   13.365 13.59631 18.90542 
1 1 1    2   24    4 f  623.938   9.6543  298.102   9.2200  305.500   13.177  291.006   12.905  631.458   13.634  616.294   13.681 15.16351 19.31405 
1 1 1    2   24    5 o  779.902   10.082  465.786   12.035  470.579   17.270  461.262   16.780  783.654   14.398  775.875   14.129 7.778992 20.17286 
1 1 1    2   24    6 o  330.081   10.823   83.444   5.4682   85.542   8.0498   81.646   7.4514  334.072   15.743  326.400   14.915 7.671753 21.68590 
1 1 1    2   24    7 o  958.559   11.046  703.732   16.206  705.869   23.028  701.634   22.812  959.644   15.678  956.770   15.577 2.873840 22.10027 
1 1 1    2   24    8 o  644.068   9.7856  317.663   9.6470  321.970   13.841  313.594   13.453  648.218   13.950  639.742   13.739 8.475708 19.57947 
1 1 1    2   24    9 o  742.918   10.197  422.681   11.595  427.569   16.466  417.875   16.331  746.951   14.402  738.432   14.448 8.519287 20.40042 
1 1 1    2   24   10 o  986.401   11.386  745.279   17.191  749.727   24.513  740.974   24.116  988.907   16.195  983.135   16.026 5.771912 22.78344 
1 1 1    2   24   11 o  1269.38   13.187  1234.63   25.622  1224.45   35.939  1245.15   36.538  1263.40   18.585  1274.02   18.737 -10.61279 26.39064 
1 1 1    2   24   12 o  249.287   10.131   47.594   3.8656   47.467   5.5802   47.710   5.3601  248.421   14.741  249.110   14.116 -0.6885071 20.40979 
1 1 1    2   24   13 o  211.917   11.599   34.505   3.7480   35.843   5.3285   33.195   5.2729  215.599   16.267  207.383   16.755 8.216080 23.35221 
1 1 1    2   24   14 o  628.976   7.4311  302.891   7.1542  298.567   10.033  307.363   10.204  624.344   10.499  633.472   10.524 -9.128784 14.86535 
1 1 1    2   24   15 o  697.526   7.4647  372.517   7.9697  370.503   11.255  374.543   11.287  695.487   10.572  699.270   10.545 -3.783203 14.93256 
1 1 1    2   24   16 o  726.976   7.6191  404.652   8.4780  389.123   11.606  422.422   12.415  712.733   10.638  742.585   10.922 -29.85181 15.24700 
1 1 1    2   24   17 o  333.057   9.2185   84.954   4.6995   81.379   6.6399   88.543   6.6522  325.847   13.313  339.908   12.786 -14.06012 18.45855 
1 1 1    2   24   18 o  982.281   8.3088  738.881   12.492  745.381   17.809  732.583   17.528  986.288   11.797  977.793   11.712 8.494751 16.62317 
1 1 1    2   24   19 o  633.721   8.9475  307.581   8.6790  293.830   14.530  315.208   10.821  618.947   15.337  641.407   11.023 -22.45959 18.88732 
1 1 1    2   24   20 o  564.926   9.0587  244.443   7.8330  259.007   13.493  237.040   9.6198  581.085   15.171  556.181   11.300 24.90454 18.91692 
1 1 1    2   24   21 o  450.629   9.5652  155.561   6.5976  152.261   8.0999  162.068   11.373  445.705   11.873  459.538   16.169 -13.83316 20.05975 
1 1 1    2   24   22 o  805.603   9.1945  497.174   11.338  493.230   13.842  505.214   19.761  802.203   11.273  811.296   15.914 -9.093445 19.50216 
1 1 1    2   24   23 o  609.184   8.0878  284.247   7.5414  285.423   10.623  283.053   10.707  610.195   11.374  607.645   11.512 2.550781 16.18354 
1 1 1    2   24   24 o  910.138   8.3942  634.571   11.694  633.677   16.398  635.495   16.681  909.065   11.785  910.340   11.972 -1.274658 16.79872 
1 1 1    2   24   25 o  1152.18   9.2655  1017.29   16.340  991.531   22.508  1045.99   23.760  1136.79   12.935  1167.51   13.296 -30.71570 18.55021 
1 1 1    2   24   26 o  808.344   8.3189  500.648   10.293  497.611   14.480  503.750   14.634  805.427   11.746  810.373   11.798 -4.945313 16.64763 
1 1 1    2   24   27 o  720.806   8.2975  398.127   9.1546  396.897   12.871  399.386   13.023  719.247   11.691  721.484   11.793 -2.236633 16.60612 
1 1 1    2   24   28 o  557.971   8.7405  238.629   7.4648  233.726   10.493  243.653   10.622  551.782   12.424  563.393   12.317 -11.61011 17.49494 
1 1 1    2   24   29 o  813.729   8.4666  507.546   10.545  489.592   14.447  528.018   15.428  798.618   11.819  829.294   12.154 -30.67590 16.95308 
1 1 1    2   24   30 o  133.908   28.775   14.507   5.7220   21.738   6.7612  -3.7439   10.742  164.902   27.774   87.884   39.225 77.01817 48.06291 
1 1 1    2   24   31 o  150.526   34.342   18.541   7.7374   27.152   11.153   10.550   10.743  181.096   41.168  123.151   44.467 57.94579 60.59808 
1 1 1    2   24   32 o  301.378   12.412   69.810   5.7258   71.583   8.2044   68.127   7.9948  304.008   17.708  296.557   17.693 7.451263 25.03284 
1 1 1    2   24   33 f  399.920   10.531  122.811   6.4460  126.650   9.1547  119.037   9.0780  405.472   14.751  393.036   15.090 12.43564 21.10187 
1 1 1    2   24   34 o  255.912   14.230   50.607   5.5521   55.032   7.8897   46.266   7.8147  265.808   19.529  243.203   21.205 22.60472 28.82750 
1 1 1    2   24   35 o  321.148   12.369   79.361   6.0799   70.750   8.7047   87.564   8.4957  301.552   18.956  336.629   16.488 -35.07690 25.12333 
1 1 1    2   24   36 o  467.424   8.1066  167.635   5.7999  166.772   10.594  168.004   6.9308  464.823   14.890  467.685   9.6819 -2.862244 17.76106 
1 1 1    2   24   37 o  392.276   7.7154  118.063   4.6326  112.338   6.4164  124.296   6.6953  382.157   10.969  402.000   10.881 -19.84280 15.45081 
1 1 1    2   24   38 o  292.095   8.6869   65.522   3.8838   67.163   5.5565   63.955   5.4308  295.220   12.297  288.080   12.316 7.139374 17.40387 
1 1 1    2   24   39 f  313.652   7.8957   75.525   3.7906   73.169   5.3609   77.881   5.3606  308.208   11.364  318.040   11.012 -9.832336 15.82399 
1 1 1    2   24   40 o  124.966   14.732   12.252   2.7638   17.672   4.1432   7.9070   3.7098  149.513   18.499   98.172   24.707 51.34135 30.86547 
1 1 1    2   24   41 o  376.339   9.3214  108.928   5.3695  110.053   6.2412  105.726   10.533  377.960   10.788  367.554   18.786 10.40558 21.66316 
1 1 1    2   24   42 o  326.408   10.072   82.039   5.0319   83.038   5.7531   78.785   10.381  328.097   11.456  315.744   21.609 12.35324 24.45810 
1 1 1    2   24   43 o  215.492   10.554   35.793   3.4810   35.958   4.7592   35.604   5.1048  214.825   14.560  213.445   15.736 1.380035 21.43837 
1 1 1    2   24   44 o  150.723   13.947   17.761   3.1811   15.625   4.4867   19.920   4.5109  139.143   21.781  158.346   18.991 -19.20204 28.89725 
1 1 1    2   24   45 o  336.862   13.781   88.044   7.1057   0.0000   0.0000   88.044   7.1057  ?   ?   336.862   13.781 0.000000 13.78115 
1 1 1    2   24   46 o  197.176   12.189   30.209   3.6605   33.146   5.3890   27.692   4.9877  205.051   17.333  187.209   17.613 17.84142 24.71126 
1 1 1    2   24   47 o   74.711   27.667   3.7549   4.1990   3.6622   4.6155   4.2001   10.115   75.995   28.824   97.971   40.773 -21.97602 49.93223 
1 1 1    2   24   48 o   91.638   29.107   6.8983   4.5885   8.6830   5.0794  -1.0193   10.698  101.417   30.354   88.289   39.295 13.12775 49.65356 
1 1 1    2   24   49 o  265.375   11.148   54.536   4.5280   61.043   6.4600   48.252   6.3486  278.978   15.186  247.225   16.878 31.75301 22.70400 
1 1 1    2   24   50 f  218.129   17.123   37.735   5.6712   25.927   11.850   41.243   6.4588  163.862   45.585  227.334   18.728 -63.47180 49.28263 
1 1 1    2   24   51 o   68.926   26.761   2.8450   4.0428   1.3426   5.9147   4.1625   5.5385   72.367   30.711   80.495   31.303 -8.128120 43.85267 
1 1 1    2   24   52 o   46.248   21.421  -2.5888   3.5980  -0.6462   5.1487  -4.4429   5.0300   62.176   27.486   52.268   24.574 9.907890 36.86977 
1 1 1    2   24   53 o   46.268   21.667  -3.2950   3.8448  -6.1082   5.5838  -0.7586   5.3019   52.477   25.026   62.484   27.744 -10.00772 37.36332 
1 1 1    2   24   54 o   95.203   27.027   7.9587   4.1219   6.7189   5.8310   9.1970   5.8275   89.954   32.717  100.935   32.875 -10.98096 46.38050 
1 1 1    2   24   55 o  122.069   23.741   12.839   4.2762   9.0066   6.1881   16.341   5.9159   98.994   33.910  134.303   29.578 -35.30917 44.99725 
1 1 1    2   24   56 o   71.043   27.006   3.7087   4.0576   7.1588   5.7120   0.1945   5.7649   89.818   32.425   65.909   29.113 23.90919 43.57726 
1 1 1    2   24   57 o   77.729   28.967   4.9323   4.6172   1.4047   6.5233   8.4739   6.5363   71.755   31.354   94.938   34.623 -23.18336 46.70949 
1 1 1    2   25    1 o  1318.54   18.867  1333.62   38.078   0.0000   0.0000  1333.62   38.078  ?   ?   1318.54   18.867 0.000000 18.86740 
1 1 1    2   25    2 o  482.058   13.876  178.067   10.238   0.0000   0.0000  178.067   10.238  ?   ?   482.058   13.876 0.000000 13.87597 
1 1 1    2   25    3 o  859.463   10.616  565.738   13.966  561.778   19.770  569.683   19.733  856.127   15.087  862.141   14.953 -6.014221 21.24169 
1 1 1    2   25    4 o  514.264   9.9437  202.533   7.8271  202.820   11.152  202.255   10.988  514.455   14.163  513.747   13.973 0.7076416 19.89561 
1 1 1    2   25    5 o  1069.80   11.798  876.689   19.319  891.748   27.920  862.854   26.760  1078.42   16.914  1060.85   16.480 17.56335 23.61563 
1 1 1    2   25    6 o  849.442   10.714  552.644   13.930  552.931   19.840  552.366   19.563  849.322   15.262  848.906   15.056 0.4159546 21.43844 
1 1 1    2   25    7 f  597.615   10.031  273.516   9.1757  269.642   13.003  277.359   12.950  593.154   14.322  601.597   14.064 -8.443665 20.07246 
1 1 1    2   25    8 o  447.316   10.445  153.250   7.1513  148.891   10.205  157.456   10.024  440.724   15.128  453.254   14.449 -12.53030 20.91972 
1 1 1    2   25    9 o  1395.80   14.043  1493.12   30.002  1495.50   42.655  1490.80   42.207  1395.90   19.964  1393.74   19.785 2.162598 28.10713 
1 1 1    2   25   10 o  1065.05   9.8133  868.730   15.998  868.703   19.610  868.784   27.661  1064.84   12.031  1064.33   16.980 0.5091553 20.81007 
1 1 1    2   25   11 o  846.967   8.9945  549.334   11.660  550.412   14.293  547.190   20.164  847.668   11.016  844.797   15.594 2.871155 19.09225 
1 1 1    2   25   12 o  654.862   7.4768  328.342   7.4944  325.159   10.566  331.565   10.631  651.538   10.595  657.926   10.557 -6.388062 14.95689 
1 1 1    2   25   13 o  118.643   21.011   11.131   3.6760   9.1580   5.1243   13.222   5.2763  107.483   30.003  128.617   27.626 -21.13428 40.78416 
1 1 1    2   25   14 o  710.995   7.6438  387.064   8.3185  383.009   11.649  391.282   11.883  707.094   10.763  714.683   10.862 -7.589294 15.29193 
1 1 1    2   25   15 o  217.008   12.425   36.206   4.1098   34.494   5.7872   37.949   5.8374  211.235   18.073  221.719   17.339 -10.48405 25.04550 
1 1 1    2   25   16 o  1503.96   15.015  1734.60   34.564   0.0000   0.0000  1734.60   34.564  ?   ?   1503.96   15.015 0.000000 15.01472 
1 1 1    2   25   17 o  663.334   8.8012  336.997   8.9360  344.746   15.402  333.064   10.971  670.445   15.009  659.324   10.872 11.12085 18.53249 
1 1 1    2   25   18 o  355.902   10.639   97.051   5.7957   90.116   9.8045  100.776   7.1856  342.021   18.801  362.567   12.948 -20.54568 22.82792 
1 1 1    2   25   19 o  809.557   9.0676  502.023   11.236  500.004   13.760  506.061   19.465  807.745   11.129  812.086   15.660 -4.341431 19.21161 
1 1 1    2   25   20 f  927.585   9.5304  659.190   13.531  667.182   16.815  644.506   22.792  932.929   11.775  916.263   16.252 16.66589 20.06935 
1 1 1    2   25   21 o  232.745   12.884   41.671   4.5719   40.588   6.2676   42.904   6.6838  229.119   18.017  235.516   18.695 -6.397522 25.96365 
1 1 1    2   25   22 o  361.771   9.5680  100.290   5.2982   95.999   7.3234  105.002   7.6744  353.722   13.526  369.936   13.553 -16.21402 19.14821 
1 1 1    2   25   23 o  466.358   12.161  166.818   8.6807   0.0000   0.0000  166.818   8.6807  ?   ?   466.358   12.161 0.000000 12.16086 
1 1 1    2   25   24 o  1030.64   8.8353  813.962   13.938  800.922   19.432  827.781   20.003  1021.71   12.425  1038.67   12.582 -16.95679 17.68330 
1 1 1    2   25   25 o  353.602   10.123   95.865   5.4788   91.376   7.7241  100.410   7.7725  344.884   14.632  361.583   14.044 -16.69958 20.28106 
1 1 1    2   25   26 o  562.831   8.4508  242.769   7.2802  243.332   10.205  242.186   10.389  563.110   11.840  561.751   12.082 1.358948 16.91664 
1 1 1    2   25   27 o  282.986   11.738   61.464   5.0844   64.378   7.0945   58.387   7.2904  288.806   16.113  274.794   17.423 14.01196 23.73190 
1 1 1    2   25   28 o  867.455   9.9852  577.188   13.258  585.169   16.204  561.025   23.060  872.962   12.127  853.170   17.658 19.79138 21.42147 
1 1 1    2   25   29 o  517.687   13.348  206.005   10.576  196.984   14.656  215.808   15.278  505.104   18.957  528.705   18.879 -23.60150 26.75411 
1 1 1    2   25   30 o  123.699   29.783   12.452   5.5714   1.7251   10.367   16.809   6.6067   97.548   40.986  143.766   30.940 -46.21783 51.35277 
1 1 1    2   25   31 o  512.476   9.2032  201.483   7.2191  201.826   10.083  201.122   10.341  512.323   12.858  511.362   13.212 0.9603577 18.43560 
1 1 1    2   25   32 o  623.065   8.8569  297.823   8.4466  301.833   11.968  293.844   11.923  626.498   12.480  618.122   12.602 8.376404 17.73609 
1 1 1    2   25   33 o   81.165   29.454   4.3513   4.7222   7.9461   6.7644   0.9341   6.5951  103.428   35.454   77.667   32.665 25.76077 48.20747 
1 1 1    2   25   34 o  218.575   16.678   37.139   5.5378   46.235   8.0500   28.967   7.6301  242.756   21.901  190.336   26.943 52.42012 34.72113 
1 1 1    2   25   35 o  292.852   13.142   66.081   5.8908   78.350   8.5280   54.885   8.1468  317.560   17.614  264.933   20.243 52.62643 26.83375 
1 1 1    2   25   36 o  245.387   11.604   46.348   4.3584   50.840   4.9379   30.512   9.2719  256.876   12.559  193.064   32.533 63.81158 34.87249 
1 1 1    2   25   37 o  377.510   17.117  110.550   9.8909  110.550   9.8909   0.0000   0.0000  377.510   17.117  ?   ?  0.000000 17.11732 
1 1 1    2   25   38 o  196.179   10.008   29.678   2.9950   30.650   4.2487   28.718   4.2227  198.653   14.064  192.178   14.462 6.474808 20.17246 
1 1 1    2   25   39 o  151.264   12.102   17.759   2.7785   16.038   3.7362   19.889   4.1561  142.580   17.486  159.028   17.356 -16.44835 24.63747 
1 1 1    2   25   40 o  448.853   8.7438  154.856   6.0072  163.963   7.1176  132.305   11.200  461.536   10.075  412.116   17.755 49.42007 20.41491 
1 1 1    2   25   41 o  186.173   13.876   26.977   3.9257   27.388   4.3816   25.306   8.8390  187.226   15.427  173.159   34.560 14.06726 37.84705 
1 1 1    2   25   42 o  349.446   7.9309   93.830   4.2420   98.068   6.0819   89.815   5.9196  356.556   11.144  341.177   11.336 15.37976 15.89607 
1 1 1    2   25   43 o  213.208   10.440   35.047   3.4071   31.593   4.7490   38.711   4.8909  200.958   15.561  222.889   14.413 -21.93137 21.21027 
1 1 1    2   25   44 o  313.823   9.8570   75.900   4.7348   73.629   6.6068   78.298   6.7890  307.999   14.014  317.632   13.964 -9.632813 19.78364 
1 1 1    2   25   45 o  339.320   8.6105   88.619   4.4721   97.046   6.5567   81.289   6.1152  354.110   12.097  324.019   12.330 30.09094 17.27351 
1 1 1    2   25   46 o  145.941   15.763   16.811   3.4652   19.647   4.8564   13.870   4.9458  156.260   20.823  129.113   25.927 27.14697 33.25356 
1 1 1    2   25   47 o  284.307   13.681   62.866   5.9537   66.936   6.9961   52.180   11.337  292.235   15.698  250.007   30.241 42.22810 34.07279 
1 1 1    2   25   48 o  215.770   16.320   36.715   5.3501   10.742   11.182   44.427   6.0928  116.630   44.713  237.220   16.891 -120.5899 47.79707 
1 1 1    2   25   49 o  237.466   15.827   44.445   5.7196   25.357   11.925   50.149   6.5184  162.020   45.961  251.743   17.016 -89.72267 49.01019 
1 1 1    2   25   50 o  148.361   26.624   18.611   5.8238   36.978   15.442   15.566   6.2882  188.997   51.826  133.105   31.377 55.89243 60.58463 
1 1 1    2   25   51 o  351.784   12.258   96.474   6.6001   75.653   11.197  107.558   8.1702  302.690   24.375  370.146   14.421 -67.45569 28.32144 
1 1 1    2   25   52 o   90.963   25.679   7.1044   3.7317   4.3894   5.1402   10.130   5.4262   79.347   30.341  106.629   31.238 -27.28117 43.54725 
1 1 1    2   25   53 o   87.037   26.501   6.5322   3.8476   5.0456   5.4170   8.0457   5.4658   82.289   31.223   95.644   31.872 -13.35539 44.61681 
1 1 1    2   25   54 o   56.856   24.665   0.2002   3.9757  -0.0176   5.8876   0.3828   5.3903   66.626   29.426   65.294   28.517 1.332390 40.97665 
1 1 1    2   25   55 o   88.210   27.420   6.9368   4.0937   9.6981   6.1975   4.7994   5.4525  101.262   33.940   79.902   31.063 21.36003 46.00881 
1 1 1    2   25   56 o   88.060   28.764   7.0214   4.4600  -1.3377   6.7043   13.658   5.9736   66.156   30.118  119.337   32.032 -53.17999 43.96802 
1 1 1    2   26    1 o  165.967   27.882   21.769   6.8317   0.0000   0.0000   21.769   6.8317  ?   ?   165.967   27.882 0.000000 27.88171 
1 1 1    2   26    2 o  1520.48   21.092  1775.03   49.087   0.0000   0.0000  1775.03   49.087  ?   ?   1520.48   21.092 0.000000 21.09193 
1 1 1    2   26    3 o  1043.61   11.808  834.374   18.862  840.361   27.144  828.784   26.229  1046.79   16.942  1039.61   16.483 7.176880 23.63704 
1 1 1    2   26    4 f  1178.30   12.594  1063.79   22.713  1050.33   31.900  1077.63   32.347  1170.14   17.811  1185.24   17.830 -15.10278 25.20213 
1 1 1    2   26    5 o  709.269   10.408  385.312   11.299  396.416   16.383  375.240   15.603  719.114   14.884  699.667   14.569 19.44647 20.82821 
1 1 1    2   26    6 o  766.940   10.634  450.540   12.483  457.121   17.979  444.415   17.344  772.176   15.212  761.398   14.882 10.77838 21.28138 
1 1 1    2   26    7 o  1093.21   12.164  915.667   20.353  932.594   29.418  900.124   28.189  1102.61   17.431  1083.30   17.000 19.30310 24.34861 
1 1 1    2   26    8 o  223.788   16.145   38.605   5.4932   43.397   7.9208   34.164   7.6247  236.652   22.124  209.423   24.234 27.22966 32.81388 
1 1 1    2   26    9 o  1082.73   12.194  898.244   20.208  943.041   29.987  860.972   27.352  1108.67   17.671  1059.45   16.867 49.22229 24.42863 
1 1 1    2   26   10 o  311.958   13.065   74.583   6.2382   79.293   8.9127   70.060   8.7344  320.931   18.219  301.521   19.023 19.41064 26.34003 
1 1 1    2   26   11 o  406.024   9.4928  126.262   5.8995  129.578   7.3147  120.092   9.9788  411.242   11.621  395.674   16.477 15.56784 20.16238 
1 1 1    2   26   12 o  334.583   10.569   85.757   5.4127   85.517   6.6492   86.229   9.3193  334.030   13.005  334.682   18.261 -0.6521912 22.41879 
1 1 1    2   26   13 o  191.506   15.428   28.310   4.4839   42.277   7.9769   21.858   5.4215  233.413   22.611  167.262   21.687 66.15082 31.33014 
1 1 1    2   26   14 o  479.808   9.0963  176.327   6.6804  185.596   11.559  171.677   8.1860  491.900   15.352  473.339   11.299 18.56128 19.06151 
1 1 1    2   26   15 o  443.219   9.4278  150.475   6.3958  161.126   11.127  145.219   7.8162  458.263   15.863  435.302   11.731 22.96082 19.72926 
1 1 1    2   26   16 o  223.206   13.824   38.352   4.6996   31.554   5.6919   52.912   8.3299  201.828   18.635  261.497   20.988 -59.66890 28.06766 
1 1 1    2   26   17 o  655.066   8.8809  328.699   8.9045  322.494   10.831  341.641   15.642  648.706   10.908  667.248   15.316 -18.54187 18.80298 
1 1 1    2   26   18 o  962.322   8.3901  709.335   12.358  712.750   17.449  705.899   17.505  964.229   11.823  959.571   11.918 4.658081 16.78783 
1 1 1    2   26   19 o  814.769   7.9817  508.476   9.9541  505.075   13.973  511.981   14.184  811.707   11.247  817.226   11.339 -5.519531 15.97067 
1 1 1    2   26   20 o  561.379   7.9964  241.403   6.8710  235.437   9.5783  247.727   9.8620  554.151   11.292  568.427   11.335 -14.27612 16.00006 
1 1 1    2   26   21 o  677.296   7.9757  351.411   8.2683  352.880   11.668  349.930   11.718  678.389   11.237  675.536   11.333 2.853455 15.95965 
1 1 1    2   26   22 o  239.204   12.611   44.025   4.6012   41.660   6.3993   46.557   6.6203  231.989   18.167  245.383   17.746 -13.39339 25.39608 
1 1 1    2   26   23 o   46.012   21.770  -4.7646   4.0617  -7.3737   5.7760  -2.2124   5.7128   53.701   25.566   64.259   28.649 -10.55780 38.39795 
1 1 1    2   26   24 o  413.178   9.1197  130.858   5.7675  127.599   8.1235  134.171   8.1898  407.665   13.019  418.055   12.799 -10.38901 18.25647 
1 1 1    2   26   25 o  291.803   11.125   65.332   4.9690   58.908   6.9367   72.102   7.1214  276.184   16.484  306.215   15.194 -30.03040 22.41835 
1 1 1    2   26   26 o  833.005   8.5376  531.909   10.886  543.849   15.317  519.724   15.473  841.665   11.890  822.697   12.287 18.96735 17.09825 
1 1 1    2   26   27 o  256.784   15.180   50.916   5.9398   46.111   7.0768   62.371   10.926  243.666   19.128  282.174   25.576 -38.50815 31.93796 
1 1 1    2   26   28 o  260.324   15.034   52.336   5.9650   47.463   10.861   54.441   7.1380  244.641   29.607  265.073   17.695 -20.43181 34.49127 
1 1 1    2   26   29 o  104.323   27.618   8.8057   4.4794   18.484   6.3985  -0.4966   6.2730  151.356   28.669   72.012   31.110 79.34434 42.30526 
1 1 1    2   26   30 o  340.918   10.991   89.267   5.7355   86.005   7.9713   92.769   8.2587  334.028   15.591  346.920   15.553 -12.89172 22.02222 
1 1 1    2   26   31 o  497.097   9.2285  189.629   7.0217  195.571   9.9610  183.759   9.8996  504.172   12.908  488.642   13.236 15.52960 18.48798 
1 1 1    2   26   32 o  112.701   27.276   10.356   4.6546   2.7691   6.5245   18.220   6.6422   83.033   33.432  149.504   30.068 -66.47088 44.96450 
1 1 1    2   26   33 o  424.924   10.364  138.737   6.7408  134.582   9.5135  142.926   9.5524  417.632   14.883  430.474   14.498 -12.84210 20.77676 
1 1 1    2   26   34 o  241.607   16.441   45.362   6.0439   48.837   9.7280   43.178   7.7131  248.009   26.014  234.357   21.750 13.65263 33.90843 
1 1 1    2   26   35 o  559.168   12.443  240.900   10.649  240.090   15.164  241.690   14.959  556.280   17.809  558.258   17.507 -1.978149 24.97303 
1 1 1    2   26   36 o  372.017   11.723  106.603   6.6751  108.097   9.4129  105.092   9.4672  373.446   16.467  368.122   16.802 5.323639 23.52626 
1 1 1    2   26   37 o  327.366   12.895   82.711   6.4614   73.887   9.1628   91.440   9.1129  307.143   19.593  342.596   17.436 -35.45300 26.22737 
1 1 1    2   26   38 o  287.877   9.9665   63.764   4.3916   64.375   5.0560   61.884   8.8620  289.012   11.429  280.393   20.797 8.619232 23.73084 
1 1 1    2   26   39 o   64.333   23.592   2.6780   3.0410   2.8635   3.3152   1.6934   7.6371   66.767   24.611   83.803   35.193 -17.03569 42.94442 
1 1 1    2   26   40 o  105.380   16.323   8.8281   2.5477   10.620   3.5497   6.9248   3.6587  114.608   21.009   91.882   25.240 22.72538 32.84003 
1 1 1    2   26   41 o  249.336   11.462   47.977   4.3743   53.727   4.9716   28.266   9.2043  263.687   12.318  183.148   34.088 80.53831 36.24547 
1 1 1    2   26   42 o  199.609   10.510   30.804   3.1997   31.949   4.6613   29.784   4.4002  202.206   15.171  195.289   14.831 6.917221 21.21632 
1 1 1    2   26   43 o  277.280   10.232   59.283   4.3424   62.664   6.0972   55.803   6.1859  284.149   14.019  267.415   15.176 16.73441 20.65974 
1 1 1    2   26   44 o  226.613   10.659   39.643   3.6972   44.434   5.2986   35.096   5.1615  238.601   14.578  211.498   16.064 27.10329 21.69292 
1 1 1    2   26   45 o  143.460   21.198   16.631   4.5146   18.809   5.0498   7.9591   10.076  152.321   22.322  107.990   42.159 44.33040 47.70415 
1 1 1    2   26   46 o  211.853   15.179   35.198   4.8893   36.328   5.5357   31.189   10.426  214.598   16.992  188.402   37.474 26.19524 41.14661 
1 1 1    2   26   47 o  265.668   13.447   55.059   5.4503   63.166   6.3049   31.087   10.842  284.151   14.545  186.074   39.300 98.07794 41.90500 
1 1 1    2   26   48 o  122.358   24.929   12.553   4.5102   22.933   10.759   10.340   4.9678  155.770   43.472  109.622   29.116 46.14854 52.32129 
1 1 1    2   26   49 o   75.330   30.166   3.0389   5.2803  -7.9029   15.249   4.5296   5.6285   91.328   42.890   82.370   31.689 8.958504 53.32670 
1 1 1    2   26   50 o  271.753   11.273   57.396   4.6889   54.123   6.2700   61.548   7.0629  261.577   15.734  278.465   16.647 -16.88797 22.90559 
1 1 1    2   26   51 o   90.105   25.808   6.9555   3.7414   8.7938   5.2862   5.1105   5.2960  100.062   31.168   82.922   30.999 17.13994 43.95862 
1 1 1    2   26   52 o  143.005   18.671   16.679   3.9892   16.703   5.5387   16.653   5.7505  138.706   27.060  137.817   28.210 0.8893433 39.09035 
1 1 1    2   26   53 o  142.911   19.505   16.856   4.1551   23.045   6.1634   11.700   5.6259  163.665   25.429  112.650   31.434 51.01484 40.43144 
1 1 1    2   26   54 o   81.599   27.465   5.7311   4.0586   3.6118   6.0102   7.5078   5.5028   77.425   31.747   91.608   31.945 -14.18269 45.03689 
1 1 1    2   26   55 o  160.572   26.714   22.892   6.3350   0.0000   0.0000   22.892   6.3350  ?   ?   160.572   26.714 0.000000 26.71412 
1 1 1    2   27    1 f  831.203   15.411  529.778   19.607   0.0000   0.0000  529.778   19.607  ?   ?   831.203   15.411 0.000000 15.41086 
1 1 1    2   27    2 o  1308.27   19.223  1313.86   38.493   0.0000   0.0000  1313.86   38.493  ?   ?   1308.27   19.223 0.000000 19.22287 
1 1 1    2   27    3 o  582.729   10.592  260.120   9.4473  270.301   13.637  250.725   13.100  593.746   15.005  571.844   14.967 21.90192 21.19351 
1 1 1    2   27    4 o  700.005   10.522  375.355   11.274  377.593   16.219  373.264   15.682  701.745   15.100  697.746   14.684 3.998535 21.06246 
1 1 1    2   27    5 o  1092.58   12.224  914.743   20.443  915.653   29.183  913.865   28.646  1092.41   17.453  1091.40   17.148 1.018555 24.46749 
1 1 1    2   27    6 o  715.249   10.602  391.899   11.607  397.734   16.849  386.628   16.013  720.180   15.285  710.105   14.733 10.07526 21.22894 
1 1 1    2   27    7 o  1169.16   12.688  1047.60   22.706  1100.21   33.774  1004.22   30.672  1197.22   18.431  1143.96   17.517 53.25879 25.42741 
1 1 1    2   27    8 o  612.750   10.788  287.647   10.118  283.477   14.444  291.665   14.178  607.953   15.522  616.713   15.020 -8.759949 21.59909 
1 1 1    2   27    9 o  216.597   23.917   36.526   7.7970   0.0000   0.0000   36.526   7.7970  ?   ?   216.597   23.917 0.000000 23.91734 
1 1 1    2   27   10 f  381.553   16.771  111.715   9.7945   0.0000   0.0000  111.715   9.7945  ?   ?   381.553   16.771 0.000000 16.77097 
1 1 1    2   27   11 o  905.072   11.393  627.719   15.783  645.917   22.776  610.906   21.892  917.493   16.218  892.308   16.029 25.18518 22.80251 
1 1 1    2   27   12 o  919.959   16.345  649.494   23.015   0.0000   0.0000  649.494   23.015  ?   ?   919.959   16.345 0.000000 16.34477 
1 1 1    2   27   13 o  193.654   20.357   29.143   5.9436   29.143   5.9436   0.0000   0.0000  193.654   20.357  ?   ?  0.000000 20.35672 
1 1 1    2   27   14 o  166.221   18.206   21.476   4.5562   17.869   5.6278   28.338   7.7621  150.230   25.379  189.684   27.540 -39.45332 37.45003 
1 1 1    2   27   15 o  436.130   9.6330  145.734   6.4305  145.232   7.8897  146.727   11.099  435.254   11.843  437.132   16.588 -1.878113 20.38153 
1 1 1    2   27   16 o  892.574   8.1854  610.243   11.183  604.256   15.582  616.601   16.058  887.817   11.467  896.809   11.698 -8.992188 16.38105 
1 1 1    2   27   17 o  288.355   10.488   63.731   4.6290   69.282   6.5596   58.224   6.5332  300.460   14.263  274.928   15.589 25.53128 21.12991 
1 1 1    2   27   18 o  415.331   8.6578  132.161   5.5039  126.637   7.5567  138.402   8.0325  406.343   12.150  424.784   12.354 -18.44110 17.32743 
1 1 1    2   27   19 o  104.209   25.801   8.7268   4.0935   13.479   5.8281   4.0996   5.7509  129.271   30.029   85.161   32.204 44.10995 44.03252 
1 1 1    2   27   20 f  443.698   8.6907  150.856   5.9022  152.962   8.3973  148.799   8.2975  446.505   12.287  440.385   12.310 6.119812 17.39240 
1 1 1    2   27   21 o   87.713   27.195   5.9433   4.0298   8.0046   5.6356   3.7866   5.7647  101.984   32.243   83.891   32.118 18.09317 45.51069 
1 1 1    2   27   22 o  872.578   8.3421  583.479   11.142  569.826   15.441  598.309   16.093  861.754   11.706  882.989   11.907 -21.23523 16.69779 
1 1 1    2   27   23 o  285.841   11.020   62.686   4.8216   62.158   6.7591   63.232   6.8799  283.857   15.617  286.286   15.761 -2.428894 22.18788 
1 1 1    2   27   24 o  614.774   9.5581  289.830   8.9941  274.153   10.642  329.029   16.827  597.628   11.633  653.656   16.819 -56.02863 20.45031 
1 1 1    2   27   25 o  296.601   13.016   67.596   5.9089   72.103   7.1904   58.220   10.370  305.705   15.416  272.686   25.127 33.01828 29.47978 
1 1 1    2   27   26 o  275.238   13.984   58.410   5.8719   56.037   10.438   59.509   7.1022  267.174   25.848  277.368   16.808 -10.19409 30.83205 
1 1 1    2   27   27 o  172.658   17.344   23.224   4.5216   25.430   6.4412   21.082   6.3487  179.371   24.068  162.482   26.437 16.88948 35.75153 
1 1 1    2   27   28 o  223.562   14.095   38.619   4.7984   35.437   6.8422   41.699   6.7311  212.777   21.295  231.430   19.175 -18.65279 28.65519 
1 1 1    2   27   29 o  678.354   8.5226  352.960   8.8490  354.856   12.472  351.038   12.557  679.428   11.993  675.726   12.141 3.702087 17.06558 
1 1 1    2   27   30 o  391.169   10.060  117.496   6.0235  103.681   8.3090  132.797   8.7447  366.741   14.802  415.256   13.758 -48.51526 20.20855 
1 1 1    2   27   31 o   61.270   26.415  -0.2970   4.5037   1.6783   6.3715  -2.2694   6.3668   78.689   32.522   67.680   30.204 11.00861 44.38430 
1 1 1    2   27   32 o  150.015   22.010   17.892   4.9036   17.043   7.1942   18.629   6.7015  143.490   33.384  150.982   30.055 -7.491501 44.92016 
1 1 1    2   27   33 o  232.803   18.798   42.345   6.6412   42.070   9.5156   42.606   9.2732  229.360   27.664  231.168   26.699 -1.808029 38.44615 
1 1 1    2   27   34 o  270.397   15.530   56.737   6.4004   58.393   8.4300   54.484   9.8343  273.009   20.319  262.174   24.801 10.83499 32.06201 
1 1 1    2   27   35 o  195.535   18.302   29.980   5.4138   20.918   7.5393   39.627   7.7790  158.892   32.104  223.608   23.059 -64.71564 39.52758 
1 1 1    2   27   36 o  353.423   12.211   96.328   6.6059   79.900   9.0052  115.468   9.7201  319.808   18.475  385.746   16.463 -65.93799 24.74564 
1 1 1    2   27   37 o   51.560   24.446  -5.9169   5.1751  -6.3588   7.3391  -5.4798   7.2984   64.336   30.066   65.704   30.459 -1.368004 42.79895 
1 1 1    2   27   38 o   78.435   24.057   4.8887   3.1632   3.9107   3.4667   9.7522   7.7309   73.304   25.367  111.079   37.903 -37.77464 45.60810 
1 1 1    2   27   39 o  311.021   7.9496   74.315   3.7845   70.982   5.2767   77.846   5.4308  303.364   11.364  317.735   11.167 -14.37115 15.93218 
1 1 1    2   27   40 o  233.244   9.2000   41.860   3.2845   42.525   4.5622   41.145   4.7324  234.168   12.777  230.152   13.493 4.016266 18.58225 
1 1 1    2   27   41 o  301.438   8.7266   69.899   4.0263   67.082   5.3147   73.692   6.1684  294.683   11.783  308.531   13.062 -13.84882 17.59122 
1 1 1    2   27   42 o  144.839   14.447   16.449   3.1601   16.379   4.5654   16.514   4.3786  142.480   21.613  143.426   20.531 -0.9460297 29.80970 
1 1 1    2   27   43 o   71.806   22.970   4.0479   2.8538   2.2679   3.9479   5.9957   4.1299   66.756   26.291   86.419   27.632 -19.66290 38.14114 
1 1 1    2   27   44 o  264.719   18.316   55.319   7.3760   42.329   10.198   69.569   10.681  225.419   30.326  293.945   23.948 -68.52556 38.64182 
1 1 1    2   27   45 o   69.905   27.189   2.7574   4.1788   6.2319   4.6432 -12.0527   9.5862   88.315   29.373   66.506   32.000 21.80927 43.43665 
1 1 1    2   27   46 o   78.494   24.946   4.9599   3.3700   8.1374   4.9287   2.1701   4.6182   98.297   30.009   69.477   28.073 28.82037 41.09323 
1 1 1    2   27   47 o  172.555   18.691   23.834   4.8578   31.276   11.249   22.128   5.3859  184.560   40.898  164.878   21.882 19.68169 46.38344 
1 1 1    2   27   48 o  127.682   50.142   14.466   14.321   14.466   14.321   0.0000   0.0000  127.682   50.142  ?   ?  0.000000 50.14195 
1 1 1    2   27   49 o  406.720   13.967  129.582   8.6951  129.582   8.6951   0.0000   0.0000  406.720   13.967  ?   ?  0.000000 13.96726 
1 1 1    2   27   50 o  227.875   13.741   40.851   4.7702   44.474   6.7133   37.157   6.7793  235.069   18.816  213.447   21.023 21.62260 28.21381 
1 1 1    2   27   51 o  243.316   12.557   46.455   4.6605   47.403   7.0273   45.711   6.2269  241.920   19.134  238.834   17.148 3.086594 25.69353 
1 1 1    2   27   52 o  166.412   16.960   22.382   4.2596   25.413   6.1706   19.623   5.8875  173.155   23.921  150.164   26.588 22.99065 35.76488 
1 1 1    2   27   53 o   96.914   26.642   8.3896   4.0747   16.021   5.9932   1.8297   5.5565  132.132   30.281   70.076   29.754 62.05589 42.45328 
1 1 1    2   28    0 o  687.949   14.926  363.099   15.700  363.099   15.700  363.099   15.700  687.949   14.926  687.949   14.926 0.000000 0.000000 
1 1 1    2   28    1 o  881.311   15.809  595.848   21.325   0.0000   0.0000  595.848   21.325  ?   ?   881.311   15.809 0.000000 15.80878 
1 1 1    2   28    2 o  175.730   27.910   24.385   7.2562   0.0000   0.0000   24.385   7.2562  ?   ?   175.730   27.910 0.000000 27.91010 
1 1 1    2   28    3 o  1616.07   22.327  2008.43   55.228   0.0000   0.0000  2008.43   55.228  ?   ?   1616.07   22.327 0.000000 22.32692 
1 1 1    2   28    4 o  415.150   15.990  132.233   10.161   0.0000   0.0000  132.233   10.161  ?   ?   415.150   15.990 0.000000 15.98974 
1 1 1    2   28    5 o  421.425   16.293  136.280   10.510   0.0000   0.0000  136.280   10.510  ?   ?   421.425   16.293 0.000000 16.29315 
1 1 1    2   28    6 o  102.972   36.010   7.3156   6.9949   0.0000   0.0000   7.3156   6.9949  ?   ?   102.972   36.010 0.000000 36.00989 
1 1 1    2   28    7 o  672.580   14.907  347.005   15.346   0.0000   0.0000  347.005   15.346  ?   ?   672.580   14.907 0.000000 14.90679 
1 1 1    2   28    8 o  720.735   10.846  398.053   11.965  396.040   17.081  399.992   16.766  718.432   15.533  722.052   15.170 -3.619629 21.71225 
1 1 1    2   28    9 o  115.757   29.779   10.746   5.3065   5.5105   7.5500   15.859   7.4600   98.069   36.943  140.277   34.889 -42.20760 50.81410 
1 1 1    2   28   10 o  291.913   21.162   65.891   9.3912   65.891   9.3912   0.0000   0.0000  291.913   21.162  ?   ?  0.000000 21.16204 
1 1 1    2   28   11 o  513.274   16.157  202.255   12.694  202.255   12.694   0.0000   0.0000  513.274   16.157  ?   ?  0.000000 16.15727 
1 1 1    2   28   12 o  638.955   11.012  312.927   10.770  312.927   10.770   0.0000   0.0000  638.955   11.012  ?   ?  0.000000 11.01246 
1 1 1    2   28   13 o  394.036   10.126  118.987   6.1073  122.653   7.4902  111.715   10.549  399.935   12.236  381.241   18.078 18.69418 21.82961 
1 1 1    2   28   14 o  671.408   7.8419  345.290   8.0590  345.264   11.427  345.315   11.367  671.093   11.125  671.149   11.065 -0.5584717E-01 15.69081 
1 1 1    2   28   15 o  469.023   8.2460  168.523   5.9198  168.826   8.2478  168.201   8.5016  469.226   11.484  468.326   11.860 0.9002380 16.50870 
1 1 1    2   28   16 f  846.188   8.1263  548.551   10.525  553.282   14.950  543.901   14.820  849.395   11.499  842.164   11.497 7.230774 16.26090 
1 1 1    2   28   17 o  292.507   10.382   65.596   4.6484   73.025   6.6124   58.338   6.5359  308.405   14.008  275.111   15.585 33.29410 20.95524 
1 1 1    2   28   18 o  268.666   11.275   55.363   4.6368   54.340   6.4490   56.459   6.6715  265.406   15.949  270.518   16.187 -5.111389 22.72388 
1 1 1    2   28   19 o  467.260   8.3900  167.309   6.0005  169.864   8.4729  164.737   8.4993  470.521   11.765  463.343   11.984 7.177307 16.79374 
1 1 1    2   28   20 o  333.207   9.9130   85.134   5.0558   91.194   7.1082   78.930   7.1924  344.581   13.477  320.471   14.663 24.10986 19.91558 
1 1 1    2   28   21 o  273.041   11.218   57.205   4.6881   53.281   6.5699   61.276   6.6917  262.612   16.427  281.825   15.573 -19.21249 22.63569 
1 1 1    2   28   22 f  466.574   9.9964  166.972   7.1389  169.738   8.6428  161.032   12.665  470.192   12.009  457.049   18.104 13.14319 21.72468 
1 1 1    2   28   23 o  590.774   9.7037  267.700   8.7746  271.773   10.652  259.101   15.477  594.953   11.697  579.776   17.441 15.17682 21.00003 
1 1 1    2   28   24 f  208.189   16.859   33.621   5.3261   31.679   9.5881   34.487   6.4052  198.414   32.711  210.280   20.147 -11.86653 38.41809 
1 1 1    2   28   25 o  291.491   13.439   65.339   5.9959   75.189   11.217   61.398   7.0946  310.244   23.802  281.746   16.524 28.49710 28.97550 
1 1 1    2   28   26 o  297.883   11.322   68.157   5.1624   73.907   7.3464   62.547   7.2560  309.313   15.567  284.267   16.750 25.04636 22.86694 
1 1 1    2   28   27 o  243.449   12.983   45.717   4.8204   49.705   6.7650   41.605   6.8703  253.073   17.573  231.014   19.615 22.05878 26.33587 
1 1 1    2   28   28 o  152.146   19.863   18.233   4.5153   18.110   6.3697   18.357   6.4017  149.458   28.889  150.517   28.837 -1.059555 40.81855 
1 1 1    2   28   29 o  361.192   10.382  100.215   5.7395   99.277   7.9704  101.225   8.2716  358.864   14.511  362.293   14.916 -3.428955 20.80984 
1 1 1    2   28   30 o  657.182   8.6785  331.453   8.7297  338.037   12.489  325.164   12.207  662.743   12.312  650.013   12.269 12.72968 17.38139 
1 1 1    2   28   31 o  168.988   21.116   22.569   5.3426   21.854   8.5619   23.025   6.8370  162.092   35.493  168.984   27.369 -6.892380 44.81962 
1 1 1    2   28   32 o  319.276   14.884   78.752   7.2736   85.335   10.529   72.742   10.060  330.217   20.939  304.520   21.726 25.69763 30.17377 
1 1 1    2   28   33 o  347.523   11.513   92.993   6.1239   96.555   8.7648   89.595   8.5599  353.063   16.219  340.043   16.446 13.02005 23.09828 
1 1 1    2   28   34 o   59.208   26.380  -1.6225   4.8353   1.6798   7.0650  -4.5323   6.6319   81.495   34.010   63.816   29.389 17.67980 44.94823 
1 1 1    2   28   35 o   44.886   21.961  -9.3924   5.0403   1.7705   7.2591 -19.7841   7.0038   82.534   34.461   45.819   22.986 36.71508 41.42378 
1 1 1    2   28   36 o  150.806   24.608   18.394   5.4843   12.195   7.7407   24.643   7.7715  121.126   37.714  172.930   30.474 -51.80452 48.48676 
1 1 1    2   28   37 o  113.008   31.379   10.653   5.6208   9.0517   7.8645   12.326   8.0363  108.591   38.171  121.616   38.509 -13.02413 54.22150 
1 1 1    2   28   38 o  106.897   32.606   9.4292   5.8205   15.033   7.9545   2.9703   8.5396  132.515   37.519   90.846   37.607 41.66894 53.12241 
1 1 1    2   28   39 o  293.468   10.176   66.350   4.5708   69.650   5.2458   55.945   9.3148  300.423   11.408  264.918   23.206 35.50525 25.85815 
1 1 1    2   28   40 o  224.067   10.549   38.713   3.6178   38.723   5.0862   38.703   5.1471  222.764   15.004  222.653   15.194 0.1111908 21.35376 
1 1 1    2   28   41 o  143.070   14.226   16.043   3.0740   22.622   4.6548   10.954   4.0937  168.991   18.288  115.325   23.974 53.66604 30.15240 
1 1 1    2   28   42 o   69.307   22.843   3.6921   2.8106   1.2535   4.1508   5.7568   3.8194   63.666   26.276   84.517   26.520 -20.85031 37.33295 
1 1 1    2   28   43 o  152.379   18.790   18.524   4.2897   21.032   4.8013   8.5970   9.5504  162.173   19.750  108.742   41.410 53.43050 45.87880 
1 1 1    2   28   44 o   58.972   23.008   1.8324   2.9995  -0.4328   4.5062   3.6345   4.0193   59.769   26.089   73.301   27.083 -13.53179 37.60521 
1 1 1    2   28   45 f  222.539   11.326   38.446   3.8451   45.466   5.8350   33.059   5.1120  240.433   15.946  204.677   16.457 35.75645 22.91480 
1 1 1    2   28   46 o   88.216   28.956   6.3584   4.5177  -5.0201   12.211   8.1628   4.8627   86.170   39.753   98.065   29.778 -11.89500 49.66958 
1 1 1    2   28   47 o  339.621   13.528   90.058   7.0322   83.236   15.929   91.710   7.8373  309.221   34.230  341.959   14.973 -32.73813 37.36141 
1 1 1    2   28   48 o  229.408   12.896   41.202   4.5099   47.936   6.7186   35.680   6.0843  244.943   18.047  210.620   19.080 34.32370 26.26322 
1 1 1    2   28   49 o   70.808   25.937   3.6155   3.6741   2.6965   5.2822   4.4768   5.1138   73.489   29.905   79.799   30.322 -6.310211 42.58790 
1 1 1    2   28   50 o  189.270   17.959   28.903   5.1403  -2.0367   10.268   39.250   5.9380   81.301   37.114  220.929   17.708 -139.6276 41.12215 
1 1 1    2   28   51 o   51.458   23.042  -0.9992   3.7386  -2.7686   5.3791   0.6542   5.1997   57.365   26.437   65.350   28.278 -7.984554 38.71097 
1 1 1    2   28   52 o  113.556   24.569   11.256   4.1464   14.392   5.9054   8.2063   5.8232  124.632   31.066   95.160   32.880 29.47121 45.23463 
1 1 1    2   29    0 o  198.949   27.279   32.075   7.8634   32.075   7.8634   32.075   7.8634  198.949   27.279  198.949   27.279 0.000000 0.000000 
1 1 1    2   29    1 o  864.062   15.908  573.072   21.040   0.0000   0.0000  573.072   21.040  ?   ?   864.062   15.908 0.000000 15.90829 
1 1 1    2   29    2 o  757.948   10.943  440.279   12.696  437.357   18.120  443.098   17.794  754.870   15.683  759.862   15.299 -4.991150 21.90895 
1 1 1    2   29    3 o  728.936   10.991  407.230   12.263  433.968   18.004  384.087   16.749  751.936   15.643  707.425   15.469 44.51086 21.99924 
1 1 1    2   29    4 o  407.523   16.742  127.527   10.443  127.527   10.443   0.0000   0.0000  407.523   16.742  ?   ?  0.000000 16.74158 
1 1 1    2   29    5 o  250.171   23.081   48.611   8.7383   48.611   8.7383   0.0000   0.0000  250.171   23.081  ?   ?  0.000000 23.08067 
1 1 1    2   29    6 o  798.170   15.983  489.120   19.526  489.120   19.526   0.0000   0.0000  798.170   15.983  ?   ?  0.000000 15.98262 
1 1 1    2   29    7 o  466.279   16.344  166.962   11.665  166.962   11.665   0.0000   0.0000  466.279   16.344  ?   ?  0.000000 16.34445 
1 1 1    2   29    8 o  424.199   12.286  137.989   7.9773  151.244   11.255  124.609   11.308  443.745   16.571  402.617   18.350 41.12790 24.72485 
1 1 1    2   29    9 o  378.252   12.557  109.732   7.2701  123.009   10.521   97.598   10.058  400.109   17.179  355.802   18.532 44.30777 25.26994 
1 1 1    2   29   10 o  452.814   11.854  157.231   8.2159  170.914   12.120  145.597   11.175  471.639   16.789  435.310   16.772 36.32901 23.73161 
1 1 1    2   29   11 o  230.957   17.035   41.216   5.9795   24.084   8.2665   60.018   8.6599  173.394   32.337  278.451   20.462 -105.0572 38.26688 
1 1 1    2   29   12 o  396.712   12.365  120.726   7.5085  111.715   10.423  130.445   10.825  381.139   17.867  411.927   17.169 -30.78787 24.77925 
1 1 1    2   29   13 o  731.758   9.0371  410.334   10.122  411.344   12.454  408.369   17.375  732.415   11.109  729.074   15.570 3.341614 19.12644 
1 1 1    2   29   14 o  215.920   14.809   35.977   4.8647   38.284   5.9840   31.482   8.3538  222.383   17.727  199.630   28.118 22.75241 33.24002 
1 1 1    2   29   15 o  372.735   9.0046  106.477   5.1373  108.980   7.3068  104.030   7.2244  376.830   12.668  368.160   12.820 8.670105 18.02328 
1 1 1    2   29   16 o  473.572   8.2914  171.854   6.0102  174.849   8.5558  168.936   8.4446  477.382   11.709  469.237   11.758 8.145264 16.59348 
1 1 1    2   29   17 o  129.380   20.382   13.220   3.9028   14.440   5.5453   12.023   5.4939  133.936   27.953  121.916   29.712 12.01979 40.79413 
1 1 1    2   29   18 o  249.190   11.626   47.654   4.4345   52.612   6.3737   43.001   6.1737  261.028   16.030  235.710   17.231 25.31805 23.53491 
1 1 1    2   29   19 o  254.766   11.753   49.821   4.5830   52.498   6.4829   47.146   6.4796  260.659   16.332  246.820   17.260 13.83949 23.76192 
1 1 1    2   29   20 o  212.533   15.694   34.949   5.0691   34.108   6.1817   36.677   8.8570  209.319   19.520  215.424   27.487 -6.104462 33.71313 
1 1 1    2   29   21 o  561.952   9.7162  242.225   8.3573  245.123   10.206  236.325   14.561  565.001   11.801  553.740   17.180 11.26050 20.84242 
1 1 1    2   29   22 o  603.298   9.6716  279.208   8.9310  292.700   16.348  273.469   10.663  616.099   17.336  596.745   11.674 19.35419 20.90024 
1 1 1    2   29   23 o  274.548   13.839   58.127   5.7968   44.263   10.161   64.816   7.0580  236.295   28.682  289.600   15.984 -53.30519 32.83544 
1 1 1    2   29   24 o  385.067   9.6716  113.779   5.7004  110.652   7.8131  117.339   8.3353  379.269   13.459  390.487   13.946 -11.21838 19.38109 
1 1 1    2   29   25 o  433.696   9.2617  144.322   6.1482  145.563   8.7522  143.113   8.6387  434.989   13.145  431.323   13.085 3.666412 18.54764 
1 1 1    2   29   26 o  169.920   17.682   22.551   4.5315   22.371   6.2016   22.757   6.6376  167.599   24.934  168.634   26.597 -1.034698 36.45727 
1 1 1    2   29   27 o  324.881   10.920   81.105   5.4304   78.387   7.5074   84.087   7.8644  318.758   15.387  330.112   15.565 -11.35464 21.88650 
1 1 1    2   29   28 o  294.852   11.740   66.868   5.2985   68.890   7.5182   64.873   7.4685  298.100   16.542  289.160   16.948 8.939941 23.68291 
1 1 1    2   29   29 f  338.303   12.199   88.097   6.3170   74.681   10.228   96.371   8.0320  308.818   21.778  353.342   14.851 -44.52484 26.35954 
1 1 1    2   29   30 o   56.091   26.141  -4.8382   5.4874  -2.3802   7.9073  -7.1217   7.6214   75.805   33.758   65.024   30.468 10.78097 45.47371 
1 1 1    2   29   31 o  273.803   14.503   58.069   6.0562   58.374   7.8443   57.618   9.5289  273.403   18.860  270.220   23.266 3.183258 29.94985 
1 1 1    2   29   32 o  170.779   19.827   23.025   5.0863   26.787   7.3831   19.626   7.0171  182.081   27.336  154.254   30.799 27.82753 41.17998 
1 1 1    2   29   33 o  103.059   29.566   8.7048   4.9069   0.2288   6.8510   17.633   7.0313   76.290   32.730  145.386   32.423 -69.09636 46.07067 
1 1 1    2   29   34 o  185.329   19.037   27.051   5.3235   28.361   7.5987   25.789   7.4603  187.130   27.336  177.924   28.345 9.206223 39.37843 
1 1 1    2   29   35 o  160.814   22.986   20.741   5.4971   16.778   7.6682   24.929   7.8843  140.593   35.598  173.786   30.766 -33.19249 47.05070 
1 1 1    2   29   36 o  101.963   31.717   8.4622   5.4764   5.3145   7.6619   11.750   7.8304   94.772   36.829  119.054   38.046 -24.28136 52.95137 
1 1 1    2   29   37 o  216.276   18.527   36.801   6.0739   34.558   8.4620   39.185   8.7236  206.214   27.494  220.249   26.403 -14.03474 38.11911 
1 1 1    2   29   38 o   77.458   31.264   2.6170   5.7211   4.3613   8.1240   0.9011   8.0580   92.993   37.354   83.162   35.583 9.831604 51.58937 
1 1 1    2   29   39 o  487.309   18.647  186.060   13.909  198.302   19.492  173.361   19.853  497.353   25.692  462.845   28.156 34.50839 38.11671 
1 1 1    2   29   40 o  223.060   13.040   38.674   4.4328   45.122   5.0733   17.860   9.1143  240.775   13.824  142.282   40.119 98.49348 42.43379 
1 1 1    2   29   41 o  332.889   10.728   85.553   5.4665   68.502   9.9123   93.005   6.5530  292.939   22.274  346.594   12.352 -53.65530 25.46972 
1 1 1    2   29   42 o  146.996   18.079   17.204   3.9819   17.899   4.3860   13.943   9.4982  149.469   19.647  126.532   42.007 22.93725 46.37463 
1 1 1    2   29   43 o  164.272   13.341   21.101   3.3255   23.882   4.8474   18.629   4.5708  173.183   18.577  152.204   20.112 20.97949 27.37896 
1 1 1    2   29   44 o  212.023   14.617   35.243   4.7148   4.4211   10.237   43.541   5.3117   98.020   40.925  235.698   14.798 -137.6775 43.51836 
1 1 1    2   29   45 o  118.072   26.565   11.822   4.6849  -4.9467   12.071   14.795   5.0833   85.756   39.549  132.674   25.961 -46.91782 47.30891 
1 1 1    2   29   46 f  182.278   15.009   26.225   4.1503   18.798   5.6689   34.804   6.0929  149.683   25.667  208.196   19.341 -58.51276 32.13829 
1 1 1    2   29   47 o  139.831   17.923   15.758   3.7477   11.337   5.3731   19.947   5.2300  113.553   30.337  155.434   22.648 -41.88178 37.85909 
1 1 1    2   29   48 o  202.648   13.475   32.295   4.1558   33.618   5.9731   31.053   5.7856  203.934   19.368  195.833   19.563 8.100708 27.52903 
1 1 1    2   29   49 o   99.615   25.403   8.5950   3.8853   11.457   5.7151   6.1359   5.2979  112.449   31.790   86.901   31.246 25.54784 44.57479 
1 1 1    2   29   50 o  197.075   14.041   30.807   4.2077   27.705   5.8991   34.019   6.0035  182.600   21.520  203.941   19.469 -21.34122 29.01943 
1 1 1    2   29   51 o  169.128   15.986   23.055   4.0892   17.461   5.8525   28.391   5.7160  139.689   28.341  184.942   20.539 -45.25372 35.00099 
1 1 1    2   30    2 o  599.773   11.027  275.786   10.123  280.183   14.598  271.713   14.049  603.982   15.790  594.830   15.431 9.152039 22.07831 
1 1 1    2   30    3 o  583.664   10.940  261.167   9.7731  250.254   13.760  272.277   13.883  570.809   15.749  595.465   15.232 -24.65576 21.91032 
1 1 1    2   30    4 o  786.536   11.179  474.321   13.458  468.791   18.915  479.991   19.152  781.221   15.818  790.496   15.829 -9.275085 22.37771 
1 1 1    2   30    5 o  214.307   17.994   35.564   5.8480   31.284   8.1114   40.197   8.4389  199.285   27.310  226.845   24.704 -27.55954 36.82590 
1 1 1    2   30    6 o  841.083   11.372  542.463   14.641  532.037   20.461  553.401   20.958  832.149   16.064  848.678   16.134 -16.52893 22.76746 
1 1 1    2   30    7 o  406.972   12.006  127.040   7.4787  133.739   10.590  120.374   10.563  417.141   16.585  395.661   17.443 21.48007 24.06915 
1 1 1    2   30    8 o   73.375   30.164   1.3705   5.4435  -1.6226   7.7274   4.3190   7.6696   77.759   34.047   94.210   36.781 -16.45155 50.12038 
1 1 1    2   30    9 o   65.963   28.267  -0.2203   5.0995  -1.1604   7.4917   0.5914   6.9610   77.568   33.754   79.358   33.477 -1.790245 47.53958 
1 1 1    2   30   10 o  309.097   13.604   73.348   6.4364   74.512   9.3274   72.290   8.8931  310.389   19.735  305.813   19.094 4.576202 27.46046 
1 1 1    2   30   11 o  302.323   13.824   70.183   6.3969   68.187   9.2818   71.989   8.8285  296.699   20.565  305.159   18.995 -8.460022 27.99563 
1 1 1    2   30   12 o  450.246   11.480  155.517   7.9117  151.527   11.111  159.620   11.268  443.888   16.354  455.615   16.158 -11.72739 22.98954 
1 1 1    2   30   13 o  464.066   11.448  165.224   8.1315  173.550   11.898  157.926   11.139  475.003   16.365  453.161   16.059 21.84229 22.92810 
1 1 1    2   30   14 o  744.352   9.2167  424.739   10.501  437.910   13.153  401.592   17.437  755.476   11.375  722.627   15.765 32.84894 19.44026 
1 1 1    2   30   15 o  497.949   9.4050  190.107   7.1683  200.241   8.9395  171.856   11.997  510.827   11.433  472.538   16.587 38.28882 20.14567 
1 1 1    2   30   16 o  405.613   10.194  126.192   6.3291  129.847   7.7828  119.057   10.876  411.229   12.365  393.040   18.078 18.18909 21.90184 
1 1 1    2   30   17 o  215.588   14.983   35.920   4.9133   36.199   6.0142   35.359   8.5196  215.903   18.374  211.614   26.912 4.288467 32.58595 
1 1 1    2   30   18 o  515.321   9.6580  203.680   7.6179  219.326   9.6034  177.126   12.511  534.468   11.739  479.448   17.048 55.01990 20.69894 
1 1 1    2   30   19 o  637.667   9.4716  311.878   9.2446  322.723   16.852  307.210   11.057  647.072   17.015  632.560   11.420 14.51257 20.49195 
1 1 1    2   30   20 o  159.500   21.392   20.038   5.0910   27.425   9.0280   16.594   6.1646  184.083   33.266  143.224   29.113 40.85913 44.20579 
1 1 1    2   30   21 o  591.027   8.3524  267.843   7.5559  259.834   10.613  276.075   10.760  581.551   11.923  599.489   11.726 -17.93799 16.72298 
1 1 1    2   30   22 o  173.978   16.512   23.551   4.3444   19.735   5.9947   27.772   6.3047  157.145   25.820  187.883   22.363 -30.73804 34.15784 
1 1 1    2   30   23 o  198.178   15.378   30.451   4.6282   31.966   6.3125   28.691   6.8058  202.047   20.704  190.576   23.854 11.47130 31.58591 
1 1 1    2   30   24 o  314.484   11.053   75.987   5.3205   73.432   7.2048   79.051   7.8906  308.608   15.253  319.651   16.180 -11.04346 22.23599 
1 1 1    2   30   25 o  365.231   10.168  102.447   5.6840  103.669   7.9493  101.168   8.1304  366.803   14.159  362.261   14.663 4.541840 20.38329 
1 1 1    2   30   26 o  276.602   12.108   58.863   5.1262   55.401   7.2335   62.356   7.2656  266.957   17.805  283.515   16.818 -16.55844 24.49178 
1 1 1    2   30   27 o  324.011   12.409   80.821   6.1541   86.596   10.148   77.462   7.7397  333.256   19.987  316.186   16.045 17.07010 25.63009 
1 1 1    2   30   28 o  303.610   14.754   71.173   6.8563   66.888   9.5963   75.641   9.7995  292.107   21.617  311.021   20.703 -18.91397 29.93146 
1 1 1    2   30   29 o  271.895   14.060   57.213   5.8314   52.919   7.3920   64.291   9.4891  260.345   18.674  286.097   21.834 -25.75137 28.73043 
1 1 1    2   30   30 o  358.114   10.928   98.693   5.9900  111.369   8.7121   87.328   8.2491  379.494   14.998  335.793   16.050 43.70102 21.96684 
1 1 1    2   30   31 o   80.549   29.279   4.3772   4.6689  -1.3634   6.5917   10.157   6.6141   70.765   31.201  111.725   34.873 -40.96089 46.79361 
1 1 1    2   30   32 o  106.215   29.119   9.3011   4.8753   10.873   6.8979   7.7319   6.8915  115.043   35.566  101.758   35.734 13.28516 50.41632 
1 1 1    2   30   33 o  344.630   11.935   91.589   6.2955   82.407   8.6999  101.681   9.1214  325.024   17.553  361.887   16.467 -36.86334 24.06785 
1 1 1    2   30   34 o   85.923   30.650   5.2721   5.0880   10.110   7.1575   0.3298   7.2341  111.684   36.436   78.222   33.598 33.46146 49.56260 
1 1 1    2   30   35 o   83.759   31.359   4.5294   5.4239   7.3082   7.5077   1.4955   7.8446  101.197   37.076   84.066   35.504 17.13163 51.33383 
1 1 1    2   30   36 o  180.193   21.340   25.877   5.7713   29.059   7.9968   22.417   8.3376  188.300   28.649  162.570   34.570 25.72935 44.89862 
1 1 1    2   30   37 o  231.851   21.176   42.663   7.4319   42.955   8.4762   41.693   15.456  231.366   24.298  214.406   48.261 16.96053 54.03241 
1 1 1    2   30   38 o  380.900   16.280  113.073   9.4913  150.303   18.559   99.886   11.045  430.593   28.316  355.662   20.374 74.93051 34.88419 
1 1 1    2   30   39 o  195.788   21.387   30.632   6.3049   28.402   8.6266   33.190   9.2378  183.918   31.794  199.376   31.302 -15.45831 44.61712 
1 1 1    2   30   40 o   74.867   31.322   1.5516   6.0138   3.8775   8.2722  -1.0554   8.7581   91.342   37.325   81.051   35.839 10.29018 51.74514 
1 1 1    2   30   41 o  158.114   17.219   19.806   4.0998   20.046   4.5387   18.744   9.5557  158.474   19.096  144.352   41.211 14.12221 45.41994 
1 1 1    2   30   42 o  229.040   10.389   40.525   3.6420   48.118   5.3098   33.780   5.0049  248.247   14.031  207.253   15.898 40.99455 21.20455 
1 1 1    2   30   43 o  153.033   14.042   18.399   3.2525   14.908   4.5548   22.031   4.6460  134.680   22.916  166.056   18.598 -31.37645 29.51319 
1 1 1    2   30   44 o   60.987   25.963   0.5201   4.2509   14.183   12.230  -1.3575   4.5335  126.517   47.144   56.851   25.421 69.66649 53.56073 
1 1 1    2   30   45 o  147.017   15.885   17.187   3.5178   26.739   5.2336   9.3149   4.7512  182.398   19.026  103.839   28.856 78.55889 34.56386 
1 1 1    2   30   46 o  165.880   14.575   21.745   3.6629   18.598   5.1067   25.081   5.2569  149.819   23.004  175.970   19.865 -26.15141 30.39457 
1 1 1    2   30   47 o  380.954   9.9989  112.505   5.8304  123.461   8.5099  102.812   8.0041  396.634   14.017  361.662   14.459 34.97180 20.13825 
1 1 1    2   30   48 o  156.197   16.784   19.626   3.9499   21.662   5.6395   17.665   5.5339  160.572   23.654  143.323   26.191 17.24927 35.29163 
1 1 1    2   30   49 o   37.486   18.397  -6.7024   3.6208 -12.7315   5.2260  -1.1363   5.0214   40.819   20.386   59.283   26.613 -18.46333 33.52391 
1 1 1    2   30   50 o  139.696   20.017   16.238   4.1578   13.708   5.5956   19.356   6.2128  122.288   30.098  147.084   28.627 -24.79595 41.53742 
1 1 1    2   30   51 o  127.327   22.940   13.941   4.3063   13.408   6.1621   14.450   6.0205  118.442   32.844  123.898   31.636 -5.456810 45.60235 
1 1 1    2   31    0 o  697.772   15.398  373.922   16.428  373.922   16.428  373.922   16.428  697.772   15.398  697.772   15.398 0.000000 0.000000 
1 1 1    2   31    2 o  579.260   15.609  257.878   13.839  257.878   13.839   0.0000   0.0000  579.260   15.609  ?   ?  0.000000 15.60870 
1 1 1    2   31    3 o  399.694   12.427  122.592   7.6024  129.409   10.446  114.915   11.085  410.221   16.637  386.316   18.746 23.90436 25.06440 
1 1 1    2   31    4 o  1377.40   14.282  1457.20   30.111  1476.68   43.340  1439.03   41.865  1383.97   20.460  1366.43   20.017 17.54126 28.62290 
1 1 1    2   31    5 o  109.261   28.935   9.6020   4.9156   9.4775   7.1654   9.7128   6.7560  111.764   36.456  111.979   35.293 -0.2145996 50.74072 
1 1 1    2   31    6 o  297.653   14.376   68.060   6.5495   77.354   9.6622   60.159   8.9085  316.143   20.071  278.473   21.056 37.66940 29.08974 
1 1 1    2   31    7 o  206.211   18.127   32.990   5.6634   30.785   8.0565   35.143   7.9628  197.388   27.405  211.630   25.069 -14.24200 37.14202 
1 1 1    2   31    8 o  826.950   11.277  524.622   14.274  516.979   20.090  532.414   20.283  819.901   16.008  832.072   15.926 -12.17029 22.58097 
1 1 1    2   31    9 o  684.039   11.015  358.946   11.533  365.170   16.520  353.029   16.108  689.113   15.662  677.588   15.532 11.52563 22.05767 
1 1 1    2   31   10 o  829.239   11.406  527.633   14.478  543.896   21.083  513.120   19.916  840.758   16.383  816.744   15.931 24.01428 22.85159 
1 1 1    2   31   11 o  179.314   21.935   25.211   5.8948   25.035   8.5114   25.374   8.1721  176.259   32.754  177.856   31.154 -1.597046 45.20422 
1 1 1    2   31   12 o  259.413   15.996   51.977   6.3203   50.192   8.7453   53.928   9.1445  253.706   22.763  263.012   22.945 -9.305771 32.32023 
1 1 1    2   31   13 o  374.133   12.569  107.500   7.1977  109.833   10.470  105.410   9.9109  377.461   18.122  369.872   17.506 7.589813 25.19699 
1 1 1    2   31   14 o  312.133   14.137   74.904   6.7542   73.712   9.9476   75.923   9.1999  308.052   21.227  313.057   19.293 -5.004761 28.68461 
1 1 1    2   31   15 o   94.582   28.931   7.0093   4.5782   0.8999   5.7491   17.600   7.5693   73.290   30.640  146.780   34.307 -73.48988 45.99796 
1 1 1    2   31   16 o  683.241   9.5367  358.065   9.9733  349.452   17.140  362.473   12.263  673.439   16.628  687.054   11.661 -13.61505 20.30972 
1 1 1    2   31   17 o  224.396   15.439   38.953   5.2705   39.651   9.0577   38.595   6.4807  224.016   26.957  222.712   19.199 1.304428 33.09508 
1 1 1    2   31   18 o  452.368   10.308  157.059   7.1374  155.950   13.036  157.534   8.5294  449.245   18.958  452.777   12.307 -3.531616 22.60276 
1 1 1    2   31   19 o  650.829   8.2594  324.792   8.2278  327.234   11.760  322.451   11.515  652.626   11.773  647.873   11.612 4.752747 16.53616 
1 1 1    2   31   20 o  559.897   8.4655  240.422   7.2549  247.293   10.322  233.715   10.199  567.259   11.889  551.429   12.083 15.83057 16.95127 
1 1 1    2   31   21 o  535.868   8.5433  220.261   7.0074  216.566   9.8419  224.059   9.9793  530.750   12.115  539.861   12.077 -9.111328 17.10612 
1 1 1    2   31   22 f  123.883   23.376   12.328   4.2701   8.7250   5.9653   16.115   6.1150  105.248   33.162  140.683   29.347 -35.43430 44.28328 
1 1 1    2   31   23 o   79.349   27.916   4.4028   4.2069   8.6197   5.9198   0.1004   5.9795  104.584   33.044   71.785   30.682 32.79810 45.09236 
1 1 1    2   31   24 o   97.841   27.560   7.7386   4.3035   6.4102   5.9507   9.1951   6.2312   94.560   33.205  107.641   33.890 -13.08114 47.44590 
1 1 1    2   31   25 o  170.854   19.992   22.977   5.1294   23.077   8.2543   22.914   6.5470  167.439   33.379  169.002   26.154 -1.563492 42.40492 
1 1 1    2   31   26 o  325.461   14.396   81.749   7.1717   87.170   10.125   76.290   10.160  334.254   19.879  312.146   21.394 22.10873 29.20441 
1 1 1    2   31   27 o  147.719   23.692   17.500   5.1758   17.079   6.5963   18.174   8.3489  143.920   30.869  147.024   37.100 -3.103958 48.26299 
1 1 1    2   31   28 o  324.845   11.435   81.243   5.6858   77.233   7.9316   85.483   8.1550  315.299   16.492  332.257   16.035 -16.95773 23.00275 
1 1 1    2   31   29 o  449.268   9.9628  155.213   6.8511  152.547   9.6059  157.972   9.7740  444.326   14.124  452.157   14.123 -7.831635 19.97355 
1 1 1    2   31   30 o  359.779   11.166   99.684   6.1492  105.604   8.7494   93.905   8.6442  369.250   15.481  347.991   16.229 21.25919 22.42820 
1 1 1    2   31   31 o   76.977   29.460   3.4325   4.8487   2.8429   6.9126   4.0035   6.8029   84.183   34.228   87.536   34.501 -3.353012 48.59871 
1 1 1    2   31   32 o  178.454   19.946   25.193   5.3551   20.517   7.5333   29.968   7.6138  156.712   32.474  192.601   26.531 -35.88977 41.93352 
1 1 1    2   31   33 o  230.957   16.138   41.627   5.6692   42.722   7.9131   40.471   8.1262  231.893   22.581  225.135   23.949 6.758255 32.91587 
1 1 1    2   31   34 o   60.673   27.247  -2.0575   5.2684 -10.2910   7.2048   7.4040   7.7234   57.206   27.579  102.022   37.570 -44.81600 46.60620 
1 1 1    2   31   35 f  177.542   27.062   25.727   7.1217   19.591   8.1211   46.154   14.818  151.295   35.653  229.358   43.807 -78.06270 56.48177 
1 1 1    2   31   36 o  327.755   21.834   85.162   10.891   70.850   14.987  101.175   15.853  291.570   34.234  352.370   29.670 -60.79980 45.30192 
1 1 1    2   31   37 o  301.789   18.051   71.531   8.2998   66.483   16.753   73.173   9.5549  277.166   40.701  304.056   20.653 -26.88974 45.64151 
1 1 1    2   31   38 o  110.012   32.628   10.211   5.8887   9.3269   8.2407   11.133   8.4180  109.096   38.996  115.993   39.552 -6.897011 55.54326 
1 1 1    2   31   39 o  172.218   24.996   24.208   6.3965   29.742   8.6725   17.607   9.4722  188.228   31.194  140.505   41.304 47.72307 51.75949 
1 1 1    2   31   40 o   68.302   30.186  -1.0416   6.2056 -15.4977   8.6134   14.560   8.9483   57.908   28.410  128.447   40.631 -70.53825 49.57859 
1 1 1    2   31   41 o   99.112   34.560   7.8549   6.4407   19.816   9.0768  -4.2749   9.1405  148.350   39.334   75.868   34.777 72.48174 52.50344 
1 1 1    2   31   42 o  255.922   20.557   52.442   7.9848   53.759   12.643   51.568   10.299  250.138   33.894  249.595   27.408 0.5424652 43.58942 
1 1 1    2   31   43 o  108.049   28.741   10.042   4.8360   5.5670   11.615   10.980   5.3190  103.474   43.424  112.532   30.235 -9.057838 52.91340 
1 1 1    2   31   44 f  169.193   18.494   22.985   4.7114  -0.7509   10.037   29.692   5.3357   84.731   37.861  192.601   18.320 -107.8698 42.06017 
1 1 1    2   31   45 o  240.160   13.697   45.271   5.0140   50.312   5.7820   29.987   10.068  252.587   15.023  181.007   37.569 71.57996 40.46161 
1 1 1    2   31   46 o  423.153   11.153  139.264   7.2239  159.572   9.1199  105.065   11.835  451.514   13.196  359.164   21.629 92.34933 25.33664 
1 1 1    2   31   47 o  110.085   22.791   10.281   3.7138   18.858   5.3250   2.1570   5.1822  149.324   24.120   70.588   29.264 78.73565 37.92356 
1 1 1    2   31   48 o  118.376   22.627   11.912   3.9503   7.2604   5.9579   15.560   5.2770   91.993   33.129  133.285   26.795 -41.29191 42.60887 
1 1 1    2   31   49 o  186.122   14.632   27.662   4.1347   23.063   5.8865   32.141   5.8090  164.148   24.151  197.675   19.451 -33.52730 31.00979 
1 1 1    2   32    0 o   85.111   43.500   8.2822   7.1599   8.2822   7.1599   8.2822   7.1599   85.111   43.500   85.111   43.500 0.000000 0.000000 
1 1 1    2   32    1 o  697.175   15.571  373.828   16.617   0.0000   0.0000  373.828   16.617  ?   ?   697.175   15.571 0.000000 15.57141 
1 1 1    2   32    2 o  355.127   12.606   96.833   6.8522   89.984   9.6141  103.904   9.7687  341.212   18.477  367.327   17.375 -26.11539 25.36303 
1 1 1    2   32    3 o  569.385   15.868  249.407   13.829  249.407   13.829   0.0000   0.0000  569.385   15.868  ?   ?  0.000000 15.86811 
1 1 1    2   32    4 o  298.014   20.311   68.865   9.2098   68.865   9.2098   0.0000   0.0000  298.014   20.311  ?   ?  0.000000 20.31134 
1 1 1    2   32    5 o  943.436   12.197  683.328   17.614  704.081   24.910  662.576   24.910  956.236   17.019  927.445   17.547 28.79089 24.44473 
1 1 1    2   32    6 o  362.302   12.958  100.820   7.1856  102.116   10.264   99.575   10.063  363.483   18.510  358.946   18.377 4.537048 26.08342 
1 1 1    2   32    7 o  948.276   11.925  690.334   17.309  698.810   24.921  682.434   24.059  952.523   17.093  941.433   16.696 11.08972 23.89425 
1 1 1    2   32    8 o  432.686   11.967  143.737   7.9254  153.691   11.680  135.245   10.789  446.679   17.084  419.058   16.820 27.62134 23.97472 
1 1 1    2   32    9 o  346.490   13.142   92.241   6.9697   95.810   9.8918   88.723   9.8217  351.995   18.424  338.571   19.030 13.42398 26.48722 
1 1 1    2   32   10 o  630.664   11.078  305.264   10.693  305.312   15.322  305.218   14.931  629.763   15.895  629.759   15.490 0.4272461E-02 22.19430 
1 1 1    2   32   11 o  350.059   13.066   94.165   7.0011  101.739   10.118   87.208   9.6976  362.710   18.284  335.605   18.956 27.10492 26.33676 
1 1 1    2   32   12 o  354.446   13.401   96.573   7.2706  100.704   10.417   92.648   10.153  360.675   18.935  345.837   19.257 14.83749 27.00622 
1 1 1    2   32   13 o  267.024   15.815   55.104   6.4349   61.731   9.3923   49.241   8.8338  281.463   21.976  250.907   23.267 30.55544 32.00416 
1 1 1    2   32   14 o  368.829   13.303  104.594   7.5101  107.669   10.918  101.833   10.347  372.797   19.199  362.640   18.705 10.15662 26.80407 
1 1 1    2   32   15 o  360.595   13.597  100.014   7.5046  103.151   11.257   97.504   10.069  364.552   20.253  354.795   18.605 9.757477 27.50181 
1 1 1    2   32   16 o  606.939   11.723  283.020   10.891  291.477   15.661  275.101   15.154  614.732   16.644  597.232   16.578 17.49994 23.49176 
1 1 1    2   32   17 o  191.242   15.057   28.348   4.3719   33.469   6.2806   23.534   6.0895  206.961   20.079  172.407   23.703 34.55380 31.06428 
1 1 1    2   32   18 o  125.242   21.932   12.522   4.0511   18.378   5.8741   7.2113   5.5945  151.310   26.319   97.491   32.233 53.81873 41.61311 
1 1 1    2   32   19 o  530.680   8.5933  216.039   6.9801  206.891   9.6943  225.888   10.059  518.699   12.210  542.008   12.124 -23.30945 17.20738 
1 1 1    2   32   20 o  650.603   8.4407  324.720   8.4055  322.826   11.785  326.682   11.992  647.944   11.883  651.767   12.021 -3.822937 16.90275 
1 1 1    2   32   21 o  260.075   12.619   52.055   5.0234   49.132   6.9727   55.210   7.2435  251.264   18.255  266.516   17.860 -15.25211 25.53833 
1 1 1    2   32   22 o  1005.69   10.442  777.177   16.074  722.622   25.907  811.327   20.497  966.218   17.517  1026.38   13.047 -60.16577 21.84232 
1 1 1    2   32   23 o  350.457   11.862   94.512   6.3629   97.222   10.462   92.921   8.0156  353.320   19.420  346.910   15.096 6.410736 24.59744 
1 1 1    2   32   24 f  344.225   12.217   91.240   6.4371   96.150   8.1340   83.010   10.530  352.808   15.062  325.680   21.240 27.12814 26.03856 
1 1 1    2   32   25 o  300.640   13.286   69.704   6.1140   78.179   7.7238   55.481   10.006  317.876   15.875  264.596   25.001 53.27936 29.61541 
1 1 1    2   32   26 o  147.357   21.631   17.309   4.7337   10.648   6.5156   24.753   6.8888  114.067   34.432  175.278   26.505 -61.21108 43.45214 
1 1 1    2   32   27 o  277.566   13.225   59.455   5.6187   56.468   7.9838   62.386   7.9089  268.513   19.560  282.670   18.379 -14.15628 26.84023 
1 1 1    2   32   28 o  461.030   9.8930  163.457   6.9812  161.832   9.8693  165.084   9.8764  457.597   14.091  462.212   13.960 -4.615234 19.83514 
1 1 1    2   32   29 o  328.323   11.971   83.107   6.0158   83.692   8.4467   82.504   8.5700  327.875   16.888  325.409   17.268 2.466553 24.15359 
1 1 1    2   32   30 o  277.896   13.758   59.707   5.8522   60.684   8.1982   58.692   8.3566  278.147   19.377  273.263   20.121 4.884277 27.93424 
1 1 1    2   32   31 o  204.216   18.325   32.766   5.6671   40.221   8.0293   25.365   7.9998  224.589   23.716  175.176   30.968 49.41287 39.00620 
1 1 1    2   32   32 o  440.842   10.774  149.749   7.2698  150.758   10.266  148.735   10.296  440.838   15.215  437.811   15.364 3.026733 21.62264 
1 1 1    2   32   33 o  226.769   16.987   40.268   5.8532   45.963   8.2046   34.365   8.3528  240.363   22.565  205.732   27.192 34.63081 35.33502 
1 1 1    2   32   34 o  285.616   17.580   63.905   7.6482   58.768   8.8536   79.010   15.183  272.333   21.412  309.540   32.532 -37.20691 38.94635 
1 1 1    2   32   35 o  325.520   16.550   82.805   8.2191   75.312   15.938   85.520   9.5930  299.628   35.440  329.712   19.090 -30.08447 40.25429 
1 1 1    2   32   36 o  171.682   22.903   23.759   5.8683   29.420   8.1329   17.610   8.4758  188.670   29.098  141.941   38.180 46.72897 48.00415 
1 1 1    2   32   37 o  400.414   17.328  125.455   10.620  125.455   10.620   0.0000   0.0000  400.414   17.328  ?   ?  0.000000 17.32811 
1 1 1    2   32   38 o  258.749   16.819   52.587   6.6251   58.800   9.2130   45.934   9.5340  271.050   22.408  237.153   26.731 33.89729 34.88050 
1 1 1    2   32   39 o   79.605   32.199   2.9889   6.0819  -3.5387   8.2650   10.698   8.9820   73.334   33.407  114.219   40.725 -40.88493 52.67410 
1 1 1    2   32   40 o  108.237   35.054   9.9567   6.6304   12.706   9.4535   7.2948   9.3019  121.102   41.890  103.376   40.466 17.72617 58.24295 
1 1 1    2   32   41 o  209.990   28.015   36.804   8.7800   43.538   12.412   30.061   12.421  221.540   37.970  177.872   45.454 43.66812 59.22696 
1 1 1    2   32   42 o  108.516   37.142   10.125   7.4240   20.102   9.5379  -5.2103   11.825  146.740   40.923   84.141   38.923 62.59805 56.47767 
1 1 1    2   32   43 o  343.262   11.541   91.539   6.0635   99.395   7.2643   73.493   11.010  356.816   13.301  299.279   24.244 57.53754 27.65269 
1 1 1    2   32   44 o  121.704   19.773   12.131   3.5569   14.012   4.8784   9.9953   5.1972  128.389   25.721  106.706   30.368 21.68262 39.79662 
1 1 1    2   32   45 o  205.695   16.077   33.682   5.0216   40.221   5.7779   13.493   10.152  224.409   16.946  119.493   43.215 104.9165 46.41852 
1 1 1    2   32   46 o  171.405   27.469   25.413   6.9633   25.815   9.8859   25.017   9.8096  162.644   39.991  159.877   40.144 2.767044 56.66384 
1 1 1    2   32   47 o  234.824   14.274   43.750   5.1062   30.923   9.5095   48.946   6.0528  181.514   35.499  247.266   16.080 -65.75148 38.97153 
1 1 1    2   32   48 o  136.123   40.697   19.141   9.1343   19.141   9.1343   0.0000   0.0000  136.123   40.697  ?   ?  0.000000 40.69658 
1 1 1    2   33    0 o  828.765   16.220  527.896   20.558  527.896   20.558  527.896   20.558  828.765   16.220  828.765   16.220 0.000000 0.000000 
1 1 1    2   33    1 o  653.183   9.1032  327.162   9.1012  334.641   11.281  313.218   15.403  660.282   11.162  637.860   15.776 22.42169 19.32589 
1 1 1    2   33    2 o  302.421   14.187   70.330   6.5669   68.488   9.3273   72.140   9.2472  296.950   20.650  304.951   19.921 -8.001556 28.69218 
1 1 1    2   33    3 o  333.371   13.189   85.408   6.7299   82.568   9.6552   88.092   9.3854  326.430   19.412  337.450   18.239 -11.01971 26.63569 
1 1 1    2   33    4 o  574.459   11.410  253.350   10.032  262.489   14.554  245.078   13.848  583.778   16.288  564.140   16.037 19.63867 22.85800 
1 1 1    2   33    5 o  505.376   16.697  196.796   12.916  196.796   12.916   0.0000   0.0000  505.376   16.697  ?   ?  0.000000 16.69744 
1 1 1    2   33    6 o  514.686   16.717  204.137   13.170  204.137   13.170   0.0000   0.0000  514.686   16.717  ?   ?  0.000000 16.71739 
1 1 1    2   33    7 o  647.484   11.652  321.945   11.547  335.806   16.290  307.947   16.371  660.248   16.120  632.058   16.922 28.18939 23.37074 
1 1 1    2   33    8 o  508.622   11.574  198.666   9.0108  212.137   13.288  187.197   12.261  524.645   16.547  492.901   16.251 31.74402 23.19255 
1 1 1    2   33    9 o  843.051   11.670  545.880   15.059  562.907   22.016  530.908   20.644  854.456   16.834  830.023   16.249 24.43286 23.39689 
1 1 1    2   33   10 o  299.419   14.871   69.019   6.8153   73.307   10.118   65.458   9.2209  306.827   21.684  290.032   20.911 16.79465 30.12436 
1 1 1    2   33   11 o  528.214   11.679  214.333   9.4423  223.996   13.928  206.114   12.845  538.891   16.885  517.087   16.229 21.80414 23.42007 
1 1 1    2   33   12 o  195.939   20.182   30.024   5.9662   25.280   8.5804   34.465   8.3015  176.420   32.988  208.546   26.613 -32.12654 42.38514 
1 1 1    2   33   13 o  488.337   11.931  183.266   8.9181  199.149   13.138  169.691   12.145  508.004   16.896  468.923   16.921 39.08075 23.91220 
1 1 1    2   33   14 f  547.891   11.908  230.718   9.9865  242.725   14.557  220.043   13.726  560.739   16.960  533.941   16.795 26.79761 23.86882 
1 1 1    2   33   15 o  270.126   16.606   56.530   6.8328   55.124   9.7441   57.891   9.5840  264.901   24.303  271.806   23.261 -6.904999 33.64060 
1 1 1    2   33   16 o  324.939   12.140   81.191   6.0377   81.983   7.4134   79.631   10.405  326.136   14.851  319.527   21.399 6.608887 26.04729 
1 1 1    2   33   17 o  249.859   18.014   48.541   6.8431   53.364   9.8051   43.962   9.5550  260.241   24.920  235.377   27.011 24.86411 36.75035 
1 1 1    2   33   18 o   65.111   27.633   0.2842   4.7889  -0.3123   8.4931   0.5622   5.7986   83.819   36.205   72.119   30.496 11.70019 47.33722 
1 1 1    2   33   19 o  157.301   22.122   19.631   5.1791   11.012   8.7567   24.268   6.4229  119.357   40.341  174.518   24.737 -55.16060 47.32174 
1 1 1    2   33   20 o   89.973   29.654   6.1722   4.7364   20.244   7.9355  -1.6149   5.9031  156.416   34.107   66.432   29.396 89.98414 45.02680 
1 1 1    2   33   21 o   64.874   27.458   0.4021   4.7078  -2.9684   7.5937   2.5064   6.0000   72.913   32.730   79.383   32.026 -6.470436 45.79213 
1 1 1    2   33   22 o  461.739   10.651  163.946   7.5279  163.304   9.2907  165.173   12.845  460.251   13.188  461.367   18.189 -1.116272 22.46716 
1 1 1    2   33   23 o  551.432   17.490  235.854   14.763   0.0000   0.0000  235.854   14.763  ?   ?   551.432   17.490 0.000000 17.49048 
1 1 1    2   33   24 o  471.269   9.6404  170.701   6.9540  183.284   10.138  159.520   9.5563  487.305   13.592  454.577   13.734 32.72809 19.32318 
1 1 1    2   33   25 o  231.612   14.783   41.646   5.2135   42.531   7.3369   40.743   7.4097  232.469   20.841  227.272   21.558 5.196579 29.98485 
1 1 1    2   33   26 o  136.801   25.068   15.188   5.0556   11.020   7.3235   18.983   6.9877  116.232   36.757  151.412   31.189 -35.17970 48.20631 
1 1 1    2   33   27 o  332.305   11.950   85.129   6.0780   87.080   8.6718   83.245   8.5213  334.439   16.996  326.944   17.087 7.494781 24.10084 
1 1 1    2   33   28 o  321.607   12.604   79.832   6.2045   68.474   8.6802   91.697   8.8718  295.590   19.291  343.531   16.872 -47.94101 25.62865 
1 1 1    2   33   29 o  543.823   9.8784  227.564   8.2227  238.879   11.706  216.543   11.553  555.771   13.761  528.943   14.269 26.82758 19.82369 
1 1 1    2   33   30 o  334.804   12.337   86.544   6.3221   80.618   8.7997   92.867   9.0891  321.089   17.977  345.397   17.192 -24.30835 24.87463 
1 1 1    2   33   31 o  535.960   14.346  222.579   11.769  222.579   11.769   0.0000   0.0000  535.960   14.346  ?   ?  0.000000 14.34647 
1 1 1    2   33   32 o  118.769   34.340   11.912   6.5960   7.3470   7.6614   24.988   12.967  101.449   37.410  166.075   48.184 -64.62630 61.00197 
1 1 1    2   33   33 o  160.994   29.547   21.531   7.0127   35.877   14.822   17.394   7.9600  197.757   49.174  142.003   36.441 55.75372 61.20449 
1 1 1    2   33   34 o  333.194   13.362   86.014   6.8143   75.879   9.5487   96.533   9.7276  309.906   20.241  350.722   18.183 -40.81595 27.20906 
1 1 1    2   33   35 o  167.910   23.195   22.786   5.8022   25.076   7.9655   20.196   8.4688  172.839   31.260  152.415   36.733 20.42415 48.23380 
1 1 1    2   33   36 o  293.624   14.968   67.272   6.7046   61.252   9.2199   74.028   9.7671  277.111   21.916  305.260   21.032 -28.14868 30.37538 
1 1 1    2   33   37 f  312.028   14.628   75.805   6.9865   76.426   9.5504   75.090   10.247  310.315   20.218  306.592   21.982 3.723114 29.86550 
1 1 1    2   33   38 o  239.818   18.836   45.616   6.8584   58.577   9.4625   31.270   9.9547  269.628   23.153  189.795   35.574 79.83353 42.44482 
1 1 1    2   33   39 o  249.055   20.375   49.590   7.6991   47.096   11.550   51.584   10.328  234.848   33.046  249.826   27.463 -14.97844 42.96789 
1 1 1    2   33   40 o  226.493   24.929   42.108   8.4992   47.877   11.683   35.623   12.388  235.792   33.296  196.120   42.494 39.67232 53.98521 
1 1 1    2   33   41 o   69.291   30.777  -0.9948   6.5299  -2.5099   9.1954   0.5465   9.2745   78.330   35.510   84.815   37.214 -6.484894 51.43802 
1 1 1    2   33   42 o  224.666   20.848   40.849   7.0875   38.200   9.9744   43.550   10.073  209.792   32.081  225.903   29.863 -16.11066 43.82948 
1 1 1    2   33   43 o  193.117   24.726   31.080   7.1411   23.668   10.336   37.849   9.8776  156.349   42.206  208.004   32.054 -51.65576 52.99878 
1 1 1    2   33   44 o   93.014   24.019   7.4052   3.4434   11.166   4.8371   3.5412   4.9028  112.739   28.124   74.879   29.359 37.86002 40.65654 
1 1 1    2   33   45 o   73.529   25.451   4.3140   3.4899   2.4876   4.8691   6.2434   5.0044   70.210   28.657   86.527   30.447 -16.31618 41.81172 
1 1 1    2   33   46 o  113.540   34.176   12.167   6.4256   8.5363   9.1056   15.768   9.0688  100.541   39.823  124.634   41.031 -24.09278 57.17862 
1 1 1    2   34    0 o  325.479   19.716   82.389   9.7398   82.389   9.7398   82.389   9.7398  325.479   19.716  325.479   19.716 0.000000 0.000000 
1 1 1    2   34    1 o  501.777   9.5896  193.177   7.3651  201.609   9.1932  178.067   12.307  512.291   11.724  480.517   16.733 31.77374 20.43137 
1 1 1    2   34    2 o  315.445   14.109   76.571   6.8123   97.975   10.210   59.397   9.1459  355.580   18.826  275.951   21.832 79.62912 28.82780 
1 1 1    2   34    3 f  604.233   11.263  280.397   10.417  279.054   14.880  281.689   14.588  601.668   16.158  604.607   15.763 -2.939087 22.57320 
1 1 1    2   34    4 o  565.844   11.263  245.907   9.7552  241.690   13.926  249.972   13.670  559.902   16.249  569.558   15.680 -9.656067 22.58122 
1 1 1    2   34    5 o  238.713   16.697   44.163   6.0623   44.329   9.2012   44.037   8.0587  237.141   25.764  237.175   22.466 -0.3482056E-01 34.18371 
1 1 1    2   34    6 o  454.023   11.998  158.409   8.3378  167.056   12.342  151.150   11.309  465.212   17.333  442.649   16.691 22.56339 24.06257 
1 1 1    2   34    7 o  126.662   38.363   12.950   8.0783   12.950   8.0783   0.0000   0.0000  126.662   38.363  ?   ?  0.000000 38.36327 
1 1 1    2   34    8 o  539.911   16.712  224.937   13.811  224.937   13.811   0.0000   0.0000  539.911   16.712  ?   ?  0.000000 16.71234 
1 1 1    2   34    9 o  613.792   16.601  290.724   15.596  290.724   15.596   0.0000   0.0000  613.792   16.601  ?   ?  0.000000 16.60074 
1 1 1    2   34   10 o  615.773   11.520  291.377   10.858  298.630   15.863  284.983   14.894  622.006   16.662  607.826   16.009 14.18018 23.10632 
1 1 1    2   34   11 o  163.429   23.701   21.211   5.7557   21.797   8.3796   20.687   7.9196  162.837   34.682  158.810   33.628 4.027359 48.30819 
1 1 1    2   34   12 o  533.990   11.747  219.205   9.6011  238.772   14.267  203.008   12.980  556.029   16.763  512.761   16.538 43.26837 23.54852 
1 1 1    2   34   13 o  238.116   17.912   44.098   6.4807   60.084   9.5956   30.691   8.7877  276.891   22.845  195.162   30.408 81.72932 38.03362 
1 1 1    2   34   14 o  586.917   11.927  264.927   10.715  254.301   15.113  275.665   15.193  573.507   17.217  597.319   16.618 -23.81219 23.92837 
1 1 1    2   34   15 o  177.744   24.215   25.108   6.4165   18.418   9.1520   31.576   8.9985  148.390   39.569  197.714   30.733 -49.32332 50.10206 
1 1 1    2   34   16 o  450.245   18.353  157.079   12.648   0.0000   0.0000  157.079   12.648  ?   ?   450.245   18.353 0.000000 18.35268 
1 1 1    2   34   17 o  319.309   15.627   78.761   7.6375   74.822   10.520   83.151   11.106  308.953   22.398  325.771   22.409 -16.81812 31.68326 
1 1 1    2   34   18 o  451.401   11.175  156.721   7.7210  162.750   9.6931  146.256   12.771  459.406   13.785  433.962   19.226 25.44467 23.65722 
1 1 1    2   34   19 o  281.465   17.211   61.599   7.3791   56.253   10.586   66.653   10.292  266.107   26.336  290.966   23.304 -24.85977 35.16594 
1 1 1    2   34   20 o  218.659   21.619   37.672   7.1408   27.999   10.112   47.293   10.085  182.925   37.379  243.207   27.579 -60.28195 46.45206 
1 1 1    2   34   21 o  297.156   12.130   68.027   5.5171   66.387   7.9005   69.588   7.7077  291.936   17.765  299.161   16.902 -7.224243 24.52076 
1 1 1    2   34   22 o  111.328   26.956   10.181   4.5444   10.948   6.4474   9.4246   6.4063  115.341   34.125  108.339   34.391 7.001564 48.44800 
1 1 1    2   34   23 o  265.181   13.397   54.415   5.4203   54.475   7.8118   54.359   7.5269  263.725   19.490  263.661   18.774 0.6423950E-01 27.06143 
1 1 1    2   34   24 o  362.868   11.255  101.402   6.2513  114.225   9.0588   89.745   8.6376  384.084   15.409  340.135   16.591 43.94971 22.64277 
1 1 1    2   34   25 o  548.164   9.6124  231.057   8.0651  235.009   11.425  227.132   11.386  551.553   13.533  542.159   13.721 9.393250 19.27243 
1 1 1    2   34   26 o   96.370   30.404   7.4302   5.0131   2.5299   7.0058   12.572   7.1764   83.574   34.273  122.527   35.932 -38.95378 49.65603 
1 1 1    2   34   27 o  116.864   28.462   11.331   5.0438   12.382   7.0802   10.248   7.1869  121.529   35.705  112.393   36.503 9.136185 51.06210 
1 1 1    2   34   28 o   88.254   30.784   5.7679   5.1103   3.9241   7.1676   7.6742   7.2880   88.442   35.237  102.099   36.654 -13.65691 50.84442 
1 1 1    2   34   29 o  353.234   12.347   96.363   6.6759   99.402   9.2577   93.070   9.6359  357.343   16.926  344.822   18.323 12.52118 24.94400 
1 1 1    2   34   30 o  414.355   13.400  132.871   8.4986  135.119   10.007  127.056   16.097  416.992   15.679  397.995   26.576 18.99722 30.85620 
1 1 1    2   34   31 o   81.266   33.271   2.5674   6.5888   19.237   12.707  -3.5629   7.7057  147.331   48.572   71.257   32.382 76.07449 58.37626 
1 1 1    2   34   32 o  130.336   29.021   14.223   5.6409   18.307   8.2341   10.612   7.7434  145.383   36.931  113.633   37.938 31.75011 52.94476 
1 1 1    2   34   33 o  197.623   19.670   30.986   5.8710   27.664   8.1752   34.523   8.4366  182.275   30.371  205.417   27.525 -23.14243 40.98796 
1 1 1    2   34   34 o   70.898   32.129  -3.0933   7.5192  -3.0933   7.5192   0.0000   0.0000   70.898   32.129  ?   ?  0.000000 32.12859 
1 1 1    2   34   35 o  142.947   27.894   17.073   5.8841   15.656   8.0468   18.701   8.6262  133.496   37.715  145.481   38.237 -11.98438 53.70745 
1 1 1    2   34   36 o  173.847   24.266   24.655   6.2811   14.869   8.5173   36.323   9.2999  129.616   39.422  208.528   30.001 -78.91248 49.53909 
1 1 1    2   34   37 o  227.995   20.961   41.651   7.2329   51.067   11.085   34.671   9.5446  247.247   29.899  202.023   31.927 45.22368 43.74157 
1 1 1    2   34   38 o  143.204   36.383   18.307   7.9908   10.306   10.224   30.870   12.811  113.650   42.948  179.925   46.259 -66.27427 63.12275 
1 1 1    2   34   39 o   72.237   31.668  -0.2249   6.7034   5.3309   8.4076  -9.9198   11.106   94.201   37.943   75.028   35.643 19.17382 52.05860 
1 1 1    2   34   40 o   66.796   30.181  -2.1358   6.5790   1.4176   9.2945  -5.7041   9.3138   86.671   37.655   73.199   34.094 13.47186 50.79704 
1 1 1    2   34   41 f   54.548   26.169  -7.6992   6.3052  -2.6289   8.8391 -12.9520   8.9967   76.147   34.634   61.606   29.964 14.54105 45.79698 
1 1 1    2   34   42 o   83.078   33.089   4.2998   6.3185   2.3694   9.0062   6.1709   8.8668   86.685   37.363   96.077   38.872 -9.392174 53.91713 
1 1 1    2   34   43 o   58.506   27.494  -4.9680   6.2833  -3.7917   8.8342  -6.1723   8.9386   72.883   33.690   69.457   32.688 3.425735 46.94136 
1 1 1    2   34   44 o  204.486   15.393   33.346   4.7826   39.280   5.7052   19.316   8.7717  221.077   16.990  140.010   39.315 81.06752 42.82921 
1 1 1    2   34   45 o   91.622   24.310   7.3110   3.4655   8.0056   4.7539   6.5233   5.0625   94.555   29.574   87.314   30.629 7.240929 42.57642 
1 1 1    2   34   46 o   67.126   25.867   3.0424   3.7552   11.237   5.4712  -4.2567   5.1635  109.978   31.109   52.600   24.782 57.37802 39.77303 
1 1 1    2   35    0 o  405.243   17.970  127.056   11.097  127.056   11.097  127.056   11.097  405.243   17.970  405.243   17.970 0.000000 0.000000 
1 1 1    2   35    1 o  185.980   16.847   26.921   4.7437   31.818   5.8557   17.571   8.0911  201.851   19.184  145.732   36.385 56.11807 41.13223 
1 1 1    2   35    2 o  714.964   11.654  392.894   12.754  391.334   18.370  394.346   17.721  711.877   16.859  714.857   16.195 -2.980774 23.37799 
1 1 1    2   35    3 o  162.082   23.814   20.879   5.7318   17.233   8.4471   23.990   7.8031  144.178   37.810  172.097   30.751 -27.91945 48.73658 
1 1 1    2   35    4 o  133.510   28.384   14.497   5.6217   17.675   7.9526   11.322   7.9481  146.185   35.822  119.624   38.342 26.56076 52.47165 
1 1 1    2   35    5 o  233.617   17.885   42.442   6.3467   37.656   9.1808   46.823   8.7837  217.335   28.267  244.010   23.822 -26.67467 36.96638 
1 1 1    2   35    6 o  491.757   11.967  185.946   9.0079  184.467   13.053  187.291   12.447  488.504   17.457  492.487   16.512 -3.982635 24.02883 
1 1 1    2   35    7 o  179.602   21.519   25.409   5.7978   18.051   8.2165   32.705   8.1824  147.505   36.573  202.600   27.062 -55.09421 45.49691 
1 1 1    2   35    8 o  108.457   32.008   9.4879   5.6785   10.146   8.0650   8.8412   7.9967  115.026   38.716  109.917   38.499 5.108650 54.59911 
1 1 1    2   35    9 f  387.118   19.048  116.139   11.287  116.139   11.287   0.0000   0.0000  387.118   19.048  ?   ?  0.000000 19.04817 
1 1 1    2   35   10 o  363.302   20.179  102.774   11.177  102.774   11.177   0.0000   0.0000  363.302   20.179  ?   ?  0.000000 20.17888 
1 1 1    2   35   12 o  254.861   23.964   51.190   9.2384   0.0000   0.0000   51.190   9.2384  ?   ?   254.861   23.964 0.000000 23.96354 
1 1 1    2   35   13 o  214.118   29.545   36.865   9.4250   0.0000   0.0000   36.865   9.4250  ?   ?   214.118   29.545 0.000000 29.54508 
1 1 1    2   35   14 o  157.331   36.043   20.640   8.4934   0.0000   0.0000   20.640   8.4934  ?   ?   157.331   36.043 0.000000 36.04315 
1 1 1    2   35   15 f  219.261   20.172   37.704   6.6940   53.693   9.9591   24.527   9.0409  260.354   25.311  171.816   35.550 88.53792 43.64007 
1 1 1    2   35   16 o  257.057   26.674   52.592   10.342   52.592   10.342   0.0000   0.0000  257.057   26.674  ?   ?  0.000000 26.67366 
1 1 1    2   35   17 o  276.106   16.618   59.251   6.9903   59.251   6.9903   0.0000   0.0000  276.106   16.618  ?   ?  0.000000 16.61794 
1 1 1    2   35   18 o  372.349   12.238  106.819   6.9747  108.762   8.6267  103.151   11.852  375.085   15.026  362.811   21.438 12.27432 26.17926 
1 1 1    2   35   19 o  358.742   12.362   99.186   6.7881   99.034   8.3547   99.480   11.644  357.815   15.255  356.176   21.458 1.638916 26.32783 
1 1 1    2   35   20 o  358.115   10.736   98.683   5.8850  101.876   8.4501   95.676   8.2008  362.874   15.214  351.653   15.236 11.22073 21.53119 
1 1 1    2   35   21 o  154.292   24.217   19.146   5.5308   14.343   9.9737   21.278   6.6464  131.837   43.011  161.683   27.862 -29.84663 51.24710 
1 1 1    2   35   22 o  218.311   18.518   37.354   6.1294   22.183   10.354   45.539   7.6052  160.417   41.760  240.472   20.869 -80.05510 46.68465 
1 1 1    2   35   23 o  315.696   14.032   77.055   6.7806   59.368   11.670   86.070   8.3312  271.547   28.502  333.051   16.343 -61.50415 32.85544 
1 1 1    2   35   24 o  665.861   9.1438  340.837   9.3193  339.650   13.145  342.036   13.214  663.216   12.949  665.531   12.972 -2.314819 18.32878 
1 1 1    2   35   25 o  236.936   15.540   43.718   5.6044   45.188   7.7157   42.076   8.1542  239.125   21.304  229.892   23.504 9.233002 31.72185 
1 1 1    2   35   26 o  284.980   13.496   62.806   5.8870   71.315   8.2235   53.861   8.4313  301.996   17.870  261.107   21.281 40.88852 27.78909 
1 1 1    2   35   27 o   89.077   32.912   5.3842   5.9353   8.5072   6.9728  -2.8301   11.309  104.546   35.987   89.380   40.044 15.16575 53.83895 
1 1 1    2   35   28 o  199.518   22.229   31.748   6.6729   34.846   7.9286   24.225   12.356  207.882   25.449  164.223   46.854 43.65904 53.31937 
1 1 1    2   35   29 o  314.261   15.918   77.008   7.6317   84.930   14.704   74.087   8.9284  322.635   30.125  306.985   19.096 15.64957 35.66719 
1 1 1    2   35   30 o  330.689   15.446   85.033   7.8183   86.220   14.942   84.585   9.1745  324.542   30.435  328.288   18.331 -3.745728 35.52897 
1 1 1    2   35   31 o  174.663   22.580   24.532   5.8953   25.293   8.2943   23.755   8.3807  173.236   32.474  167.101   33.925 6.135498 46.96222 
1 1 1    2   35   32 o  319.700   13.526   79.266   6.6186   75.631   9.2212   83.130   9.5056  309.500   19.566  324.708   19.211 -15.20831 27.42055 
1 1 1    2   35   33 o   94.758   33.170   6.9368   5.9357   6.4363   8.0285   7.5403   8.8154   98.353   37.844  104.009   39.742 -5.656754 54.87864 
1 1 1    2   35   34 o  151.033   27.215   18.975   6.0599   21.498   8.3078   16.105   8.8587  157.160   35.388  134.570   40.043 22.59015 53.43927 
1 1 1    2   35   35 o   71.641   30.642   0.6830   5.9712   0.4706   8.2902   0.9121   8.6080   81.910   35.575   84.281   36.427 -2.370293 50.91653 
1 1 1    2   35   36 o  171.904   27.446   24.663   6.9788   34.861   10.547   16.720   9.3081  199.777   35.805  135.491   41.212 64.28629 54.59344 
1 1 1    2   35   37 o  198.089   24.829   32.282   7.3626   30.760   9.3564   34.757   11.932  188.029   33.750  194.574   41.338 -6.545471 53.36595 
1 1 1    2   35   38 o   94.431   33.998   7.0415   6.2744  -0.0396   8.6473   14.915   9.1181   81.191   35.770  127.368   41.092 -46.17737 54.48014 
1 1 1    2   35   39 o  205.514   21.507   34.313   6.6651   38.363   9.3378   30.106   9.5163  212.281   29.539  183.977   35.074 28.30453 45.85579 
1 1 1    2   35   40 o   76.642   32.168   2.1579   6.3750   5.7882   8.9100  -1.6497   9.1249   95.604   38.864   78.963   35.623 16.64106 52.72056 
1 1 1    2   35   41 o  164.392   26.973   23.116   6.5515   21.455   9.3208   24.739   9.2107  149.242   39.993  162.415   37.765 -13.17337 55.00594 
1 1 1    2   35   42 o   94.419   33.556   7.6222   6.0935   11.938   8.6793   3.4268   8.5571  112.685   40.048   86.686   36.868 25.99904 54.43478 
1 1 1    2   35   43 o  113.086   33.542   11.926   6.2233   15.011   8.8941   8.9667   8.7109  122.638   40.646  101.812   39.351 20.82604 56.57415 
1 1 1    2   35   44 o   96.918   35.718   8.3225   6.9826   13.838   8.5496  -2.7265   12.101  117.613   39.861   84.261   39.118 33.35131 55.84890 
1 1 1    2   36    0 o  101.540   46.046   11.802   7.7254   11.802   7.7254   11.802   7.7254  101.540   46.046  101.540   46.046 0.000000 0.000000 
1 1 1    2   36    1 f  379.457   10.817  110.665   6.2827  111.803   7.7129  108.422   10.831  381.003   13.226  373.476   19.010 7.526398 23.15797 
1 1 1    2   36    2 o  432.796   12.696  144.196   8.4104  140.233   12.138  147.856   11.664  425.369   18.643  437.123   17.433 -11.75333 25.52427 
1 1 1    2   36    3 o  278.051   16.008   59.917   6.7843   55.472   9.9284   63.811   9.2921  265.188   24.746  285.597   21.412 -20.40976 32.72375 
1 1 1    2   36    4 o  640.332   16.561  316.982   16.232   0.0000   0.0000  316.982   16.232  ?   ?   640.332   16.561 0.000000 16.56121 
1 1 1    2   36    5 o  199.410   27.930   31.868   8.2910   0.0000   0.0000   31.868   8.2910  ?   ?   199.410   27.930 0.000000 27.93021 
1 1 1    2   36    6 o  117.442   38.375   10.899   7.9381   0.0000   0.0000   10.899   7.9381  ?   ?   117.442   38.375 0.000000 38.37454 
1 1 1    2   36    7 o   98.631   37.304   6.0178   7.7171   0.0000   0.0000   6.0178   7.7171  ?   ?    98.631   37.304 0.000000 37.30404 
1 1 1    2   36    8 o  401.247   18.645  124.892   11.451   0.0000   0.0000  124.892   11.451  ?   ?   401.247   18.645 0.000000 18.64500 
1 1 1    2   36    9 o  168.044   33.938   23.322   8.4287   0.0000   0.0000   23.322   8.4287  ?   ?   168.044   33.938 0.000000 33.93804 
1 1 1    2   36   10 o  187.145   22.791   27.746   6.3936   20.847   9.3038   33.919   8.8010  157.316   38.865  205.297   28.800 -47.98123 48.37285 
1 1 1    2   36   11 o  391.659   19.459  119.245   11.665  119.245   11.665   0.0000   0.0000  391.659   19.459  ?   ?  0.000000 19.45875 
1 1 1    2   36   12 o  244.098   26.260   47.425   9.6568   47.425   9.6568   0.0000   0.0000  244.098   26.260  ?   ?  0.000000 26.25955 
1 1 1    2   36   13 o  222.591   28.805   39.858   9.5838   39.858   9.5838   0.0000   0.0000  222.591   28.805  ?   ?  0.000000 28.80516 
1 1 1    2   36   14 o  216.669   30.236   38.004   9.7541   38.004   9.7541   0.0000   0.0000  216.669   30.236  ?   ?  0.000000 30.23568 
1 1 1    2   36   15 o  169.467   26.953   23.201   6.7573   26.757   9.7955   19.971   9.3338  178.656   37.037  153.373   39.515 25.28229 54.15871 
1 1 1    2   36   16 o  444.584   13.524  152.544   9.2030  171.103   13.852  137.880   12.313  468.823   19.304  420.923   19.112 47.89932 27.16410 
1 1 1    2   36   17 o  521.214   13.265  209.632   10.582  218.913   15.174  200.843   14.765  530.483   18.688  507.983   18.990 22.49994 26.64311 
1 1 1    2   36   18 o   89.400   31.246   5.8351   5.2663   6.8256   6.3306   3.6093   9.4896   96.783   34.224   97.051   39.854 -0.2679825 52.53204 
1 1 1    2   36   19 o  512.236   10.914  202.002   8.5569  198.038   10.471  209.973   14.848  506.390   13.509  519.292   18.680 -12.90164 23.05305 
1 1 1    2   36   20 o  367.389   12.740  104.158   7.1639  118.749   8.8852   77.053   12.110  391.707   14.820  311.141   25.658 80.56564 29.63038 
1 1 1    2   36   21 o  518.847   9.5424  207.012   7.5782  209.187   10.767  204.876   10.668  520.318   13.519  514.922   13.536 5.395813 19.13067 
1 1 1    2   36   22 o  200.495   17.007   31.460   5.1700   25.561   7.2287   37.638   7.3971  177.317   27.527  217.719   22.523 -40.40211 35.56671 
1 1 1    2   36   23 o  306.616   14.410   72.789   6.7626   77.279   11.888   70.640   8.2227  311.375   25.158  300.597   17.954 10.77829 30.90702 
1 1 1    2   36   24 o  138.347   29.087   15.877   5.9639   17.675   10.748   15.077   7.1687  142.863   44.434  133.316   34.769 9.547119 56.42031 
1 1 1    2   36   25 o  104.625   37.627   8.1399   7.6833   12.555   10.271   2.5289   11.578  124.717   43.633  100.910   42.901 23.80627 61.19107 
1 1 1    2   36   26 o  344.258   14.794   91.937   7.7953   97.737   9.4849   79.867   13.684  353.999   17.505  313.921   28.799 40.07779 33.70175 
1 1 1    2   36   27 o  357.220   14.148   98.920   7.7355  113.033   14.401   93.196   9.1709  375.966   25.170  345.189   17.414 30.77628 30.60675 
1 1 1    2   36   28 o   85.799   31.698   5.0221   5.5054   4.0971   8.2620   5.7609   7.3835   92.569   37.498   94.831   36.339 -2.262032 52.21740 
1 1 1    2   36   29 o  189.976   20.640   28.739   5.9051   21.100   8.5152   35.816   8.1960  156.312   36.288  210.068   26.049 -53.75616 44.66977 
1 1 1    2   36   30 o  211.652   18.800   35.416   6.0271   40.859   8.8252   30.657   8.2511  224.254   26.205  192.676   28.866 31.57724 38.98684 
1 1 1    2   36   31 o  186.247   21.901   27.851   6.1242   31.700   8.6963   24.064   8.6262  195.086   30.091  167.226   34.832 27.85979 46.02962 
1 1 1    2   36   32 o  217.692   19.167   37.601   6.3214   46.388   8.9630   28.904   8.9169  239.233   24.839  184.416   32.791 54.81729 41.13717 
1 1 1    2   36   33 o  183.198   22.594   27.153   6.2013   25.683   8.6740   28.691   8.8693  172.497   34.061  183.257   32.825 -10.75980 47.30387 
1 1 1    2   36   34 o   54.175   26.070  -8.5278   6.3677 -15.2750   9.6244  -3.2747   8.4921   62.789   30.639   74.608   33.939 -11.81986 45.72360 
1 1 1    2   36   35 o  119.296   35.255   12.558   6.8851   20.447   8.6434  -1.1379   11.389  150.643   37.603   89.816   40.217 60.82766 55.05816 
1 1 1    2   36   36 o   62.284   28.435  -2.8760   6.0289   4.0319   8.2313 -10.8703   8.8550   89.940   37.048   63.904   30.750 26.03617 48.14631 
1 1 1    2   36   37 o  194.291   31.389   32.532   9.0164   32.532   9.0164   0.0000   0.0000  194.291   31.389  ?   ?  0.000000 31.38893 
1 1 1    2   36   38 o   62.135   28.345  -2.6467   5.9766  -0.6805   8.2373  -4.8324   8.6848   77.536   34.497   71.526   33.183 6.010094 47.86561 
1 1 1    2   36   39 o  156.609   27.269   20.992   6.2991   35.204   9.3538   9.1980   8.5208  200.493   31.521  104.687   39.284 95.80579 50.36625 
1 1 1    2   36   40 o   92.323   33.199   7.0878   5.9811  -5.4953   8.5713   19.030   8.3500   68.974   32.316  141.339   37.844 -72.36470 49.76414 
1 1 1    2   36   41 o  184.577   21.954   28.283   6.0806   36.927   8.9615   20.908   8.2777  205.353   29.346  148.284   36.675 57.06903 46.97025 
1 1 1    2   36   42 o   64.340   29.572  -2.7328   6.6702   2.1471   8.3478 -11.3504   11.093   82.018   35.660   70.429   34.021 11.58941 49.28547 
1 1 1    2   37    0 o  264.287   17.173   54.452   6.8796   54.452   6.8796   54.452   6.8796  264.287   17.173  264.287   17.173 0.000000 0.000000 
1 1 1    2   37    1 o  405.261   10.934  126.319   6.7825  128.207   8.4166  122.821   11.455  407.752   13.486  397.680   18.818 10.07236 23.15138 
1 1 1    2   37    2 o  173.884   19.162   23.765   5.0153   25.836   6.1836   19.783   8.5738  180.423   22.908  153.575   36.928 26.84737 43.45595 
1 1 1    2   37    3 o  262.130   16.984   53.438   6.7777   52.903   9.8012   53.928   9.3827  258.401   25.097  261.388   23.710 -2.987274 34.52567 
1 1 1    2   37    4 o  132.683   29.926   14.499   5.9329   20.781   8.6938   9.0229   8.1166  157.437   36.747  110.223   38.776 47.21378 53.42179 
1 1 1    2   37    5 o  124.391   30.599   12.781   5.7859   12.009   8.3687   13.487   8.0081  122.016   39.368  127.645   38.092 -5.628830 54.78021 
1 1 1    2   37    6 o  255.061   25.446   51.632   9.8017   51.632   9.8017   0.0000   0.0000  255.061   25.446  ?   ?  0.000000 25.44632 
1 1 1    2   37    7 o  265.229   25.036   55.745   10.043   55.745   10.043   0.0000   0.0000  265.229   25.036  ?   ?  0.000000 25.03573 
1 1 1    2   37    8 o  350.297   21.237   96.092   11.333   96.092   11.333   0.0000   0.0000  350.297   21.237  ?   ?  0.000000 21.23679 
1 1 1    2   37    9 o  356.689   20.918   99.575   11.370   99.575   11.370   0.0000   0.0000  356.689   20.918  ?   ?  0.000000 20.91783 
1 1 1    2   37   10 o  516.041   13.351  205.430   10.546  238.584   15.625  177.691   14.292  554.143   18.421  477.777   19.543 76.36551 26.85664 
1 1 1    2   37   11 o  498.340   12.719  191.457   9.7014  196.326   14.040  187.008   13.421  502.700   18.246  490.777   17.866 11.92303 25.53670 
1 1 1    2   37   12 o  312.594   16.210   75.884   7.7295   72.450   10.687   79.650   11.193  303.117   23.210  317.917   23.162 -14.80023 32.78974 
1 1 1    2   37   13 o   97.854   39.057   4.7453   8.8207   4.7453   8.8207   0.0000   0.0000   97.854   39.057  ?   ?  0.000000 39.05689 
1 1 1    2   37   14 f  477.932   19.109  177.879   13.979  177.879   13.979   0.0000   0.0000  477.932   19.109  ?   ?  0.000000 19.10925 
1 1 1    2   37   15 o  258.382   27.536   53.524   10.722   53.524   10.722   0.0000   0.0000  258.382   27.536  ?   ?  0.000000 27.53564 
1 1 1    2   37   16 o  222.816   22.456   39.319   7.5542   34.606   10.940   43.613   10.444  203.438   36.472  231.820   30.147 -28.38211 47.31869 
1 1 1    2   37   17 o  163.932   29.095   22.013   7.0331   30.117   10.279   14.880   9.6441  189.217   36.816  133.197   42.187 56.01968 55.99242 
1 1 1    2   37   18 o  221.978   21.987   39.015   7.3723   40.065   10.578   38.023   10.281  220.926   32.229  215.132   32.212 5.794144 45.56667 
1 1 1    2   37   19 o  283.790   14.701   62.517   6.3641   69.453   7.9289   49.957   10.670  298.321   17.440  248.663   28.551 49.65817 33.45651 
1 1 1    2   37   20 o  215.888   18.386   36.586   6.0177   37.900   7.4299   34.079   10.260  218.413   22.549  202.212   34.380 16.20084 41.11484 
1 1 1    2   37   21 o   71.992   28.526   2.4759   4.6739   11.646   7.0511  -4.7111   6.2422  118.147   35.854   60.878   28.203 57.26971 45.61752 
1 1 1    2   37   22 o  198.733   20.646   31.291   6.1886   32.343   7.4062   28.856   11.266  200.682   24.628  182.150   41.353 18.53275 48.13082 
1 1 1    2   37   23 o  442.087   12.229  150.936   8.2752  155.552   10.075  141.362   14.508  447.900   14.696  422.768   22.501 25.13208 26.87462 
1 1 1    2   37   24 o  190.432   22.005   28.938   6.2959   32.517   11.663   27.466   7.4791  193.448   40.681  183.414   27.488 10.03415 49.09670 
1 1 1    2   37   25 o  178.208   24.837   25.696   6.5906   16.621   12.377   29.288   7.7863  139.153   47.943  189.288   27.693 -50.13541 55.36618 
1 1 1    2   37   26 o  215.008   20.512   36.677   6.6685   53.279   12.901   30.624   7.7898  252.341   34.290  193.778   26.997 58.56369 43.64246 
1 1 1    2   37   27 f  200.824   22.572   32.309   6.8182   36.188   12.703   30.740   8.0809  202.383   42.367  193.513   28.104 8.869843 50.84073 
1 1 1    2   37   28 o   89.744   31.857   5.9995   5.4903   16.810   8.3051  -2.3922   7.3172  138.645   38.004   71.397   32.084 67.24808 49.73582 
1 1 1    2   37   29 o   91.174   32.137   6.3057   5.5780   9.6675   8.0341   3.1771   7.7505  109.764   38.581   87.399   35.969 22.36570 52.74668 
1 1 1    2   37   30 o   81.297   31.638   3.8969   5.6608   6.8762   8.1097   1.0658   7.9053   99.817   38.124   82.083   35.186 17.73393 51.87946 
1 1 1    2   37   31 f  127.347   34.080   14.116   6.7739   11.388   11.095   15.737   8.5529  119.376   44.821  132.907   39.298 -13.53157 59.60944 
1 1 1    2   37   32 o  229.945   20.847   42.356   7.2575   45.430   11.503   40.323   9.3543  230.498   33.591  220.230   28.413 10.26833 43.99618 
1 1 1    2   37   33 o  236.109   21.545   44.896   7.7004   42.334   9.4019   50.117   13.421  225.583   27.819  237.931   38.141 -12.34782 47.20800 
1 1 1    2   37   34 o  127.519   33.183   14.328   6.5390   21.659   9.3062   7.1799   9.1900  153.735   39.375  101.834   40.111 51.90126 56.20742 
1 1 1    2   37   35 o  181.845   23.190   27.110   6.3076   29.234   8.6467   24.695   9.2215  183.857   31.881  165.190   37.348 18.66692 49.10478 
1 1 1    2   37   36 o   53.856   25.722  -6.8313   5.9442 -10.8418   8.1075  -2.1697   8.7409   59.942   28.986   76.752   34.724 -16.81017 45.23206 
1 1 1    2   37   37 o  140.863   29.943   17.369   6.2571   14.449   8.9854   20.119   8.7183  123.806   40.846  146.439   38.417 -22.63250 56.07355 
1 1 1    2   37   38 o  125.612   31.218   14.147   5.9760   17.229   8.6719   11.360   8.2467  133.763   39.577  111.413   39.092 22.34959 55.62785 
1 1 1    2   37   39 o   59.453   27.429  -3.1105   5.8145  -1.8003   8.1586  -4.4629   8.2889   73.544   33.382   69.211   32.212 4.332756 46.38974 
1 1 1    2   37   40 o   74.029   30.781   2.5598   5.7572  -7.1664   8.3521   11.365   7.9469   64.845   30.835  109.717   38.382 -44.87236 49.23370 
1 1 1    2   37   41 o  133.677   33.832   16.818   6.9285   13.147   8.4351   24.432   12.148  115.470   39.591  148.274   47.388 -32.80393 61.74943 
1 1 1    2   38    0 o  494.425   18.715  189.361   14.117  189.361   14.117  189.361   14.117  494.425   18.715  494.425   18.715 0.000000 0.000000 
1 1 1    2   38    1 o  461.152   18.476  165.268   13.041  165.268   13.041   0.0000   0.0000  461.152   18.476  ?   ?  0.000000 18.47564 
1 1 1    2   38    2 o  292.009   22.965   67.199   10.182   67.199   10.182   0.0000   0.0000  292.009   22.965  ?   ?  0.000000 22.96517 
1 1 1    2   38    3 o   95.492   38.090   4.4507   8.3843   4.4507   8.3843   0.0000   0.0000   95.492   38.090  ?   ?  0.000000 38.08971 
1 1 1    2   38    4 o  153.337   27.494   19.122   6.2159   13.364   8.6822   25.176   8.9031  127.327   39.990  173.985   34.649 -46.65816 52.91302 
1 1 1    2   38    5 o  111.816   33.351   10.235   6.1398   14.541   8.7256   6.0121   8.6409  131.937   39.851  101.138   39.164 30.79913 55.87389 
1 1 1    2   38    6 o  523.272   12.862  211.167   10.302  217.219   14.722  205.361   14.421  528.700   18.193  514.007   18.329 14.69305 25.82513 
1 1 1    2   38    7 o  334.766   15.115   86.689   7.7449   88.337   11.267   85.213   10.664  335.243   22.080  329.556   21.254 5.687775 30.64768 
1 1 1    2   38    8 o  183.662   24.210   26.950   6.6399   23.294   9.3544   30.663   9.4266  165.987   37.681  192.876   33.124 -26.88872 50.16994 
1 1 1    2   38    9 f  192.222   23.724   29.445   6.8319   19.426   9.5121   40.122   9.8189  150.787   40.399  222.628   29.544 -71.84169 50.04930 
1 1 1    2   38   10 o  259.699   18.752   52.761   7.4038   61.740   10.692   44.489   10.262  278.645   25.346  234.688   29.200 43.95639 38.66601 
1 1 1    2   38   11 o  446.096   13.965  153.771   9.5351  159.997   13.606  147.762   13.367  452.928   19.626  435.079   20.072 17.84946 28.07216 
1 1 1    2   38   12 o  458.447   13.893  162.409   9.7487  155.856   13.656  169.220   13.922  446.821   19.967  465.783   19.527 -18.96259 27.92809 
1 1 1    2   38   13 o  329.504   16.675   84.481   8.3827   82.389   12.061   86.436   11.659  322.284   24.635  330.808   23.173 -8.523621 33.82140 
1 1 1    2   38   14 o  155.228   29.322   19.821   6.7115   21.637   9.7321   18.174   9.2678  158.677   40.063  145.598   40.244 13.07947 56.78591 
1 1 1    2   38   15 o  316.242   25.393   79.622   12.188   79.622   12.188   0.0000   0.0000  316.242   25.393  ?   ?  0.000000 25.39297 
1 1 1    2   38   16 o  366.664   22.087  105.975   12.338  105.975   12.338   0.0000   0.0000  366.664   22.087  ?   ?  0.000000 22.08671 
1 1 1    2   38   17 o  149.380   43.104   19.397   10.402   19.397   10.402   0.0000   0.0000  149.380   43.104  ?   ?  0.000000 43.10408 
1 1 1    2   38   18 o  100.755   35.774   7.5503   6.9238   11.379   9.8377   3.7929   9.7463  120.481   42.657   97.766   40.297 22.71507 58.68069 
1 1 1    2   38   19 o  349.694   16.023   94.999   8.5762   92.770   12.137   97.222   12.120  342.019   23.324  350.476   22.715 -8.456543 32.55729 
1 1 1    2   38   20 o  187.595   22.500   28.111   6.3318   27.711   7.7535   28.912   10.970  184.013   28.446  182.647   40.320 1.366013 49.34455 
1 1 1    2   38   21 o  298.248   19.346   69.924   8.7840   79.471   12.739   61.269   12.129  314.382   26.726  274.423   29.329 39.95816 39.67963 
1 1 1    2   38   22 o  159.707   25.304   20.747   5.9794   9.8351   10.736   25.654   7.1993  116.636   44.027  177.110   27.445 -60.47401 51.88053 
1 1 1    2   38   23 o  382.756   13.220  113.407   7.7451  102.022   13.979  118.450   9.3036  356.600   25.784  390.316   15.573 -33.71634 30.12225 
1 1 1    2   38   24 o  276.984   14.415   59.694   6.0904   72.603   9.0304   48.924   8.2488  303.527   19.541  247.947   21.962 55.58038 29.39748 
1 1 1    2   38   25 o  108.632   37.056   9.5243   7.3892   0.0000   0.0000   9.5243   7.3892  ?   ?   108.632   37.056 0.000000 37.05583 
1 1 1    2   38   26 o  226.506   17.018   40.312   5.8569   45.333   8.5359   35.846   8.0511  237.435   23.808  210.108   25.562 27.32751 34.93166 
1 1 1    2   38   27 o  288.872   14.726   65.089   6.4898   75.092   9.6566   56.849   8.7640  307.619   20.628  267.001   21.631 40.61826 29.89007 
1 1 1    2   38   28 o  131.993   33.718   15.085   6.8369   21.778   13.391   12.725   7.9513  152.396   49.844  121.203   38.297 31.19312 62.85754 
1 1 1    2   38   29 o  128.871   38.735   14.711   8.2588   0.0000   0.0000   14.711   8.2588  ?   ?   128.871   38.735 0.000000 38.73532 
1 1 1    2   38   30 o  299.581   17.132   70.728   7.8232   59.406   12.481   78.055   10.040  265.707   31.288  312.462   21.117 -46.75494 37.74768 
1 1 1    2   38   31 o  126.943   35.114   14.262   7.0526   8.8208   8.8716   23.604   11.625  106.692   40.075  157.506   45.603 -50.81310 60.70896 
1 1 1    2   38   32 o   86.968   33.374   5.0945   6.2330   3.0414   8.6256   7.3380   9.0170   88.800   37.352  101.975   39.862 -13.17477 54.62751 
1 1 1    2   38   33 o  147.099   29.269   18.546   6.3581   10.792   8.7908   27.052   9.2072  112.379   40.266  174.352   35.702 -61.97349 53.81436 
1 1 1    2   38   34 o  131.984   30.801   15.249   6.1088   13.728   8.6170   16.786   8.6615  122.369   39.982  134.316   39.500 -11.94678 56.20292 
1 1 1    2   38   35 o  203.590   20.891   33.714   6.4178   23.764   8.9316   44.335   9.2280  160.669   37.072  229.639   26.755 -68.97038 45.71875 
1 1 1    2   38   36 o  147.158   29.221   18.921   6.3497   12.630   8.8056   25.736   9.1647  116.397   40.420  166.547   36.920 -50.15047 54.74349 
1 1 1    2   38   37 o  153.605   26.872   20.324   6.0878   22.189   8.5399   18.396   8.6808  153.550   36.813  137.753   39.262 15.79720 53.82119 
1 1 1    2   38   38 o  144.331   28.274   18.314   6.0228   12.105   8.5063   24.556   8.5289  112.775   39.693  162.174   35.356 -49.39949 53.15670 
1 1 1    2   38   39 o  212.984   22.591   37.887   7.2522   39.049   8.8787   35.557   12.571  211.640   28.103  184.867   44.877 26.77267 52.95004 
1 1 1    2   39    0 o  610.825   12.587  287.023   11.757  287.023   11.757  287.023   11.757  610.825   12.587  610.825   12.587 0.000000 0.000000 
1 1 1    2   39    3 o  413.338   14.163  132.057   8.9602  144.468   13.094  121.127   12.288  430.266   19.882  393.248   20.486 37.01797 28.54735 
1 1 1    2   39    4 o   77.223   32.134   1.5442   6.2816   2.2249   9.1176   0.9291   8.6665   91.901   38.516   86.760   37.006 5.140533 53.41316 
1 1 1    2   39    5 o  300.949   16.953   70.530   7.7775   69.232   11.281   71.707   10.737  295.107   25.217  301.108   23.483 -6.001160 34.45746 
1 1 1    2   39    6 o   85.221   33.051   4.0654   6.1612   0.1803   8.6746   8.0206   8.7524   84.935   36.639  107.582   39.923 -22.64729 54.18707 
1 1 1    2   39    7 o  338.618   15.604   88.848   8.0873   82.191   11.238   95.998   11.647  322.653   22.905  349.265   21.897 -26.61160 31.68778 
1 1 1    2   39    8 o  267.046   18.932   55.853   7.6884   66.446   11.476   47.227   10.356  288.470   26.279  241.913   28.517 46.55789 38.77855 
1 1 1    2   39    9 f  629.947   12.958  306.379   12.495  298.630   17.706  314.065   17.634  619.017   18.688  635.143   18.139 -16.12622 26.04337 
1 1 1    2   39   10 o  499.591   13.782  192.944   10.539  176.091   14.786  210.349   15.026  474.479   20.360  519.357   18.902 -44.87790 27.78136 
1 1 1    2   39   11 o  183.275   25.202   27.025   6.8827   36.620   10.051   18.550   9.4450  210.963   32.141  146.800   40.646 64.16286 51.81849 
1 1 1    2   39   12 o  172.852   27.776   24.345   7.0998   34.456   9.9645   13.920   10.119  204.044   33.034  129.767   43.367 74.27711 54.51594 
1 1 1    2   39   13 o  313.509   17.455   76.724   8.3427   74.323   11.776   79.142   11.821  305.230   25.438  315.395   24.683 -10.16513 35.44471 
1 1 1    2   39   14 o  125.140   34.861   13.217   6.9255   19.341   10.179   7.9396   9.4501  149.099   42.522  108.611   41.232 40.48817 59.22996 
1 1 1    2   39   15 o  196.679   24.651   31.070   7.2581   40.507   11.129   24.084   9.5746  220.710   34.037  167.533   38.187 53.17657 51.15434 
1 1 1    2   39   16 o  202.202   24.906   32.869   7.5454   43.416   11.001   23.501   10.369  229.406   32.218  164.100   41.309 65.30641 52.38747 
1 1 1    2   39   17 o  262.482   29.266   56.027   11.558   56.027   11.558   0.0000   0.0000  262.482   29.266  ?   ?  0.000000 29.26563 
1 1 1    2   39   18 o  169.776   41.870   25.308   10.812   25.308   10.812   0.0000   0.0000  169.776   41.870  ?   ?  0.000000 41.86988 
1 1 1    2   39   19 o  130.312   44.181   14.277   10.503   14.277   10.503   0.0000   0.0000  130.312   44.181  ?   ?  0.000000 44.18112 
1 1 1    2   39   20 o  411.686   15.860  131.836   9.9943  123.386   14.197  140.139   14.072  393.770   23.665  420.858   21.921 -27.08813 32.25733 
1 1 1    2   39   21 o   72.898   30.924   0.8339   5.9930  -2.1172   7.2517   7.1914   10.644   71.894   32.149  108.629   43.046 -36.73438 53.72635 
1 1 1    2   39   22 o  208.773   21.172   34.715   6.6719   42.612   8.3522   20.790   11.091  230.270   24.052  152.142   44.684 78.12805 50.74630 
1 1 1    2   39   23 o  274.409   14.393   58.645   6.0241   60.232   8.7034   57.186   8.3465  275.553   20.788  268.609   20.455 6.944000 29.16423 
1 1 1    2   39   24 o  144.496   25.589   17.188   5.4524   14.707   7.9062   19.438   7.5294  129.913   37.606  150.595   33.527 -20.68182 50.38067 
1 1 1    2   39   25 o  164.546   23.261   21.969   5.6952   18.206   8.1885   25.494   7.9263  144.021   36.961  174.033   30.887 -30.01210 48.16724 
1 1 1    2   39   26 o  336.357   15.098   88.218   7.7733  103.245   13.180   80.204   9.6253  358.026   24.194  318.010   19.874 40.01593 31.31003 
1 1 1    2   39   27 o  156.876   28.634   20.675   6.6222   10.522   10.654   27.068   8.4538  115.938   43.835  178.124   32.192 -62.18576 54.38594 
1 1 1    2   39   28 o  450.580   13.710  158.070   9.4554  153.870   11.957  165.079   15.447  442.069   17.671  454.208   22.219 -12.13913 28.38938 
1 1 1    2   39   29 f   95.350   35.318   6.8111   6.8434   11.003   8.8646   0.6277   10.766  114.035   40.479   91.123   40.036 22.91209 56.93385 
1 1 1    2   39   30 o  267.763   20.839   57.565   8.4735   64.394   17.162   55.363   9.7441  263.813   44.055  260.086   24.776 3.726624 50.54380 
1 1 1    2   39   31 o   78.998   34.137   0.9364   7.5571 -11.1151   14.875   5.1294   8.7739   86.961   41.293   94.545   38.515 -7.584045 56.46699 
1 1 1    2   39   32 o  173.610   25.581   25.175   6.5941   30.316   9.5214   20.436   9.1411  184.636   34.971  147.998   39.583 36.63818 52.81824 
1 1 1    2   39   33 o  100.246   33.768   8.6587   6.1353   16.263   8.6371   0.9135   8.7167  131.317   39.645   82.691   36.185 48.62518 53.67554 
1 1 1    2   39   34 o  221.783   19.456   39.783   6.5379   30.763   9.1022   49.396   9.3967  185.637   33.255  242.674   25.688 -57.03757 42.02161 
1 1 1    2   39   35 o  190.151   22.230   29.911   6.3479   34.312   8.9736   25.502   8.9809  197.609   30.662  165.457   36.447 32.15250 47.62862 
1 1 1    2   39   36 o  239.545   17.632   46.177   6.4195   46.349   9.0833   46.004   9.0739  233.670   25.828  232.718   25.914 0.9518585 36.58716 
1 1 1    2   39   37 o  236.980   21.217   46.320   7.6145   48.638   9.3810   41.844   13.037  238.600   26.113  203.999   43.101 34.60011 50.39440 
1 1 1    2   40    0 o  261.521   18.193   53.555   7.2016   53.555   7.2016   53.555   7.2016  261.521   18.193  261.521   18.193 0.000000 0.000000 
1 1 1    2   40    1 o  288.604   12.085   64.247   5.3384   66.999   7.7772   61.796   7.3409  292.995   17.420  281.443   17.122 11.55209 24.42598 
1 1 1    2   40    2 o  453.832   11.181  158.693   7.7666  161.318   9.5020  153.409   13.481  456.838   13.589  443.005   19.882 13.83325 24.08177 
1 1 1    2   40    3 o  414.579   11.670  132.513   7.4055  132.512   8.9484  132.515   13.192  413.871   14.126  410.695   21.057 3.175934 25.35625 
1 1 1    2   40    4 o  117.386   34.930   11.474   6.7408   4.5439   9.7592   17.797   9.3217   99.980   40.662  143.844   40.577 -43.86364 57.44504 
1 1 1    2   40    5 o  349.616   15.865   94.841   8.4898  101.551   12.235   88.610   11.790  358.711   22.396  334.636   23.161 24.07535 32.21788 
1 1 1    2   40    6 o   89.153   34.331   4.7254   6.6107   13.939   9.4465  -4.1166   9.2543  129.135   41.843   78.328   35.554 50.80643 54.90816 
1 1 1    2   40    7 o  109.769   34.735   9.8356   6.5392   15.953   10.015   5.2893   8.6337  136.755   42.949   98.158   38.810 38.59680 57.88618 
1 1 1    2   40    8 o  236.833   21.015   44.316   7.5389   40.479   10.521   48.366   10.808  221.820   31.905  243.928   29.552 -22.10744 43.48817 
1 1 1    2   40    9 o   78.896   32.614   1.9734   6.4094  -0.4574   9.0030   4.4714   9.1267   84.548   36.892   97.392   39.426 -12.84349 53.99439 
1 1 1    2   40   10 o  130.777   34.115   14.474   6.9004   9.0125   10.058   19.331   9.4846  113.285   42.647  149.333   40.480 -36.04835 58.79984 
1 1 1    2   40   11 o  160.025   28.851   21.093   6.8068   29.204   10.047   14.212   9.2541  185.505   36.685  129.668   41.352 55.83777 55.27919 
1 1 1    2   40   12 o  233.801   21.255   43.283   7.5234   38.569   10.516   48.225   10.768  215.663   32.899  243.290   29.521 -27.62639 44.20168 
1 1 1    2   40   13 o  165.915   29.748   22.761   7.2771   27.388   10.346   18.230   10.237  178.233   39.008  144.514   43.056 33.71927 58.09873 
1 1 1    2   40   14 o  142.824   34.314   17.349   7.4079   15.275   10.273   19.595   10.692  133.783   43.653  149.187   43.890 -15.40405 61.90206 
1 1 1    2   40   15 o   73.333   32.462  -1.4619   7.2056   9.7222   10.374 -11.8868   10.016  115.635   43.355   69.637   33.295 45.99863 54.66427 
1 1 1    2   40   16 f  472.239   14.766  173.060   10.673  180.891   15.458  165.926   14.754  479.392   21.067  459.179   20.993 20.21234 29.74059 
1 1 1    2   40   17 o  322.676   18.111   81.643   8.9088   64.112   12.848   97.881   12.364  279.643   30.511  350.801   23.157 -71.15771 38.30356 
1 1 1    2   40   18 o   79.218   33.979   0.6346   7.3808   5.9660   11.037  -3.6780   9.9268  106.446   43.262   81.517   36.930 24.92876 56.88080 
1 1 1    2   40   19 o  319.240   19.781   80.413   9.6180   88.685   13.211   71.086   14.029  331.621   26.242  293.236   31.765 38.38458 41.20269 
1 1 1    2   40   20 o  112.080   44.475   8.0027   11.376   8.0027   11.376   0.0000   0.0000  112.080   44.475  ?   ?  0.000000 44.47461 
1 1 1    2   40   21 o  126.564   47.106   12.894   12.203   12.894   12.203   0.0000   0.0000  126.564   47.106  ?   ?  0.000000 47.10632 
1 1 1    2   40   22 o  236.915   19.957   44.575   7.1696   44.309   8.6151   45.176   12.931  234.141   24.397  228.062   38.408 6.077972 45.50129 
1 1 1    2   40   23 o  149.528   31.702   19.083   7.0305   13.208   8.4144   32.668   12.796  123.233   39.445  188.538   44.970 -65.30474 59.81839 
1 1 1    2   40   24 o  321.712   15.941   80.929   7.8498   85.495   13.365   78.524   9.6990  323.192   27.272  314.264   20.271 8.927826 33.98087 
1 1 1    2   40   25 f  214.605   21.957   37.101   7.1108   31.501   11.879   40.228   8.8769  185.365   42.742  220.957   26.795 -35.59160 50.44647 
1 1 1    2   40   26 o   83.234   33.456   3.6530   6.5220   10.692   8.6340  -5.7015   9.9530  112.923   39.964   76.778   35.585 36.14477 53.51072 
1 1 1    2   40   27 o  135.053   32.845   15.958   6.7241   14.030   8.4780   19.228   11.040  125.013   39.550  142.856   45.126 -17.84227 60.00434 
1 1 1    2   40   28 o   67.863   29.964  -0.7576   6.1009  -5.5919   8.5608   4.2314   8.6967   70.333   32.735   92.140   38.031 -21.80692 50.17932 
1 1 1    2   40   29 o   81.480   32.464   3.8070   6.0844   3.0541   8.5834   4.5673   8.6260   88.280   37.204   92.450   37.985 -4.170158 53.16917 
1 1 1    2   40   30 o  159.314   27.732   21.591   6.5168   19.033   9.1299   24.247   9.3048  142.279   40.165  162.335   38.102 -20.05568 55.36249 
1 1 1    2   40   31 o  137.168   30.243   16.514   6.1787   23.170   8.7149   9.7868   8.7614  158.868   36.593  107.378   39.924 51.48944 54.15743 
1 1 1    2   40   32 o  222.699   22.927   40.927   7.7034   43.039   13.588   39.927   9.3514  210.099   43.679  215.355   29.116 -5.256378 52.49362 
1 1 1    2   40   33 o  121.860   37.202   14.013   7.5747   24.461   13.716   9.4282   9.0860  149.391   50.488  105.230   40.315 44.16116 64.60911 
1 1 1    2   40   34 o   66.282   30.489  -3.0603   7.1102 -21.0914   12.571   5.4205   8.6217   67.248   33.246   92.017   37.911 -24.76867 50.42341 
1 1 1    2   40   35 o   81.359   33.727   3.5703   6.8824   10.693   8.6330  -8.8507   11.400  107.661   39.710   74.802   35.697 32.85906 53.39582 
1 1 1    2   41    0 o  368.613   14.853  105.164   8.3492  105.164   8.3492  105.164   8.3492  368.613   14.853  368.613   14.853 0.000000 0.000000 
1 1 1    2   41    1 o  113.188   26.752   10.602   4.5614   5.9041   6.3703   15.546   6.5345   92.600   34.118  135.980   31.939 -43.38049 46.73466 
1 1 1    2   41    2 o  181.804   20.045   26.184   5.4853   21.904   6.5400   36.338   10.073  163.801   27.028  209.485   32.467 -45.68436 42.24446 
1 1 1    2   41    3 o  340.867   12.737   89.777   6.6456   86.334   8.1401   96.657   11.508  333.367   15.953  349.974   21.588 -16.60703 26.84271 
1 1 1    2   41    4 o  108.038   35.096   9.4645   6.6433   26.597   9.4924  -6.9834   9.3008  176.945   36.267   73.388   34.145 103.5570 49.81120 
1 1 1    2   41    5 o  233.660   21.621   43.285   7.6451   50.296   11.020   36.780   10.615  248.476   29.555  209.841   34.229 38.63493 45.22317 
1 1 1    2   41    6 o  161.324   28.359   21.405   6.7471   18.541   9.7044   24.084   9.3872  145.898   41.488  167.576   37.531 -21.67842 55.94447 
1 1 1    2   41    7 o  190.733   26.604   29.517   7.5555   47.745   11.085   13.703   10.325  241.354   30.703  128.527   43.803 112.8268 53.49198 
1 1 1    2   41    8 o  323.270   17.177   81.643   8.4689   79.857   11.819   83.528   12.141  316.350   24.603  323.521   24.704 -7.171021 34.86525 
1 1 1    2   41    9 o  333.679   17.561   87.069   8.9377   67.133   12.265  109.645   13.051  287.985   28.185  371.779   23.049 -83.79367 36.40960 
1 1 1    2   41   10 o  294.937   18.212   68.201   8.1813   87.820   12.149   51.924   11.067  331.980   24.073  252.406   29.183 79.57460 37.83063 
1 1 1    2   41   11 o  274.981   19.142   59.488   8.0064   48.761   11.544   69.429   11.114  243.043   31.794  294.502   24.888 -51.45856 40.37652 
1 1 1    2   41   12 o  159.877   30.404   21.310   7.1683   9.6375   10.030   33.496   10.248  114.428   42.684  199.193   34.884 -84.76527 55.12500 
1 1 1    2   41   13 o  424.865   15.372  140.322   9.9963  123.104   13.848  159.056   14.445  393.531   23.091  449.330   21.003 -55.79944 31.21405 
1 1 1    2   41   14 o   87.340   35.420   3.4918   7.3802   5.8879   10.502   1.1539   10.374  104.684   42.322   92.958   40.083 11.72591 58.29087 
1 1 1    2   41   15 o  323.338   18.857   82.253   9.2922   89.005   13.333   75.876   12.957  332.120   26.448  305.545   28.017 26.57483 38.52840 
1 1 1    2   41   16 o   99.409   36.802   7.1012   7.4286   16.291   10.988  -0.6366   10.082  136.370   45.176   87.797   38.655 48.57376 59.45649 
1 1 1    2   41   17 o   85.292   35.715   2.2722   7.8285   7.0690   11.779  -1.5228   10.477  110.549   44.777   87.459   38.909 23.09002 59.31993 
1 1 1    2   41   18 o   57.968   27.991 -10.6290   7.4915  -9.4963   10.655 -11.7362   10.535   75.096   35.447   71.627   34.219 3.468620 49.26866 
1 1 1    2   41   19 o  277.659   22.535   61.721   9.4947   75.076   13.640   49.166   13.225  301.525   29.950  238.656   37.435 62.86861 47.94153 
1 1 1    2   41   20 o   98.220   43.122   0.7509   12.469   0.0000   0.0000   0.7509   12.469  ?   ?    98.220   43.122 0.000000 43.12180 
1 1 1    2   41   21 o   96.868   43.648  -2.0367   13.651   0.0000   0.0000  -2.0367   13.651  ?   ?    96.868   43.648 0.000000 43.64798 
1 1 1    2   41   23 o   85.111   35.676   2.5791   7.8250   2.5791   7.8250   0.0000   0.0000   85.111   35.676  ?   ?  0.000000 35.67640 
1 1 1    2   41   24 o  246.268   23.997   49.346   8.9307   49.346   8.9307   0.0000   0.0000  246.268   23.997  ?   ?  0.000000 23.99722 
1 1 1    2   41   25 o   92.225   33.162   6.5811   5.9677   7.3512   8.3810   5.7892   8.4994  100.665   38.683   96.130   38.348 4.534943 54.46981 
1 1 1    2   41   26 o  195.232   22.040   30.971   6.4709   25.071   9.0240   37.216   9.2839  167.447   36.259  209.534   29.786 -42.08717 46.92440 
1 1 1    2   41   27 o  250.696   18.220   50.105   6.9435   48.901   9.5426   51.459   10.122  242.677   26.101  248.279   27.075 -5.601868 37.60699 
1 1 1    2   41   28 o  217.235   20.861   38.271   6.8510   44.503   9.8468   32.424   9.5380  228.925   28.735  191.471   33.780 37.45433 44.34847 
1 1 1    2   41   29 o  107.943   33.672   10.402   6.1673   10.114   8.7489   10.686   8.6951  108.226   39.964  110.123   39.968 -1.897087 56.51992 
1 1 1    2   41   30 o  209.414   21.329   35.897   6.7412   36.764   9.5442   35.035   9.5229  204.586   31.488  198.928   32.390 5.657913 45.17318 
1 1 1    2   41   31 o  195.821   22.045   31.664   6.4926   41.982   9.4265   22.352   8.9554  220.639   28.584  153.122   38.306 67.51768 47.79537 
1 1 1    2   41   32 o  162.625   26.333   22.700   6.3305   11.153   8.9897   34.059   8.9162  110.038   40.532  196.337   30.673 -86.29824 50.82940 
1 1 1    2   42    0 o  258.208   19.277   52.471   7.5210   52.471   7.5210   52.471   7.5210  258.208   19.277  258.208   19.277 0.000000 0.000000 
1 1 1    2   42    1 o  458.458   9.9435  161.887   6.9776  164.325   9.8089  159.391   9.9278  460.494   13.916  453.368   14.307 7.125519 19.95857 
1 1 1    2   42    2 o  541.014   11.023  225.773   9.1282  225.856   11.064  225.596   16.155  540.112   13.383  536.225   19.682 3.886963 23.80126 
1 1 1    2   42    3 o  454.249   11.501  159.279   7.9963  153.570   9.5770  172.420   14.530  445.094   14.057  468.417   20.266 -23.32318 24.66407 
1 1 1    2   42    4 o  482.155   14.079  180.230   10.390  175.244   14.372  185.691   15.039  472.435   19.875  486.102   20.213 -13.66760 28.34753 
1 1 1    2   42    5 o   88.745   34.407   4.6962   6.6755   0.8761   9.3548   8.6596   9.5287   88.511   38.115  110.188   41.504 -21.67688 56.35033 
1 1 1    2   42    6 o  215.022   23.483   37.067   7.6030   46.832   10.650   26.917   10.858  238.903   29.770  174.856   41.237 64.04707 50.86059 
1 1 1    2   42    7 o  208.131   24.458   34.897   7.6430   32.545   10.586   37.458   11.046  195.036   36.809  210.243   35.597 -15.20683 51.20641 
1 1 1    2   42    8 o   75.601   32.779  -0.0635   7.0150   2.1016   9.5373  -2.6155   10.354   91.959   39.010   85.271   38.252 6.688622 54.63539 
1 1 1    2   42    9 o  330.771   17.422   85.713   8.7896   89.608   12.413   81.796   12.448  334.568   24.407  318.805   25.729 15.76300 35.46416 
1 1 1    2   42   10 o  312.410   18.716   76.789   8.9083   70.719   12.698   82.671   12.501  294.523   28.525  320.412   25.706 -25.88907 38.39867 
1 1 1    2   42   11 o  133.186   34.927   15.289   7.2079   15.614   10.117   14.955   10.272  133.699   43.301  131.461   43.686 2.237427 61.50948 
1 1 1    2   42   12 o  353.141   17.397   97.563   9.4036   97.881   13.072   97.222   13.537  349.189   24.616  347.320   25.646 1.868500 35.54750 
1 1 1    2   42   13 o  201.795   27.500   33.425   8.2727   24.583   11.139   44.300   12.353  164.807   43.516  227.283   36.765 -62.47614 56.96780 
1 1 1    2   42   14 o  117.758   37.222   11.849   7.5107   16.470   10.728   7.4060   10.518  136.172   44.617  107.894   42.780 28.27780 61.81295 
1 1 1    2   42   15 o  157.492   34.397   21.408   8.0596   30.663   11.594   12.753   11.212  184.800   41.948  124.307   45.343 60.49319 61.77063 
1 1 1    2   42   16 o  197.881   42.415   35.275   12.461   0.0000   0.0000   35.275   12.461  ?   ?   197.881   42.415 0.000000 42.41496 
1 1 1    2   42   17 o   74.425   35.709 -13.4021   11.748   0.0000   0.0000 -13.4021   11.748  ?   ?    74.425   35.709 0.000000 35.70941 
1 1 1    2   42   18 o  289.176   33.041   70.719   14.362   0.0000   0.0000   70.719   14.362  ?   ?   289.176   33.041 0.000000 33.04089 
1 1 1    2   42   19 o  235.048   27.104   45.534   9.5725   50.851   13.115   39.472   14.003  241.924   36.559  205.864   45.638 36.06058 58.47563 
1 1 1    2   42   20 o  125.474   47.389   13.261   12.442   13.261   12.442   0.0000   0.0000  125.474   47.389  ?   ?  0.000000 47.38894 
1 1 1    2   42   21 o  350.718   28.699  102.022   15.271  102.022   15.271   0.0000   0.0000  350.718   28.699  ?   ?  0.000000 28.69886 
1 1 1    2   42   22 o  442.124   18.207  154.513   12.321  144.562   16.857  165.926   18.053  419.733   26.373  449.809   26.336 -30.07547 37.27090 
1 1 1    2   42   23 o  185.048   36.237   30.441   9.8966   25.167   13.705   36.188   14.306  158.374   50.304  191.812   48.653 -33.43762 69.98323 
1 1 1    2   42   25 o  192.984   32.437   32.540   9.2415   32.540   9.2415   0.0000   0.0000  192.984   32.437  ?   ?  0.000000 32.43668 
1 1 1    2   42   26 o  194.603   23.461   31.295   6.8473   40.084   9.5336   21.931   9.8406  216.129   29.596  151.108   41.347 65.02101 50.84768 
1 1 1    2   42   27 o  156.798   28.884   21.307   6.6768   25.249   9.6900   17.743   9.2130  163.428   39.234  135.574   40.948 27.85318 56.71012 
1 1 1    2   42   28 o  103.639   33.869   9.5836   6.1835   12.010   8.8971   7.3169   8.5999  113.963   40.543   98.293   38.775 15.66957 56.09983 
1 1 1    2   42   29 o  125.576   31.857   14.290   6.1329   10.116   8.7621   18.300   8.5871  106.910   39.891  137.634   38.988 -30.72449 55.77938 
1 1 1    2   42   30 o  282.807   18.527   64.555   7.9753   72.400   9.9334   50.324   13.378  296.425   22.051  230.052   39.411 66.37320 45.16053 
1 1 1    2   43    0 o  107.887   42.926   12.867   6.8495   12.867   6.8495   12.867   6.8495  107.887   42.926  107.887   42.926 0.000000 0.000000 
1 1 1    2   43    1 o  145.950   23.324   17.319   5.0351   10.318   6.9804   24.913   7.2697  111.195   35.963  173.521   28.350 -62.32594 45.79367 
1 1 1    2   43    2 o  304.859   12.795   71.985   5.9705   61.872   8.2488   83.113   8.6527  279.877   19.375  325.488   17.431 -45.61133 26.06201 
1 1 1    2   43    3 o  328.782   14.420   84.001   7.2566   85.611   8.7198   80.375   13.087  330.399   17.303  314.419   27.470 15.97971 32.46498 
1 1 1    2   43    4 o   65.466   28.860  -0.9817   5.6378  -1.7198   6.8711   0.5391   9.8625   70.518   31.431   89.215   38.775 -18.69714 49.91378 
1 1 1    2   43    5 o  259.303   20.896   53.451   8.2230   47.613   11.458   59.651   11.808  238.691   32.182  269.494   29.088 -30.80299 43.37940 
1 1 1    2   43    6 o  177.236   29.142   26.118   7.6309   17.308   10.254   37.053   11.424  139.273   43.414  207.032   37.428 -67.75940 57.32029 
1 1 1    2   43    7 o  279.684   19.866   61.957   8.4490   56.761   12.218   66.719   11.697  261.355   31.155  286.299   27.011 -24.94379 41.23375 
1 1 1    2   43    8 o  335.145   17.479   88.227   8.9356   83.302   12.242   93.843   13.073  321.306   25.091  341.033   25.223 -19.72714 35.57724 
1 1 1    2   43    9 o  310.435   18.951   76.108   8.9617   79.076   12.490   72.959   12.866  312.009   26.400  298.186   28.539 13.82355 38.87709 
1 1 1    2   43   10 o  145.313   34.552   18.329   7.5725   25.609   11.052   11.887   10.397  167.823   42.869  120.396   43.702 47.42731 61.21786 
1 1 1    2   43   11 o  286.054   28.941   67.481   12.497   0.0000   0.0000   67.481   12.497  ?   ?   286.054   28.941 0.000000 28.94074 
1 1 1    2   43   12 o   83.365   38.003  -3.9444   10.719   0.0000   0.0000  -3.9444   10.719  ?   ?    83.365   38.003 0.000000 38.00317 
1 1 1    2   43   13 o  187.909   42.956   32.216   12.086   0.0000   0.0000   32.216   12.086  ?   ?   187.909   42.956 0.000000 42.95573 
1 1 1    2   43   14 o  275.207   32.786   64.046   13.539   0.0000   0.0000   64.046   13.539  ?   ?   275.207   32.786 0.000000 32.78620 
1 1 1    2   43   15 o  316.061   19.711   79.388   9.4880   72.592   12.634   88.177   14.368  296.549   28.173  326.284   29.075 -29.73514 40.48534 
1 1 1    2   43   16 o  191.903   40.429   33.223   11.501   33.223   11.501   0.0000   0.0000  191.903   40.429  ?   ?  0.000000 40.42945 
1 1 1    2   43   17 o  327.640   27.190   88.337   13.512   88.337   13.512   0.0000   0.0000  327.640   27.190  ?   ?  0.000000 27.18975 
1 1 1    2   43   18 o  180.754   43.414   30.494   11.861   30.494   11.861   0.0000   0.0000  180.754   43.414  ?   ?  0.000000 43.41436 
1 1 1    2   43   19 o  402.459   17.688  127.888   10.896  111.433   14.984  146.350   15.872  367.665   26.812  423.952   24.565 -56.28625 36.36326 
1 1 1    2   43   21 o  340.691   20.699   93.370   10.743   93.843   15.837   92.968   14.621  331.144   31.630  332.320   29.036 -1.176605 42.93633 
1 1 1    2   43   22 o  166.299   38.192   25.489   9.5165   39.162   14.152   14.202   12.858  198.847   47.202  124.898   47.933 73.94899 67.27255 
1 1 1    2   43   23 o  107.375   40.533   9.6256   9.0999   4.7726   12.774   14.626   12.966  102.665   44.374  125.271   48.120 -22.60529 65.45705 
1 1 1    2   43   24 o  105.950   40.303   9.3469   9.0405   6.8705   12.901   11.736   12.672  106.521   45.286  117.035   46.779 -10.51403 65.10870 
1 1 1    2   43   25 o  158.938   32.264   22.556   7.5810   26.814   9.0898   12.828   13.740  170.881   35.895  119.891   48.430 50.99020 60.28161 
1 1 1    2   43   26 o  251.721   25.379   53.228   9.6448   53.228   9.6448   0.0000   0.0000  251.721   25.379  ?   ?  0.000000 25.37878 
1 1 1    2   43   27 o  134.732   39.847   17.726   8.7925   17.726   8.7925   0.0000   0.0000  134.732   39.847  ?   ?  0.000000 39.84733 
1 1 1    2   44    0 o   48.163   33.969 -10.5786   9.9814 -10.5786   9.9814 -10.5786   9.9814   48.163   33.969   48.163   33.969 0.000000 0.000000 
1 1 1    2   44    1 o  172.319   28.974   24.843   7.3708   21.873   10.121   28.197   10.756  155.191   41.711  177.268   40.523 -22.07678 58.15471 
1 1 1    2   44    2 o  412.022   15.612  132.592   9.8454  128.939   13.424  136.844   14.484  401.884   21.905  413.190   22.993 -11.30612 31.75665 
1 1 1    2   44    3 o  320.933   18.087   81.241   8.8485   62.568   12.300  101.269   12.739  274.597   29.740  354.831   23.589 -80.23383 37.95938 
1 1 1    2   44    4 o   97.534   36.339   6.9367   7.2659   4.1740   9.8525   10.230   10.758   96.878   40.273  115.495   43.958 -18.61756 59.61696 
1 1 1    2   44    5 o  119.552   43.870   11.736   10.518   0.0000   0.0000   11.736   10.518  ?   ?   119.552   43.870 0.000000 43.87045 
1 1 1    2   44    6 o  251.954   32.626   53.655   12.287   0.0000   0.0000   53.655   12.287  ?   ?   251.954   32.626 0.000000 32.62558 
1 1 1    2   44    7 o  137.069   45.447   17.120   11.119   0.0000   0.0000   17.120   11.119  ?   ?   137.069   45.447 0.000000 45.44703 
1 1 1    2   44    8 o  273.761   20.771   59.839   8.6388   47.030   12.345   72.130   12.093  233.347   35.698  296.674   26.924 -63.32664 44.71354 
1 1 1    2   44    9 o  109.137   36.946   9.9972   7.3447   8.0403   9.9882   12.301   10.838  107.230   41.944  121.262   44.527 -14.03254 61.17150 
1 1 1    2   44   10 f  294.795   19.300   69.012   8.6607   67.735   11.946   70.427   12.574  286.762   27.556  291.718   28.526 -4.956604 39.66193 
1 1 1    2   44   11 o  112.297   43.029   9.6375   10.352   9.6375   10.352   0.0000   0.0000  112.297   43.029  ?   ?  0.000000 43.02888 
1 1 1    2   44   12 o  151.835   44.129   21.609   10.867   21.609   10.867   0.0000   0.0000  151.835   44.129  ?   ?  0.000000 44.12868 
1 1 1    2   44   13 o   98.981   41.537   4.4752   10.626   4.4752   10.626   0.0000   0.0000   98.981   41.537  ?   ?  0.000000 41.53693 
1 1 1    2   44   14 o  132.596   45.692   16.254   11.242   16.254   11.242   0.0000   0.0000  132.596   45.692  ?   ?  0.000000 45.69208 
1 1 1    2   44   15 o  175.373   31.967   26.582   8.2648   14.644   11.590   38.936   11.789  127.245   46.149  208.234   38.404 -80.98858 60.03800 
1 1 1    2   44   16 o   93.075   36.710   5.6924   7.7075   6.9608   11.136   4.5260   10.678  105.250   43.192   98.332   41.471 6.917801 59.87786 
1 1 1    2   44   17 o   75.978   33.694  -0.6550   7.7965 -11.8868   10.847   11.350   11.214   71.185   34.197  116.385   44.741 -45.20000 56.31310 
1 1 1    2   44   18 o  306.175   20.859   75.656   9.7172  103.057   14.926   55.500   12.802  350.478   28.059  251.470   34.142 99.00768 44.19218 
1 1 1    2   44   19 o  183.032   32.575   29.451   8.7916   29.741   12.837   29.195   12.065  171.754   47.319  172.040   45.222 -0.2856140 65.45305 
1 1 1    2   44   20 o  128.715   38.902   15.562   8.3133   17.967   12.452   13.628   11.166  134.169   47.939  121.321   45.079 12.84746 65.80460 
1 1 1    2   44   21 o  119.555   39.984   13.383   8.6014   14.117   12.205   12.659   12.123  122.634   46.787  118.704   46.271 3.930550 65.80272 
1 1 1    2   44   22 o  142.090   38.487   19.182   8.5775   14.880   12.112   23.510   12.149  124.065   46.780  150.356   47.318 -26.29056 66.53836 
1 1 1    2   44   23 f  128.716   39.885   15.997   8.6694   31.717   12.637   2.0188   11.916  175.772   46.319   93.900   41.647 81.87242 62.28882 
1 1 1    2   45    0 o  425.956   22.094  143.150   14.316  143.150   14.316  143.150   14.316  425.956   22.094  425.956   22.094 0.000000 0.000000 
1 1 1    2   45    1 o  449.323   12.432  156.778   8.5500  155.079   10.516  160.091   14.687  445.144   15.434  447.707   21.432 -2.563690 26.41043 
1 1 1    2   45    2 o  346.897   12.276   93.417   6.5184   89.943   9.0910   97.093   9.3514  337.422   17.664  351.160   17.398 -13.73776 24.79312 
1 1 1    2   45    4 o  187.189   28.707   29.441   7.9626   29.441   7.9626   0.0000   0.0000  187.189   28.707  ?   ?  0.000000 28.70721 
1 1 1    2   45    5 o  216.512   24.852   38.436   8.0866   38.436   8.0866   0.0000   0.0000  216.512   24.852  ?   ?  0.000000 24.85163 
1 1 1    2   45    6 o  104.472   41.835   7.2319   10.156   7.2319   10.156   0.0000   0.0000  104.472   41.835  ?   ?  0.000000 41.83530 
1 1 1    2   45    7 o  172.933   42.080   27.811   11.033   27.811   11.033   0.0000   0.0000  172.933   42.080  ?   ?  0.000000 42.07985 
1 1 1    2   45    8 o   91.471   39.804   1.6047   10.418   1.6047   10.418   0.0000   0.0000   91.471   39.804  ?   ?  0.000000 39.80403 
1 1 1    2   45    9 o  254.574   22.957   52.682   8.8490   55.707   12.040   49.128   13.050  255.578   31.440  234.935   37.555 20.64259 48.97821 
1 1 1    2   45   10 o  164.674   31.701   23.534   7.7005   17.251   10.713   30.249   11.076  135.011   44.603  180.580   41.008 -45.56906 60.58944 
1 1 1    2   45   11 o  349.578   18.192   97.150   9.7004   92.742   13.957  101.269   13.491  333.617   27.580  350.946   25.285 -17.32916 37.41663 
1 1 1    2   45   12 o  252.673   22.436   51.958   8.5868   51.623   12.253   52.281   12.037  243.097   33.849  245.511   32.855 -2.414108 47.17241 
1 1 1    2   45   13 o  224.761   25.096   41.861   8.4863   39.642   12.088   44.018   11.916  207.732   39.461  221.865   36.350 -14.13313 53.65108 
1 1 1    2   45   14 o   83.989   34.977   3.1771   7.4503   2.2258   11.087   3.9604   10.060   93.619   40.892   94.364   40.050 -0.7454681 57.23760 
1 1 1    2   45   15 o  196.730   28.532   33.005   8.3409   14.324   12.116   49.834   11.500  124.171   46.795  239.183   32.232 -115.0115 56.82172 
1 1 1    2   45   16 f  268.338   21.773   58.684   8.8658   84.074   13.368   38.748   11.846  315.473   27.974  204.237   39.320 111.2359 48.25583 
1 1 1    2   45   17 o  136.570   36.913   17.371   7.9003   34.823   11.913   3.6696   10.555  190.460   41.993   94.304   40.547 96.15645 58.37409 
1 1 1    2   45   18 o  142.562   37.955   19.167   8.4291   34.324   12.203   5.3373   11.657  187.164   43.435  100.345   42.862 86.81876 61.02306 
1 1 1    2   45   19 o   91.767   37.193   5.4679   8.1329   11.379   11.941   0.3535   11.108  114.508   45.525   88.795   39.742 25.71266 60.43100 
1 1 1    2   46    0 o  144.295   41.565   20.602   7.9621   20.602   7.9621   20.602   7.9621  144.295   41.565  144.295   41.565 0.000000 0.000000 
1 1 1    2   46    1 o  226.346   19.613   41.186   6.7278   36.686   11.670   43.426   8.2339  199.781   39.562  229.970   23.733 -30.18898 46.13465 
1 1 1    2   46    2 o   98.381   37.104   7.4750   7.6210   0.0000   0.0000   7.4750   7.6210  ?   ?    98.381   37.104 0.000000 37.10432 
1 1 1    2   46    3 o  111.071   34.604   10.944   6.5156   7.8455   12.624   12.069   7.6070  109.629   45.582  115.799   37.551 -6.170113 59.05757 
1 1 1    2   46    4 o  151.409   36.159   20.830   8.2646   42.973   12.210   2.1082   11.227  217.753   38.018   94.053   41.114 123.7004 55.99760 
1 1 1    2   46    5 o   96.662   37.262   6.9037   7.7944   4.7576   11.069   9.0144   10.977   99.101   42.032  109.194   43.575 -10.09300 60.54291 
1 1 1    2   46    6 o  130.016   38.306   15.668   8.1391   26.032   11.823   6.3321   11.221  162.209   45.678  102.960   42.905 59.24824 62.66823 
1 1 1    2   46    7 o  281.340   20.866   64.003   8.9215   72.403   12.953   56.422   12.306  291.928   29.388  254.943   32.256 36.98466 43.63629 
1 1 1    2   46    8 o  163.490   32.400   23.590   7.8212   37.204   11.358   11.313   10.786  201.538   38.218  114.773   43.935 86.76552 58.23180 
1 1 1    2   46    9 o   68.011   31.316  -3.6677   7.5262  -1.6659   11.318  -5.2545   10.077   86.862   39.386   76.500   35.576 10.36184 53.07402 
1 1 1    2   46   10 o  191.105   27.888   31.088   7.9173   31.519   11.238   30.663   11.156  182.072   41.276  179.332   41.470 2.739349 58.51073 
1 1 1    2   46   11 o  168.222   30.702   24.735   7.6140   28.781   11.046   21.073   10.510  172.684   42.157  146.147   43.645 26.53729 60.68038 
1 1 1    2   46   12 o  121.619   36.585   13.681   7.3652   16.790   10.546   10.720   10.291  130.840   44.271  111.651   42.874 19.18888 61.62835 
1 1 1    2   46   13 o  128.012   37.507   15.363   7.8223   20.988   10.655   8.7876   11.521  144.987   44.091  108.030   44.085 36.95776 62.34984 
1 1 1    2   46   14 o  203.894   27.308   35.389   8.3082   35.293   12.198   35.472   11.347  190.280   42.906  194.032   39.549 -3.751511 58.35278 
1 1 1    2   47    0 o  120.608   45.047   16.237   7.7491   16.237   7.7491   16.237   7.7491  120.608   45.047  120.608   45.047 0.000000 0.000000 
1 1 1    2   47    1 o  296.503   13.910   68.958   6.3126   66.159   8.6113   72.209   9.2811  286.321   19.770  298.664   20.425 -12.34238 28.42623 
1 1 1    2   47    2 o  199.198   18.956   32.017   5.7098   28.923   8.0568   35.139   8.0931  182.607   29.857  203.971   26.552 -21.36325 39.95586 
1 1 1    2   47    3 o  114.364   32.955   11.784   6.0841   4.7124   9.8338   16.170   7.7443   94.697   39.860  131.699   36.927 -37.00205 54.33604 
1 1 1    2   47    4 o   70.127   31.803  -2.1315   7.3843  -8.1815   10.095   4.8319   10.830   71.955   34.124   97.483   41.469 -25.52738 53.70404 
1 1 1    2   47    5 o  204.735   21.281   34.269   6.5715   31.061   7.9190   41.364   11.777  190.559   27.984  212.046   37.664 -21.48663 46.92215 
1 1 1    3    0    1 o  1045.88   14.218  838.008   22.752  838.008   22.752  838.008   22.752  1045.88   14.218  1045.88   14.218 0.000000 0.000000 
1 1 1    3    0    3 o  810.324   8.4120  502.769   10.431  502.769   10.431  502.769   10.431  810.324   8.4120  810.324   8.4120 0.000000 0.000000 
1 1 1    3    0    4 o   74.532   6.0688   4.3357   0.6818   4.3357   0.6818   4.3357   0.6818   74.532   6.0688   74.532   6.0688 0.000000 0.000000 
1 1 1    3    0    5 o  666.112   6.1419  339.690   6.2609  339.690   6.2609  339.690   6.2609  666.112   6.1419  666.112   6.1419 0.000000 0.000000 
1 1 1    3    0    6 o  181.654   4.2952   25.298   1.1928   25.298   1.1928   25.298   1.1928  181.654   4.2952  181.654   4.2952 0.000000 0.000000 
1 1 1    3    0    7 f  1304.99   8.6387  1303.73   17.254  1303.73   17.254  1303.73   17.254  1304.99   8.6387  1304.99   8.6387 0.000000 0.000000 
1 1 1    3    0    8 o  489.453   4.7836  183.404   3.5829  183.404   3.5829  183.404   3.5829  489.453   4.7836  489.453   4.7836 0.000000 0.000000 
1 1 1    3    0    9 o   90.976   8.3877   6.4953   1.1452   6.4953   1.1452   6.4953   1.1452   90.976   8.3877   90.976   8.3877 0.000000 0.000000 
1 1 1    3    0   10 o   22.712   13.856   0.3370   0.9103   0.3370   0.9103   0.3370   0.9103   22.712   13.856   22.712   13.856 0.000000 0.000000 
1 1 1    3    0   11 o  2031.03   14.829  3159.09   46.093  3159.09   46.093  3159.09   46.093  2031.03   14.829  2031.03   14.829 0.000000 0.000000 
1 1 1    3    0   12 o  508.669   5.1255  198.093   3.9897  198.093   3.9897  198.093   3.9897  508.669   5.1255  508.669   5.1255 0.000000 0.000000 
1 1 1    3    0   13 o  1149.90   7.9738  1012.25   14.033  1012.25   14.033  1012.25   14.033  1149.90   7.9738  1149.90   7.9738 0.000000 0.000000 
1 1 1    3    0   14 o  1308.03   10.189  1310.01   20.396  1310.01   20.396  1310.01   20.396  1308.03   10.189  1308.03   10.189 0.000000 0.000000 
1 1 1    3    0   15 o  455.350   5.2657  158.760   3.6689  158.760   3.6689  158.760   3.6689  455.350   5.2657  455.350   5.2657 0.000000 0.000000 
1 1 1    3    0   16 o  1244.69   8.5439  1186.12   16.276  1186.12   16.276  1186.12   16.276  1244.69   8.5439  1244.69   8.5439 0.000000 0.000000 
1 1 1    3    0   17 o  167.280   8.3976   21.582   2.1378   21.582   2.1378   21.582   2.1378  167.280   8.3976  167.280   8.3976 0.000000 0.000000 
1 1 1    3    0   18 o  542.978   5.6492  225.736   4.6939  225.736   4.6939  225.736   4.6939  542.978   5.6492  542.978   5.6492 0.000000 0.000000 
1 1 1    3    0   19 o  573.203   5.8151  251.569   5.1007  251.569   5.1007  251.569   5.1007  573.203   5.8151  573.203   5.8151 0.000000 0.000000 
1 1 1    3    0   20 o  645.152   6.0887  318.682   6.0113  318.682   6.0113  318.682   6.0113  645.152   6.0887  645.152   6.0887 0.000000 0.000000 
1 1 1    3    0   21 o   33.493   20.911   0.4971   2.1908   0.4971   2.1908   0.4971   2.1908   33.493   20.911   33.493   20.911 0.000000 0.000000 
1 1 1    3    0   22 o  231.211   7.2693   41.044   2.5668   41.044   2.5668   41.044   2.5668  231.211   7.2693  231.211   7.2693 0.000000 0.000000 
1 1 1    3    0   23 f  165.305   9.7333   21.138   2.4432   21.138   2.4432   21.138   2.4432  165.305   9.7333  165.305   9.7333 0.000000 0.000000 
1 1 1    3    0   24 o  396.899   7.2120  120.703   4.3781  120.703   4.3781  120.703   4.3781  396.899   7.2120  396.899   7.2120 0.000000 0.000000 
1 1 1    3    0   25 o  303.478   7.0409   70.610   3.2666   70.610   3.2666   70.610   3.2666  303.478   7.0409  303.478   7.0409 0.000000 0.000000 
1 1 1    3    0   26 o  599.292   6.5039  274.996   5.9644  274.996   5.9644  274.996   5.9644  599.292   6.5039  599.292   6.5039 0.000000 0.000000 
1 1 1    3    0   27 o  782.315   8.1135  468.623   9.7130  468.623   9.7130  468.623   9.7130  782.315   8.1135  782.315   8.1135 0.000000 0.000000 
1 1 1    3    0   28 o  2379.72   15.136  4337.17   55.128  4337.17   55.128  4337.17   55.128  2379.72   15.136  2379.72   15.136 0.000000 0.000000 
1 1 1    3    0   29 o  446.439   8.0819  152.709   5.5185  152.709   5.5185  152.709   5.5185  446.439   8.0819  446.439   8.0819 0.000000 0.000000 
1 1 1    3    0   30 o  102.745   23.934   9.2879   3.2728   9.2879   3.2728   9.2879   3.2728  102.745   23.934  102.745   23.934 0.000000 0.000000 
1 1 1    3    0   31 o  1182.31   8.8771  1070.22   16.063  1070.22   16.063  1070.22   16.063  1182.31   8.8771  1182.31   8.8771 0.000000 0.000000 
1 1 1    3    0   32 o  911.861   7.9254  636.618   11.060  636.618   11.060  636.618   11.060  911.861   7.9254  911.861   7.9254 0.000000 0.000000 
1 1 1    3    0   33 o  217.620   13.451   36.679   4.4412   36.679   4.4412   36.679   4.4412  217.620   13.451  217.620   13.451 0.000000 0.000000 
1 1 1    3    0   34 o  473.609   9.8121  171.945   7.1061  171.945   7.1061  171.945   7.1061  473.609   9.8121  473.609   9.8121 0.000000 0.000000 
1 1 1    3    0   35 o  210.832   17.547   34.760   5.5722   34.760   5.5722   34.760   5.5722  210.832   17.547  210.832   17.547 0.000000 0.000000 
1 1 1    3    0   36 o  190.537   24.350   29.181   6.7843   29.181   6.7843   29.181   6.7843  190.537   24.350  190.537   24.350 0.000000 0.000000 
1 1 1    3    0   37 o  296.789   12.751   67.835   5.7681   67.835   5.7681   67.835   5.7681  296.789   12.751  296.789   12.751 0.000000 0.000000 
1 1 1    3    0   38 f   45.661   30.000  -0.9211   5.2898  -0.9211   5.2898  -0.9211   5.2898   45.661   30.000   45.661   30.000 0.000000 0.000000 
1 1 1    3    0   39 o  1168.09   10.924  1045.22   19.527  1045.22   19.527  1045.22   19.527  1168.09   10.924  1168.09   10.924 0.000000 0.000000 
1 1 1    3    0   40 o  358.703   11.810   98.884   6.4681   98.884   6.4681   98.884   6.4681  358.703   11.810  358.703   11.810 0.000000 0.000000 
1 1 1    3    0   41 o  310.089   15.063   74.240   7.1111   74.240   7.1111   74.240   7.1111  310.089   15.063  310.089   15.063 0.000000 0.000000 
1 1 1    3    0   42 o  626.074   8.8801  300.378   8.5059  300.378   8.5059  300.378   8.5059  626.074   8.8801  626.074   8.8801 0.000000 0.000000 
1 1 1    3    0   43 o  190.817   19.248   28.813   5.4905   28.813   5.4905   28.813   5.4905  190.817   19.248  190.817   19.248 0.000000 0.000000 
1 1 1    3    0   44 o  184.534   19.229   27.013   5.2963   27.013   5.2963   27.013   5.2963  184.534   19.229  184.534   19.229 0.000000 0.000000 
1 1 1    3    0   45 o  392.532   12.440  118.531   7.4571  118.531   7.4571  118.531   7.4571  392.532   12.440  392.532   12.440 0.000000 0.000000 
1 1 1    3    0   46 o  345.259   12.912   91.850   6.8020   91.850   6.8020   91.850   6.8020  345.259   12.912  345.259   12.912 0.000000 0.000000 
1 1 1    3    0   47 o  656.633   9.7516  330.755   9.7960  330.755   9.7960  330.755   9.7960  656.633   9.7516  656.633   9.7516 0.000000 0.000000 
1 1 1    3    0   48 o  354.509   12.314   96.820   6.6635   96.820   6.6635   96.820   6.6635  354.509   12.314  354.509   12.314 0.000000 0.000000 
1 1 1    3    0   49 o   42.098   28.038  -1.3946   4.8812  -1.3946   4.8812  -1.3946   4.8812   42.098   28.038   42.098   28.038 0.000000 0.000000 
1 1 1    3    0   50 o  203.211   17.700   32.558   5.4094   32.558   5.4094   32.558   5.4094  203.211   17.700  203.211   17.700 0.000000 0.000000 
1 1 1    3    0   51 o   36.817   26.030  -7.1731   5.9806  -7.1731   5.9806  -7.1731   5.9806   36.817   26.030   36.817   26.030 0.000000 0.000000 
1 1 1    3    0   52 o   37.170   25.793  -4.2222   5.1206  -4.2222   5.1206  -4.2222   5.1206   37.170   25.793   37.170   25.793 0.000000 0.000000 
1 1 1    3    0   53 o  464.589   12.096  166.339   8.5887  166.339   8.5887  166.339   8.5887  464.589   12.096  464.589   12.096 0.000000 0.000000 
1 1 1    3    0   54 o   85.580   39.168   8.5277   5.5954   8.5277   5.5954   8.5277   5.5954   85.580   39.168   85.580   39.168 0.000000 0.000000 
1 1 1    3    0   55 o  387.030   11.740  115.576   6.9405  115.576   6.9405  115.576   6.9405  387.030   11.740  387.030   11.740 0.000000 0.000000 
1 1 1    3    0   56 o   66.131   36.854   4.9528   5.5448   4.9528   5.5448   4.9528   5.5448   66.131   36.854   66.131   36.854 0.000000 0.000000 
1 1 1    3    0   57 o  338.258   14.500   88.894   7.4758   88.894   7.4758   88.894   7.4758  338.258   14.500  338.258   14.500 0.000000 0.000000 
1 1 1    3    0   58 o  162.793   25.238   22.248   5.8386   22.248   5.8386   22.248   5.8386  162.793   25.238  162.793   25.238 0.000000 0.000000 
1 1 1    3    0   59 o   70.686   39.409   5.8819   6.3432   5.8819   6.3432   5.8819   6.3432   70.686   39.409   70.686   39.409 0.000000 0.000000 
1 1 1    3    0   60 o   85.385   38.813   8.6951   5.4906   8.6951   5.4906   8.6951   5.4906   85.385   38.813   85.385   38.813 0.000000 0.000000 
1 1 1    3    0   61 o   71.829   39.163   6.3511   6.1096   6.3511   6.1096   6.3511   6.1096   71.829   39.163   71.829   39.163 0.000000 0.000000 
1 1 1    3    0   62 o   84.881   37.828   8.6290   5.2123   8.6290   5.2123   8.6290   5.2123   84.881   37.828   84.881   37.828 0.000000 0.000000 
1 1 1    3    0   63 o   81.426   37.761   8.1482   5.2079   8.1482   5.2079   8.1482   5.2079   81.426   37.761   81.426   37.761 0.000000 0.000000 
1 1 1    3    0   64 o   45.175   29.475   0.1962   4.9773   0.1962   4.9773   0.1962   4.9773   45.175   29.475   45.175   29.475 0.000000 0.000000 
1 1 1    3    0   65 o   71.382   35.743   6.5580   4.7768   6.5580   4.7768   6.5580   4.7768   71.382   35.743   71.382   35.743 0.000000 0.000000 
1 1 1    3    0   66 o   39.481   26.593  -1.2208   4.6192  -1.2208   4.6192  -1.2208   4.6192   39.481   26.593   39.481   26.593 0.000000 0.000000 
1 1 1    3    1    1 o  1036.08   14.109  822.291   22.374   0.0000   0.0000  822.291   22.374  ?   ?   1036.08   14.109 0.000000 14.10852 
1 1 1    3    1    2 f  490.214   6.2886  183.946   4.7186  176.373   6.5191  192.279   6.8385  479.974   8.8736  501.149   8.9151 -21.17444 12.57850 
1 1 1    3    1    3 o  827.661   5.3814  524.327   6.8173  533.617   10.967  518.477   8.7030  834.875   8.5824  822.996   6.9088 11.87976 11.01765 
1 1 1    3    1    4 o  291.058   3.2427   64.837   1.4446   64.423   2.0432   65.251   2.0429  290.120   4.6011  291.979   4.5711 -1.859222 6.485753 
1 1 1    3    1    5 o  1397.26   6.4393  1494.43   13.772  1509.46   19.712  1480.10   19.248  1404.13   9.1719  1390.42   9.0443 13.71240 12.88112 
1 1 1    3    1    6 o  815.870   4.2791  509.470   5.3437  514.282   7.6294  504.836   7.4869  819.679   6.0810  812.118   6.0230 7.561218 8.558920 
1 1 1    3    1    7 f  435.603   3.4272  145.226   2.2851  145.107   3.0347  145.383   3.4726  435.415   4.5535  435.823   5.2056 -0.4076538 6.916141 
1 1 1    3    1    8 o  868.153   4.8224  576.870   6.4081  565.086   8.3246  594.009   10.039  859.207   6.3299  880.889   7.4457 -21.68243 9.772757 
1 1 1    3    1    9 o  665.002   4.1437  338.470   4.2178  341.230   6.4738  336.434   5.5597  667.673   6.3347  662.979   5.4788 4.693542 8.375256 
1 1 1    3    1   10 o  564.893   3.8971  244.232   3.3696  249.237   4.5168  237.952   5.0601  570.636   5.1713  557.557   5.9292 13.07910 7.867541 
1 1 1    3    1   11 o  812.110   5.0989  504.803   6.3381  511.272   9.0786  498.651   8.8526  817.247   7.2576  807.100   7.1660 10.14752 10.19924 
1 1 1    3    1   12 o  530.634   3.6580  215.505   2.9711  216.048   4.2098  214.966   4.1937  531.285   5.1768  529.953   5.1700 1.332520 7.316290 
1 1 1    3    1   13 o  622.337   3.9240  296.432   3.7379  305.171   5.4047  288.420   5.1751  631.419   5.5922  613.846   5.5080 17.57257 7.849263 
1 1 1    3    1   14 o  617.390   4.5451  291.747   4.2951  287.833   6.0388  295.754   6.1101  613.200   6.4340  621.580   6.4222 -8.380554 9.090655 
1 1 1    3    1   15 o  560.831   3.8753  240.737   3.3266  237.942   4.6615  243.638   4.7488  557.542   5.4623  564.175   5.4993 -6.633667 7.751044 
1 1 1    3    1   16 o  735.367   4.6269  413.912   5.2080  417.442   8.0051  411.322   6.8577  738.427   7.0826  733.024   6.1121 5.402710 9.355206 
1 1 1    3    1   17 f  820.200   5.3377  514.955   6.7011  518.626   9.5173  511.346   9.4368  823.033   7.5549  817.237   7.5441 5.796204 10.67660 
1 1 1    3    1   18 o  174.553   5.1781   23.323   1.3835   25.281   1.9718   21.426   1.9415  181.712   7.0895  167.280   7.5828 14.43137 10.38070 
1 1 1    3    1   19 o  152.080   5.9534   17.706   1.3858   18.217   1.9474   17.182   1.9726  154.011   8.2915  149.536   8.6552 4.475357 11.98592 
1 1 1    3    1   20 o  256.749   4.6113   50.460   1.8122   49.359   2.5315   51.617   2.5953  253.908   6.5137  259.649   6.5304 -5.741638 9.223551 
1 1 1    3    1   21 o  545.747   4.8372  227.993   4.0407  223.828   5.6558  232.335   5.7749  540.679   6.8341  550.856   6.8491 -10.17743 9.675525 
1 1 1    3    1   22 o  767.828   4.6743  451.291   5.4935  445.977   7.6977  456.807   7.8423  763.216   6.5894  772.425   6.6331 -9.209290 9.349748 
1 1 1    3    1   23 o  813.244   5.1682  506.270   6.4333  503.832   8.4923  509.552   9.8550  811.214   6.8394  815.750   7.8928 -4.536865 10.44387 
1 1 1    3    1   24 o  1146.30   6.8121  1005.99   11.952  997.951   16.767  1014.29   17.042  1141.51   9.5965  1150.81   9.6750 -9.299316 13.62714 
1 1 1    3    1   25 o  505.708   4.4699  195.749   3.4599  194.600   4.8703  196.920   4.9162  504.188   6.3109  507.183   6.3327 -2.995148 8.940404 
1 1 1    3    1   26 o  872.400   5.1429  582.562   6.8674  589.894   9.7909  575.460   9.6351  877.802   7.2871  866.997   7.2605 10.80487 10.28675 
1 1 1    3    1   27 f  657.991   5.4961  331.401   5.5353  331.190   7.8310  331.611   7.8253  657.726   7.7786  658.145   7.7680 -0.4190674 10.99311 
1 1 1    3    1   28 o  338.641   5.2737   87.777   2.7335   87.269   3.8266   88.307   3.9062  337.634   7.4045  339.636   7.5139 -2.001587 10.54922 
1 1 1    3    1   29 o  441.902   5.8144  149.475   3.9328  150.678   5.4919  148.209   5.6345  443.640   8.0877  439.985   8.3666 3.655060 11.63661 
1 1 1    3    1   30 o  423.430   5.2949  137.236   3.4317  138.791   4.7936  135.602   4.9149  425.792   7.3553  420.866   7.6295 4.926056 10.59762 
1 1 1    3    1   31 o  150.205   11.218   17.375   2.5606   17.436   3.6817   17.319   3.5636  149.943   16.305  149.492   15.814 0.4509277 22.71413 
1 1 1    3    1   32 o  494.272   5.4298  187.004   4.1079  186.277   5.7746  187.749   5.8448  493.267   7.6485  495.210   7.7111 -1.943634 10.86090 
1 1 1    3    1   33 o  1125.47   6.6293  969.703   11.420  978.693   15.235  958.172   17.254  1130.55   8.8038  1118.55   10.078 12.00525 13.38184 
1 1 1    3    1   34 o  981.272   7.4504  737.213   11.190  721.490   14.136  763.603   18.314  970.628   9.5149  998.362   11.984 -27.73395 15.30230 
1 1 1    3    1   35 o  491.472   6.0894  184.911   4.5808  185.496   6.4899  184.330   6.4666  492.177   8.6149  490.628   8.6111 1.549103 12.18058 
1 1 1    3    1   36 f  623.969   7.1632  298.096   6.8413  303.086   10.821  294.772   8.8301  628.968   11.240  620.388   9.2989 8.580872 14.58767 
1 1 1    3    1   37 o  589.946   6.4709  266.462   5.8431  271.576   8.9384  262.645   7.7214  595.430   9.8075  585.618   8.6142 9.812134 13.05341 
1 1 1    3    1   38 o  618.214   6.1326  292.609   5.8030  286.245   8.2876  298.730   8.1281  611.325   8.8570  624.535   8.5029 -13.20990 12.27780 
1 1 1    3    1   39 f  264.424   12.035   53.602   4.8710   57.985   7.1058   49.716   6.6901  274.269   17.010  253.845   17.322 20.42361 24.27764 
1 1 1    3    1   40 o  274.658   9.8780   57.810   4.1527   53.802   5.8080   62.001   5.9399  264.381   14.407  284.269   13.651 -19.88800 19.84732 
1 1 1    3    1   41 o  302.853   10.670   70.322   4.9460   74.265   6.8554   66.041   7.1428  310.998   14.401  292.728   16.002 18.26987 21.52850 
1 1 1    3    1   42 o  224.828   11.818   38.892   4.0526   33.608   5.6680   44.418   5.7966  208.174   17.964  239.832   15.880 -31.65773 23.97703 
1 1 1    3    1   43 o  765.566   6.1707  448.911   7.2309  452.310   10.254  445.548   10.199  768.146   8.7209  762.380   8.7398 5.766357 12.34656 
1 1 1    3    1   44 o  547.166   6.8929  229.396   5.7729  224.964   8.6740  232.921   7.7347  541.439   10.466  551.105   9.1693 -9.666016 13.91483 
1 1 1    3    1   45 o  283.494   11.024   61.718   4.7834   55.142   7.2743   66.728   6.3492  266.634   17.928  294.457   14.087 -27.82318 22.80069 
1 1 1    3    1   46 o  224.287   11.121   38.650   3.8180   32.910   5.2662   45.010   5.5434  205.771   16.869  241.182   15.092 -35.41083 22.63460 
1 1 1    3    1   47 o  208.573   12.125   33.579   3.8543   26.102   5.1352   43.225   5.8326  182.640   18.630  236.004   16.245 -53.36369 24.71832 
1 1 1    3    1   48 o  247.685   11.232   47.188   4.2583   54.743   6.1376   40.175   5.9130  265.813   15.148  227.164   17.132 38.64934 22.86843 
1 1 1    3    1   49 o   81.121   25.985   5.0985   3.6510   4.1053   5.1959   6.0673   5.1314   81.615   30.666   90.244   30.880 -8.629440 43.51979 
1 1 1    3    1   50 o  153.271   17.324   18.472   3.9928   19.912   5.1881   16.380   6.2533  157.962   22.060  140.716   29.952 17.24603 37.19923 
1 1 1    3    1   51 o  185.543   14.478   26.815   4.0791   23.011   6.4585   29.339   5.2613  168.521   25.865  193.245   17.994 -24.72409 31.50860 
1 1 1    3    1   52 o  462.132   7.1984  163.978   5.0918  162.225   7.2105  165.723   7.1913  458.884   10.266  463.845   10.129 -4.961273 14.42157 
1 1 1    3    1   53 o  195.776   15.948   30.025   4.7376   22.253   6.5399   38.607   6.8723  164.723   26.865  220.580   20.593 -55.85722 33.84963 
1 1 1    3    1   54 o  338.214   8.8397   88.046   4.5762   84.203   6.5918   91.621   6.3579  329.638   13.065  344.164   12.069 -14.52676 17.78617 
1 1 1    3    1   55 o   83.426   26.637   5.5785   3.8390   6.5458   5.5577   4.6957   5.3092   92.079   32.104   83.250   31.054 8.828568 44.66557 
1 1 1    3    1   56 o  311.150   9.5719   74.673   4.5587   81.423   6.4302   67.853   6.4638  323.857   12.972  295.190   14.306 28.66776 19.31132 
1 1 1    3    1   57 o   94.161   27.889   7.4342   4.3046   6.3545   6.1317   8.4833   6.0444   92.006   33.537  100.991   33.509 -8.985481 47.40897 
1 1 1    3    1   58 o   94.030   26.552   7.4609   3.9893   11.236   5.7993   4.0699   5.4963  113.604   31.991   80.560   31.224 33.04372 44.70301 
1 1 1    3    1   59 o  110.747   26.715   10.480   4.4763   10.934   6.3901   10.043   6.2724  111.378   34.198  107.302   34.026 4.075142 48.24215 
1 1 1    3    1   60 o  215.292   12.802   36.296   4.1998   39.526   5.9697   33.130   5.9095  222.470   17.677  202.765   19.273 19.70518 26.15181 
1 1 1    3    1   61 o  130.591   23.845   14.398   4.5906   12.728   6.5188   16.040   6.4658  117.883   34.154  133.475   32.052 -15.59221 46.83810 
1 1 1    3    1   62 o  119.576   21.198   11.963   3.7377   11.083   5.3085   12.829   5.2635  110.797   30.389  119.952   28.990 -9.156067 41.99910 
1 1 1    3    1   63 o  121.791   22.093   12.569   3.9669   7.4744   6.0581   16.394   5.2486   92.718   33.405  137.189   25.946 -44.47049 42.29703 
1 1 1    3    1   64 o   74.451   26.847   4.4882   3.9141   7.2704   5.1612   0.7222   6.0050   89.850   30.959   68.359   29.970 21.49101 43.08960 
1 1 1    3    1   65 o  143.623   16.186   16.875   3.4961   14.014   4.9244   19.782   4.9644  124.156   26.706  151.753   22.016 -27.59666 34.61033 
1 1 1    3    1   66 o   92.277   23.686   7.6746   3.3625   3.9218   4.7962   11.302   4.7153   72.718   28.871  109.419   28.030 -36.70125 40.23891 
1 1 1    3    2    1 o  511.105   9.0136  199.996   7.0515  199.996   7.0515   0.0000   0.0000  511.105   9.0136  ?   ?  0.000000 9.013648 
1 1 1    3    2    2 o  1740.71   12.761  2320.68   34.000  2403.86   43.439  2189.14   54.627  1771.25   16.022  1689.56   21.123 81.68970 26.51248 
1 1 1    3    2    3 o  1304.19   8.5652  1302.17   17.098  1313.08   24.424  1291.68   23.943  1309.42   12.186  1298.71   12.045 10.70544 17.13436 
1 1 1    3    2    4 f  1018.81   7.0390  794.560   10.977  810.585   15.862  779.832   15.206  1028.91   10.072  1009.22   9.8439 19.69672 14.08336 
1 1 1    3    2    5 o  1018.04   5.7582  793.294   8.9726  748.890   14.585  820.332   11.381  989.001   9.6348  1035.20   7.1827 -46.19781 12.01752 
1 1 1    3    2    6 o  684.123   4.1210  358.214   4.3152  353.389   6.5417  361.930   5.7416  679.465   6.2900  687.643   5.4550 -8.177673 8.325967 
1 1 1    3    2    7 o  311.405   4.3067   74.221   2.0528   80.638   3.0599   68.970   2.7681  324.573   6.1592  300.174   6.0247 24.39969 8.615838 
1 1 1    3    2    8 o  475.519   3.8434  173.063   2.7974  175.870   3.9775  170.316   3.9350  479.343   5.4212  471.714   5.4499 7.629700 7.687081 
1 1 1    3    2    9 o  561.248   3.8372  241.090   3.2964  242.124   5.0296  240.311   4.3645  562.425   5.8425  560.326   5.0889 2.099365 7.747978 
1 1 1    3    2   10 f  1298.57   6.5690  1290.80   13.057  1285.44   17.196  1298.10   20.063  1295.78   8.6703  1302.07   10.067 -6.289917 13.28605 
1 1 1    3    2   11 o  203.714   3.9319   31.762   1.2260   32.043   1.9032   31.563   1.6029  204.602   6.0771  203.069   5.1571 1.532715 7.970353 
1 1 1    3    2   12 o  762.111   4.2861  444.544   4.9998  444.954   7.0845  444.136   7.0571  762.429   6.0707  761.728   6.0528 0.7008667 8.572651 
1 1 1    3    2   13 o  725.378   4.2120  402.725   4.6765  400.068   6.5823  405.433   6.6452  722.949   5.9484  727.780   5.9654 -4.830627 8.424337 
1 1 1    3    2   14 o  129.233   6.1089   12.784   1.2084   13.563   1.7655   12.098   1.6575  132.810   8.7337  125.403   8.6887 7.407188 12.31952 
1 1 1    3    2   15 o  526.792   3.8085  212.401   3.0709  212.455   4.3570  212.347   4.3289  526.836   5.4031  526.703   5.3696 0.1328735 7.617431 
1 1 1    3    2   16 o  220.660   4.4797   37.269   1.5130   37.106   2.2862   37.396   2.0182  220.159   6.7842  221.024   5.9657 -0.8645172 9.034083 
1 1 1    3    2   17 o  612.763   4.3703  287.400   4.0990  289.444   5.4262  284.684   6.2555  614.906   5.7653  609.803   6.7019 5.103760 8.840502 
1 1 1    3    2   18 o  190.341   4.9209   27.733   1.4337   27.115   2.0359   28.341   2.0193  188.187   7.0679  192.398   6.8568 -4.210800 9.847393 
1 1 1    3    2   19 o  903.697   4.9475  625.149   6.8435  627.672   9.7193  622.668   9.6375  905.417   7.0132  901.802   6.9821 3.615173 9.896153 
1 1 1    3    2   20 o  916.823   5.0210  643.455   7.0461  652.892   10.128  634.602   9.8092  923.405   7.1657  910.387   7.0394 13.01776 10.04490 
1 1 1    3    2   21 o  947.087   5.9318  686.700   8.5989  687.346   12.155  686.054   12.167  947.372   8.3822  946.480   8.3983 0.8920288 11.86557 
1 1 1    3    2   22 o  276.772   4.7534   58.637   2.0137   58.786   2.8912   58.497   2.8063  277.092   6.8168  276.413   6.6329 0.6791687 9.511312 
1 1 1    3    2   23 o  415.046   4.6023  131.860   2.9238  132.094   3.8994  131.559   4.4188  415.386   6.1330  414.525   6.9645 0.8612061 9.279948 
1 1 1    3    2   24 o  582.138   4.7719  259.398   4.2520  255.239   6.4474  262.600   5.6564  577.385   7.2954  585.681   6.3097 -8.296570 9.645443 
1 1 1    3    2   25 o  849.229   5.0296  552.031   6.5377  548.051   9.1955  556.099   9.2969  846.090   7.1005  852.278   7.1267 -6.188293 10.06012 
1 1 1    3    2   26 o  343.434   4.9150   90.280   2.5837   89.180   3.6436   91.391   3.6642  341.312   6.9745  345.517   6.9284 -4.205627 9.830892 
1 1 1    3    2   27 o  494.429   5.3610  187.119   4.0572  187.456   5.7581  186.786   5.7175  494.835   7.6024  493.951   7.5622 0.8840027 10.72305 
1 1 1    3    2   28 o  225.473   6.5881   38.916   2.2737   38.640   3.2358   39.186   3.1955  224.644   9.4105  226.228   9.2282 -1.583542 13.18021 
1 1 1    3    2   29 o  252.925   7.4741   48.972   2.8935   45.638   3.9888   52.675   4.2037  244.127   10.675  262.275   10.471 -18.14799 14.95319 
1 1 1    3    2   30 o  531.488   5.0645  216.216   4.1201  215.330   5.7370  217.160   5.9207  530.363   7.0670  532.608   7.2626 -2.244324 10.13356 
1 1 1    3    2   31 o  384.531   5.7893  113.185   3.4075  114.898   4.8034  111.449   4.8345  387.395   8.1007  381.533   8.2785 5.862366 11.58251 
1 1 1    3    2   32 o  599.834   5.6703  275.415   5.2060  274.877   6.8936  276.130   7.9421  599.202   7.5163  600.532   8.6403 -1.330688 11.45208 
1 1 1    3    2   33 o  549.609   6.4795  231.244   5.4509  244.233   7.7621  218.607   7.6564  564.760   8.9794  534.298   9.3620 30.46216 12.97214 
1 1 1    3    2   34 o  1243.88   7.6640  1184.62   14.592  1201.59   20.884  1168.43   20.396  1252.48   10.894  1235.09   10.789 17.39282 15.33209 
1 1 1    3    2   35 o  361.248   7.5919   99.919   4.1978   99.356   5.7070  100.583   6.1964  360.158   10.353  362.350   11.172 -2.192383 15.23135 
1 1 1    3    2   36 o  717.598   6.6136  394.244   7.2642  392.507   10.397  395.901   10.154  715.872   9.4887  718.976   9.2265 -3.104065 13.23494 
1 1 1    3    2   37 o  374.217   7.5849  107.231   4.3445  106.573   6.2280  107.856   6.0635  372.958   10.910  375.210   10.558 -2.251556 15.18206 
1 1 1    3    2   38 o  940.903   6.5310  677.833   9.4058  684.614   14.453  672.851   12.388  945.315   9.9889  937.282   8.6349 8.032654 13.20378 
1 1 1    3    2   39 o  340.999   10.687   89.111   5.5778   86.253   8.8597   90.988   7.1791  334.671   17.355  344.425   13.618 -9.753906 22.05989 
1 1 1    3    2   40 o  1205.19   7.2242  1112.40   13.327  1099.74   20.168  1122.21   17.755  1197.75   11.001  1210.16   9.5852 -12.41602 14.59097 
1 1 1    3    2   41 o  439.491   8.2617  147.984   5.5576  140.321   7.6420  156.587   8.0970  427.726   11.673  451.836   11.708 -24.10950 16.53259 
1 1 1    3    2   42 o  348.794   9.4288   93.261   5.0338   93.367   7.0248   93.149   7.2168  348.718   13.161  348.276   13.538 0.4412842 18.88085 
1 1 1    3    2   43 o   76.941   26.801   4.1256   3.8729   6.3634   5.8448   2.3740   5.1710   94.765   32.929   75.320   29.954 19.44544 44.51485 
1 1 1    3    2   44 o   66.456   25.260   2.4394   3.5496   5.3224   5.0646  -0.3442   4.9764   87.312   30.635   64.539   27.796 22.77260 41.36555 
1 1 1    3    2   45 o  169.010   16.168   22.220   4.1315   15.086   5.6466   30.438   6.0610  136.527   27.962  197.259   20.367 -60.73195 34.59307 
1 1 1    3    2   46 o  390.187   7.3794  116.718   4.4072  115.687   6.2857  117.716   6.1811  388.103   10.581  391.528   10.314 -3.424286 14.77650 
1 1 1    3    2   47 o  430.082   7.3781  141.837   4.8570  138.723   6.6122  145.486   7.1578  424.963   10.165  435.103   10.748 -10.14029 14.79355 
1 1 1    3    2   48 o   88.730   25.366   6.3363   3.6178   3.0112   5.3941   9.0549   4.8774   78.254   30.760  105.348   29.223 -27.09398 42.42823 
1 1 1    3    2   49 o  129.932   19.100   13.398   3.6852   9.7588   5.0292   17.617   5.4155  108.952   29.453  147.838   24.811 -38.88610 38.51101 
1 1 1    3    2   50 o  126.163   22.156   12.824   4.1225   15.098   5.2502   9.1664   6.6572  136.023   26.167  107.316   35.146 28.70624 43.81744 
1 1 1    3    2   51 o  134.719   19.956   14.488   3.9905   22.693   6.6510   9.8737   4.9880  166.933   26.948  109.053   29.270 57.87938 39.78621 
1 1 1    3    2   52 o  150.060   18.220   17.835   4.0991   13.790   6.3392   20.742   5.3737  127.677   32.388  160.685   22.463 -33.00757 39.41520 
1 1 1    3    2   53 o   67.311   26.491   2.2799   4.0056   1.2971   5.2123   3.6977   6.2603   70.165   29.241   83.519   33.039 -13.35392 44.12027 
1 1 1    3    2   54 o  150.373   16.943   17.879   3.8318   16.406   5.4513   19.319   5.3873  140.911   26.240  154.204   23.573 -13.29262 35.27380 
1 1 1    3    2   55 o  255.120   10.852   50.277   4.2375   52.309   5.9540   48.191   6.0321  258.689   15.103  247.953   15.979 10.73601 21.98684 
1 1 1    3    2   56 o   48.685   22.513  -2.9045   3.9504  -2.0722   5.7358  -3.6554   5.4487   62.921   28.328   57.443   26.519 5.478085 38.80401 
1 1 1    3    2   57 o   94.292   27.100   7.4678   4.1191   3.2811   5.5439   12.627   6.1544   78.004   31.017  120.477   32.587 -42.47308 44.98900 
1 1 1    3    2   58 o  295.076   10.257   67.339   4.6324   66.278   6.5361   68.410   6.5664  290.785   14.733  295.873   14.499 -5.088440 20.67126 
1 1 1    3    2   59 f  373.821   9.2665  107.954   5.3021  111.351   7.8562  105.113   7.1852  377.634   13.592  367.326   12.780 10.30771 18.65615 
1 1 1    3    2   60 o   79.098   27.317   4.9473   4.0192   6.0592   5.5245   3.6971   5.8582   87.972   31.869   79.658   31.818 8.313759 45.03306 
1 1 1    3    2   61 o  204.508   15.438   33.217   4.7970   32.099   6.7273   34.374   6.8421  196.943   22.735  204.179   22.253 -7.236710 31.81313 
1 1 1    3    2   62 o  215.611   12.836   36.589   4.2171   32.815   5.6147   41.473   6.3875  201.219   18.435  226.259   18.609 -25.03979 26.19428 
1 1 1    3    2   63 o  149.727   19.620   18.513   4.3882   21.409   7.8154   17.180   5.3031  150.528   34.640  140.725   25.561 9.803253 43.04990 
1 1 1    3    2   64 o  136.875   20.003   15.701   4.0671   20.947   5.3403   8.4554   6.2759  156.396   22.995   95.519   34.043 60.87745 41.08190 
1 1 1    3    2   65 o   55.496   23.462   0.9677   3.4310  -5.7299   4.8369   7.7502   4.8676   47.149   22.697   91.051   30.064 -43.90140 37.66987 
1 1 1    3    2   66 o  164.710   13.950   21.891   3.4839   18.347   4.9886   25.266   4.8676  144.267   23.392  173.692   18.598 -29.42468 29.88472 
1 1 1    3    3    0 o  192.068   7.2745   28.357   2.1316   28.357   2.1316   28.357   2.1316  192.068   7.2745  192.068   7.2745 0.000000 0.000000 
1 1 1    3    3    1 o  260.245   5.3673   51.839   2.1380   56.215   3.0825   47.783   2.9679  270.990   7.4316  249.836   7.7612 21.15366 10.74546 
1 1 1    3    3    2 o  434.143   6.0980  144.271   4.0522  147.103   5.7888  141.550   5.6743  438.346   8.6278  429.993   8.6215 8.352783 12.19709 
1 1 1    3    3    3 o  1262.49   8.3628  1220.21   16.160  1205.42   22.521  1235.92   23.203  1254.62   11.727  1270.38   11.933 -15.76050 16.73085 
1 1 1    3    3    4 o  1009.89   7.0160  780.699   10.845  788.036   15.491  773.648   15.188  1014.51   9.9763  1005.21   9.8712 9.299194 14.03445 
1 1 1    3    3    5 o  548.037   4.3404  229.877   3.6409  233.759   4.7362  224.270   5.6927  552.628   5.5992  541.276   6.8712 11.35266 8.863680 
1 1 1    3    3    6 o  892.269   5.2565  609.378   7.1789  610.975   10.183  607.800   10.122  893.381   7.4468  891.057   7.4218 2.323914 10.51365 
1 1 1    3    3    7 o  684.788   4.4831  358.915   4.6990  360.301   6.6715  357.551   6.6195  686.076   6.3530  683.454   6.3277 2.622253 8.966625 
1 1 1    3    3    8 o  1493.22   7.3444  1706.86   16.786  1749.10   26.383  1678.13   21.758  1511.32   11.405  1480.48   9.6017 30.84766 14.90873 
1 1 1    3    3    9 o  464.786   3.6217  165.338   2.5765  164.292   3.4030  166.743   3.9441  463.304   4.7987  466.738   5.5208 -3.434052 7.314802 
1 1 1    3    3   10 o  963.677   4.9058  710.806   7.2363  716.813   10.323  705.003   10.146  967.686   6.9696  959.684   6.9073 8.002625 9.812603 
1 1 1    3    3   11 o  567.178   3.9966  246.213   3.4696  245.137   5.3169  247.011   4.5790  565.909   6.1382  568.080   5.2661 -2.171448 8.087603 
1 1 1    3    3   12 o  1957.61   8.7907  2934.00   26.340  2938.55   37.323  2929.48   37.179  1958.76   12.449  1955.73   12.420 3.023682 17.58479 
1 1 1    3    3   13 o  504.189   3.6771  194.561   2.8377  193.831   4.0083  195.296   4.0179  503.223   5.2039  505.122   5.1968 -1.899017 7.354372 
1 1 1    3    3   14 o  878.412   5.4467  590.621   7.3232  589.313   10.355  591.929   10.358  877.365   7.7110  879.310   7.6958 -1.945313 10.89430 
1 1 1    3    3   15 f  333.893   3.9305   85.329   2.0088   85.576   3.0464   85.139   2.6719  334.355   5.9526  333.509   5.2341 0.8467712 7.926539 
1 1 1    3    3   16 o  394.190   3.9911  118.932   2.4081  118.626   3.6435  119.169   3.2087  393.655   6.0470  394.566   5.3131 -0.9112854 8.049516 
1 1 1    3    3   17 o  580.561   4.6930  257.994   4.1703  261.979   5.9557  254.160   5.8414  584.978   6.6516  576.183   6.6235 8.795105 9.386954 
1 1 1    3    3   18 o  387.780   3.9430  115.099   2.3404  111.326   3.2824  119.000   3.3379  381.346   5.6234  394.271   5.5310 -12.92490 7.887632 
1 1 1    3    3   19 o  646.583   4.2629  320.008   4.2189  324.428   6.0542  315.836   5.8823  650.975   6.0761  642.301   5.9832 8.673828 8.527481 
1 1 1    3    3   20 o  713.614   4.4624  389.809   4.8742  391.077   6.9347  388.570   6.8524  714.703   6.3391  712.411   6.2841 2.291626 8.926062 
1 1 1    3    3   21 o  361.587   4.8832  100.084   2.7026  106.466   3.8790   94.063   3.7677  372.897   6.7960  350.498   7.0230 22.39923 9.772824 
1 1 1    3    3   22 o  1151.64   5.8668  1015.33   10.341  1033.06   14.877  998.750   14.385  1161.46   8.3685  1142.02   8.2296 19.43604 11.73700 
1 1 1    3    3   23 o  799.362   5.1316  489.128   6.2786  491.696   8.3520  485.790   9.5210  801.390   6.8089  796.514   7.8094 4.875916 10.36089 
1 1 1    3    3   24 o  625.412   4.8453  299.397   4.6383  301.005   7.1508  298.230   6.0943  627.014   7.4509  624.151   6.3791 2.862549 9.808604 
1 1 1    3    3   25 o  583.745   4.5095  260.822   4.0293  260.240   5.7211  261.395   5.6756  583.053   6.4107  584.347   6.3456 -1.293274 9.020145 
1 1 1    3    3   26 o  842.551   5.0645  543.373   6.5313  544.782   9.2810  541.992   9.1929  843.578   7.1878  841.416   7.1379 2.161682 10.12992 
1 1 1    3    3   27 o  467.358   5.4487  167.189   3.8977  162.249   5.6123  171.792   5.4172  460.359   7.9648  473.713   7.4713 -13.35425 10.92054 
1 1 1    3    3   28 o  723.325   5.2683  400.470   5.8327  399.782   8.8592  400.997   7.7493  722.634   8.0095  723.760   6.9951 -1.126160 10.63409 
1 1 1    3    3   29 o  296.603   6.8097   67.344   3.0915   66.369   4.2648   68.422   4.4878  294.416   9.4639  298.930   9.8084 -4.513885 13.62971 
1 1 1    3    3   30 o  772.967   5.5737  457.336   6.5944  453.466   8.6422  462.729   10.203  769.642   7.3361  777.422   8.5740 -7.779663 11.28420 
1 1 1    3    3   31 o  584.389   5.5737  261.410   4.9856  266.438   6.6069  254.761   7.5978  589.943   7.3167  576.837   8.6052 13.10681 11.29534 
1 1 1    3    3   32 o  631.116   5.2511  304.883   5.0726  315.808   7.3267  294.826   7.0299  642.267   7.4529  620.567   7.4010 21.70068 10.50337 
1 1 1    3    3   33 o  484.352   6.5243  179.592   4.8369  185.168   6.7780  173.807   6.9045  491.749   9.0051  476.411   9.4685 15.33798 13.06695 
1 1 1    3    3   34 o  347.252   7.5328   92.323   4.0038   89.555   5.3088   95.975   6.0971  341.949   10.143  353.961   11.254 -12.01221 15.15011 
1 1 1    3    3   35 o  1252.94   7.1328  1201.93   13.679  1211.89   18.335  1189.42   20.543  1257.93   9.5228  1246.08   10.771 11.84399 14.37686 
1 1 1    3    3   36 o  943.076   6.4204  680.909   9.2678  692.642   14.389  672.591   12.115  950.933   9.8860  937.175   8.4459 13.75793 13.00253 
1 1 1    3    3   37 o  1195.56   6.6350  1094.38   12.142  1113.53   17.454  1076.41   16.901  1205.72   9.4577  1185.47   9.3145 20.25037 13.27431 
1 1 1    3    3   38 o  731.953   5.9421  410.174   6.6573  411.576   9.4146  408.772   9.4150  733.067   8.3905  730.563   8.4196 2.503723 11.88657 
1 1 1    3    3   39 o  169.202   19.145   22.285   4.8710   21.153   7.9622   22.962   6.1578  162.312   33.169  170.955   24.209 -8.643204 41.06440 
1 1 1    3    3   40 o  688.085   6.4616  362.558   6.8054  354.089   10.282  369.161   9.0787  679.736   9.8823  694.171   8.5445 -14.43549 13.06403 
1 1 1    3    3   41 o  939.744   7.9021  676.555   11.366  664.253   17.523  685.491   14.935  930.484   12.303  945.589   10.319 -15.10492 16.05761 
1 1 1    3    3   42 o  657.022   7.2796  330.703   7.3208  325.453   10.280  336.106   10.428  651.456   10.309  662.035   10.291 -10.57898 14.56664 
1 1 1    3    3   43 o  476.129   6.8113  173.673   4.9639  173.105   6.9862  174.252   7.0544  475.111   9.6068  476.675   9.6687 -1.564301 13.62990 
1 1 1    3    3   44 o  198.733   12.271   30.455   3.7143   31.105   5.2030   29.780   5.3042  200.143   17.150  195.672   17.909 4.471268 24.79595 
1 1 1    3    3   45 o  375.647   8.5674  108.222   4.9260  107.110   6.8953  109.381   7.0398  373.325   12.067  377.247   12.192 -3.921692 17.15373 
1 1 1    3    3   46 o  489.985   6.6345  184.001   4.9757  185.574   7.0490  182.439   7.0246  491.729   9.3655  487.550   9.4132 4.178284 13.27853 
1 1 1    3    3   47 o  304.865   8.7878   71.329   4.1007   63.555   5.4247   81.696   6.2639  287.382   12.332  325.793   12.561 -38.41095 17.60321 
1 1 1    3    3   48 o  172.282   14.422   23.064   3.7680   26.230   5.6531   20.532   5.0545  182.464   20.602  161.072   21.001 21.39211 29.41936 
1 1 1    3    3   49 o  369.725   7.7550  104.903   4.3886   96.538   6.1631  113.507   6.2507  354.122   11.370  384.126   10.631 -30.00424 15.56634 
1 1 1    3    3   50 o  262.367   12.476   53.101   5.0102   51.811   6.8883   54.551   7.3007  257.590   17.576  264.164   18.167 -6.573853 25.27714 
1 1 1    3    3   51 o  165.552   15.295   21.430   3.8318   15.521   5.2256   28.303   5.6357  137.813   25.719  189.245   19.747 -51.43193 32.42520 
1 1 1    3    3   52 o  279.267   10.274   60.088   4.3917   59.802   6.6481   60.309   5.8497  276.933   15.749  279.059   13.695 -2.125793 20.87074 
1 1 1    3    3   53 o  199.451   14.006   30.997   4.2487   35.409   5.4718   24.299   6.7421  212.383   16.974  172.446   26.382 39.93756 31.37086 
1 1 1    3    3   54 o  111.037   22.870   10.127   3.7575   12.175   5.3438   8.1253   5.2844  120.105   29.324   99.337   31.199 20.76830 42.81624 
1 1 1    3    3   55 o  117.630   22.472   11.343   3.8986   7.1549   5.4984   15.576   5.5285   94.711   31.967  136.527   27.408 -41.81633 42.10789 
1 1 1    3    3   56 o  300.377   10.061   69.654   4.6255   75.385   6.9347   65.062   6.2082  311.016   14.567  289.126   14.028 21.88989 20.22376 
1 1 1    3    3   57 o   75.298   27.102   4.0952   3.9869   14.065   5.2823  -9.1026   6.0776  128.933   27.599   51.517   24.957 77.41606 37.20968 
1 1 1    3    3   58 o  162.892   17.236   21.124   4.2320   18.781   5.6056   24.230   6.4536  150.227   25.276  170.956   25.438 -20.72903 35.86034 
1 1 1    3    3   59 o  136.305   21.419   15.239   4.3213   17.554   6.3867   13.285   5.8686  142.254   30.262  123.062   31.132 19.19141 43.41688 
1 1 1    3    3   60 o  229.612   12.211   41.195   4.2763   41.212   5.9380   41.177   6.1633  227.398   17.187  226.928   17.889 0.4707031 24.80783 
1 1 1    3    3   61 o  201.286   16.515   32.362   5.0434   25.595   6.7443   40.946   7.5965  173.458   26.220  222.702   22.598 -49.24422 34.61494 
1 1 1    3    3   62 o   61.517   24.978   1.7843   3.6754   8.6356   5.2371  -4.8648   5.1592   98.298   31.083   51.811   24.520 46.48715 39.59016 
1 1 1    3    3   63 f  182.771   15.060   26.709   4.1755   18.780   6.2984   32.926   5.5773  144.538   29.469  201.065   18.324 -56.52664 34.70100 
1 1 1    3    3   64 o   68.586   26.478   3.2948   3.9402   2.9835   5.1679   3.7271   6.0892   71.863   29.449   77.507   31.888 -5.644020 43.40615 
1 1 1    3    3   65 o  119.917   20.130   12.240   3.5640   10.494   4.9645   14.096   5.1195  105.141   29.596  123.666   27.730 -18.52509 40.55740 
1 1 1    3    3   66 o   76.582   26.990   5.1573   3.9342   9.5397   5.6594   1.0591   5.4729   97.896   32.422   65.440   28.653 32.45539 43.26894 
1 1 1    3    4    0 o  490.533   6.3509  184.261   4.7666  184.261   4.7666  184.261   4.7666  490.533   6.3509  490.533   6.3509 0.000000 0.000000 
1 1 1    3    4    1 o  970.222   9.5544  720.713   14.189  727.328   20.254  714.339   19.883  974.456   13.579  965.724   13.451 8.732056 19.11359 
1 1 1    3    4    2 o  375.327   5.9230  107.827   3.4027  106.163   4.7711  109.551   4.8543  372.389   8.3704  378.284   8.3837 -5.895569 11.84699 
1 1 1    3    4    3 o  288.378   4.1227   63.650   1.8198   61.798   2.5537   65.560   2.5939  284.141   5.8717  292.662   5.7904 -8.520721 8.246569 
1 1 1    3    4    4 o  567.179   4.9548  246.223   4.3014  239.188   5.9589  253.876   6.2155  558.987   6.9646  575.893   7.0512 -16.90588 9.910878 
1 1 1    3    4    5 o  382.861   4.4091  112.192   2.5838  113.119   3.6605  111.271   3.6476  384.423   6.2210  381.270   6.2504 3.153168 8.818632 
1 1 1    3    4    6 o  1052.63   7.3064  848.198   11.772  863.461   16.957  833.999   16.356  1061.92   10.432  1043.66   10.239 18.26465 14.61722 
1 1 1    3    4    7 o  287.057   5.0393   63.070   2.2141   64.319   2.6331   60.055   4.0910  289.879   5.9346  280.069   9.5432 9.809265 11.23794 
1 1 1    3    4    8 o  817.731   7.1284  511.872   8.9222  522.260   11.050  492.414   15.124  825.938   8.7407  801.853   12.322 24.08557 15.10757 
1 1 1    3    4    9 o  758.598   4.8623  440.464   5.6458  461.580   10.248  431.262   6.7649  776.479   8.6227  750.613   5.8881 25.86578 10.44131 
1 1 1    3    4   10 o  1557.79   8.2792  1857.79   19.741  1852.76   34.149  1860.31   24.193  1555.19   14.346  1558.73   10.140 -3.535645 17.56773 
1 1 1    3    4   11 o  768.290   4.6000  451.788   5.4094  451.741   8.3150  451.822   7.1228  768.197   7.0716  768.290   6.0570 -0.9313965E-01 9.310990 
1 1 1    3    4   12 f  744.162   4.2508  423.852   4.8419  426.185   6.8927  421.581   6.8030  746.172   6.0350  742.131   5.9890 4.040283 8.502330 
1 1 1    3    4   13 o  606.798   4.1902  281.818   3.8918  289.536   6.0722  276.438   5.0700  615.010   6.4505  600.956   5.5119 14.05383 8.484652 
1 1 1    3    4   14 o  1345.71   6.8426  1386.31   14.094  1386.44   18.648  1386.15   21.524  1345.63   9.0541  1345.38   10.452 0.2517090 13.82851 
1 1 1    3    4   15 o  532.602   4.0956  217.117   3.3388  214.355   5.0346  219.284   4.4609  529.167   6.2158  535.232   5.4451 -6.065125 8.263535 
1 1 1    3    4   16 o  980.355   5.1270  735.678   7.6933  738.372   10.909  733.013   10.851  982.055   7.2574  978.485   7.2453 3.570190 10.25490 
1 1 1    3    4   17 o  649.099   4.4978  322.502   4.4687  323.235   5.9103  321.523   6.8279  649.796   5.9425  648.042   6.8836 1.754211 9.093775 
1 1 1    3    4   18 o  1343.36   6.4755  1381.63   13.315  1369.63   18.660  1394.08   19.005  1337.27   9.1163  1349.14   9.2033 -11.87390 12.95410 
1 1 1    3    4   19 o  427.839   4.0189  140.110   2.6318  141.362   3.7593  138.906   3.6857  429.713   5.7155  425.966   5.6530 3.747681 8.038882 
1 1 1    3    4   20 o  919.690   5.3952  647.508   7.5948  642.604   9.9872  654.234   11.695  916.104   7.1224  924.278   8.2669 -8.173706 10.91197 
1 1 1    3    4   21 o  427.361   4.7644  139.805   3.1165  142.429   4.3998  137.163   4.4151  431.308   6.6646  423.256   6.8151 8.052460 9.532214 
1 1 1    3    4   22 o  1002.92   5.7375  770.017   8.8076  773.309   11.712  765.732   13.362  1004.95   7.6141  999.935   8.7304 5.016235 11.58423 
1 1 1    3    4   23 o  437.586   4.3531  146.566   2.9157  146.052   4.1373  147.073   4.1095  436.784   6.1885  438.309   6.1255 -1.525818 8.707421 
1 1 1    3    4   24 o  256.820   5.7810   50.489   2.2725   52.222   3.6329   49.376   2.9127  261.143   9.0888  253.951   7.4933 7.191666 11.77948 
1 1 1    3    4   25 o  964.500   5.3742  712.074   7.9340  725.113   11.439  699.984   11.014  973.198   7.6789  956.193   7.5255 17.00482 10.75168 
1 1 1    3    4   26 o  302.382   6.0467   69.991   2.7986   70.806   4.1386   69.304   3.7988  304.101   8.8913  300.867   8.2491 3.233673 12.12860 
1 1 1    3    4   27 o  295.942   5.4345   67.038   2.4617   68.729   3.5593   65.488   3.4084  299.625   7.7609  292.478   7.6135 7.146973 10.87187 
1 1 1    3    4   28 o  495.811   5.5436  188.166   4.2071  186.563   5.8493  189.884   6.0555  493.657   7.7412  498.027   7.9437 -4.370575 11.09183 
1 1 1    3    4   29 o  198.113   8.4139   30.049   2.5514   27.961   3.3122   33.095   4.0011  190.738   11.397  207.476   12.660 -16.73868 17.03420 
1 1 1    3    4   30 o  642.005   5.9392  315.502   5.8363  304.566   8.1328  327.112   8.3802  630.719   8.4243  653.649   8.3761 -22.92920 11.87973 
1 1 1    3    4   31 o  627.642   5.2074  301.532   5.0027  302.833   7.0960  300.246   7.0540  628.944   7.3711  626.253   7.3590 2.691895 10.41573 
1 1 1    3    4   32 o  224.746   8.5049   38.674   2.9257   38.917   4.1327   38.430   4.1425  225.078   12.039  223.653   12.146 1.424713 17.10218 
1 1 1    3    4   33 o  865.151   6.5252  572.996   8.6408  581.560   12.257  564.534   12.183  871.467   9.1887  858.611   9.2705 12.85626 13.05273 
1 1 1    3    4   34 o  795.433   5.6688  484.341   6.9018  491.789   9.8746  477.228   9.6505  801.428   8.0498  789.478   7.9862 11.95026 11.33929 
1 1 1    3    4   35 o  1151.26   6.8613  1014.72   12.091  1011.25   16.055  1019.28   18.377  1149.11   9.1279  1153.55   10.408 -4.434204 13.84363 
1 1 1    3    4   36 o  484.052   6.8070  179.391   5.0433  177.172   7.8257  180.967   6.5957  480.907   10.631  486.104   8.8646 -5.197540 13.84231 
1 1 1    3    4   37 o  956.469   6.1053  700.387   8.9382  709.101   12.775  692.031   12.510  962.224   8.6739  950.578   8.5982 11.64624 12.21330 
1 1 1    3    4   38 o  279.848   9.3128   59.992   3.9891   56.852   5.5328   63.391   5.7567  272.295   13.275  287.536   13.080 -15.24081 18.63633 
1 1 1    3    4   39 o  486.246   8.6289  181.113   6.4221  171.122   11.204  186.002   7.8373  472.162   15.503  492.664   10.393 -20.50156 18.66484 
1 1 1    3    4   40 o  164.688   17.079   21.065   4.2427   20.535   6.9774   21.376   5.3442  160.360   29.515  165.188   21.658 -4.827667 36.60857 
1 1 1    3    4   41 o  895.440   7.1277  614.161   9.7691  600.902   13.504  628.718   14.149  885.360   9.9652  905.583   10.208 -20.22278 14.26562 
1 1 1    3    4   42 o  250.217   10.771   48.023   4.1252   44.697   6.0612   50.894   5.6305  240.464   16.569  256.963   14.373 -16.49890 21.93442 
1 1 1    3    4   43 o  483.362   6.7356  178.989   4.9833  179.632   7.1053  178.366   6.9910  483.976   9.5915  482.280   9.4704 1.695740 13.47912 
1 1 1    3    4   44 o  302.685   8.6618   70.252   4.0130   69.762   5.6220   70.762   5.7301  301.342   12.189  303.481   12.336 -2.138306 17.34161 
1 1 1    3    4   45 o  287.933   10.263   63.644   4.5232   66.561   6.0847   60.042   6.7624  294.125   13.516  278.619   15.923 15.50665 20.88574 
1 1 1    3    4   46 o   66.776   24.870   2.6910   3.4027   0.8971   4.7330   4.6101   4.8955   66.959   27.881   83.077   30.014 -16.11766 40.96577 
1 1 1    3    4   47 o  320.415   8.8253   78.797   4.3282   74.695   5.8672   83.694   6.4109  311.544   12.304  329.717   12.703 -18.17236 17.68492 
1 1 1    3    4   48 o  181.442   13.907   25.541   3.8327   24.010   5.7919   26.735   5.1121  174.027   22.253  184.759   18.318 -10.73279 28.82315 
1 1 1    3    4   49 o  448.603   6.9912  154.363   4.8005  146.527   6.7275  162.493   6.8520  436.538   10.068  459.776   9.7365 -23.23825 14.00619 
1 1 1    3    4   50 o  242.962   12.663   45.673   4.6929   39.323   6.8803   51.198   6.4175  223.426   20.342  256.350   16.442 -32.92453 26.15577 
1 1 1    3    4   51 f  197.775   12.599   30.330   3.7940   28.967   5.4880   31.579   5.2508  191.679   18.954  200.696   17.261 -9.016830 25.63562 
1 1 1    3    4   52 o  372.808   8.7949  106.896   5.0186  100.128   7.1967  113.302   7.0021  359.742   13.070  383.021   11.944 -23.27844 17.70514 
1 1 1    3    4   53 o   94.588   27.375   7.3771   4.1899   11.409   5.1195  -0.8025   7.2917  116.608   28.843   75.112   32.976 41.49593 43.81030 
1 1 1    3    4   54 o  252.844   10.432   49.324   4.0372   42.364   5.7258   56.206   5.6932  232.480   16.192  268.727   13.889 -36.24794 21.33249 
1 1 1    3    4   55 o  166.410   15.169   21.754   3.8212   22.089   5.3970   21.416   5.4109  165.483   21.841  162.728   22.311 2.754608 31.22224 
1 1 1    3    4   56 o  221.622   12.556   38.222   4.2419   35.365   6.2675   40.637   5.7623  210.624   19.668  227.124   16.692 -16.50101 25.79683 
1 1 1    3    4   57 o   88.137   27.405   6.4102   4.0890   0.8518   5.2883   14.674   6.4481   68.320   29.019  129.773   32.526 -61.45344 43.58899 
1 1 1    3    4   58 o  109.342   25.396   10.096   4.1690   13.316   5.6154   6.1412   6.2229  124.142   29.907   90.940   33.680 33.20152 45.04163 
1 1 1    3    4   59 o   72.715   27.716   3.4279   4.2806   6.1491   6.4894   1.3318   5.6955   91.139   34.266   71.401   30.209 19.73798 45.68128 
1 1 1    3    4   60 o   89.778   26.582   6.8682   3.9111   8.8158   5.3912   4.7044   5.6826  100.528   31.502   82.715   31.836 17.81293 44.78736 
1 1 1    3    4   61 o  184.781   16.626   27.329   4.6521   24.228   6.7341   30.161   6.4342  168.038   27.104  190.893   22.450 -22.85443 35.19428 
1 1 1    3    4   62 o  172.274   15.080   23.669   3.9363   27.635   5.5703   19.714   5.5632  183.455   20.170  152.047   24.756 31.40808 31.93296 
1 1 1    3    4   63 o   90.474   26.374   7.2211   3.8767   7.5945   5.7895   6.9175   5.2196   92.755   32.736   89.173   31.111 3.582413 45.16109 
1 1 1    3    4   64 o   95.795   28.000   8.3896   4.3641   0.4108   6.2343   16.056   6.1111   68.347   30.228  130.735   31.008 -62.38800 43.30417 
1 1 1    3    4   65 o   37.982   18.475  -5.2463   3.4219  -7.7777   4.8180  -2.6695   4.8610   43.725   21.409   53.289   24.757 -9.564678 32.73034 
1 1 1    3    4   66 o   60.061   24.794   1.8439   3.6972   2.4642   5.6454   1.3780   4.8924   70.205   29.904   63.875   27.535 6.330490 40.65032 
1 1 1    3    5    0 o  412.408   6.1021  130.262   3.8500  130.262   3.8500  130.262   3.8500  412.408   6.1021  412.408   6.1021 0.000000 0.000000 
1 1 1    3    5    1 o  626.741   7.2611  300.691   6.9656  299.477   9.8134  301.924   9.8888  625.400   10.252  627.948   10.288 -2.548767 14.52403 
1 1 1    3    5    2 o  620.770   7.2549  294.988   6.8934  291.665   9.6567  298.441   9.8434  617.190   10.222  624.316   10.301 -7.126221 14.51199 
1 1 1    3    5    3 o  652.321   7.5317  325.743   7.5201  325.743   7.5201   0.0000   0.0000  652.321   7.5317  ?   ?  0.000000 7.531722 
1 1 1    3    5    4 o  371.654   4.4072  105.719   2.5071  105.426   3.5367  106.016   3.5545  371.120   6.2260  372.159   6.2399 -1.038208 8.814731 
1 1 1    3    5    5 o  1430.57   10.805  1567.06   23.659  1581.08   29.276  1540.68   40.166  1436.75   13.313  1417.74   18.509 19.01099 22.79948 
1 1 1    3    5    6 o  859.091   7.3708  564.970   9.6922  567.038   11.918  560.931   16.655  860.608   9.0477  855.805   12.714 4.803101 15.60489 
1 1 1    3    5    7 o  696.804   6.5065  371.660   6.9395  379.005   12.153  368.106   8.4530  703.519   11.286  693.432   7.9641 10.08740 13.81318 
1 1 1    3    5    8 o  432.160   4.8234  142.947   3.1906  141.766   4.5115  144.128   4.5128  430.349   6.8491  433.919   6.7947 -3.570648 9.647668 
1 1 1    3    5    9 f  917.143   6.7312  643.879   9.4493  637.976   13.244  650.000   13.486  912.836   9.4790  921.394   9.5623 -8.558716 13.46433 
1 1 1    3    5   10 o  1128.31   7.8372  974.588   13.535  968.899   19.033  980.409   19.251  1124.84   11.055  1131.50   11.116 -6.658447 15.67702 
1 1 1    3    5   11 o  818.091   5.1681  512.272   6.4714  536.099   11.758  501.918   7.7510  836.779   9.1803  809.755   6.2537 27.02411 11.10789 
1 1 1    3    5   12 o  437.113   3.7846  146.238   2.5321  149.817   3.9341  143.707   3.3085  442.406   5.8097  433.302   4.9885 9.103729 7.657556 
1 1 1    3    5   13 o  1121.06   7.0158  962.097   12.039  987.218   15.993  929.255   18.286  1135.49   9.2020  1101.55   10.846 33.94141 14.22344 
1 1 1    3    5   14 o  920.932   5.2105  649.185   7.3448  647.045   11.185  650.806   9.7388  919.311   7.9488  922.023   6.9007 -2.712158 10.52627 
1 1 1    3    5   15 o  312.833   4.4538   74.907   2.1326   76.407   3.0553   73.482   2.9782  315.928   6.3182  309.822   6.2802 6.106720 8.908407 
1 1 1    3    5   16 o  566.400   4.2855  245.554   3.7153  247.719   4.9165  242.672   5.6726  568.862   5.6465  563.013   6.5826 5.849182 8.672583 
1 1 1    3    5   17 o  789.906   4.5731  477.605   5.5291  484.986   7.9180  470.581   7.7243  795.913   6.4995  784.006   6.4368 11.90649 9.147492 
1 1 1    3    5   18 o  415.339   4.2517  132.044   2.7030  137.610   4.2698  128.321   3.4916  423.954   6.5800  409.419   5.5717 14.53571 8.622074 
1 1 1    3    5   19 o  474.406   4.0216  172.270   2.9203  169.614   4.0859  175.043   4.1753  470.698   5.6712  478.172   5.7048 -7.473450 8.044054 
1 1 1    3    5   20 o  771.554   5.3215  455.712   6.2845  454.997   8.8462  456.440   8.9297  770.846   7.4975  772.064   7.5564 -1.218018 10.64478 
1 1 1    3    5   21 f  666.019   4.7179  339.550   4.8096  345.459   6.4686  332.245   7.1923  671.735   6.2913  658.729   7.1333 13.00696 9.511309 
1 1 1    3    5   22 o  184.628   6.2497   26.096   1.7661   26.225   2.3560   25.931   2.6685  185.058   8.3176  183.756   9.5202 1.302078 12.64186 
1 1 1    3    5   23 o  418.164   4.6896  133.846   3.0016  134.748   4.6783  133.215   3.9133  419.520   7.2856  417.152   6.1288 2.368408 9.520607 
1 1 1    3    5   24 o  723.801   4.7198  401.000   5.2289  400.971   7.4840  401.027   7.3087  723.717   6.7561  723.773   6.5973 -0.5590820E-01 9.442992 
1 1 1    3    5   25 o  930.106   5.2646  662.183   7.4949  658.808   10.579  665.585   10.620  927.653   7.4504  932.413   7.4414 -4.760010 10.53013 
1 1 1    3    5   26 o  110.488   12.623   9.4727   2.0964   11.864   3.2505   7.7700   2.7431  123.135   17.760   99.034   18.784 24.10152 25.85039 
1 1 1    3    5   27 o  272.768   6.2173   56.953   2.5958   54.031   3.4235   60.904   3.9813  265.657   8.4194  282.038   9.2224 -16.38083 12.48759 
1 1 1    3    5   28 o  440.402   5.6458  148.460   3.8058  151.149   5.2985  145.595   5.4700  444.338   7.7905  436.091   8.1949 8.247345 11.30702 
1 1 1    3    5   29 o  850.066   5.6838  553.120   7.3954  547.996   9.6977  560.241   11.432  846.065   7.4885  855.420   8.7315 -9.354675 11.50289 
1 1 1    3    5   30 o  648.952   5.0710  322.350   5.0370  322.319   7.1493  322.381   7.0979  648.873   7.1983  648.937   7.1459 -0.6372070E-01 10.14296 
1 1 1    3    5   31 o  713.570   5.2296  389.749   5.7119  387.870   8.0753  391.630   8.0803  711.789   7.4121  715.232   7.3809 -3.442383 10.46025 
1 1 1    3    5   32 o  670.055   5.3382  343.669   5.4749  343.491   7.7562  343.846   7.7293  669.818   7.5652  670.166   7.5351 -0.3470459 10.67754 
1 1 1    3    5   33 o  1442.68   8.3680  1593.64   18.478  1587.52   25.898  1599.99   26.373  1439.56   11.754  1445.18   11.922 -5.625854 16.74180 
1 1 1    3    5   34 o  480.899   6.2282  177.041   4.5844  170.819   6.1295  184.941   6.9065  472.313   8.4787  491.425   9.1818 -19.11160 12.49774 
1 1 1    3    5   35 o  636.554   6.0194  310.199   5.8649  310.920   7.9172  309.322   8.7307  637.216   8.1174  635.537   8.9751 1.677979 12.10142 
1 1 1    3    5   36 o  687.703   6.2585  362.071   6.5878  365.466   10.286  359.711   8.5780  690.746   9.7288  685.372   8.1769 5.374084 12.70873 
1 1 1    3    5   37 o  709.680   6.3762  385.602   6.9262  385.588   10.706  385.612   9.0832  709.469   9.8587  709.586   8.3630 -0.1177979 12.92806 
1 1 1    3    5   38 o  406.434   8.2817  126.517   5.1521  110.310   7.5580  140.585   7.0416  379.297   13.018  428.324   10.741 -49.02713 16.87717 
1 1 1    3    5   39 o  440.684   8.3149  148.756   5.6086  141.743   11.192  151.108   6.4810  429.570   17.022  444.092   9.5345 -14.52267 19.51071 
1 1 1    3    5   40 o  877.049   6.4792  589.057   8.6979  584.644   13.109  592.528   11.625  873.408   9.8061  879.417   8.6365 -6.009155 13.06703 
1 1 1    3    5   41 o  307.487   9.4429   72.471   4.4443   73.903   5.8006   70.435   6.9159  310.350   12.211  302.788   14.922 7.561523 19.28173 
1 1 1    3    5   42 o  320.752   8.4056   78.848   4.1267   77.107   5.7743   80.666   5.8999  316.966   11.902  324.199   11.890 -7.233124 16.82310 
1 1 1    3    5   43 o  600.928   6.5526  276.640   6.0271  280.607   9.1501  273.599   8.0104  604.841   9.8836  597.385   8.7605 7.456238 13.20728 
1 1 1    3    5   44 o  236.299   10.614   42.860   3.8390   39.666   5.6745   45.556   5.2131  226.262   16.499  242.944   14.079 -16.68158 21.68962 
1 1 1    3    5   45 o  410.961   8.0858  129.505   5.0862  130.575   6.9349  128.260   7.4821  412.314   10.989  408.507   11.966 3.807007 16.24623 
1 1 1    3    5   46 o  249.788   10.041   47.912   3.8391   50.172   5.3125   45.441   5.5542  254.889   13.667  242.300   15.051 12.58873 20.32979 
1 1 1    3    5   47 o  104.929   22.499   8.9020   3.5051   16.444   4.7942   0.2406   5.1376  143.589   22.557   67.100   28.553 76.48978 36.38848 
1 1 1    3    5   48 o  294.297   9.3310   66.527   4.2032   66.073   6.5535   66.844   5.4785  292.143   14.703  294.624   12.148 -2.481628 19.07249 
1 1 1    3    5   49 o  165.444   14.046   21.291   3.5233   22.756   5.0293   19.878   4.9372  169.810   19.717  158.262   20.892 11.54802 28.72708 
1 1 1    3    5   50 o  163.964   18.169   21.175   4.4831   19.027   6.6568   22.957   6.0647  151.859   29.703  169.083   24.117 -17.22360 38.26087 
1 1 1    3    5   51 o  224.345   11.011   38.795   3.7811   35.708   5.2377   42.155   5.4641  213.785   16.125  232.572   15.437 -18.78702 22.32307 
1 1 1    3    5   52 o  229.951   11.725   40.931   4.1131   46.865   6.1538   36.140   5.5297  244.777   16.522  214.684   16.966 30.09265 23.68174 
1 1 1    3    5   53 o  141.240   20.515   16.007   4.3053   14.369   5.2582   19.340   7.4993  131.593   27.011  150.685   33.393 -19.09163 42.94939 
1 1 1    3    5   54 o  260.696   10.599   52.453   4.2294   48.142   5.8147   57.296   6.1630  248.154   15.385  270.964   14.917 -22.80962 21.42913 
1 1 1    3    5   55 o   64.502   25.098   2.2627   3.5618   4.1324   5.0463   0.4067   5.0279   79.800   30.170   65.787   28.127 14.01327 41.24728 
1 1 1    3    5   56 o   60.508   25.619   0.5699   4.1012   5.4513   5.3353  -6.4799   6.4117   86.240   31.306   57.827   27.357 28.41271 41.57530 
1 1 1    3    5   57 o  133.172   19.244   14.305   3.8088   16.988   5.1463   11.054   5.6638  143.358   24.323  113.064   31.536 30.29382 39.82607 
1 1 1    3    5   58 o   77.080   26.952   4.5219   3.9185   6.7344   5.2816   1.8130   5.8442   91.337   31.327   73.949   30.902 17.38842 44.00388 
1 1 1    3    5   59 o  146.448   20.258   17.447   4.4194   20.322   6.6371   15.157   5.9235  153.751   29.272  131.965   30.005 21.78645 41.91791 
1 1 1    3    5   60 f  179.157   14.780   25.395   4.0169   26.464   5.5760   24.243   5.7917  180.234   20.581  171.355   22.636 8.878326 30.59382 
1 1 1    3    5   61 o  234.974   13.845   43.540   4.9574   35.958   7.1014   50.747   6.9237  208.377   22.629  251.157   18.132 -42.78059 28.99720 
1 1 1    3    5   62 o  311.777   10.505   75.674   5.0133   77.116   7.1744   74.297   7.0081  311.986   15.024  306.282   14.949 5.704285 21.19406 
1 1 1    3    5   63 o   83.516   26.200   6.0652   3.7279   4.8113   5.2395   7.3509   5.3053   79.863   30.610   91.123   31.389 -11.25997 43.84353 
1 1 1    3    5   64 o   80.115   26.853   5.5963   3.8796   1.9583   5.0947   10.618   5.9856   67.840   28.630  104.750   33.242 -36.90971 43.87116 
1 1 1    3    5   65 o  125.111   19.235   13.214   3.5654   6.1612   4.9320   20.936   5.1604   83.148   30.113  155.714   22.287 -72.56593 37.46312 
1 1 1    3    6    0 o  312.985   8.3654   75.142   4.0011   75.142   4.0011   75.142   4.0011  312.985   8.3654  312.985   8.3654 0.000000 0.000000 
1 1 1    3    6    1 o  1476.01   13.557  1668.71   30.627  1711.03   44.626  1631.03   42.111  1493.94   19.516  1458.68   18.861 35.25928 27.14032 
1 1 1    3    6    2 o  837.091   8.7347  536.458   11.192  535.802   15.795  537.119   15.860  836.434   12.337  837.461   12.372 -1.026245 17.47248 
1 1 1    3    6    3 o  678.725   6.3233  352.619   6.5692  356.347   8.1271  345.594   11.158  682.271   7.7823  671.810   10.851 10.46045 13.35290 
1 1 1    3    6    4 o  704.110   5.6385  379.476   6.0767  382.001   8.6031  376.961   8.5845  706.399   7.9568  701.722   7.9924 4.676819 11.27783 
1 1 1    3    6    5 o  593.461   6.0048  269.585   5.4546  267.289   9.4015  270.749   6.6970  590.832   10.396  594.717   7.3570 -3.884888 12.73580 
1 1 1    3    6    6 o  252.720   5.2854   48.885   2.0445   47.030   3.4988   49.847   2.5194  247.846   9.2230  255.186   6.4500 -7.339874 11.25462 
1 1 1    3    6    7 o  492.607   4.9378  185.733   3.7231  181.348   5.1927  190.373   5.3410  486.730   6.9700  498.694   6.9972 -11.96426 9.876310 
1 1 1    3    6    8 o  683.529   5.6775  357.617   5.9400  355.140   8.3362  360.172   8.4662  681.107   7.9962  685.915   8.0640 -4.807129 11.35634 
1 1 1    3    6    9 o  436.451   4.9373  145.801   3.2984  146.032   4.6866  145.575   4.6429  436.770   7.0103  436.086   6.9558 0.6839294 9.875569 
1 1 1    3    6   10 o  704.940   5.8537  380.381   6.3161  378.028   8.8908  382.779   8.9744  702.696   8.2662  707.097   8.2919 -4.400940 11.70837 
1 1 1    3    6   11 o  763.758   5.4650  446.499   6.3888  450.214   8.2856  441.051   10.034  766.889   7.0587  758.995   8.6366 7.893616 11.15419 
1 1 1    3    6   12 o  739.405   5.3950  418.481   6.1058  411.058   7.7718  430.452   9.8688  732.779   6.9291  749.811   8.5989 -17.03241 11.04330 
1 1 1    3    6   13 o  712.648   5.9362  388.761   6.4752  384.349   9.0648  393.358   9.2529  708.518   8.3587  716.771   8.4338 -8.252563 11.87421 
1 1 1    3    6   14 o  469.367   3.9623  168.620   2.8466  175.076   4.4712  164.220   3.6914  478.233   6.1083  463.184   5.2068 15.04929 8.026329 
1 1 1    3    6   15 o  685.113   4.5062  359.276   4.7255  363.229   7.3144  356.445   6.1909  688.801   6.9377  682.370   5.9274 6.430298 9.125029 
1 1 1    3    6   16 o  862.845   5.1130  569.900   6.7527  563.513   8.8249  578.924   10.489  857.929   6.7203  869.520   7.8809 -11.59137 10.35716 
1 1 1    3    6   17 o  712.143   4.3674  388.194   4.7606  381.749   6.6559  394.944   6.8118  706.147   6.1581  718.245   6.1961 -12.09833 8.735782 
1 1 1    3    6   18 o  1307.57   6.3486  1308.98   12.706  1298.52   17.807  1319.84   18.136  1302.09   8.9347  1312.72   9.0262 -10.63489 12.70038 
1 1 1    3    6   19 o  1194.23   5.9742  1091.86   10.920  1094.32   15.434  1089.39   15.454  1195.37   8.4353  1192.67   8.4652 2.695923 11.95045 
1 1 1    3    6   20 o  682.792   5.0864  356.880   5.3158  360.637   7.5308  353.149   7.5046  686.294   7.1690  679.130   7.2195 7.164429 10.17425 
1 1 1    3    6   21 o  364.515   4.5504  101.707   2.5388   97.028   3.3518  108.004   3.8887  356.005   6.1511  375.588   6.7642 -19.58279 9.142800 
1 1 1    3    6   22 f  298.752   4.9179   68.320   2.2488   69.609   3.3945   67.312   3.0022  301.520   7.3551  296.516   6.6149 5.004486 9.892109 
1 1 1    3    6   23 o  1110.31   6.1998  943.730   10.536  946.468   16.224  941.733   13.856  1111.70   9.5343  1109.02   8.1626 2.686401 12.55116 
1 1 1    3    6   24 o  1040.37   5.5729  828.518   8.8743  839.033   12.736  818.597   12.372  1046.84   7.9487  1034.02   7.8170 12.82043 11.14839 
1 1 1    3    6   25 o  733.251   5.1363  411.540   5.7646  410.570   7.6108  412.845   8.8289  732.344   6.7896  734.336   7.8550 -1.991943 10.38264 
1 1 1    3    6   26 o  611.589   5.9299  286.313   5.5510  285.383   7.2365  287.643   8.6526  610.553   7.7435  612.924   9.2229 -2.371704 12.04258 
1 1 1    3    6   27 o  682.367   5.5716  356.406   5.8192  354.991   8.0550  357.951   8.4162  680.960   7.7281  683.784   8.0413 -2.824585 11.15286 
1 1 1    3    6   28 o  594.874   4.8331  270.859   4.4007  277.924   6.3550  264.349   6.0999  602.546   6.8906  587.648   6.7817 14.89813 9.668075 
1 1 1    3    6   29 o  541.984   5.3872  224.843   4.4691  226.667   5.9686  222.516   6.7424  544.144   7.1662  539.117   8.1708 5.027771 10.86814 
1 1 1    3    6   30 o  1686.09   8.0385  2176.52   20.746  2201.87   29.758  2152.56   28.937  1695.56   11.466  1676.48   11.277 19.07080 16.08223 
1 1 1    3    6   31 o  570.316   5.2414  248.968   4.5754  252.553   6.5554  245.564   6.3891  574.357   7.4568  566.356   7.3702 8.000977 10.48443 
1 1 1    3    6   32 o  971.894   6.1757  723.082   9.1871  727.027   14.056  720.140   12.139  974.377   9.4245  969.822   8.1775 4.554932 12.47768 
1 1 1    3    6   33 o  456.978   6.7796  159.872   4.7421  159.415   6.4609  160.407   6.9820  456.259   9.2515  457.653   9.9672 -1.394348 13.59914 
1 1 1    3    6   34 o  458.341   6.3555  160.825   4.4587  156.909   5.9844  165.711   6.6846  452.666   8.6372  465.165   9.3886 -12.49881 12.75719 
1 1 1    3    6   35 f  430.611   6.4145  141.958   4.2278  144.541   6.0034  139.417   5.9550  434.436   9.0282  426.663   9.1185 7.773529 12.83186 
1 1 1    3    6   36 o  632.735   6.2741  306.507   6.0764  299.533   9.4545  311.416   7.9313  625.327   9.8779  637.703   8.1256 -12.37598 12.79054 
1 1 1    3    6   37 o  189.236   13.198   27.588   3.7988   28.848   5.9589   26.724   4.9305  192.662   20.523  185.757   17.549 6.905258 27.00294 
1 1 1    3    6   38 o  527.063   7.3285  212.731   5.9121  214.580   8.8073  211.215   7.9764  529.153   10.874  525.046   9.9252 4.106689 14.72257 
1 1 1    3    6   39 o  1006.03   6.7728  775.046   10.429  758.482   15.961  787.388   13.777  994.806   10.482  1013.79   8.8786 -18.98590 13.73688 
1 1 1    3    6   40 o  244.384   10.465   45.784   3.9146   36.908   5.6578   53.935   5.4218  218.461   17.055  264.765   13.422 -46.30406 21.70373 
1 1 1    3    6   41 o  152.724   17.307   18.173   3.9744   13.712   5.0460   25.462   6.4504  130.810   26.117  179.932   24.021 -49.12134 35.48369 
1 1 1    3    6   42 o  581.445   6.2383  258.944   5.5519  256.774   7.7732  261.204   7.9324  578.774   8.7744  583.736   8.8781 -4.961243 12.48243 
1 1 1    3    6   43 o  556.223   6.3077  237.000   5.3702  228.316   7.4795  246.239   7.7153  545.676   8.9550  566.697   8.8947 -21.02130 12.62171 
1 1 1    3    6   44 o  192.759   12.739   28.684   3.7374   34.027   5.7480   24.771   4.9192  209.164   18.133  178.191   18.295 30.97220 25.75938 
1 1 1    3    6   45 f  438.427   8.4440  147.428   5.6665  148.098   8.0918  146.783   7.9378  438.930   12.044  437.004   11.867 1.926392 16.90835 
1 1 1    3    6   46 o  268.445   9.4462   55.319   3.8814   56.639   5.2681   53.752   5.7404  271.297   12.686  263.723   14.274 7.573700 19.09693 
1 1 1    3    6   47 f  177.400   12.704   24.356   3.4268   22.880   4.7674   25.934   4.9291  170.817   18.531  182.119   17.914 -11.30183 25.77455 
1 1 1    3    6   48 f  233.573   10.745   41.960   3.8413   44.706   5.9091   39.950   5.0551  239.816   16.193  226.976   14.629 12.84058 21.82220 
1 1 1    3    6   49 o  139.025   15.957   15.162   3.3340   18.749   4.6538   11.380   4.7786  153.757   20.268  117.651   27.095 36.10597 33.83717 
1 1 1    3    6   50 o  154.251   18.451   18.791   4.2699   10.372   6.4592   25.327   5.6907  112.241   34.369  178.596   21.234 -66.35438 40.39943 
1 1 1    3    6   51 o  168.360   14.693   22.135   3.7483   21.589   5.5510   22.593   5.0818  164.020   22.721  168.678   20.077 -4.658371 30.32064 
1 1 1    3    6   52 o  151.932   16.143   18.158   3.6965   20.000   5.1785   16.246   5.2782  157.790   22.043  140.836   25.421 16.95399 33.64681 
1 1 1    3    6   53 o  376.121   8.6872  108.843   5.0013  108.099   6.4067  110.003   8.0020  374.183   11.186  376.575   13.883 -2.391571 17.82877 
1 1 1    3    6   54 o   49.077   22.120  -1.5682   3.5085   4.6965   5.0100  -7.5970   4.9148   82.317   30.268   46.452   22.488 35.86511 37.70747 
1 1 1    3    6   55 o  252.604   10.774   49.300   4.1658   51.578   5.6938   46.676   6.1110  256.992   14.534  243.732   16.477 13.25931 21.97157 
1 1 1    3    6   56 o  274.698   11.550   58.437   4.8565   56.771   6.2792   60.916   7.6613  269.157   15.305  277.549   18.134 -8.391663 23.72905 
1 1 1    3    6   57 o  104.215   24.457   9.1096   3.8343   9.1948   5.0829   8.9972   5.8407  103.727   30.189  102.992   32.853 0.7350464 44.61728 
1 1 1    3    6   58 o   82.781   26.749   5.5793   3.8625   7.4561   5.2796   3.4179   5.6658   94.720   31.313   78.605   31.325 16.11532 44.29123 
1 1 1    3    6   59 o  358.251   9.6330   99.267   5.2823   91.761   7.6568  106.085   7.2968  342.102   14.622  368.799   12.926 -26.69714 19.51672 
1 1 1    3    6   60 o   89.096   26.754   6.7713   3.9413   5.1969   5.2777   8.7562   5.9262   83.381   30.990  100.258   33.176 -16.87672 45.39835 
1 1 1    3    6   61 o  100.643   26.799   8.8552   4.2018  -3.3609   6.7593   16.549   5.3642   64.080   29.567  138.608   26.245 -74.52799 39.53531 
1 1 1    3    6   62 o   95.387   25.956   7.9695   3.8906   5.2055   5.5091   10.720   5.4952   82.838   31.474  108.335   31.350 -25.49773 44.42279 
1 1 1    3    6   63 f   89.426   25.152   7.0386   3.5871  -0.0941   4.9536   14.902   5.2012   61.382   27.057  129.469   27.115 -68.08705 38.30537 
1 1 1    3    6   64 o   98.012   25.353   8.6258   3.8322   8.8554   4.9192   8.2712   6.1122   97.286   30.027   94.070   33.589 3.216278 45.05396 
1 1 1    3    6   65 o  158.653   15.461   20.494   3.7068   24.480   5.2349   16.487   5.2495  169.804   20.560  134.774   26.392 35.03004 33.45522 
1 1 1    3    7    0 o  365.433   8.8332  102.398   4.9343  102.398   4.9343  102.398   4.9343  365.433   8.8332  365.433   8.8332 0.000000 0.000000 
1 1 1    3    7    1 o  279.100   6.1372   59.626   2.6218   61.599   3.7552   57.750   3.6621  283.656   8.6491  274.650   8.7114 9.006561 12.27581 
1 1 1    3    7    2 o  824.700   8.7081  520.692   10.992  531.943   15.862  510.296   15.247  833.413   12.434  816.291   12.203 17.12280 17.42234 
1 1 1    3    7    3 o  951.449   9.6611  693.099   14.070  686.669   19.799  699.657   19.998  946.826   13.661  955.738   13.670 -8.911926 19.32620 
1 1 1    3    7    4 o  269.999   5.2791   55.798   2.1817   58.437   3.8482   54.548   2.6484  276.275   9.1001  266.950   6.4817 9.324738 11.17246 
1 1 1    3    7    5 o  1441.14   9.4615  1590.12   20.871  1557.52   28.780  1626.28   30.310  1426.02   13.186  1457.12   13.590 -31.09949 18.93549 
1 1 1    3    7    6 o  341.054   4.6460   89.029   2.4253   89.686   3.4284   88.370   3.4315  342.294   6.5437  339.773   6.5981 2.521149 9.292747 
1 1 1    3    7    7 o  306.163   4.7483   71.745   2.2252   71.478   3.1333   72.017   3.1606  305.576   6.6990  306.726   6.7320 -1.149780 9.497211 
1 1 1    3    7    8 o  1444.52   9.5200  1597.63   21.049  1619.40   30.242  1577.18   29.314  1453.99   13.589  1434.93   13.347 19.05688 19.04729 
1 1 1    3    7    9 o  432.701   4.9730  143.308   3.2936  142.733   4.6794  143.872   4.6367  431.805   7.0800  433.525   6.9875 -1.720276 9.947423 
1 1 1    3    7   10 o  465.623   5.1038  165.947   3.6375  170.533   5.2390  161.679   5.0543  471.980   7.2520  459.565   7.1853 12.41525 10.20884 
1 1 1    3    7   11 o  695.525   8.2554  370.367   8.7886  380.228   12.772  361.499   12.112  704.580   11.843  687.023   11.518 17.55725 16.52045 
1 1 1    3    7   12 o  840.712   7.4643  541.104   9.6052  545.826   11.866  532.131   16.358  844.299   9.1822  833.438   12.823 10.86102 15.77154 
1 1 1    3    7   13 o  916.990   6.1603  643.692   8.6464  649.838   11.237  634.771   13.538  921.280   7.9686  910.445   9.7145 10.83514 12.56465 
1 1 1    3    7   14 o  834.711   5.3559  533.338   6.8428  539.276   9.7432  527.558   9.6126  839.258   7.5846  830.091   7.5656 9.167358 10.71286 
1 1 1    3    7   15 o  1179.67   6.7407  1065.41   12.171  1036.29   16.659  1098.75   17.825  1163.24   9.3566  1197.75   9.7230 -34.51147 13.49380 
1 1 1    3    7   16 o  438.677   4.1141  147.297   2.7625  144.286   4.2160  149.563   3.6568  434.124   6.3448  442.014   5.4050 -7.889801 8.334894 
1 1 1    3    7   17 o  682.295   4.6026  356.345   4.8067  358.713   7.4097  354.624   6.3159  684.467   7.0726  680.597   6.0629 3.870544 9.315556 
1 1 1    3    7   18 o  851.444   5.1325  554.961   6.6890  562.908   10.382  549.323   8.7460  857.368   7.9115  847.029   6.7459 10.33899 10.39706 
1 1 1    3    7   19 o  290.798   4.8474   64.732   2.1576   63.977   2.9882   65.554   3.1185  289.067   6.7538  292.605   6.9629 -3.537750 9.700324 
1 1 1    3    7   20 o  556.026   4.4711  236.652   3.8052  234.796   5.0175  239.164   5.8380  553.804   5.9192  558.903   6.8243 -5.098816 9.033738 
1 1 1    3    7   21 o  362.509   4.5919  100.590   2.5479  103.618   3.9914   98.507   3.3101  367.880   7.0885  358.713   6.0286 9.167053 9.305421 
1 1 1    3    7   22 o  575.171   4.3285  253.218   3.8107  253.136   5.3946  253.301   5.3836  575.036   6.1291  575.223   6.1146 -0.1877441 8.657580 
1 1 1    3    7   23 o  291.697   5.2426   65.131   2.3407   66.823   3.7272   64.029   3.0078  295.422   8.2428  289.200   6.7948 6.221344 10.68239 
1 1 1    3    7   24 o  517.968   4.8094  205.355   3.8129  202.397   4.9900  209.506   5.9108  514.196   6.3402  523.126   7.3819 -8.929504 9.730903 
1 1 1    3    7   25 o  1387.19   8.6086  1473.31   18.278  1478.46   23.755  1465.85   28.618  1389.42   11.170  1383.26   13.517 6.160889 17.53480 
1 1 1    3    7   26 o  944.903   5.7064  683.421   8.2531  674.373   12.430  690.554   11.037  938.523   8.6530  949.759   7.5921 -11.23566 11.51150 
1 1 1    3    7   27 o  275.839   5.6829   58.240   2.3994   58.035   3.4855   58.425   3.3078  275.326   8.2709  276.257   7.8228 -0.9300537 11.38439 
1 1 1    3    7   28 o  1868.28   8.6887  2672.37   24.847  2713.31   35.807  2634.35   34.506  1882.15   12.429  1854.59   12.156 27.55688 17.38525 
1 1 1    3    7   29 o  911.690   5.8701  636.233   8.1915  636.102   10.790  636.411   12.585  911.532   7.7337  911.700   9.0185 -0.1676025 11.88036 
1 1 1    3    7   30 o  874.727   5.4566  585.681   7.3057  590.081   10.417  581.421   10.249  877.929   7.7517  871.465   7.6836 6.463745 10.91454 
1 1 1    3    7   31 o  358.661   6.0586   98.471   3.3260  100.338   4.7249   96.637   4.6828  362.003   8.5273  355.264   8.6115 6.739532 12.11911 
1 1 1    3    7   32 o  960.893   6.6781  706.842   9.8220  713.857   13.835  699.714   13.946  965.507   9.3618  955.885   9.5320 9.622314 13.36042 
1 1 1    3    7   33 o  1134.07   7.2692  984.665   12.618  981.057   15.395  992.050   22.025  1131.88   8.8861  1137.87   12.646 -5.984619 15.45592 
1 1 1    3    7   34 o  598.524   6.0034  274.239   5.4999  281.395   7.5628  266.206   8.0126  606.209   8.1507  589.593   8.8787 16.61627 12.05261 
1 1 1    3    7   35 o  852.692   6.2638  556.638   8.1752  567.418   12.860  549.326   10.591  860.701   9.7613  846.972   8.1694 13.72827 12.72882 
1 1 1    3    7   36 o  231.866   10.604   41.189   3.7633   39.057   5.9963   42.574   4.8338  224.900   17.558  235.271   13.479 -10.37106 22.13531 
1 1 1    3    7   37 f  471.794   6.4383  170.426   4.6494  169.510   6.6197  171.317   6.5317  470.419   9.1935  472.927   9.0232 -2.508179 12.88174 
1 1 1    3    7   38 o  449.893   7.6714  155.011   5.2826  153.222   8.1489  156.308   6.9380  447.068   11.908  451.658   10.036 -4.589722 15.57332 
1 1 1    3    7   39 o  573.167   6.3871  251.564   5.6035  258.677   8.5040  246.105   7.4494  581.011   9.5624  566.786   8.5868 14.22449 12.85195 
1 1 1    3    7   40 o  367.673   7.4073  103.549   4.1686   96.163   5.8865  110.980   5.9041  354.137   10.860  380.490   10.138 -26.35358 14.85620 
1 1 1    3    7   41 o  202.782   12.597   31.684   3.8905   29.382   5.0128   35.171   6.1694  194.686   16.992  212.803   19.146 -18.11722 25.59887 
1 1 1    3    7   42 f  125.695   17.824   12.411   3.3331   11.338   4.6915   13.505   4.7361  118.544   26.520  129.902   24.723 -11.35816 36.25601 
1 1 1    3    7   43 o  176.531   12.501   24.060   3.3561   21.302   4.7809   26.739   4.7122  164.990   19.296  185.534   16.775 -20.54372 25.56788 
1 1 1    3    7   44 o  111.072   20.548   9.8482   3.3647   7.5329   4.9030   11.909   4.6258   97.778   29.945  121.419   25.692 -23.64090 39.45568 
1 1 1    3    7   45 o  209.258   12.008   33.773   3.8302   31.840   5.0087   36.497   5.9438  202.487   16.299  216.533   18.100 -14.04584 24.35679 
1 1 1    3    7   46 o  261.710   9.8333   52.597   3.9390   47.836   5.5804   57.325   5.5610  248.634   14.729  272.833   13.316 -24.19893 19.85617 
1 1 1    3    7   47 o  376.539   7.5718  108.753   4.3639  109.248   6.6830  108.385   5.7619  376.825   11.587  375.582   10.023 1.242859 15.32036 
1 1 1    3    7   48 o  323.194   8.5699   80.199   4.2394   76.360   6.6497   82.829   5.5028  314.553   13.811  328.113   10.957 -13.56049 17.62971 
1 1 1    3    7   49 o  312.701   8.6619   75.112   4.1458   72.220   5.5750   78.690   6.2010  306.119   11.898  319.385   12.685 -13.26569 17.39157 
1 1 1    3    7   50 o  444.553   7.7992  151.756   5.3070  140.839   8.5387  158.628   6.7743  426.973   13.065  454.078   9.7468 -27.10556 16.30045 
1 1 1    3    7   51 o  294.631   9.1370   66.777   4.1205   68.059   6.1307   65.720   5.5649  296.549   13.507  291.649   12.466 4.899719 18.38013 
1 1 1    3    7   52 o  263.609   9.6624   53.511   3.8987   52.109   5.4381   54.993   5.5923  258.960   13.769  266.047   13.780 -7.086945 19.48014 
1 1 1    3    7   53 o  210.096   13.414   34.350   4.2912   35.529   5.4180   32.366   7.0292  212.706   16.778  200.582   23.331 12.12320 28.73718 
1 1 1    3    7   54 o  166.086   14.533   21.610   3.6573   22.032   5.2314   21.207   5.1149  165.652   21.112  162.494   21.060 3.158508 29.82069 
1 1 1    3    7   55 o  265.523   10.176   54.422   4.1356   55.540   5.9901   53.405   5.7168  266.602   14.736  261.558   14.334 5.044037 20.55791 
1 1 1    3    7   56 o   63.934   25.791   1.7689   3.8907   5.0985   5.0818  -2.9475   6.0481   83.824   30.535   62.593   28.539 21.23049 41.79499 
1 1 1    3    7   57 o  133.749   19.787   14.479   3.9285   19.055   5.3355   9.0602   5.8058  152.196   23.673  103.199   32.737 48.99783 40.39955 
1 1 1    3    7   58 o  180.363   14.680   25.619   4.0176   26.639   5.5219   24.472   5.8564  181.723   20.194  172.962   22.667 8.761902 30.35736 
1 1 1    3    7   59 o  103.556   25.674   9.1577   4.0493   12.604   5.9950   6.2667   5.4911  119.181   32.132   89.018   31.831 30.16267 45.22919 
1 1 1    3    7   60 o   72.902   26.466   3.9302   3.8131   7.4352   5.1047  -0.4943   5.7353   93.278   30.787   65.733   29.037 27.54523 42.31998 
1 1 1    3    7   61 o  109.821   25.056   10.413   4.1187   6.3139   6.6663   12.944   5.2380   90.334   34.550  120.858   28.736 -30.52324 44.93832 
1 1 1    3    7   62 o  143.209   18.964   16.834   4.0546   16.714   5.8936   16.943   5.5867  136.890   29.028  139.003   27.232 -2.112549 39.80263 
1 1 1    3    7   63 o   56.475   24.131   0.6483   3.6966  -3.4389   5.0344   5.4300   5.4454   53.384   24.932   82.528   31.307 -29.14376 40.02157 
1 1 1    3    7   64 o   77.435   27.618   5.0782   4.1310   0.1225   6.1385   9.1801   5.5848   66.825   29.752   98.025   32.195 -31.19917 43.83753 
1 1 1    3    7   65 o  139.594   19.351   16.453   4.0235   9.7694   6.1445   21.470   5.3236   98.937   33.791  157.061   22.812 -58.12376 40.76995 
1 1 1    3    8    0 o  724.010   11.480  401.592   12.715  401.592   12.715  401.592   12.715  724.010   11.480  724.010   11.480 0.000000 0.000000 
1 1 1    3    8    1 o  1068.38   14.839  874.431   24.266   0.0000   0.0000  874.431   24.266  ?   ?   1068.38   14.839 0.000000 14.83863 
1 1 1    3    8    2 o  1745.45   22.356  2336.90   59.726   0.0000   0.0000  2336.90   59.726  ?   ?   1745.45   22.356 0.000000 22.35564 
1 1 1    3    8    3 o  469.485   5.5997  168.712   4.0240  165.268   4.9041  175.809   7.0397  464.651   6.8955  479.190   9.5979 -14.53992 11.81810 
1 1 1    3    8    4 f  857.951   9.0960  563.550   11.945  563.550   11.945   0.0000   0.0000  857.951   9.0960  ?   ?  0.000000 9.096036 
1 1 1    3    8    5 o  904.469   6.6643  626.209   9.2261  624.406   13.001  628.038   13.095  903.072   9.4056  905.693   9.4461 -2.621033 13.33018 
1 1 1    3    8    6 o  1084.71   7.5849  900.724   12.593  900.297   17.785  901.153   17.833  1084.31   10.716  1084.82   10.740 -0.5142822 15.17190 
1 1 1    3    8    7 o  267.998   4.8979   54.974   2.0092   53.597   2.8303   56.373   2.8526  264.604   6.9881  271.371   6.8677 -6.766205 9.797929 
1 1 1    3    8    8 o  914.529   6.7774  640.234   9.4871  648.649   13.605  632.270   13.236  920.406   9.6571  908.717   9.5162 11.68854 13.55795 
1 1 1    3    8    9 o  1128.74   9.0708  975.499   15.671  993.864   27.687  966.841   19.010  1138.79   15.884  1123.60   11.053 15.18970 19.35151 
1 1 1    3    8   10 o  1250.52   12.028  1197.80   23.022  1224.45   33.379  1173.62   31.794  1263.80   17.256  1237.35   16.787 26.44910 24.07429 
1 1 1    3    8   11 o  1017.82   8.4670  793.189   13.191  793.179   16.191  793.209   22.748  1017.70   10.394  1017.39   14.608 0.3113403 17.92824 
1 1 1    3    8   12 o  381.600   5.2499  111.465   3.0664  112.985   4.3431  109.953   4.3300  384.159   7.3861  378.969   7.4647 5.190521 10.50128 
1 1 1    3    8   13 o  914.707   6.9333  640.553   9.7072  646.658   13.856  634.668   13.604  918.892   9.8513  910.339   9.7631 8.552917 13.86961 
1 1 1    3    8   14 o  323.297   4.8452   80.007   2.3976   81.441   3.0560   77.709   3.8669  326.165   6.1213  318.572   7.9302 7.593719 10.01787 
1 1 1    3    8   15 o  348.900   4.9226   93.183   2.6288   99.563   3.4142   83.892   4.1200  360.624   6.1853  330.988   8.1323 29.63589 10.21728 
1 1 1    3    8   16 o  873.988   5.5789  584.756   7.4632  581.066   10.478  588.557   10.633  871.102   7.8586  876.695   7.9237 -5.592651 11.15986 
1 1 1    3    8   17 o  420.669   4.6113  135.460   2.9692  133.840   4.1527  137.154   4.2469  418.103   6.4889  423.247   6.5556 -5.143677 9.224007 
1 1 1    3    8   18 o  592.494   5.9502  268.753   5.3962  268.969   7.5229  268.525   7.7446  592.638   8.2933  592.137   8.5449 0.5009766 11.90777 
1 1 1    3    8   19 f  643.664   5.4417  317.159   5.3612  309.782   8.3545  322.324   6.9903  636.005   8.5821  648.824   7.0389 -12.81891 11.09943 
1 1 1    3    8   20 o  516.990   4.8253  204.593   3.8183  195.316   5.3383  214.311   5.4638  505.081   6.9051  529.076   6.7470 -23.99500 9.654123 
1 1 1    3    8   21 o  218.650   5.1189   36.595   1.7132   36.339   2.4539   36.839   2.3928  217.859   7.3588  219.355   7.1267 -1.495880 10.24412 
1 1 1    3    8   22 o  597.378   5.1639  273.161   4.7217  281.088   6.7845  265.716   6.5753  605.927   7.3153  589.126   7.2918 16.80084 10.32879 
1 1 1    3    8   23 o  798.972   5.2086  488.627   6.3698  489.113   8.4127  487.975   9.7513  799.318   6.8761  798.347   7.9800 0.9711304 10.53380 
1 1 1    3    8   24 o  1049.54   6.0073  843.199   9.6505  872.442   15.271  823.755   12.452  1067.43   9.3466  1037.30   7.8429 30.13477 12.20123 
1 1 1    3    8   25 o  839.503   6.2746  539.480   8.0626  531.616   12.690  544.804   10.441  833.228   9.9504  843.576   8.0859 -10.34772 12.82159 
1 1 1    3    8   26 o  736.922   5.1595  415.664   5.8197  414.660   8.7975  416.445   7.7603  735.966   7.8096  737.575   6.8739 -1.608398 10.40389 
1 1 1    3    8   27 o  1255.18   6.4134  1205.98   12.321  1197.29   17.315  1214.91   17.538  1250.51   9.0460  1259.68   9.0959 -9.166870 12.82831 
1 1 1    3    8   28 f  782.349   5.5597  468.503   6.6577  474.150   8.8279  461.056   10.138  787.002   7.3285  776.019   8.5354 10.98254 11.24983 
1 1 1    3    8   29 o  1076.45   6.3653  887.010   10.488  899.809   14.004  870.662   15.826  1084.10   8.4394  1066.32   9.6967 17.77197 12.85495 
1 1 1    3    8   30 o  259.888   6.9024   51.706   2.7457   49.639   3.9139   53.709   3.8529  254.600   10.043  264.840   9.5047 -10.23952 13.82784 
1 1 1    3    8   31 o  1165.32   6.2910  1039.55   11.221  1033.81   15.809  1045.38   15.929  1161.95   8.8891  1168.44   8.9068 -6.485474 12.58361 
1 1 1    3    8   32 o  285.962   8.3972   62.614   3.6755   65.573   4.9701   59.042   5.4602  292.587   11.098  277.593   12.851 14.99457 16.97958 
1 1 1    3    8   33 o  933.732   6.7172  667.473   9.6003  676.032   13.969  659.811   13.216  939.525   9.7135  928.212   9.3023 11.31299 13.44937 
1 1 1    3    8   34 o  646.509   6.0718  319.978   6.0084  312.159   9.3639  325.451   7.8337  638.416   9.5826  651.947   7.8503 -13.53107 12.38765 
1 1 1    3    8   35 o  807.231   6.2162  498.869   7.6805  499.965   11.970  498.102   10.013  807.918   9.6799  806.513   8.1116 1.405518 12.62924 
1 1 1    3    8   36 o  463.490   6.3547  164.472   4.5083  168.251   6.4201  160.797   6.3321  468.692   8.9492  458.190   9.0288 10.50226 12.71252 
1 1 1    3    8   37 o  573.847   6.2640  252.127   5.5020  254.996   7.4866  248.758   8.1131  577.000   8.4769  569.852   9.3015 7.148010 12.58480 
1 1 1    3    8   38 o  456.055   7.3041  159.281   5.0986  147.784   8.0715  166.915   6.5769  439.036   12.011  466.763   9.2057 -27.72690 15.13317 
1 1 1    3    8   39 o  431.774   6.9723  142.777   4.6079  148.961   6.8659  137.710   6.2156  440.848   10.175  423.909   9.5795 16.93915 13.97494 
1 1 1    3    8   40 o  604.257   6.1301  279.615   5.6697  273.921   8.0355  285.260   8.0008  597.873   8.7808  610.141   8.5671 -12.26788 12.26778 
1 1 1    3    8   41 o  647.308   6.5554  320.943   6.4950  320.595   8.4293  321.451   10.190  646.770   8.5147  647.423   10.283 -0.6531372 13.35051 
1 1 1    3    8   42 o  125.824   16.923   12.409   3.1766   9.8683   4.4578   15.030   4.5277  110.504   26.662  137.688   22.242 -27.18391 34.72148 
1 1 1    3    8   43 f  231.508   9.6400   41.116   3.4160   37.554   4.8052   44.755   4.8570  220.481   14.316  240.926   13.222 -20.44507 19.48742 
1 1 1    3    8   44 o  547.523   7.1126  229.765   5.9608  225.570   8.0318  234.908   8.8936  542.163   9.6786  553.138   10.504 -10.97443 14.28352 
1 1 1    3    8   45 o  364.207   7.5137  101.702   4.1886  100.993   5.7231  102.521   6.1469  362.642   10.311  365.288   10.994 -2.645966 15.07219 
1 1 1    3    8   46 o  433.172   6.7309  143.839   4.4628  143.689   6.3777  143.983   6.2469  432.573   9.6325  433.048   9.4245 -0.4741211 13.47613 
1 1 1    3    8   47 o  169.118   14.168   22.218   3.6338   17.489   6.0609   24.872   4.5403  146.592   28.034  178.488   16.817 -31.89574 32.69099 
1 1 1    3    8   48 o  389.897   7.3862  116.632   4.4080  116.631   6.5222  116.632   5.9807  389.320   10.945  389.490   10.032 -0.1697693 14.84700 
1 1 1    3    8   49 o  171.188   13.382   22.766   3.4784   25.594   4.8498   19.770   4.9918  180.598   17.775  157.609   21.232 22.98833 27.69030 
1 1 1    3    8   50 o  253.518   10.825   49.517   4.2007   54.242   7.2613   47.140   5.1499  263.177   18.137  246.498   13.704 16.67941 22.73159 
1 1 1    3    8   51 o  272.956   9.5114   57.344   3.9738   63.328   5.9552   52.541   5.3353  286.001   13.604  260.206   13.442 25.79471 19.12457 
1 1 1    3    8   52 o  216.571   11.307   36.301   3.7352   39.351   5.1581   32.937   5.4162  224.555   15.095  204.669   17.456 19.88657 23.07729 
1 1 1    3    8   53 o  298.178   8.9707   68.444   4.0942   66.585   5.6610   70.483   5.9284  293.265   12.611  301.664   12.839 -8.399414 17.99724 
1 1 1    3    8   54 o  144.521   16.369   16.515   3.5572   17.080   5.0924   15.977   4.9710  144.544   23.849  139.593   24.139 4.950958 33.93330 
1 1 1    3    8   55 o  108.981   22.282   9.7809   3.5914   9.6812   5.1863   9.8727   4.9780  106.760   30.320  107.843   29.366 -1.083076 42.20930 
1 1 1    3    8   56 o  125.525   21.419   12.870   3.9676   10.412   5.1871   16.337   6.1595  110.254   29.957  138.259   29.971 -28.00490 42.37517 
1 1 1    3    8   57 o   87.826   26.135   6.4286   3.7737   1.0406   5.0167   13.451   5.7271   67.334   28.413  124.761   30.294 -57.42754 41.53298 
1 1 1    3    8   58 f   78.510   26.640   4.8603   3.8189   5.4659   5.2241   4.1653   5.5965   85.191   30.970   80.990   31.475 4.201469 44.15697 
1 1 1    3    8   59 o  105.246   26.100   9.4965   4.1839   10.229   6.1002   8.8460   5.7492  107.565   33.478  101.018   32.634 6.546288 46.75168 
1 1 1    3    8   60 o  174.102   15.515   24.115   4.0911   17.353   5.4990   32.496   6.1224  142.480   26.180  199.763   20.305 -57.28284 33.13160 
1 1 1    3    8   61 o   89.484   27.310   6.9466   4.0826   21.011   6.6913  -1.3936   5.1528  154.290   29.407   59.644   26.851 94.64590 39.82195 
1 1 1    3    8   62 o  214.951   12.828   36.437   4.2012   35.059   6.0791   37.697   5.8126  206.957   19.418  215.788   17.756 -8.830658 26.31203 
1 1 1    3    8   63 o  262.322   12.837   54.318   5.1542   44.469   7.0678   65.505   7.5327  231.588   20.139  284.026   17.411 -52.43800 26.62205 
1 1 1    3    8   64 f   71.771   26.979   4.0124   4.0224  -4.8979   5.9853   11.352   5.4320   55.363   26.261  108.737   31.081 -53.37415 40.69013 
1 1 1    3    8   65 o   78.759   26.308   5.5466   3.7236   8.7518   5.4599   2.7595   5.0914   94.775   31.855   69.493   28.925 25.28262 43.02806 
1 1 1    3    9    0 o  565.534   10.334  245.078   8.9383  245.078   8.9383  245.078   8.9383  565.534   10.334  565.534   10.334 0.000000 0.000000 
1 1 1    3    9    1 o  1342.12   17.862  1380.68   36.694   0.0000   0.0000  1380.68   36.694  ?   ?   1342.12   17.862 0.000000 17.86212 
1 1 1    3    9    2 o  947.974   9.7122  688.069   14.092  697.022   20.219  679.611   19.652  953.895   13.848  941.919   13.631 11.97565 19.43128 
1 1 1    3    9    3 o  666.716   6.4856  340.260   6.6185  347.249   8.2697  327.806   11.039  673.491   8.0221  654.272   11.023 19.21924 13.63332 
1 1 1    3    9    4 f  869.633   7.5288  578.942   10.021  583.758   12.400  569.872   17.016  873.178   9.2778  862.557   12.889 10.62097 15.88067 
1 1 1    3    9    5 o  987.435   7.1123  746.396   10.750  747.764   15.249  745.045   15.156  988.210   10.082  986.414   10.038 1.795837 14.22662 
1 1 1    3    9    6 o  1299.55   8.7609  1293.01   17.427  1292.95   24.700  1293.07   24.590  1299.25   12.420  1299.32   12.365 -0.6494141E-01 17.52549 
1 1 1    3    9    7 o  1017.16   8.4006  792.117   13.079  779.844   22.245  798.600   16.169  1008.88   14.406  1021.22   10.344 -12.33990 17.73464 
1 1 1    3    9    8 o  597.553   6.2928  273.332   5.7556  274.818   9.9243  272.578   7.0651  599.043   10.824  596.694   7.7357 2.348938 13.30382 
1 1 1    3    9    9 o  209.869   6.3953   33.717   2.0544   32.308   2.5258   36.470   3.5313  205.424   8.0329  218.223   10.572 -12.79927 13.27781 
1 1 1    3    9   10 o  521.848   6.1039  208.464   4.8755  208.175   5.9916  209.031   8.3878  521.454   7.5069  522.436   10.489 -0.9820557 12.89879 
1 1 1    3    9   11 o  815.631   6.4329  509.273   8.0309  509.107   11.334  509.440   11.381  815.382   9.0814  815.648   9.1162 -0.2650757 12.86763 
1 1 1    3    9   12 o  112.383   9.3508   9.7390   1.5939   7.0861   2.2856   12.250   2.2238   94.790   16.344  125.917   11.671 -31.12637 20.08302 
1 1 1    3    9   13 o  372.916   5.4493  106.455   3.1104  106.682   4.3967  106.228   4.4010  373.268   7.6954  372.471   7.7195 0.7966309 10.89999 
1 1 1    3    9   14 o  502.510   5.6177  193.309   4.3209  194.880   6.1309  191.758   6.0905  504.479   7.9399  500.421   7.9515 4.057709 11.23689 
1 1 1    3    9   15 o  315.880   5.9126   76.388   2.8587   80.780   4.1725   72.503   3.9245  324.781   8.3934  307.694   8.3329 17.08716 11.82736 
1 1 1    3    9   16 o  652.378   5.3874  325.807   5.3796  323.861   6.8686  328.895   8.6522  650.369   6.8999  655.319   8.6259 -4.950806 11.04599 
1 1 1    3    9   17 o  738.846   6.3382  417.938   7.1679  405.115   9.7936  432.730   10.519  727.296   8.7975  751.653   9.1430 -24.35773 12.68820 
1 1 1    3    9   18 o  343.231   5.7668   90.187   3.0297   92.913   4.2078   87.254   4.3657  348.331   7.8921  337.543   8.4501 10.78830 11.56238 
1 1 1    3    9   19 o  769.768   5.3842  453.595   6.3438  452.265   8.9518  454.936   8.9912  768.544   7.6098  770.809   7.6208 -2.265503 10.76970 
1 1 1    3    9   20 o  682.236   5.2012  356.290   5.4313  356.823   7.6607  355.750   7.7016  682.674   7.3313  681.645   7.3816 1.029663 10.40369 
1 1 1    3    9   21 o  538.386   5.5934  221.883   4.6094  226.000   7.5308  219.417   5.8287  543.259   9.0566  535.349   7.1133 7.910034 11.51605 
1 1 1    3    9   22 o  403.240   5.1080  124.463   3.1527  123.225   5.8551  124.968   3.7414  401.146   9.5359  404.044   6.0497 -2.898041 11.29302 
1 1 1    3    9   23 o  963.504   5.6986  710.606   8.4040  696.263   12.633  721.992   11.256  953.612   8.6552  971.121   7.5723 -17.50909 11.50016 
1 1 1    3    9   24 o  106.547   10.942   8.7853   1.7591   7.2602   2.6805   9.9390   2.3314   95.633   18.982  113.070   13.754 -17.43623 23.44126 
1 1 1    3    9   25 o  1838.45   9.1049  2587.80   25.621  2621.13   39.726  2564.06   33.526  1849.71   14.031  1829.71   11.971 19.99329 18.44395 
1 1 1    3    9   26 o  341.440   5.0316   89.233   2.6296   87.922   3.7222   90.539   3.7154  338.900   7.1756  343.908   7.0582 -5.008636 10.06513 
1 1 1    3    9   27 o  1158.11   6.0998  1026.66   10.813  1031.10   15.398  1022.33   15.187  1160.50   8.6689  1155.56   8.5862 4.943604 12.20131 
1 1 1    3    9   28 o  753.409   5.4829  434.483   6.3228  434.108   8.3160  434.998   9.7342  753.038   7.2148  753.770   8.4371 -0.7320557 11.10125 
1 1 1    3    9   29 o  219.042   7.2671   36.731   2.4365   32.253   3.3923   41.502   3.5017  204.931   10.854  232.805   9.8268 -27.87398 14.64120 
1 1 1    3    9   30 o   71.611   19.499   4.0607   2.1948   3.8713   3.0008   4.2785   3.2186   72.387   23.591   75.752   24.412 -3.365112 33.94806 
1 1 1    3    9   31 o  743.661   6.8042  423.376   7.7451  412.920   11.951  430.946   10.170  734.255   10.634  750.199   8.8563 -15.94379 13.83898 
1 1 1    3    9   32 o  300.392   9.1606   69.101   4.2119   68.618   5.6369   69.711   6.3377  299.267   12.306  301.601   13.729 -2.334290 18.43660 
1 1 1    3    9   33 o  599.790   5.5547  275.387   5.0995  264.959   7.1843  285.976   7.2396  588.248   7.9791  611.143   7.7393 -22.89478 11.11584 
1 1 1    3    9   34 o   81.554   22.045   5.2811   2.8175   6.5287   4.0516   4.1126   3.9208   91.435   27.051   77.419   26.966 14.01590 38.19619 
1 1 1    3    9   35 o  768.573   6.1698  452.235   7.2582  459.862   11.573  447.289   9.3189  774.821   9.7580  764.269   7.9661 10.55273 12.59672 
1 1 1    3    9   36 o  873.745   6.2662  584.500   8.3803  601.513   13.013  572.444   10.954  886.129   9.5941  864.557   8.2780 21.57239 12.67170 
1 1 1    3    9   37 o   87.595   24.900   6.0611   3.4962   2.3340   5.5957   8.4478   4.4778   77.801   31.090  102.892   27.782 -25.09073 41.69415 
1 1 1    3    9   38 o  619.859   6.1985  294.204   5.8810  297.467   8.8399  291.613   7.8771  623.090   9.2688  616.995   8.3409 6.094666 12.46923 
1 1 1    3    9   39 o  209.891   10.662   33.861   3.4140   32.522   4.7835   35.252   4.8740  205.203   15.341  213.728   14.994 -8.525223 21.45113 
1 1 1    3    9   40 o  221.291   10.194   37.547   3.4529   36.627   4.8053   38.529   4.9648  217.882   14.491  223.476   14.595 -5.594223 20.56711 
1 1 1    3    9   41 o  890.336   6.5944  607.209   8.9867  608.654   11.738  605.161   13.969  891.114   8.6058  888.265   10.275 2.849426 13.40257 
1 1 1    3    9   42 o   64.988   23.394   2.7562   2.9705   3.8759   4.0793   1.4922   4.3341   76.446   27.425   66.967   27.148 9.479019 38.58961 
1 1 1    3    9   43 o  580.020   6.3305  257.747   5.6202  253.033   8.2650  261.802   7.6652  574.320   9.4020  584.303   8.5707 -9.983276 12.72217 
1 1 1    3    9   44 o  225.370   10.768   39.007   3.7146   40.578   4.7223   36.458   6.0161  229.241   13.518  216.415   18.334 12.82578 22.77892 
1 1 1    3    9   45 o  169.374   13.006   22.208   3.3461   24.854   4.6185   19.284   4.8544  178.537   17.110  156.288   20.810 22.24881 26.94086 
1 1 1    3    9   46 o  271.719   8.5663   56.661   3.5627   49.273   4.9925   64.327   5.0857  252.612   12.956  289.200   11.489 -36.58784 17.31614 
1 1 1    3    9   47 o  193.954   12.018   29.074   3.5502   26.409   5.7764   30.692   4.5006  182.936   21.011  198.789   14.900 -15.85257 25.75773 
1 1 1    3    9   48 o  175.002   12.027   23.707   3.2020   19.354   4.4941   28.195   4.5632  156.572   19.152  190.189   15.819 -33.61728 24.83998 
1 1 1    3    9   49 o  210.951   13.277   34.504   4.2650   29.442   7.3940   37.028   5.2211  191.239   25.928  217.999   15.753 -26.75934 30.33895 
1 1 1    3    9   50 o  372.040   7.6272  106.292   4.3433  104.244   6.3659  108.076   5.9409  367.687   11.311  374.609   10.361 -6.921356 15.33939 
1 1 1    3    9   51 o  218.402   10.621   36.769   3.5504   39.429   5.0180   34.102   5.0240  224.980   14.652  208.851   15.834 16.12918 21.57305 
1 1 1    3    9   52 o   74.201   26.217   3.9546   3.7143   6.0068   4.6341   0.2677   6.2114   87.761   29.348   72.340   31.104 15.42136 42.76434 
1 1 1    3    9   53 o   79.842   24.268   5.1454   3.2284   5.4065   4.5418   4.8787   4.5898   84.283   29.042   81.819   29.118 2.464218 41.12577 
1 1 1    3    9   54 f   50.107   22.026  -0.6512   3.2624  -0.8613   4.5980  -0.4383   4.6295   59.169   26.075   60.677   26.466 -1.507488 37.15296 
1 1 1    3    9   55 o   96.595   24.032   7.7778   3.5388   3.8693   5.1705   11.222   4.8537   78.996   30.377  115.145   27.845 -36.14892 41.20785 
1 1 1    3    9   56 o  163.313   17.016   21.169   4.1909   24.615   5.4051   15.973   6.6365  174.861   20.589  135.559   32.421 39.30237 38.40642 
1 1 1    3    9   57 o  112.039   22.026   10.379   3.6426   7.5381   5.0188   13.541   5.2952   94.966   30.471  125.935   28.175 -30.96923 41.50058 
1 1 1    3    9   58 o  185.303   15.126   27.107   4.2528   37.427   6.4946   19.360   5.6269  215.683   19.897  152.291   25.008 63.39188 31.95755 
1 1 1    3    9   59 o  246.277   11.275   47.143   4.2501   44.048   5.7618   50.837   6.2945  235.702   16.066  253.143   16.332 -17.44025 22.91020 
1 1 1    3    9   60 o  153.507   21.266   19.445   4.8626   14.962   7.0235   23.572   6.7387  127.093   34.995  165.487   27.574 -38.39401 44.55293 
1 1 1    3    9   61 o  110.899   26.584   10.779   4.4538   18.843   8.0643   7.2395   5.3426  140.318   37.014   91.639   31.503 48.67834 48.60532 
1 1 1    3    9   62 o  171.015   16.827   23.646   4.3476   17.432   6.8196   27.902   5.6429  136.594   32.990  183.670   20.418 -47.07626 38.79724 
1 1 1    3    9   63 o   89.147   27.158   7.1441   4.0399   8.9493   5.1410   4.2299   6.5321   97.984   30.772   80.451   33.055 17.53289 45.16129 
1 1 1    3    9   64 o  193.041   13.198   29.747   3.8762   32.040   5.2760   27.057   5.7137  197.243   17.663  178.304   21.361 18.93938 27.71741 
1 1 1    3    9   65 o   67.330   25.807   3.4089   3.7244   4.6399   5.3713   2.2690   5.1688   77.013   30.560   68.013   28.777 9.000290 41.97666 
1 1 1    3   10    1 o  1202.75   16.422  1108.69   30.231   0.0000   0.0000  1108.69   30.231  ?   ?   1202.75   16.422 0.000000 16.42154 
1 1 1    3   10    2 o  1678.42   15.328  2158.65   39.379  2214.55   57.458  2109.14   54.075  1698.87   22.096  1658.09   21.307 40.77429 30.69576 
1 1 1    3   10    3 o  1229.72   11.820  1158.19   22.249  1190.57   32.425  1129.39   30.585  1246.29   16.998  1213.91   16.461 32.38293 23.66179 
1 1 1    3   10    4 o  1446.69   13.508  1603.34   29.911  1619.73   42.826  1587.73   41.796  1453.31   19.252  1438.93   18.977 14.38586 27.03243 
1 1 1    3   10    5 o  654.688   6.5293  328.105   6.5429  328.841   11.299  327.734   8.0253  655.266   11.265  654.278   8.0137 0.9881592 13.82494 
1 1 1    3   10    6 o  722.033   5.9446  399.065   6.5698  399.602   9.3265  398.536   9.2561  722.443   8.4342  721.480   8.3817 0.9627075 11.89073 
1 1 1    3   10    7 o  878.093   7.6716  590.305   10.311  591.354   12.647  588.224   17.807  878.794   9.4019  876.231   13.277 2.562988 16.26908 
1 1 1    3   10    8 o  681.719   6.7081  355.775   6.9996  358.351   8.6150  350.770   12.007  684.133   8.2270  676.713   11.592 7.420105 14.21466 
1 1 1    3   10    9 o  598.127   5.5669  273.853   5.0966  278.030   7.2333  269.736   7.1823  602.608   7.8421  593.550   7.9057 9.057739 11.13541 
1 1 1    3   10   10 o  654.339   5.8028  327.757   5.8118  321.966   8.0511  334.057   8.3979  648.458   8.1116  660.514   8.3066 -12.05621 11.61021 
1 1 1    3   10   11 o  921.182   6.9514  649.673   9.8014  642.814   13.706  656.851   14.021  916.137   9.7745  926.078   9.8918 -9.940430 13.90637 
1 1 1    3   10   12 o  102.591   10.338   8.1440   1.6013   7.6510   2.2450   8.6545   2.2846   98.725   15.355  105.250   14.572 -6.525322 21.16924 
1 1 1    3   10   13 o  700.628   6.1089  375.803   6.5511  376.603   9.2767  375.006   9.2528  701.258   8.6426  699.769   8.6387 1.488159 12.21975 
1 1 1    3   10   14 o  665.921   6.0422  339.495   6.1587  340.382   8.7555  338.625   8.6647  666.676   8.5802  664.958   8.5131 1.718689 12.08689 
1 1 1    3   10   15 f  791.634   6.5424  479.806   7.9274  473.075   11.073  486.884   11.355  785.904   9.2048  797.286   9.3044 -11.38110 13.08816 
1 1 1    3   10   16 o  368.525   6.7870  103.983   3.8284   99.936   4.5568  113.692   7.0585  361.246   8.2412  385.172   11.973 -23.92542 14.53482 
1 1 1    3   10   17 o  955.611   8.4209  699.334   12.317  707.546   15.113  683.093   21.255  961.052   10.274  943.820   14.713 17.23254 17.94534 
1 1 1    3   10   18 o  930.659   6.4712  663.096   9.2182  647.910   11.587  689.283   15.216  919.839   8.2297  948.583   10.480 -28.74335 13.32470 
1 1 1    3   10   19 o  1052.65   6.3659  848.291   10.257  852.061   14.539  844.555   14.472  1054.81   9.0049  1050.16   9.0035 4.656250 12.73390 
1 1 1    3   10   20 f  259.724   5.5817   51.637   2.2190   52.408   3.1614   50.888   3.1153  261.627   7.8946  257.805   7.8947 3.821869 11.16469 
1 1 1    3   10   21 o  763.163   6.0626  445.839   7.0818  451.017   11.473  442.652   9.0010  767.436   9.7675  760.373   7.7338 7.062256 12.45853 
1 1 1    3   10   22 o  1055.94   6.4866  853.544   10.484  854.883   14.848  852.212   14.805  1056.64   9.1809  1054.98   9.1681 1.651123 12.97473 
1 1 1    3   10   23 o  519.634   6.3600  206.695   5.0585  198.753   7.3586  213.811   6.9653  509.485   9.4361  528.454   8.6112 -18.96921 12.77473 
1 1 1    3   10   24 o  864.078   6.4570  571.530   8.5399  574.521   13.447  569.508   11.056  866.200   10.142  862.485   8.3747 3.714478 13.15282 
1 1 1    3   10   25 o  256.286   6.6758   50.279   2.6188   52.582   3.7131   48.000   3.6939  262.061   9.2569  250.379   9.6388 11.68161 13.36397 
1 1 1    3   10   26 o  1055.22   6.1575  852.341   9.9452  841.920   15.054  860.410   13.248  1048.62   9.3794  1060.13   8.1641 -11.51025 12.43488 
1 1 1    3   10   27 o  724.985   6.5213  402.344   7.2366  394.584   11.519  407.404   9.3014  717.831   10.484  729.477   8.3304 -11.64667 13.39035 
1 1 1    3   10   28 o  1097.88   6.9608  922.715   11.697  910.313   16.346  935.730   16.745  1090.33   9.7948  1105.44   9.8968 -15.11023 13.92420 
1 1 1    3   10   29 o  271.751   6.3295   56.531   2.6328   57.021   3.7627   56.061   3.6851  272.892   9.0081  270.586   8.8977 2.305847 12.66157 
1 1 1    3   10   30 f  557.347   5.6748  237.784   4.8411  234.875   7.6919  239.692   6.2298  553.836   9.0737  559.541   7.2740 -5.704773 11.62936 
1 1 1    3   10   31 o  515.608   7.5343  203.541   5.9461  197.503   8.2645  210.021   8.5615  507.801   10.633  523.646   10.682 -15.84421 15.07183 
1 1 1    3   10   32 o  683.792   5.7540  357.929   6.0223  356.943   8.0255  359.199   9.1111  682.782   7.6793  684.894   8.6912 -2.111938 11.59775 
1 1 1    3   10   33 o  427.371   6.0105  139.823   3.9317  144.126   5.5902  135.610   5.5309  433.835   8.4184  420.819   8.5868 13.01596 12.02510 
1 1 1    3   10   34 o  403.083   6.9587  124.399   4.2933  120.208   6.7687  127.220   5.5533  396.100   11.164  407.572   8.9018 -11.47128 14.27882 
1 1 1    3   10   35 o  536.718   6.7512  220.559   5.5462  215.859   8.1877  224.544   7.5393  530.824   10.077  541.446   9.0972 -10.62219 13.57606 
1 1 1    3   10   36 o  453.087   6.8861  157.190   4.7756  152.624   6.1744  163.989   7.5341  446.375   9.0371  462.616   10.640 -16.24158 13.95985 
1 1 1    3   10   37 o  231.424   10.907   41.048   3.8636   39.623   6.8464   41.714   4.6801  226.112   19.988  232.844   13.186 -6.732285 23.94533 
1 1 1    3   10   38 o  495.136   6.4052  187.734   4.8543  183.507   7.1133  191.418   6.6411  489.359   9.4967  499.848   8.6803 -10.48941 12.86602 
1 1 1    3   10   39 o  561.154   6.0071  241.137   5.1596  240.529   7.3975  241.713   7.2001  560.268   8.6262  561.666   8.3751 -1.397461 12.02308 
1 1 1    3   10   40 o  644.871   6.4491  318.515   6.3656  324.970   8.3337  309.474   9.8629  651.197   8.3610  635.282   10.143 15.91534 13.14485 
1 1 1    3   10   41 o  349.795   7.2351   93.748   3.8737   88.306   5.4243   99.413   5.5338  339.279   10.445  360.017   10.042 -20.73773 14.48960 
1 1 1    3   10   42 o  142.212   13.835   15.697   2.9734   19.176   4.2703   12.422   4.1427  156.628   18.148  124.771   22.521 31.85742 28.92326 
1 1 1    3   10   43 o  331.334   7.6337   84.156   3.8714   88.894   5.7318   80.181   5.2499  340.233   11.006  323.167   10.613 17.06537 15.29004 
1 1 1    3   10   44 o  187.360   12.318   27.108   3.5128   27.536   4.3740   26.332   5.8956  188.383   15.302  182.976   21.458 5.406738 26.35498 
1 1 1    3   10   45 o  197.177   10.472   29.953   3.1492   27.998   4.4874   31.849   4.4205  189.838   15.581  202.773   14.335 -12.93410 21.17203 
1 1 1    3   10   46 o  595.259   6.0475  271.565   5.5100  274.327   7.8932  268.940   7.6951  597.835   8.6259  591.962   8.4928 5.872559 12.10508 
1 1 1    3   10   47 o  212.873   10.996   34.955   3.5705   36.181   5.8895   34.243   4.4896  215.178   18.049  210.164   14.037 5.013153 22.86488 
1 1 1    3   10   48 o  146.372   14.603   16.727   3.2280   17.750   4.4977   15.640   4.6356  149.546   20.163  139.617   22.453 9.928497 30.17740 
1 1 1    3   10   49 o  191.339   12.568   28.379   3.6602   19.391   6.1218   33.379   4.5662  154.164   26.923  207.168   14.491 -53.00403 30.57542 
1 1 1    3   10   50 o  125.231   16.940   12.420   3.1637   14.305   4.4943   10.569   4.4543  132.899   22.922  113.047   26.247 19.85191 34.84681 
1 1 1    3   10   51 o   74.700   23.685   4.3843   3.0392   5.5385   4.4139   3.3436   4.1910   84.923   28.641   73.187   27.534 11.73581 39.72936 
1 1 1    3   10   52 o   73.239   25.472   3.9325   3.4975   6.5512   4.3043  -1.1572   6.0007   89.974   28.141   67.234   29.700 22.74021 40.91449 
1 1 1    3   10   53 o   89.387   23.211   6.5966   3.2039   11.083   4.6071   2.3948   4.4585  115.156   26.664   70.020   27.824 45.13532 38.53761 
1 1 1    3   10   54 o  263.834   9.9259   53.701   4.0084   53.787   5.7623   53.620   5.5796  262.518   14.395  262.264   13.949 0.2532043 20.04538 
1 1 1    3   10   55 o  182.299   14.282   26.041   3.9532   23.890   5.2905   28.761   5.9484  172.455   20.440  189.231   20.885 -16.77605 29.22311 
1 1 1    3   10   56 o  184.221   13.619   26.567   3.8130   22.793   5.2581   30.752   5.5375  167.998   20.900  196.441   18.640 -28.44307 28.00464 
1 1 1    3   10   57 o  190.363   13.245   28.362   3.8351   29.639   5.3676   27.030   5.4816  192.673   18.425  183.316   19.853 9.357880 27.08597 
1 1 1    3   10   58 o  104.313   25.322   9.2557   4.0023   11.648   5.9716   7.3045   5.3928  114.746   32.515   93.724   31.658 21.02195 45.38178 
1 1 1    3   10   59 o  185.816   14.085   27.230   3.9762   29.940   5.3570   23.906   5.9335  192.959   18.359  169.664   23.477 23.29460 29.80368 
1 1 1    3   10   60 o  125.404   22.393   13.197   4.1405   6.9488   6.6898   17.077   5.2716   92.960   34.823  141.490   25.269 -48.52972 43.02456 
1 1 1    3   10   61 o  181.441   17.377   26.580   4.7669   21.699   8.1885   29.083   5.8627  151.566   35.857  187.854   20.735 -36.28755 41.42060 
1 1 1    3   10   62 o  144.984   18.077   17.227   3.9245   20.368   5.1998   13.071   5.9822  155.135   22.559  118.041   32.212 37.09371 39.32567 
1 1 1    3   10   63 o  156.348   17.503   20.072   4.1167   17.921   5.2054   23.664   6.7264  143.076   24.660  161.915   28.164 -18.83981 37.43398 
1 1 1    3   10   64 o   69.734   25.711   3.8772   3.6185   4.4510   4.9836   3.2374   5.2625   75.896   29.644   72.121   29.655 3.775352 41.93066 
1 1 1    3   11    1 o  2586.77   32.367  5152.84  128.152   0.0000   0.0000  5152.84  128.152  ?   ?   2586.77   32.367 0.000000 32.36667 
1 1 1    3   11    2 o  1101.21   15.442  929.394   26.029   0.0000   0.0000  929.394   26.029  ?   ?   1101.21   15.442 0.000000 15.44222 
1 1 1    3   11    3 o  621.679   7.8345  295.893   7.4550  297.689   10.564  294.112   10.522  623.447   11.071  619.689   11.093 3.757202 15.67200 
1 1 1    3   11    4 o  941.433   8.0248  678.568   11.564  690.317   14.420  657.399   19.356  949.448   9.9225  926.281   13.652 23.16675 16.87695 
1 1 1    3   11    5 f  1247.42   12.047  1191.98   23.003  1191.98   23.003   0.0000   0.0000  1247.42   12.047  ?   ?  0.000000 12.04750 
1 1 1    3   11    6 o  450.538   5.9567  155.384   4.1078  153.973   5.0031  158.303   7.1955  448.461   7.2887  454.642   10.340 -6.180847 12.65077 
1 1 1    3   11    7 o  770.232   6.2181  454.150   7.3307  464.318   10.547  444.647   10.197  778.699   8.8487  762.030   8.7420 16.66888 12.43870 
1 1 1    3   11    8 o  1403.32   9.3838  1508.11   20.156  1505.32   28.438  1510.92   28.572  1401.57   13.256  1404.17   13.294 -2.597168 18.77367 
1 1 1    3   11    9 o  1156.19   8.0980  1023.58   14.331  1017.43   20.126  1029.92   20.412  1152.42   11.410  1159.46   11.501 -7.042603 16.20063 
1 1 1    3   11   10 o  887.518   6.8111  603.065   9.2526  609.303   13.197  597.035   12.976  891.919   9.6669  882.899   9.6019 9.019897 13.62519 
1 1 1    3   11   11 o  279.528   8.0200   59.832   3.4314   0.0000   0.0000   59.832   3.4314  ?   ?   279.528   8.0200 0.000000 8.020024 
1 1 1    3   11   12 o  399.785   5.4358  122.352   3.3263  120.426   4.6670  124.340   4.7421  396.574   7.6886  402.966   7.6884 -6.391632 10.87315 
1 1 1    3   11   13 o  332.745   5.6817   84.761   2.8938   84.587   4.0933   84.934   4.0915  332.354   8.0465  333.035   8.0264 -0.6811523 11.36521 
1 1 1    3   11   14 o  469.795   5.6382  168.961   4.0544  168.865   5.7150  169.058   5.7526  469.592   7.9511  469.859   7.9988 -0.2671814 11.27838 
1 1 1    3   11   15 o  670.872   12.419  344.935   12.752   0.0000   0.0000  344.935   12.752  ?   ?   670.872   12.419 0.000000 12.41874 
1 1 1    3   11   16 o  577.880   11.967  255.901   10.585  255.901   10.585   0.0000   0.0000  577.880   11.967  ?   ?  0.000000 11.96666 
1 1 1    3   11   17 f  799.959   6.7234  489.937   8.2324  488.087   11.616  491.804   11.669  798.296   9.5062  801.330   9.5141 -3.033630 13.44932 
1 1 1    3   11   18 o  1166.27   8.3852  1041.55   14.969  1043.56   21.224  1039.56   21.114  1167.08   11.881  1164.84   11.842 2.237183 16.77502 
1 1 1    3   11   19 o  880.032   7.1604  592.918   9.6451  596.909   13.754  589.056   13.529  882.826   10.179  877.006   10.078 5.820251 14.32408 
1 1 1    3   11   20 o  295.504   6.8738   66.849   3.1091   53.289   4.3874   80.527   4.4064  263.776   10.867  324.296   8.8772 -60.52063 14.03182 
1 1 1    3   11   21 o  131.671   8.8170   13.334   1.7667   11.249   2.5108   15.378   2.4864  120.375   13.881  141.223   11.605 -20.84783 18.09356 
1 1 1    3   11   22 f  647.655   5.6732  321.073   5.6239  320.236   7.3419  322.262   8.7487  646.770   7.4163  648.773   8.8101 -2.003052 11.51605 
1 1 1    3   11   23 o  1061.95   7.9306  863.347   12.891  855.115   18.102  871.817   18.362  1056.70   11.192  1066.97   11.243 -10.26672 15.86401 
1 1 1    3   11   24 o  1102.29   6.7602  930.104   11.406  917.984   15.899  942.955   16.372  1094.96   9.4865  1109.75   9.6382 -14.78418 13.52370 
1 1 1    3   11   25 o  1128.69   6.9247  975.209   11.963  982.797   17.057  967.863   16.783  1132.94   9.8362  1124.30   9.7528 8.635986 13.85163 
1 1 1    3   11   26 o  813.723   5.9823  506.845   7.4510  520.419   10.765  494.359   10.324  824.468   8.5302  803.565   8.3936 20.90283 11.96733 
1 1 1    3   11   27 o  1539.08   8.6361  1813.61   20.345  1797.02   28.461  1830.95   29.093  1531.72   12.139  1546.09   12.294 -14.37476 17.27716 
1 1 1    3   11   28 o   96.761   21.427   7.4675   3.0898   13.228   5.6893   5.0576   3.6797  128.595   29.528   81.969   26.069 46.62667 39.38868 
1 1 1    3   11   29 o  534.940   6.9048  219.069   5.6536  213.177   9.2899  222.536   7.1249  527.554   11.505  539.109   8.6344 -11.55548 14.38437 
1 1 1    3   11   30 f  680.847   6.7612  354.874   7.0460  343.239   10.859  363.334   9.2599  669.440   10.598  688.841   8.7825 -19.40076 13.76400 
1 1 1    3   11   31 o  867.441   7.1972  576.082   9.5560  585.437   12.542  563.134   14.755  874.340   9.3714  857.402   11.243 16.93738 14.63658 
1 1 1    3   11   32 o  715.244   5.4240  391.606   5.9380  393.980   8.4342  389.272   8.3616  717.324   7.6817  713.027   7.6615 4.297729 10.84927 
1 1 1    3   11   33 o  499.981   5.6774  191.367   4.3448  187.794   6.1171  195.004   6.1723  495.222   8.0701  504.642   7.9909 -9.419495 11.35695 
1 1 1    3   11   34 o  1085.46   6.7340  902.095   11.188  916.752   17.577  892.111   14.506  1093.91   10.497  1079.28   8.7812 14.63501 13.68599 
1 1 1    3   11   35 o  450.974   6.0745  155.707   4.1931  161.234   6.0305  150.534   5.8342  458.822   8.5870  443.335   8.5976 15.48660 12.15132 
1 1 1    3   11   36 o  800.813   6.6451  491.049   8.1453  513.131   12.566  475.047   10.697  818.355   10.032  787.500   8.8742 30.85431 13.39377 
1 1 1    3   11   37 o  270.203   8.3874   55.927   3.4688   55.636   5.0870   56.181   4.7425  269.350   12.339  270.705   11.446 -1.354767 16.82998 
1 1 1    3   11   38 o  601.914   5.8275  277.418   5.3689  275.270   7.5991  279.560   7.5865  599.419   8.2825  604.077   8.2050 -4.658691 11.65855 
1 1 1    3   11   39 o  417.055   6.4509  133.213   4.1180  134.305   5.7809  132.088   5.8675  418.613   9.0223  415.129   9.2342 3.483887 12.91011 
1 1 1    3   11   40 o  552.044   6.5178  233.433   5.5073  233.195   7.0300  233.811   8.8613  551.612   8.3262  552.111   10.486 -0.4996338 13.38947 
1 1 1    3   11   41 o  577.641   5.9510  255.572   5.2616  248.404   7.3404  263.147   7.5459  569.249   8.4246  585.899   8.4143 -16.65039 11.90688 
1 1 1    3   11   42 o  473.345   6.4660  171.661   4.6847  173.592   6.9493  170.053   6.3425  475.691   9.5444  470.901   8.7996 4.789886 12.98184 
1 1 1    3   11   43 o  158.470   14.003   19.479   3.3616   16.777   4.3612   23.433   5.2767  145.880   20.063  172.784   20.342 -26.90375 28.57096 
1 1 1    3   11   44 o  489.061   6.4269  183.297   4.8110  180.236   6.4980  187.012   7.1571  484.678   8.7591  493.599   9.4731 -8.920959 12.90197 
1 1 1    3   11   45 o  287.111   7.7667   63.227   3.4132   64.017   4.9051   62.485   4.7524  288.567   11.105  285.116   10.890 3.450134 15.55368 
1 1 1    3   11   46 o  126.933   16.541   12.672   3.1374   17.944   5.0953   9.4518   3.9818  149.907   22.936  107.729   24.678 42.17837 33.69035 
1 1 1    3   11   47 o  253.928   9.5929   49.555   3.7284   51.578   6.1996   48.408   4.6667  257.671   15.795  250.653   12.164 7.017593 19.93619 
1 1 1    3   11   48 o  195.675   10.975   29.574   3.2737   26.024   4.4166   33.903   4.8770  182.548   15.967  208.674   15.378 -26.12563 22.16811 
1 1 1    3   11   49 o   42.434   20.037  -3.7492   3.4097  -9.6057   6.1666  -1.1702   4.0922   51.992   25.175   55.121   24.429 -3.129162 35.07942 
1 1 1    3   11   50 o  140.714   14.238   15.495   3.0244   10.410   4.2082   20.929   4.3496  112.374   25.099  162.875   17.734 -50.50040 30.73207 
1 1 1    3   11   51 o  133.377   15.421   14.005   3.0902   13.849   4.3864   14.158   4.3542  130.574   22.776  132.202   22.312 -1.627625 31.88362 
1 1 1    3   11   52 o  107.196   22.947   9.4476   3.6513   9.5329   4.5651   9.2960   6.0834  106.719   27.704  105.877   33.503 0.8423920 43.47351 
1 1 1    3   11   53 o  239.131   10.241   44.120   3.7482   40.126   5.6124   47.335   5.0360  226.098   16.327  246.638   13.390 -20.54008 21.11568 
1 1 1    3   11   54 o   84.429   23.893   5.8775   3.2266   7.4482   4.7278   4.5082   4.4144   94.881   29.463   79.132   28.514 15.74992 41.00162 
1 1 1    3   11   55 o   85.844   26.081   6.0673   3.7295   1.6370   4.6672   13.893   6.2032   67.757   27.902  126.665   31.988 -58.90792 42.44674 
1 1 1    3   11   56 o  171.780   14.114   23.165   3.6782   23.147   5.2606   23.183   5.1449  169.311   20.732  169.663   20.209 -0.3520050 28.95261 
1 1 1    3   11   57 o  246.453   10.747   47.053   4.0542   50.792   5.6491   43.082   5.8218  254.385   14.569  233.435   16.398 20.94942 21.93492 
1 1 1    3   11   58 o  211.421   15.475   35.337   4.9729   47.219   12.129   32.936   5.4522  230.445   35.530  203.070   17.719 27.37535 39.70264 
1 1 1    3   11   59 o  222.061   13.632   38.790   4.6110   34.049   7.3494   41.867   5.9214  202.206   24.229  229.036   17.012 -26.83058 29.60469 
1 1 1    3   11   60 o   83.844   28.031   5.8957   4.2275   7.6047   8.1618   5.2690   4.9422   97.705   37.999   82.159   30.084 15.54673 48.46644 
1 1 1    3   11   61 o  155.234   16.345   19.414   3.8252   18.942   5.3059   19.925   5.5198  149.184   24.054  152.847   24.415 -3.662750 34.27415 
1 1 1    3   11   62 o   58.479   24.609   1.0925   3.7468  -0.5995   4.8782   3.5268   5.8512   59.415   26.483   76.584   31.354 -17.16854 41.04148 
1 1 1    3   11   63 o  141.332   20.425   16.873   4.2903   20.602   5.1136   8.0065   7.8849  155.166   22.160   94.239   37.143 60.92760 43.25116 
1 1 1    3   11   64 o  154.905   16.258   19.670   3.7973   18.083   5.4242   21.196   5.3179  141.596   25.985  156.025   22.954 -14.42883 34.67114 
1 1 1    3   12    3 o  1078.44   15.295  891.560   25.247  891.560   25.247   0.0000   0.0000  1078.44   15.295  ?   ?  0.000000 15.29475 
1 1 1    3   12    4 o  363.971   5.9583  101.411   3.3194  105.189   4.0988   94.210   5.6583  370.667   7.2245  350.715   10.541 19.95184 12.77875 
1 1 1    3   12    5 o  1249.20   9.8783  1195.15   18.888  1204.52   23.345  1177.39   32.139  1253.85   12.164  1239.01   16.947 14.84546 20.86052 
1 1 1    3   12    6 o  453.853   5.2393  157.675   3.6396  157.373   5.1274  157.982   5.1672  453.370   7.3888  454.245   7.4318 -0.8748169 10.47981 
1 1 1    3   12    7 o  621.042   5.7203  295.256   5.4376  293.517   7.6614  297.021   7.7188  619.128   8.0845  622.812   8.0970 -3.684143 11.44206 
1 1 1    3   12    8 o  981.021   7.2442  736.872   10.878  732.562   15.292  741.286   15.477  977.930   10.216  983.730   10.278 -5.800232 14.49201 
1 1 1    3   12    9 o  1576.60   10.373  1904.11   25.032  1903.10   35.389  1905.11   35.412  1575.43   14.676  1576.27   14.677 -0.8342285 20.75557 
1 1 1    3   12   10 o  1043.30   7.5884  833.457   12.118  839.751   17.268  827.350   17.010  1046.95   10.776  1039.20   10.694 7.751221 15.18125 
1 1 1    3   12   11 o  350.790   5.5056   94.201   2.9561   93.233   4.1685   95.181   4.1929  348.932   7.8049  352.559   7.7698 -3.626831 11.01296 
1 1 1    3   12   12 o  507.116   5.6202  196.872   4.3624  202.000   6.2136  191.887   6.1261  513.604   7.9040  500.580   7.9955 13.02448 11.24278 
1 1 1    3   12   13 o  800.219   7.5686  490.328   9.2703  488.213   11.264  494.767   16.319  798.389   9.2177  803.393   13.270 -5.003601 16.15767 
1 1 1    3   12   14 o   45.123   19.583  -0.4153   2.5081   0.5318   3.3408  -1.6386   3.7969   56.404   23.450   52.119   23.287 4.284878 33.04831 
1 1 1    3   12   15 o  621.193   7.0391  295.446   6.6929  283.665   11.313  301.790   8.3014  608.425   12.148  627.758   8.6395 -19.33398 14.90687 
1 1 1    3   12   16 o  337.972   6.1457   87.445   3.1792   82.982   4.3933   92.352   4.6065  329.184   8.7193  347.272   8.6663 -18.08838 12.29352 
1 1 1    3   12   17 o  471.383   6.0584  170.101   4.3712  173.243   6.2970  167.179   6.0728  475.648   8.6492  467.254   8.4911 8.394287 12.12055 
1 1 1    3   12   18 o  491.670   6.1543  185.055   4.6315  182.898   6.5100  187.266   6.5905  488.733   8.7025  494.534   8.7067 -5.801208 12.31016 
1 1 1    3   12   19 o  453.855   6.2000  157.681   4.3070  159.345   6.1316  156.060   6.0512  456.188   8.7814  451.462   8.7569 4.726135 12.40145 
1 1 1    3   12   20 o  373.402   5.6325  106.727   3.2192  107.435   4.0853  105.567   5.2288  374.618   7.1247  371.311   9.2001 3.307068 11.63627 
1 1 1    3   12   21 o  376.914   7.0177  108.752   4.0486  106.087   4.8569  114.821   7.3293  372.243   8.5244  387.179   12.368 -14.93616 15.02067 
1 1 1    3   12   22 o  261.564   9.6228   52.384   3.8525   52.384   3.8525   0.0000   0.0000  261.564   9.6228  ?   ?  0.000000 9.622769 
1 1 1    3   12   23 o  1663.58   9.0627  2118.88   23.077  2126.64   32.802  2111.27   32.471  1666.27   12.861  1660.25   12.778 6.022339 18.12960 
1 1 1    3   12   24 o  1105.60   6.7885  935.705   11.488  942.721   16.378  928.908   16.118  1109.61   9.6429  1101.45   9.5606 8.154663 13.57904 
1 1 1    3   12   25 o  508.710   5.5752  198.084   4.3411  190.175   5.9490  207.093   6.3490  498.412   7.7981  520.104   7.9753 -21.69263 11.15413 
1 1 1    3   12   26 o  295.399   7.7882   66.804   3.5214   64.492   6.0394   67.995   4.3344  290.143   13.599  297.997   9.5028 -7.853455 16.59034 
1 1 1    3   12   27 o  1075.80   7.5759  886.032   12.475  891.032   20.038  882.867   15.941  1078.55   12.138  1073.76   9.6994 4.786377 15.53708 
1 1 1    3   12   28 o  286.177   7.4925   62.699   3.2819   58.481   4.6302   66.958   4.6526  276.329   10.947  295.690   10.280 -19.36133 15.01726 
1 1 1    3   12   29 o  123.771   19.911   12.050   3.6442   7.5552   4.3601   22.469   6.6379   97.892   27.799  168.934   26.547 -71.04226 38.43855 
1 1 1    3   12   30 o  243.041   11.662   45.250   4.3385   43.777   4.6718   54.484   11.695  238.683   12.835  264.400   29.395 -25.71698 32.07502 
1 1 1    3   12   31 o  232.383   10.094   41.361   3.5902   40.643   5.1149   42.058   5.0405  229.796   14.618  233.818   14.151 -4.022217 20.34519 
1 1 1    3   12   32 o  721.184   5.9700  398.163   6.5901  409.793   10.607  390.851   8.4105  731.476   9.4734  714.461   7.6908 17.01489 12.20218 
1 1 1    3   12   33 o  729.020   6.7022  406.906   7.4787  412.787   14.298  404.691   8.7749  733.882   12.728  726.977   7.8859 6.905334 14.97320 
1 1 1    3   12   34 o  185.521   13.407   26.524   3.7816   14.963   8.9375   29.045   4.1736  137.398   40.044  194.109   14.145 -56.71103 42.46886 
1 1 1    3   12   35 o  903.969   6.2563  625.653   8.6565  617.546   11.613  635.790   12.986  897.933   8.4497  911.024   9.3123 -13.09076 12.57446 
1 1 1    3   12   36 o  483.911   7.3757  179.335   5.4631  164.074   8.6284  189.547   7.0581  462.591   12.186  497.399   9.2707 -34.80746 15.31159 
1 1 1    3   12   37 o  521.509   5.9168  208.249   4.7230  216.734   6.8542  200.577   6.5172  531.891   8.4190  511.687   8.3212 20.20367 11.83735 
1 1 1    3   12   38 o  343.982   6.9250   90.627   3.6461   92.393   5.1744   88.886   5.1384  347.182   9.7373  340.522   9.8586 6.660370 13.85664 
1 1 1    3   12   39 o  760.966   6.3237  443.509   7.3656  437.188   9.4957  453.056   11.670  755.326   8.2134  768.685   9.9191 -13.35852 12.87818 
1 1 1    3   12   40 o  620.200   6.3606  294.636   6.0381  289.292   7.7029  303.154   9.7245  614.372   8.1913  628.679   10.106 -14.30719 13.00864 
1 1 1    3   12   41 o  602.789   5.7852  278.310   5.3377  273.991   7.5211  282.693   7.5766  597.841   8.2192  607.269   8.1512 -9.428284 11.57568 
1 1 1    3   12   42 o  247.945   8.5454   47.145   3.2431   45.345   4.6958   48.786   4.4843  242.542   12.693  252.006   11.626 -9.464142 17.21252 
1 1 1    3   12   43 o  323.575   8.1397   80.294   4.0314   84.604   4.9970   72.259   6.8226  331.990   9.8337  306.269   14.554 25.72092 17.56468 
1 1 1    3   12   44 o  210.028   9.3109   33.861   2.9932   32.709   4.2125   35.035   4.2539  205.658   13.456  212.930   13.116 -7.272430 18.79090 
1 1 1    3   12   45 o  414.979   6.5095  132.008   4.1347  126.629   5.8089  137.532   5.8865  406.084   9.3456  423.245   9.0864 -17.16022 13.03472 
1 1 1    3   12   46 o  441.020   6.8938  149.156   4.6536  138.593   7.1945  156.755   6.1020  424.434   11.074  451.821   8.8234 -27.38669 14.15959 
1 1 1    3   12   47 o  526.791   6.3975  212.798   5.1584  203.800   6.9003  224.199   7.7666  515.092   8.7521  540.105   9.3947 -25.01343 12.83975 
1 1 1    3   12   48 o   73.787   24.705   4.0887   3.2836  -0.9570   5.8264   6.4373   3.9751   67.270   29.507   89.403   26.873 -22.13300 39.91010 
1 1 1    3   12   49 f  213.566   10.276   35.124   3.3591   38.147   4.8074   32.241   4.6954  221.488   14.256  203.322   15.197 18.16548 20.83753 
1 1 1    3   12   50 o   55.376   22.068   1.3214   2.8120   5.9447   3.9651  -3.3564   3.9884   86.205   27.017   48.125   22.380 38.08055 35.08265 
1 1 1    3   12   51 o  103.657   21.966   8.7929   3.3768   8.7032   4.1556   8.9673   5.7935  102.324   26.368  104.245   32.655 -1.920624 41.97176 
1 1 1    3   12   52 o  170.296   12.477   22.565   3.2296   22.516   4.4524   22.620   4.6917  168.790   17.487  168.885   18.450 -0.9541321E-01 25.42054 
1 1 1    3   12   53 o  213.149   10.863   35.185   3.5324   35.915   5.1702   34.546   4.8376  213.933   15.903  210.035   15.149 3.897461 21.96364 
1 1 1    3   12   54 o  109.202   21.374   9.7777   3.4448   12.228   5.1706   7.8223   4.6192  120.056   28.554   96.717   28.946 23.33829 40.65972 
1 1 1    3   12   55 o   80.639   25.867   5.2352   3.6171   0.1392   4.5740   13.741   5.9094   61.904   26.655  126.246   30.844 -64.34227 40.76588 
1 1 1    3   12   56 o  126.108   18.499   12.821   3.4647   6.9257   4.9012   18.708   4.8983   91.774   30.162  151.516   21.744 -59.74239 37.18257 
1 1 1    3   12   57 o  279.454   11.256   60.595   4.8146   57.950   7.9316   62.138   6.0585  269.089   19.387  281.922   14.040 -12.83295 23.93707 
1 1 1    3   12   58 o  137.388   22.844   15.687   4.6352   18.450   11.104   15.104   5.1009  136.899   45.419  133.310   25.932 3.588882 52.30041 
1 1 1    3   12   59 o  182.682   13.773   26.337   3.8229   27.339   5.2850   25.237   5.5366  183.665   19.078  175.355   21.048 8.309814 28.40789 
1 1 1    3   12   60 o  107.841   26.070   10.146   4.2557   5.8603   7.7402   12.002   5.0949   91.085   36.506  116.134   28.803 -25.04942 46.50000 
1 1 1    3   12   61 o  152.832   16.054   18.819   3.6993   27.681   5.1693   9.5169   5.2964  184.172   18.592  102.068   31.096 82.10366 36.23042 
1 1 1    3   12   62 o  289.413   9.4810   65.217   4.1999   69.004   5.8444   61.174   6.0395  295.540   12.920  276.976   14.295 18.56357 19.26804 
1 1 1    3   12   63 o  102.701   23.791   9.3569   3.6665   9.6709   4.9297   8.9681   5.4852  101.122   29.817   96.819   31.912 4.302948 43.67409 
1 1 1    3   12   64 o   67.234   25.788   3.3688   3.7206   3.6739   5.1469   3.0349   5.3845   72.980   29.585   71.481   29.749 1.498756 41.95538 
1 1 1    3   13    1 o  340.644   10.307   88.883   5.3740   0.0000   0.0000   88.883   5.3740  ?   ?   340.644   10.307 0.000000 10.30698 
1 1 1    3   13    2 o  466.470   10.478  166.679   7.4813   0.0000   0.0000  166.679   7.4813  ?   ?   466.470   10.478 0.000000 10.47817 
1 1 1    3   13    3 f  595.707   7.8957  271.728   7.1993  275.195   10.302  268.418   10.064  599.334   11.231  591.916   11.109 7.418091 15.79646 
1 1 1    3   13    4 o  451.290   6.1013  155.915   4.2145  155.558   5.1877  156.609   7.2277  450.735   7.5194  452.154   10.443 -1.418732 12.86884 
1 1 1    3   13    5 o  762.338   7.2294  444.971   8.4357  443.153   10.310  448.650   14.672  760.694   8.8551  765.138   12.528 -4.443787 15.34124 
1 1 1    3   13    6 o  630.687   5.7792  304.506   5.5790  310.343   7.9948  298.965   7.7889  636.609   8.2047  624.833   8.1441 11.77673 11.56048 
1 1 1    3   13    7 o  323.651   5.4084   80.188   2.6793   81.827   3.8007   78.568   3.7776  326.901   7.5958  320.323   7.7047 6.577850 10.81936 
1 1 1    3   13    8 o  462.804   5.4432  163.965   3.8559  168.430   5.5215  159.715   5.3871  468.999   7.6916  456.704   7.7063 12.29520 10.88797 
1 1 1    3   13    9 o  345.030   7.8037   91.160   4.1212   91.160   4.1212   0.0000   0.0000  345.030   7.8037  ?   ?  0.000000 7.803720 
1 1 1    3   13   10 o  526.001   5.6568  211.807   4.5543  211.424   6.3911  212.203   6.4917  525.448   7.9465  526.411   8.0568 -0.9627686 11.31631 
1 1 1    3   13   11 o  496.538   6.5246  188.762   4.9588  184.905   5.9783  197.267   8.8778  491.393   7.9484  507.397   11.431 -16.00342 13.92286 
1 1 1    3   13   12 o  272.493   6.9652   56.851   2.9051   54.099   3.4984   62.964   5.2139  265.786   8.5995  286.647   11.883 -20.86154 14.66859 
1 1 1    3   13   13 o  1124.05   9.3428  967.695   16.074  964.688   27.750  969.213   19.719  1121.45   16.167  1124.71   11.455 -3.261597 19.81323 
1 1 1    3   13   14 o  450.505   5.7934  155.367   3.9949  151.168   5.6039  159.706   5.6965  444.313   8.2401  456.690   8.1493 -12.37766 11.58918 
1 1 1    3   13   15 o  148.010   9.4892   16.846   2.1384   20.599   3.0708   13.313   2.9797  163.499   12.362  130.902   15.152 32.59698 19.55468 
1 1 1    3   13   16 o  162.023   9.1020   20.166   2.2481   21.287   3.1740   19.037   3.1846  166.212   12.569  157.049   13.375 9.163101 18.35434 
1 1 1    3   13   17 o  615.379   6.2557  289.893   5.8923  281.910   8.1761  298.519   8.4993  606.770   8.8034  624.385   8.8933 -17.61450 12.51361 
1 1 1    3   13   18 o  833.039   6.9635  531.249   8.8789  525.725   12.460  536.947   12.655  828.575   9.8250  837.369   9.8738 -8.794189 13.92918 
1 1 1    3   13   19 o  481.799   6.2742  177.692   4.6269  174.888   6.5011  180.570   6.5867  477.929   8.8870  485.632   8.8611 -7.702454 12.54982 
1 1 1    3   13   20 o  883.781   10.123  598.088   13.694  579.942   19.005  617.682   19.749  870.037   14.271  897.894   14.369 -27.85651 20.25192 
1 1 1    3   13   21 o  872.799   8.2465  583.199   11.017  586.566   13.588  576.742   18.819  875.237   10.143  867.663   14.170 7.574585 17.42661 
1 1 1    3   13   22 o  233.870   7.4886   41.871   2.6807   41.718   3.2765   42.180   4.6619  233.427   9.1705  234.302   13.051 -0.8744812 15.95089 
1 1 1    3   13   23 o  934.425   6.1676  668.361   8.8212  664.560   12.361  672.306   12.593  931.677   8.6677  937.087   8.7795 -5.409485 12.33732 
1 1 1    3   13   24 o  743.301   5.7093  422.904   6.4955  411.329   8.9955  435.515   9.3892  732.997   8.0178  754.237   8.1330 -21.23901 11.42064 
1 1 1    3   13   25 o  206.646   9.4622   32.697   2.9929   23.646   5.1964   37.189   3.6611  174.476   19.809  220.368   10.854 -45.89258 22.58798 
1 1 1    3   13   26 o  436.326   6.5966  145.737   4.4055  156.492   7.6743  140.451   5.3804  452.036   11.092  428.310   8.2071 23.72592 13.79785 
1 1 1    3   13   27 o  342.579   6.5354   89.841   3.4269   82.400   4.7133   98.187   4.9914  328.039   9.3870  358.093   9.1066 -30.05496 13.07847 
1 1 1    3   13   28 o  757.640   6.6487  439.431   7.7103  447.387   12.121  434.025   9.9926  764.308   10.361  752.887   8.6712 11.42102 13.51068 
1 1 1    3   13   29 f  203.383   14.783   31.873   4.5706   29.406   4.9912   44.686   11.376  195.098   16.880  238.711   31.936 -43.61305 36.12232 
1 1 1    3   13   30 o  271.414   8.5003   56.408   3.5313   58.528   5.0066   54.309   4.9816  276.396   11.834  266.238   12.224 10.15793 17.01414 
1 1 1    3   13   31 o  881.505   6.6494  594.902   8.9717  601.298   12.778  588.683   12.600  886.071   9.4215  876.729   9.3893 9.341736 13.30126 
1 1 1    3   13   32 o  651.733   6.5258  325.194   6.5098  320.108   9.0499  330.647   9.3711  646.500   9.1455  657.047   9.3180 -10.54712 13.05624 
1 1 1    3   13   33 o  525.029   8.0579  211.094   6.4755  216.603   11.437  208.494   7.8560  531.500   14.058  521.707   9.8380 9.793030 17.15889 
1 1 1    3   13   34 o  873.845   7.4645  584.742   9.9839  594.913   13.423  572.147   14.937  881.211   9.9517  864.055   11.294 17.15594 15.05303 
1 1 1    3   13   35 o  962.813   7.7535  709.963   11.426  687.369   17.130  728.072   15.337  946.920   11.819  974.751   10.279 -27.83118 15.66393 
1 1 1    3   13   36 o  1041.79   7.3849  831.242   11.776  833.114   16.781  829.426   16.529  1042.57   10.516  1040.28   10.381 2.290039 14.77647 
1 1 1    3   13   37 f  206.166   10.744   32.677   3.3787   27.920   5.4535   35.640   4.3042  189.522   19.058  215.106   13.136 -25.58459 23.14648 
1 1 1    3   13   38 o  939.546   6.5714  676.107   9.4503  689.154   14.882  667.290   12.234  948.038   10.256  933.146   8.5652 14.89215 13.36185 
1 1 1    3   13   39 o  321.269   9.2382   79.130   4.5428   85.227   6.5910   73.613   6.2700  333.135   12.926  309.580   13.232 23.55478 18.49767 
1 1 1    3   13   40 o  120.814   15.196   11.405   2.7480   11.357   3.8806   11.454   3.8919  119.301   22.064  119.825   22.032 -0.5246124 31.18024 
1 1 1    3   13   41 o  255.348   8.3718   49.993   3.2720   52.065   4.7761   48.160   4.4917  260.333   11.986  250.402   11.719 9.930618 16.76332 
1 1 1    3   13   42 o  202.272   10.921   31.513   3.3687   34.766   4.1844   25.521   5.6788  212.224   12.943  180.278   20.972 31.94586 24.64448 
1 1 1    3   13   43 o  317.051   7.1043   77.058   3.4476   74.843   4.8362   79.346   4.9162  312.196   10.121  321.465   9.9913 -9.268921 14.22157 
1 1 1    3   13   44 o  136.660   13.543   14.527   2.7956   9.4642   3.9389   19.665   3.9683  107.969   24.408  158.666   16.585 -50.69688 29.50961 
1 1 1    3   13   45 o  149.110   12.241   17.232   2.7691   16.976   3.9103   17.490   3.9219  146.978   17.740  149.267   17.498 -2.288818 24.91748 
1 1 1    3   13   46 o  279.047   8.4786   59.786   3.6213   59.369   5.8210   60.050   4.6254  277.347   13.712  279.376   10.817 -2.029816 17.46485 
1 1 1    3   13   47 o  292.212   7.8766   65.552   3.5230   63.133   4.8041   68.367   5.1818  286.351   10.961  297.920   11.363 -11.56863 15.78814 
1 1 1    3   13   48 o  349.973   8.3384   94.102   4.4667   85.795   7.6944   98.324   5.4857  332.698   15.110  357.429   10.027 -24.73114 18.13409 
1 1 1    3   13   49 o  402.119   6.6763  124.089   4.1092  122.713   5.7983  125.478   5.8244  399.329   9.4864  403.817   9.4231 -4.488342 13.37115 
1 1 1    3   13   50 o  137.054   13.875   14.699   2.8707   12.994   4.0705   16.387   4.0491  126.722   21.770  143.517   18.892 -16.79498 28.82412 
1 1 1    3   13   51 o  110.559   20.294   9.9046   3.3076   10.968   4.0148   7.6588   5.8356  115.564   23.497   98.089   32.933 17.47555 40.45656 
1 1 1    3   13   52 o  311.095   7.9230   74.420   3.7727   75.671   5.2979   73.134   5.3736  312.994   11.059  307.611   11.413 5.383240 15.89174 
1 1 1    3   13   53 o  219.110   10.407   37.067   3.4901   40.029   5.0745   34.408   4.8078  226.251   14.734  209.584   15.088 16.66676 21.08867 
1 1 1    3   13   54 o  322.256   9.5214   80.113   4.6964   80.607   6.0403   79.358   7.4682  322.413   12.240  318.734   15.308 3.678467 19.59969 
1 1 1    3   13   55 o  106.107   24.743   9.4471   3.9447   12.882   7.6582   8.2068   4.6022  120.709   37.500   98.476   28.745 22.23286 47.24974 
1 1 1    3   13   56 o  245.627   12.134   46.873   4.5621   56.810   8.0977   42.252   5.5218  266.365   20.008  231.569   15.671 34.79597 25.41432 
1 1 1    3   13   57 o  263.806   11.045   53.997   4.4597   48.498   6.7196   58.325   5.9620  246.711   17.917  272.556   14.342 -25.84515 22.94970 
1 1 1    3   13   58 o   44.601   20.638  -2.3886   3.3280  -2.7330   4.4827  -1.9658   4.9676   52.419   24.148   57.538   26.091 -5.119099 35.55096 
1 1 1    3   13   59 o  220.029   34.287   43.691   11.171   0.0000   0.0000   43.691   11.171  ?   ?   220.029   34.287 0.000000 34.28680 
1 1 1    3   13   60 f  124.967   19.297   12.876   3.5722   18.960   5.0988   7.0119   5.0061  150.141   22.913   90.142   30.502 59.99862 38.14935 
1 1 1    3   13   61 o  144.950   16.556   17.039   3.6073   18.318   4.9594   15.603   5.2564  146.873   22.800  132.929   26.760 13.94339 35.15622 
1 1 1    3   13   62 o  128.055   21.128   13.938   3.9967   18.548   5.0543   6.2453   6.5293  146.618   23.301   86.973   33.942 59.64531 41.17051 
1 1 1    3   13   63 o  118.206   19.696   11.854   3.4382   14.195   4.6483   9.0264   5.1089  126.110   24.965   97.166   30.697 28.94353 39.56729 
1 1 1    3   14    1 f  233.401   11.455   41.740   4.0923   0.0000   0.0000   41.740   4.0923  ?   ?   233.401   11.455 0.000000 11.45485 
1 1 1    3   14    2 o  1051.00   15.240  847.137   24.517   0.0000   0.0000  847.137   24.517  ?   ?   1051.00   15.240 0.000000 15.24047 
1 1 1    3   14    3 o  929.627   14.065  662.576   20.013   0.0000   0.0000  662.576   20.013  ?   ?   929.627   14.065 0.000000 14.06457 
1 1 1    3   14    4 o  680.943   6.9449  355.020   7.2385  352.470   8.8478  360.181   12.587  678.418   8.5206  685.575   11.995 -7.156860 14.71355 
1 1 1    3   14    5 o  532.408   6.4222  217.018   5.2336  217.400   6.4449  216.278   8.9681  532.824   7.9025  531.302   11.028 1.522339 13.56693 
1 1 1    3   14    6 o  508.241   6.3945  197.762   4.9745  199.949   6.1429  193.596   8.4786  510.994   7.8539  502.672   11.020 8.321655 13.53209 
1 1 1    3   14    7 o  191.898   7.7680   28.198   2.2817   28.165   2.8098   28.263   3.9096  191.757   9.5732  191.546   13.420 0.2115784 16.48431 
1 1 1    3   14    8 o  540.259   6.5133  223.466   5.3861  224.099   6.6024  222.208   9.3126  540.971   7.9737  538.527   11.298 2.444397 13.82819 
1 1 1    3   14    9 o  458.382   6.4021  160.863   4.4918  161.541   5.5155  159.526   7.7406  459.305   7.8453  456.306   11.083 2.999268 13.57855 
1 1 1    3   14   10 o  105.035   11.035   8.5454   1.7476   6.6827   2.4838   10.371   2.4592   91.692   18.338  115.441   14.218 -23.74876 23.20452 
1 1 1    3   14   11 o  355.453   6.7024   96.732   3.6466   93.495   6.2645   98.391   4.4847  349.317   11.716  358.455   8.1738 -9.137878 14.28586 
1 1 1    3   14   12 o  812.083   7.7235  504.954   9.6003  493.638   16.364  510.892   11.855  802.547   13.321  816.744   9.4829 -14.19641 16.35192 
1 1 1    3   14   13 o  282.589   6.3353   61.134   2.7403   61.902   3.8565   60.352   3.8945  284.314   8.8618  280.729   9.0635 3.585754 12.67588 
1 1 1    3   14   14 o  786.492   6.6833  473.553   8.0456  474.388   11.382  472.718   11.374  787.059   9.4481  785.671   9.4583 1.387756 13.36883 
1 1 1    3   14   15 o  692.781   6.3808  367.410   6.7661  369.292   9.5907  365.544   9.5469  694.459   9.0226  690.926   9.0274 3.533020 12.76329 
1 1 1    3   14   16 o  709.018   6.4681  384.829   7.0195  385.794   9.9448  383.870   9.9093  709.814   9.1534  708.042   9.1435 1.772461 12.93788 
1 1 1    3   14   17 o  436.784   6.1762  146.039   4.1291  142.082   5.7441  150.271   5.9397  430.778   8.7116  443.017   8.7594 -12.23911 12.35388 
1 1 1    3   14   18 o   60.178   21.588   2.3340   2.5276   0.6302   4.6057   3.0682   3.0236   65.880   27.473   67.456   23.670 -1.576309 36.26388 
1 1 1    3   14   19 o  637.564   8.9234  311.219   8.7081  300.794   12.169  322.159   12.466  626.664   12.687  648.542   12.558 -21.87854 17.85138 
1 1 1    3   14   20 o  503.580   7.4089  194.131   5.7108  186.103   7.0101  209.973   9.8469  493.018   9.2894  523.598   12.287 -30.57974 15.40310 
1 1 1    3   14   21 o  329.904   7.4615   83.317   3.7677   80.657   5.2702   86.099   5.3886  324.549   10.609  335.320   10.499 -10.77103 14.92577 
1 1 1    3   14   22 o  658.433   6.9651  331.871   7.0196  332.518   9.9445  331.228   9.9099  658.995   9.8590  657.716   9.8438 1.279480 13.93194 
1 1 1    3   14   23 o  1662.50   11.200  2116.62   28.500  2116.48   40.283  2116.77   40.327  1661.91   15.836  1662.02   15.852 -0.1135254 22.40694 
1 1 1    3   14   24 o  228.900   10.461   40.123   3.6653   42.907   5.1644   37.297   5.2028  236.213   14.352  220.067   15.546 16.14610 21.15763 
1 1 1    3   14   25 o  506.096   7.4632  196.085   5.7813  196.064   8.1452  196.106   8.2072  505.990   10.517  506.041   10.596 -0.5123901E-01 14.92924 
1 1 1    3   14   26 o  963.692   7.1378  710.970   10.529  735.902   13.879  677.176   16.159  980.340   9.2495  940.294   11.227 40.04590 14.54671 
1 1 1    3   14   27 o  1167.77   7.8880  1044.07   14.099  1116.23   23.621  1004.13   17.573  1207.05   12.785  1145.07   10.026 61.97778 16.24762 
1 1 1    3   14   28 o  727.917   8.6957  405.725   9.6884  403.656   11.430  411.004   18.259  725.982   10.286  732.154   16.293 -6.171692 19.26851 
1 1 1    3   14   29 o  518.517   6.4014  205.825   5.0805  204.678   7.1310  207.007   7.2402  516.993   9.0114  519.924   9.0978 -2.930908 12.80534 
1 1 1    3   14   30 o  739.476   6.8834  418.651   7.7910  410.855   11.834  424.615   10.351  732.371   10.557  744.620   9.0816 -12.24896 13.92564 
1 1 1    3   14   31 o  924.937   6.8118  654.994   9.6437  661.665   13.692  648.427   13.585  929.451   9.6241  920.104   9.6464 9.346741 13.62632 
1 1 1    3   14   32 o  559.089   7.7231  239.355   6.6091  246.478   11.455  235.801   8.0918  567.044   13.198  554.842   9.5281 12.20227 16.27767 
1 1 1    3   14   33 o  611.558   6.7410  286.363   6.3100  292.755   8.9065  279.922   8.9411  618.208   9.4125  604.492   9.6634 13.71637 13.48985 
1 1 1    3   14   34 o  209.823   12.188   33.865   3.8975   28.107   5.4244   40.010   5.6038  190.327   18.869  227.734   16.182 -37.40668 24.85703 
1 1 1    3   14   35 f  489.720   7.2457  183.668   5.4312  184.145   7.8419  183.228   7.5295  490.173   10.452  488.977   10.060 1.196686 14.50699 
1 1 1    3   14   36 o  733.181   6.8697  411.690   7.7094  428.332   11.302  397.208   10.543  747.569   9.8770  719.929   9.5677 27.63989 13.75127 
1 1 1    3   14   37 o  158.836   15.324   19.564   3.6792   21.950   5.1370   17.051   5.2720  167.533   20.458  146.624   24.345 20.90842 31.79934 
1 1 1    3   14   38 o  412.164   7.8959  130.171   4.9813  124.555   6.9782  136.005   7.1130  402.916   11.315  421.055   11.037 -18.13892 15.80647 
1 1 1    3   14   39 o  581.050   7.1551  258.679   6.3635  252.475   8.8229  265.406   9.1870  573.721   10.047  588.210   10.204 -14.48889 14.32009 
1 1 1    3   14   40 f  402.984   8.6673  124.519   5.3462  114.651   6.9576  138.744   8.3537  386.380   11.765  424.901   12.845 -38.52109 17.41800 
1 1 1    3   14   41 f  222.189   10.761   37.906   3.6597   44.580   6.3545   34.593   4.4768  239.708   17.439  211.579   13.901 28.12880 22.30122 
1 1 1    3   14   42 o   54.781   23.012   0.3647   3.2667  -2.0396   4.4581   3.1526   4.8005   55.704   25.036   76.233   29.280 -20.52952 38.52472 
1 1 1    3   14   43 o  380.417   7.2587  110.957   4.2266  109.300   7.0040  111.906   5.3004  376.948   12.139  381.844   9.0689 -4.896149 15.15283 
1 1 1    3   14   44 o  249.996   8.2292   47.956   3.1489   47.730   4.5539   48.162   4.3590  249.049   11.946  250.235   11.381 -1.186615 16.49942 
1 1 1    3   14   45 o  210.995   10.255   34.225   3.3120   30.571   5.4781   36.329   4.1579  197.639   18.317  216.783   12.585 -19.14378 22.22371 
1 1 1    3   14   46 o  704.074   6.2457  380.089   6.7308  380.275   9.1551  379.870   9.9296  703.689   8.4999  703.097   9.2267 0.5911865 12.54514 
1 1 1    3   14   47 o   69.282   23.850   3.4823   3.0627   2.5287   5.4492   3.9227   3.7029   76.255   30.606   74.362   26.187 1.892754 40.28016 
1 1 1    3   14   48 o   46.204   19.984  -0.2478   2.5946   2.3214   3.7110  -2.7047   3.6290   66.083   25.644   46.963   21.668 19.11915 33.57272 
1 1 1    3   14   49 o  287.539   7.7081   63.512   3.3925   63.783   4.8310   63.249   4.7650  287.601   10.974  286.414   10.869 1.186584 15.44592 
1 1 1    3   14   50 o  141.999   13.065   15.737   2.8078   14.958   4.0339   16.469   3.9107  136.684   19.863  144.043   18.140 -7.358551 26.89941 
1 1 1    3   14   51 o  192.499   13.820   28.894   4.0447   34.211   4.3900  -0.9732   10.405  209.559   13.763   88.334   39.061 121.2244 41.41431 
1 1 1    3   14   52 o  356.615   7.2884   97.733   3.9783  101.611   5.7944   94.274   5.4719  362.834   10.434  349.547   10.227 13.28705 14.61014 
1 1 1    3   14   53 o  161.842   13.190   20.468   3.2391   19.666   4.9605   21.065   4.2768  156.063   21.324  162.980   17.413 -6.916946 27.53097 
1 1 1    3   14   54 o  249.683   12.665   48.523   4.8243   46.516   7.1194   50.227   6.5599  241.749   19.404  252.334   17.085 -10.58435 25.85365 
1 1 1    3   14   55 o  129.726   17.006   13.446   3.2954   10.774   4.7622   15.901   4.5649  112.400   27.828  139.389   22.136 -26.98883 35.55829 
1 1 1    3   14   56 o  364.014   9.4598  102.378   5.2707  110.332   6.6787   89.245   8.5819  377.005   11.574  336.536   16.660 40.46820 20.28587 
1 1 1    3   14   57 o  346.235   12.292   93.385   6.5141   0.0000   0.0000   93.385   6.5141  ?   ?   346.235   12.292 0.000000 12.29171 
1 1 1    3   14   58 o  199.072   12.329   31.050   3.7382   30.933   5.0771   31.188   5.5244  196.653   17.036  196.680   18.571 -0.2639771E-01 25.20086 
1 1 1    3   14   59 o  208.991   13.773   34.486   4.3812   32.363   8.1189   35.359   5.2039  193.376   28.264  210.358   16.289 -16.98250 32.62239 
1 1 1    3   14   60 o   65.814   24.420   3.0924   3.2745   11.050   4.6688  -4.6116   4.5939  111.538   27.517   48.476   22.998 63.06139 35.86236 
1 1 1    3   14   61 o  104.044   21.834   9.2880   3.3663   7.9408   4.6776   10.735   4.8483   93.542   29.348  108.365   28.754 -14.82216 41.08701 
1 1 1    3   14   62 o   64.688   25.332   2.7662   3.6466   1.0065   4.4788   6.2271   6.2810   61.619   26.451   86.077   33.374 -24.45826 42.58501 
1 1 1    3   14   63 o   79.539   25.221   5.6489   3.4463   2.4746   4.9421   8.6536   4.8083   68.186   28.449   95.388   29.728 -27.20134 41.14706 
1 1 1    3   15    1 o  678.465   12.023  352.746   12.486   0.0000   0.0000  352.746   12.486  ?   ?   678.465   12.023 0.000000 12.02296 
1 1 1    3   15    2 o  318.269   11.048   77.608   5.3821   0.0000   0.0000   77.608   5.3821  ?   ?   318.269   11.048 0.000000 11.04804 
1 1 1    3   15    3 o  450.754   11.075  155.668   7.6408   0.0000   0.0000  155.668   7.6408  ?   ?   450.754   11.075 0.000000 11.07458 
1 1 1    3   15    4 o  658.269   6.9428  331.768   6.9953  332.449   8.6035  330.441   12.016  658.871   8.5311  656.672   11.955 2.199219 14.68685 
1 1 1    3   15    5 o  982.383   8.4968  739.062   12.776  746.670   15.819  724.786   21.669  987.262   10.468  972.242   14.561 15.01929 17.93319 
1 1 1    3   15    6 o  614.577   6.8189  289.182   6.4145  289.977   7.8779  287.618   11.049  615.357   8.3640  612.662   11.783 2.695068 14.44957 
1 1 1    3   15    7 o  395.405   5.6226  119.686   3.4029  119.829   4.7722  119.539   4.8537  395.588   7.8814  395.106   8.0258 0.4822083 11.24855 
1 1 1    3   15    8 o  407.425   5.6521  127.073   3.5247  125.206   4.9482  128.995   5.0220  404.368   7.9946  410.441   7.9939 -6.072998 11.30563 
1 1 1    3   15    9 o  663.310   7.0810  336.861   7.1892  339.570   12.579  335.547   8.7611  665.695   12.345  661.949   8.6470 3.745605 15.07215 
1 1 1    3   15   10 o  582.545   6.8660  259.813   6.1222  275.665   11.100  252.882   7.3395  599.820   12.090  574.672   8.3441 25.14868 14.68986 
1 1 1    3   15   11 o  1105.70   8.0260  936.104   13.583  949.512   19.483  923.422   18.948  1113.31   11.433  1097.93   11.275 15.38721 16.05745 
1 1 1    3   15   12 o  665.368   6.2301  338.909   6.3449  343.011   9.0339  334.914   8.9135  669.291   8.8184  661.345   8.8054 7.946106 12.46192 
1 1 1    3   15   13 o  714.911   6.4519  391.258   7.0601  396.611   10.097  386.138   9.8756  719.684   9.1660  710.121   9.0857 9.562561 12.90608 
1 1 1    3   15   14 o  805.545   6.7808  496.756   8.3607  491.396   11.713  502.323   11.937  801.074   9.5530  809.928   9.6292 -8.853638 13.56401 
1 1 1    3   15   15 o  596.726   6.2105  272.575   5.6724  279.026   8.1101  266.398   7.9368  603.677   8.7771  589.859   8.7908 13.81824 12.42236 
1 1 1    3   15   16 o  959.830   7.4886  705.280   11.002  689.056   15.281  722.737   15.852  948.584   10.525  971.483   10.660 -22.89948 14.98065 
1 1 1    3   15   17 o  276.322   8.1532   58.455   3.4484   63.735   6.0651   55.933   4.1918  288.441   13.738  270.269   10.133 18.17157 17.07037 
1 1 1    3   15   18 o  1515.78   11.849  1759.62   27.490  1726.79   32.981  1834.32   49.753  1501.33   14.352  1546.46   21.019 -45.12866 25.45170 
1 1 1    3   15   19 o  709.287   6.7461  385.107   7.3239  380.937   10.230  389.491   10.490  705.360   9.4755  713.231   9.6089 -7.870361 13.49500 
1 1 1    3   15   20 o  139.666   13.144   15.073   2.7769   16.130   3.9345   14.025   3.9199  143.911   18.274  133.816   19.730 10.09535 26.89222 
1 1 1    3   15   21 o  151.532   13.039   17.718   2.9949   19.414   4.1965   15.957   4.2755  158.173   17.634  142.859   20.109 15.31374 26.74559 
1 1 1    3   15   22 o  492.375   6.9771  185.584   5.2583  191.008   7.4221  180.119   7.4506  499.459   9.7087  485.005   10.036 14.45425 13.96373 
1 1 1    3   15   23 o  446.075   7.4147  152.330   5.0626  155.051   7.1713  149.626   7.1479  449.977   10.412  442.030   10.565 7.947235 14.83325 
1 1 1    3   15   24 o  888.435   6.8028  604.237   9.2509  610.660   11.921  594.513   14.667  893.069   8.7210  881.076   10.876 11.99274 13.94052 
1 1 1    3   15   25 o  762.213   6.5418  444.740   7.6321  458.127   9.9044  425.171   11.975  773.536   8.3652  745.102   10.500 28.43311 13.42470 
1 1 1    3   15   26 o  476.863   7.0633  174.088   5.1555  179.389   7.2065  168.531   7.3785  483.999   9.7277  469.106   10.276 14.89233 14.15017 
1 1 1    3   15   27 o  618.271   8.5674  292.697   8.1077  299.589   9.5863  275.383   15.195  625.449   10.014  599.290   16.565 26.15961 19.35663 
1 1 1    3   15   28 o  348.143   7.0351   92.793   3.7488   90.719   5.3069   94.859   5.2964  344.165   10.074  351.936   9.8321 -7.771301 14.07689 
1 1 1    3   15   29 o  391.447   6.8301  117.313   4.0923  121.617   5.8563  113.204   5.7209  398.492   9.6014  384.459   9.7218 14.03360 13.66386 
1 1 1    3   15   30 o  582.010   7.3178  259.357   6.5190  272.500   8.2738  237.841   10.586  596.502   9.0620  557.108   12.415 39.39398 15.37025 
1 1 1    3   15   31 o  735.429   7.4122  414.134   8.3436  425.014   14.140  408.321   10.335  744.690   12.405  730.148   9.2473 14.54205 15.47258 
1 1 1    3   15   32 o  917.885   6.8979  645.096   9.6912  643.885   13.697  646.310   13.713  916.804   9.7609  918.529   9.7540 -1.725586 13.79914 
1 1 1    3   15   33 o  922.800   8.1348  652.194   11.490  654.678   16.343  649.766   16.157  924.207   11.553  920.744   11.465 3.463135 16.27613 
1 1 1    3   15   34 o  751.544   6.8003  432.518   7.8226  421.024   10.892  444.763   11.242  741.275   9.5995  761.882   9.6404 -20.60736 13.60466 
1 1 1    3   15   35 o  772.568   6.7947  457.093   8.0348  457.682   11.283  456.487   11.445  772.814   9.5383  771.789   9.6882 1.025574 13.59560 
1 1 1    3   15   36 o  444.352   7.5176  151.252   5.1130  150.982   7.1202  151.540   7.3468  443.759   10.483  444.552   10.797 -0.7932739 15.04878 
1 1 1    3   15   37 o  490.003   7.2700  183.938   5.4525  181.179   7.6837  186.736   7.7387  486.067   10.328  493.472   10.246 -7.405090 14.54765 
1 1 1    3   15   38 o  336.637   10.345   86.927   5.3303   95.147   6.4452   69.139   9.4813  352.058   11.961  298.466   20.886 53.59177 24.06798 
1 1 1    3   15   39 o  522.061   7.7039  208.884   6.1561  203.266   7.9287  217.411   9.7684  514.732   10.064  532.069   11.995 -17.33612 15.65713 
1 1 1    3   15   40 o  110.079   21.763   9.7115   3.5368   16.583   5.3654   4.4312   4.7034  143.953   25.273   81.676   29.433 62.27698 38.79442 
1 1 1    3   15   41 o  541.199   9.2757  224.736   7.6838  226.821   8.4426  214.678   18.545  543.565   10.147  525.456   23.058 18.10883 25.19161 
1 1 1    3   15   42 o  343.366   8.6780   90.457   4.5608   95.959   6.4137   84.829   6.4869  353.270   11.861  332.028   12.764 21.24210 17.42456 
1 1 1    3   15   43 o  193.292   12.928   28.897   3.8028   31.469   5.3897   26.347   5.3662  200.863   17.712  183.285   19.424 17.57755 26.28698 
1 1 1    3   15   44 o  406.898   8.1583  127.055   5.0811  126.070   7.2685  127.997   7.1057  404.729   11.733  407.878   11.382 -3.148651 16.34646 
1 1 1    3   15   45 o  210.927   15.209   34.580   4.8774   39.415   10.512   33.254   5.5058  219.826   32.198  206.279   17.607 13.54628 36.69707 
1 1 1    3   15   46 o  313.744   8.6585   75.618   4.1580   79.749   7.1131   73.474   5.1248  321.116   14.472  308.934   10.838 12.18149 18.08021 
1 1 1    3   15   47 o  275.411   9.0071   58.314   3.7970   57.018   6.5601   58.967   4.6562  270.590   15.909  276.642   10.996 -6.052612 19.33940 
1 1 1    3   15   48 o  335.718   7.9798   86.590   4.1005   91.904   6.9006   83.690   5.0982  344.743   13.077  329.664   10.104 15.07944 16.52570 
1 1 1    3   15   49 o  138.249   15.454   15.029   3.2141   11.951   5.3098   16.809   4.0380  119.430   29.273  145.492   18.555 -26.06172 34.65859 
1 1 1    3   15   50 o   94.089   21.533   7.2588   3.0341   7.5920   3.7141   6.5906   5.2606   95.764   25.051   92.001   31.267 3.763336 40.06468 
1 1 1    3   15   51 o  179.416   11.213   24.962   3.0638   25.402   4.4657   24.571   4.2113  179.672   16.420  176.887   15.718 2.784409 22.73022 
1 1 1    3   15   52 o  113.700   20.329   10.501   3.4080   12.868   6.5792   9.6327   3.9842  122.053   33.970  107.580   24.715 14.47375 42.00974 
1 1 1    3   15   53 o  115.259   24.327   11.046   4.1569   14.894   6.3405   8.1444   5.5052  131.420   31.853   99.072   31.926 32.34791 45.09869 
1 1 1    3   15   54 o  104.768   19.782   8.9636   3.0560   13.125   4.3907   5.0533   4.2561  125.937   23.646   81.090   28.104 44.84720 36.72838 
1 1 1    3   15   55 o   39.498   18.742  -3.5052   3.0532  -3.7429   4.4109  -3.2865   4.2305   49.897   23.315   49.646   23.075 0.2511597 32.80315 
1 1 1    3   15   56 o  350.693   8.3075   94.845   4.4593   87.665   5.9453  104.079   6.7425  335.963   11.561  365.839   12.041 -29.87543 16.69296 
1 1 1    3   15   57 o   46.485   21.485  -2.4921   3.5913  -6.1320   5.5802   0.0815   4.6922   52.642   25.081   61.730   26.787 -9.087788 36.69595 
1 1 1    3   15   58 o  104.512   24.891   9.3928   3.9248  -7.5255   7.1009   16.835   4.7096   58.770   28.081  142.110   22.393 -83.34057 35.91609 
1 1 1    3   15   59 o  164.465   13.825   21.433   3.4478   19.049   4.8876   23.794   4.8644  151.273   21.733  170.907   18.912 -19.63330 28.80975 
1 1 1    3   15   60 o   50.765   22.051  -0.0068   3.1858   0.9978   4.4206  -1.0925   4.5954   62.159   26.469   56.661   25.446 5.498558 36.71709 
1 1 1    3   15   61 o  126.367   17.296   13.131   3.2576   10.657   4.6181   15.581   4.5957  108.121   27.762  134.422   23.173 -26.30029 36.16240 
1 1 1    3   15   62 f   39.867   19.488  -6.4720   3.9439  -5.2437   4.4608 -10.8692   8.4403   45.613   21.917   58.612   28.621 -12.99851 36.04888 
1 1 1    3   16    1 f  1183.18   16.667  1073.86   30.183   0.0000   0.0000  1073.86   30.183  ?   ?   1183.18   16.667 0.000000 16.66665 
1 1 1    3   16    2 o  310.225   11.200   73.730   5.3180   0.0000   0.0000   73.730   5.3180  ?   ?   310.225   11.200 0.000000 11.19960 
1 1 1    3   16    3 o  877.490   13.729  590.201   18.440   0.0000   0.0000  590.201   18.440  ?   ?   877.490   13.729 0.000000 13.72933 
1 1 1    3   16    4 o  1260.17   12.417  1216.86   23.950  1208.45   33.748  1225.39   33.995  1255.02   17.568  1263.78   17.574 -8.765015 24.84955 
1 1 1    3   16    5 o  587.732   6.8337  264.460   6.1476  260.312   7.4889  273.030   10.765  583.049   8.3916  596.959   11.781 -13.90961 14.46431 
1 1 1    3   16    6 o  576.829   8.3836  254.785   7.4020  261.266   10.747  248.936   10.209  583.949   12.024  570.021   11.701 13.92773 16.77807 
1 1 1    3   16    7 f  399.091   8.2174  121.957   5.0197  120.468   7.3015  123.292   6.9124  396.530   12.030  401.177   11.257 -4.647552 16.47540 
1 1 1    3   16    8 o  130.771   9.8957   13.172   1.9661   8.0900   2.7816   18.246   2.7793  101.092   18.664  153.865   11.894 -52.77331 22.13148 
1 1 1    3   16    9 o  570.435   6.0045  249.094   5.2427  246.222   7.3393  252.085   7.4916  567.068   8.4557  573.776   8.5303 -6.708984 12.01102 
1 1 1    3   16   10 o  590.284   6.0650  266.728   5.4798  266.906   7.7564  266.550   7.7428  590.408   8.5830  590.014   8.5736 0.3941040 12.13157 
1 1 1    3   16   11 o  875.531   7.0355  586.840   9.4283  599.292   13.551  575.154   13.127  884.628   10.008  866.636   9.8957 17.99231 14.07406 
1 1 1    3   16   12 o  1040.23   7.7748  828.441   12.379  823.734   17.404  833.260   17.611  1037.09   10.964  1043.06   11.031 -5.974731 15.55266 
1 1 1    3   16   13 o  958.856   7.4365  703.856   10.914  715.562   15.646  692.760   15.232  966.641   10.575  951.121   10.463 15.52008 14.87623 
1 1 1    3   16   14 f  390.087   7.0611  116.488   4.2160  120.939   7.3203  114.278   5.1572  397.368   12.036  386.343   8.7211 11.02551 14.86319 
1 1 1    3   16   15 o  401.265   7.2514  123.259   4.4537  135.715   7.9953  117.656   5.3628  420.940   12.409  392.010   8.9377 28.93097 15.29284 
1 1 1    3   16   16 o  1135.57   9.6222  987.341   16.725  975.731   20.317  1011.75   29.457  1128.74   11.759  1148.98   16.750 -20.23486 20.46570 
1 1 1    3   16   17 o  824.448   8.0910  520.362   10.210  521.134   12.563  518.861   17.524  824.992   9.9489  823.001   13.911 1.991028 17.10250 
1 1 1    3   16   18 o  253.417   8.0241   49.164   3.1125   48.056   4.3697   50.305   4.4344  250.505   11.396  256.302   11.303 -5.796661 16.05134 
1 1 1    3   16   19 o  803.669   7.1423  494.428   8.7858  484.856   12.188  504.784   12.677  795.756   10.006  811.936   10.200 -16.18036 14.28895 
1 1 1    3   16   20 o  259.866   8.6703   51.701   3.4487   50.238   4.7102   53.392   5.0633  256.118   12.015  264.025   12.529 -7.906891 17.35917 
1 1 1    3   16   21 o  945.216   7.7656  683.972   11.235  693.724   16.003  674.494   15.777  951.779   10.985  938.495   10.983 13.28387 15.53363 
1 1 1    3   16   22 o  1498.54   10.356  1719.63   23.754  1712.37   33.393  1727.06   33.798  1494.94   14.594  1501.33   14.708 -6.386353 20.71927 
1 1 1    3   16   23 o  1001.74   8.1063  768.279   12.429  740.578   16.895  800.957   18.350  983.348   11.225  1022.61   11.724 -39.26678 16.23095 
1 1 1    3   16   24 o  988.032   8.1259  747.408   12.289  738.896   17.163  756.364   17.604  982.195   11.416  993.727   11.573 -11.53107 16.25664 
1 1 1    3   16   25 o  634.727   8.4948  308.473   8.2530  320.234   10.051  284.136   14.459  646.648   10.155  608.839   15.515 37.80890 18.54306 
1 1 1    3   16   26 o  714.393   7.5307  390.737   8.2346  417.208   11.637  364.187   11.654  738.069   10.301  689.540   11.042 48.52948 15.10081 
1 1 1    3   16   27 o  372.807   6.6875  106.402   3.8161  104.630   5.3022  108.307   5.4966  369.631   9.3716  376.064   9.5490 -6.433258 13.37952 
1 1 1    3   16   28 o  680.093   6.1616  354.084   6.4140  348.930   8.9243  359.592   9.2249  675.028   8.6374  685.256   8.7950 -10.22803 12.32707 
1 1 1    3   16   29 f  365.100   7.2371  102.060   4.0444   96.887   5.7003  107.304   5.7391  355.642   10.472  374.286   10.018 -18.64478 14.49168 
1 1 1    3   16   30 o  448.456   7.7385  153.998   5.3119  152.489   9.3053  154.728   6.4696  445.998   13.631  449.458   9.4041 -3.460022 16.56020 
1 1 1    3   16   31 o  208.116   13.073   33.334   4.1434   33.507   8.1652   33.274   4.8084  206.890   26.385  207.721   15.230 -0.8302612 30.46496 
1 1 1    3   16   32 o  854.509   7.8249  559.200   10.234  571.625   14.785  547.768   14.181  863.647   11.184  845.456   10.959 18.19098 15.65828 
1 1 1    3   16   33 o  1003.80   7.1163  771.635   10.934  766.361   15.524  776.826   15.402  1000.04   10.142  1006.87   9.9942 -6.823425 14.23857 
1 1 1    3   16   34 o  353.075   7.9569   95.491   4.3001   90.340   6.0260  100.836   6.1381  343.255   11.469  362.669   11.057 -19.41461 15.93151 
1 1 1    3   16   35 o  819.653   6.8647  514.555   8.6124  510.126   12.068  519.152   12.295  815.812   9.6643  822.986   9.7602 -7.173828 13.73536 
1 1 1    3   16   36 o  882.612   6.9831  596.718   9.4339  608.307   13.418  585.391   13.266  890.748   9.8418  873.797   9.9188 16.95129 13.97294 
1 1 1    3   16   37 o  173.559   12.777   23.256   3.3705   17.398   4.5442   30.418   5.0252  148.768   20.501  198.096   16.730 -49.32811 26.46064 
1 1 1    3   16   38 o  515.304   7.0854  203.459   5.5885  200.876   7.8048  206.176   8.0057  511.730   9.9644  518.422   10.089 -6.692352 14.18015 
1 1 1    3   16   39 o  557.834   7.5917  238.509   6.4821  251.919   10.224  229.495   8.3823  572.715   11.663  546.886   10.014 25.82874 15.37180 
1 1 1    3   16   40 o  494.174   9.4168  187.377   7.1228  187.948   7.8120  184.561   17.344  494.800   10.315  487.268   23.254 7.532013 25.43925 
1 1 1    3   16   41 o  260.911   10.102   52.269   4.0342   53.883   5.7849   50.741   5.6286  264.085   14.365  256.239   14.410 7.845520 20.34709 
1 1 1    3   16   42 o   78.845   24.178   4.8708   3.1951   3.3258   4.4824   6.4669   4.5558   75.310   28.443   91.186   29.007 -15.87605 40.62557 
1 1 1    3   16   43 o  164.720   14.038   21.074   3.5056   24.234   4.9478   17.890   4.9676  175.794   18.674  149.885   22.335 25.90898 29.11327 
1 1 1    3   16   44 o  280.437   12.060   60.570   5.1766   49.165   10.005   64.740   6.0493  248.311   26.746  289.673   13.644 -41.36227 30.02508 
1 1 1    3   16   45 o  232.266   11.543   41.553   4.1036   40.957   5.6186   42.234   6.0075  229.358   16.107  232.704   16.984 -3.346527 23.40672 
1 1 1    3   16   46 o  238.356   11.854   43.808   4.3247   40.772   6.2617   46.577   5.9801  228.145   18.079  244.504   16.068 -16.35913 24.18807 
1 1 1    3   16   47 o   66.301   25.072   2.6167   3.4855   4.1943   5.0140   1.1414   4.8485   80.744   30.167   67.827   28.229 12.91705 41.31447 
1 1 1    3   16   48 o  156.559   16.676   19.289   3.9345   15.586   5.4956   23.184   5.6355  137.445   27.086  170.149   22.165 -32.70306 34.99922 
1 1 1    3   16   49 o  204.716   12.825   32.552   3.9984   31.446   5.5945   33.707   5.7166  199.609   18.522  206.803   18.247 -7.194122 26.00042 
1 1 1    3   16   50 o  513.977   8.1979  203.157   6.4493  201.755   9.1800  204.524   9.0625  510.904   11.739  514.497   11.508 -3.593689 16.43896 
1 1 1    3   16   51 o   74.972   27.379   3.8698   4.0894   2.7681   6.1227   4.7569   5.4946   79.297   32.224   84.207   31.556 -4.910744 45.10168 
1 1 1    3   16   52 o  145.014   17.464   16.722   3.7985   18.024   7.0808   16.196   4.5009  144.633   32.747  141.357   21.478 3.275818 39.16200 
1 1 1    3   16   53 o   68.668   26.617   2.7064   3.9942   8.0959   6.4125  -0.7102   5.1056   99.994   34.506   62.627   27.542 37.36653 44.14968 
1 1 1    3   16   54 o  255.881   10.869   50.679   4.2570   58.565   7.7331   47.250   5.0991  271.508   18.723  245.939   13.598 25.56984 23.13979 
1 1 1    3   16   55 f  125.616   20.296   12.875   3.7693   12.197   6.6964   13.189   4.5604  117.259   34.797  125.483   24.623 -8.223801 42.62760 
1 1 1    3   16   56 o   56.143   24.859  -0.8105   4.2277   0.8430   11.129  -1.0893   4.5703   91.173   40.353   57.570   25.649 33.60264 47.81416 
1 1 1    3   16   57 o  189.660   12.067   28.158   3.4849   25.072   4.7605   31.722   5.1155  176.576   17.859  199.259   16.933 -22.68314 24.61070 
1 1 1    3   16   58 o  126.513   21.078   13.307   3.9381   15.746   7.2042   12.267   4.7030  129.818   35.317  118.799   26.534 11.01973 44.17399 
1 1 1    3   16   59 o  150.042   15.496   18.051   3.5075   16.556   5.0597   19.433   4.8667  138.995   24.687  152.752   21.403 -13.75699 32.67279 
1 1 1    3   16   60 f  102.868   22.293   9.1073   3.4087   13.872   5.1059   5.2762   4.5783  124.425   27.538   80.124   29.014 44.30090 40.00190 
1 1 1    3   16   61 o   93.776   26.644   7.9753   4.0041   8.1152   4.5120   7.4565   8.6873   93.870   28.722   93.880   38.293 -0.1044464E-01 47.86790 
1 1 1    3   16   62 f  117.743   20.627   11.876   3.5819   13.382   4.8233   10.024   5.3484  121.026   26.749  101.727   31.295 19.29913 41.16932 
1 1 1    3   17    1 o  328.580   11.704   82.709   5.8865   0.0000   0.0000   82.709   5.8865  ?   ?   328.580   11.704 0.000000 11.70441 
1 1 1    3   17    2 o  954.969   14.536  698.999   21.247   0.0000   0.0000  698.999   21.247  ?   ?   954.969   14.536 0.000000 14.53601 
1 1 1    3   17    3 o  443.098   11.410  150.397   7.7382   0.0000   0.0000  150.397   7.7382  ?   ?   443.098   11.410 0.000000 11.40958 
1 1 1    3   17    4 o  1366.09   13.254  1429.98   27.714  1454.09   40.118  1407.97   38.330  1376.67   19.039  1354.76   18.485 21.90894 26.53585 
1 1 1    3   17    5 o  180.053   9.1483   24.889   2.5129   24.783   3.1296   25.082   4.2161  179.507   11.450  180.230   15.432 -0.7234497 19.21583 
1 1 1    3   17    6 o  638.372   7.1154  311.984   6.9525  318.395   8.6309  300.135   11.733  644.843   8.7445  625.927   12.247 18.91547 15.04829 
1 1 1    3   17    7 o  692.445   7.3233  367.079   7.7618  369.788   9.5421  361.781   13.344  694.935   8.9708  687.194   12.686 7.741211 15.53770 
1 1 1    3   17    8 o  900.287   7.1467  620.496   9.8481  627.859   14.061  613.407   13.797  905.468   10.146  894.990   10.072 10.47797 14.29596 
1 1 1    3   17    9 o  820.164   6.8170  514.945   8.5578  520.682   12.197  509.381   12.011  824.605   9.6632  815.609   9.6209 8.995850 13.63595 
1 1 1    3   17   10 o  805.887   6.8025  497.168   8.3910  495.563   11.844  498.784   11.890  804.480   9.6184  807.090   9.6246 -2.609924 13.60687 
1 1 1    3   17   11 o  300.888   6.5140   69.302   3.0000   70.159   4.3049   68.493   4.1830  302.706   9.2912  299.093   9.1373 3.612885 13.03137 
1 1 1    3   17   12 o  1104.54   9.3607  934.122   15.826  943.982   27.621  929.303   19.309  1109.84   16.259  1101.56   11.452 8.277710 19.88776 
1 1 1    3   17   13 o  1294.11   10.456  1282.40   20.711  1279.04   35.720  1284.10   25.420  1291.70   18.067  1294.79   12.826 -3.084351 22.15664 
1 1 1    3   17   14 o  1505.43   14.418  1736.21   33.224  1736.21   33.224   0.0000   0.0000  1505.43   14.418  ?   ?  0.000000 14.41834 
1 1 1    3   17   15 o  525.034   7.2275  211.020   5.8082  209.628   7.1430  213.737   9.9785  523.265   8.9184  528.275   12.341 -5.010742 15.22592 
1 1 1    3   17   16 o  1547.27   10.462  1833.16   24.776  1872.84   35.913  1797.12   34.226  1563.49   15.007  1531.60   14.600 31.88696 20.93676 
1 1 1    3   17   17 o  1039.61   8.0027  827.408   12.734  809.821   17.591  846.770   18.458  1028.36   11.176  1051.54   11.468 -23.18176 16.01322 
1 1 1    3   17   18 o  287.659   7.8489   63.347   3.4558   58.864   4.7758   68.275   5.0070  277.247   11.254  298.596   10.955 -21.34818 15.70579 
1 1 1    3   17   19 o  808.968   7.2140  500.977   8.9326  505.324   12.675  496.687   12.591  812.363   10.194  805.390   10.213 6.972961 14.42996 
1 1 1    3   17   20 o  1683.77   11.290  2171.20   29.096  2173.03   41.128  2169.35   41.169  1683.91   15.957  1682.48   15.986 1.429321 22.58715 
1 1 1    3   17   21 o  266.685   9.0580   54.455   3.6974   52.344   5.0572   56.879   5.4195  261.409   12.639  272.491   12.994 -11.08224 18.12708 
1 1 1    3   17   22 o  903.670   7.7404  625.190   10.706  633.823   15.192  616.672   15.091  909.729   10.910  897.331   10.987 12.39722 15.48383 
1 1 1    3   17   23 o  408.499   7.9424  127.759   4.9660  135.631   6.9903  119.738   7.0563  420.824   10.852  395.378   11.660 25.44611 15.92879 
1 1 1    3   17   24 o  831.649   11.149  529.755   14.192  537.025   20.039  522.437   20.103  837.005   15.641  825.536   15.909 11.46954 22.31042 
1 1 1    3   17   25 o  787.844   9.0387  475.299   10.900  473.685   18.985  476.092   13.312  786.048   15.780  788.391   11.032 -2.343140 19.25346 
1 1 1    3   17   26 o  617.169   7.8583  291.639   7.4234  293.561   10.533  289.742   10.464  619.057   11.116  615.018   11.116 4.039673 15.72020 
1 1 1    3   17   27 o  536.557   8.2155  220.446   6.7471  215.548   9.4995  225.432   9.5847  530.417   11.701  542.450   11.544 -12.03326 16.43680 
1 1 1    3   17   28 o  487.374   6.7289  181.857   5.0197  174.654   6.5707  191.954   7.7792  477.552   8.9892  500.599   10.152 -23.04688 13.56021 
1 1 1    3   17   29 o  989.571   7.6659  749.835   11.611  774.049   19.275  736.044   14.547  1004.97   12.531  980.272   9.6950 24.70245 15.84341 
1 1 1    3   17   30 o  999.607   7.7432  765.167   11.847  792.638   19.722  749.655   14.819  1016.89   12.671  989.247   9.7871 27.63849 16.01039 
1 1 1    3   17   31 o  670.953   7.3738  344.733   7.5728  341.231   10.720  348.221   10.699  667.332   10.495  674.142   10.369 -6.809631 14.75313 
1 1 1    3   17   32 o  955.426   6.9191  699.022   10.119  689.290   14.147  709.215   14.478  948.477   9.7447  962.077   9.8319 -13.60077 13.84291 
1 1 1    3   17   33 o  237.942   9.5534   43.385   3.4794   38.852   4.8083   48.367   5.0410  224.567   14.060  250.743   13.181 -26.17685 19.27198 
1 1 1    3   17   34 o  1109.38   7.4194  942.716   12.599  921.125   17.457  966.184   18.200  1096.14   10.405  1122.59   10.592 -26.45520 14.84777 
1 1 1    3   17   35 o  351.296   9.4152   94.598   5.0626   98.433   5.9762   84.851   9.5271  358.250   10.899  331.384   18.861 26.86612 21.78311 
1 1 1    3   17   36 o  1230.18   7.8814  1159.64   14.840  1165.33   21.094  1154.05   20.882  1232.41   11.183  1226.44   11.124 5.963135 15.77307 
1 1 1    3   17   37 o  169.258   12.805   22.131   3.2929   21.675   4.7250   22.562   4.5917  166.576   18.864  170.161   17.898 -3.584488 26.00388 
1 1 1    3   17   38 o  251.152   10.107   48.400   3.8853   47.363   5.7203   49.288   5.2939  247.588   15.167  252.800   13.733 -5.212189 20.46076 
1 1 1    3   17   39 o  717.655   10.019  395.277   11.005  392.050   12.576  405.828   22.742  714.399   11.501  723.903   20.525 -9.504700 23.52730 
1 1 1    3   17   40 o  298.229   10.868   68.318   4.9612   70.037   5.7436   63.266   9.8460  301.787   12.434  284.349   22.815 17.43796 25.98287 
1 1 1    3   17   41 o  350.183   8.2533   94.070   4.4238   99.544   6.3454   88.893   6.1706  359.828   11.521  339.987   11.858 19.84079 16.53286 
1 1 1    3   17   42 o  302.156   9.0256   70.089   4.1742   60.333   5.8345   80.319   5.9745  279.784   13.624  323.060   12.082 -43.27536 18.20990 
1 1 1    3   17   43 f  149.974   19.235   17.753   4.3138   4.3023   9.3668   21.374   4.8598   98.953   39.982  164.670   19.671 -65.71684 44.55877 
1 1 1    3   17   44 o  447.883   9.9014  154.225   6.7879  140.880   11.707  160.983   8.3313  425.850   17.960  457.127   11.907 -31.27737 21.54877 
1 1 1    3   17   45 o  234.604   11.395   42.404   4.0917   46.118   6.0238   39.223   5.5753  243.301   16.269  224.273   16.354 19.02765 23.06825 
1 1 1    3   17   46 o  260.798   10.280   52.366   4.1035   46.307   5.5259   59.815   6.1271  244.019   14.866  277.554   14.472 -33.53500 20.74706 
1 1 1    3   17   47 o  330.741   9.0419   84.136   4.5774   86.393   6.5813   82.020   6.3707  334.300   12.862  325.750   12.777 8.549438 18.12964 
1 1 1    3   17   48 o   60.013   24.260   1.3836   3.4504   3.8353   4.9538  -0.9264   4.8086   78.725   29.861   60.686   26.708 18.03851 40.06199 
1 1 1    3   17   49 o  249.453   11.073   48.032   4.2279   47.730   6.0312   48.324   5.9283  247.025   16.038  248.690   15.654 -1.665436 22.41122 
1 1 1    3   17   50 o  267.359   10.991   55.202   4.4978   64.341   6.4842   46.727   6.2443  287.232   14.799  243.971   16.824 43.26151 22.40693 
1 1 1    3   17   51 o  232.713   13.382   42.177   4.7464   38.870   6.9937   45.000   6.4626  220.602   20.964  238.840   17.806 -18.23788 27.50546 
1 1 1    3   17   52 o   70.758   29.565   1.4280   5.3486   1.0812   5.6696   4.2333   16.124   71.308   30.154  113.833   49.527 -42.52499 57.98391 
1 1 1    3   17   53 o  215.458   14.802   36.409   4.8519   37.734   6.9388   35.142   6.7869  216.674   21.194  208.876   21.537 7.797821 30.21626 
1 1 1    3   17   54 o  226.573   14.732   40.304   5.0812   31.301   7.2588   48.955   7.1151  194.967   24.892  247.850   18.898 -52.88338 31.25283 
1 1 1    3   17   55 o  125.807   24.113   13.246   4.4743   13.494   6.3825   13.007   6.2742  123.257   33.121  121.093   32.966 2.164574 46.73067 
1 1 1    3   17   56 f   89.679   32.511   6.3561   5.7511  -2.7692   10.041   10.811   7.0159   80.417   36.707  109.953   36.084 -29.53596 51.47247 
1 1 1    3   17   57 o   56.674   25.165  -0.8063   4.3621   6.0667   6.5939  -6.1548   5.8168   89.772   34.355   53.808   25.628 35.96325 42.86140 
1 1 1    3   17   58 o   92.375   28.394   7.4602   4.4037   5.3586   6.3641   9.3908   6.0998   86.020   33.527  102.060   33.653 -16.03978 47.50322 
1 1 1    3   17   59 o  169.396   16.671   23.182   4.2664   23.188   6.5540   23.178   5.6203  162.678   27.287  165.777   22.749 -3.098694 35.52642 
1 1 1    3   17   60 o  150.992   20.025   19.047   4.5138   19.748   7.6825   18.677   5.5781  141.854   35.475  145.546   25.993 -3.692078 43.97849 
1 1 1    3   17   61 f  154.089   19.998   19.975   4.6054   16.082   7.2199   22.645   5.9800  125.788   35.791  160.199   25.222 -34.41062 43.78459 
1 1 1    3   18    1 o  1119.65   16.169  960.923   27.710   0.0000   0.0000  960.923   27.710  ?   ?   1119.65   16.169 0.000000 16.16900 
1 1 1    3   18    2 o  979.125   14.891  734.669   22.316   0.0000   0.0000  734.669   22.316  ?   ?   979.125   14.891 0.000000 14.89063 
1 1 1    3   18    3 o  467.681   11.555  167.526   8.2715   0.0000   0.0000  167.526   8.2715  ?   ?   467.681   11.555 0.000000 11.55487 
1 1 1    3   18    4 o  461.044   8.3952  162.743   5.9244  156.515   8.3273  169.126   8.4303  452.038   12.035  469.907   11.721 -17.86932 16.79973 
1 1 1    3   18    5 o  469.190   8.3827  168.544   6.0201  175.432   8.7847  162.444   8.2664  478.582   11.992  460.534   11.727 18.04807 16.77301 
1 1 1    3   18    6 o  680.251   7.3233  354.248   7.6251  354.150   9.3711  354.440   13.117  680.105   9.0021  680.236   12.598 -0.1315918 15.48414 
1 1 1    3   18    7 o  521.442   6.9422  208.145   5.5408  212.166   6.8540  200.561   9.4129  526.420   8.5063  511.721   12.018 14.69958 14.72351 
1 1 1    3   18    8 o  1525.83   14.506  1783.76   33.880  1772.20   47.504  1795.73   48.333  1520.05   20.417  1530.07   20.638 -10.02087 29.03068 
1 1 1    3   18    9 o  543.216   7.0577  225.890   5.8682  241.219   10.358  218.645   7.1212  561.207   12.059  534.398   8.7060 26.80914 14.87292 
1 1 1    3   18   10 o  809.658   7.9210  501.857   9.8163  517.449   17.334  494.495   11.910  821.878   13.779  803.635   9.6826 18.24237 16.84088 
1 1 1    3   18   11 o  1347.01   9.3558  1389.20   19.290  1379.01   27.104  1399.66   27.458  1341.77   13.197  1351.78   13.271 -10.00146 18.71592 
1 1 1    3   18   12 o  1163.70   8.5240  1036.76   15.183  1076.99   22.177  1001.26   20.830  1185.85   12.218  1143.42   11.902 42.43616 17.05692 
1 1 1    3   18   13 o  427.482   7.2583  139.889   4.7492  137.351   5.8402  144.844   8.1605  423.557   9.0083  434.886   12.259 -11.32861 15.21330 
1 1 1    3   18   14 o  510.043   6.4174  199.130   5.0100  205.245   7.1938  193.372   6.9813  517.764   9.0773  502.564   9.0756 15.19937 12.83603 
1 1 1    3   18   15 o  744.859   6.8748  424.704   7.8380  419.225   10.926  430.513   11.250  739.957   9.6471  749.848   9.8018 -9.890564 13.75293 
1 1 1    3   18   16 o  1041.06   8.0273  829.706   12.791  830.566   18.094  828.847   18.085  1041.43   11.351  1040.35   11.357 1.078735 16.05706 
1 1 1    3   18   17 o  1233.96   8.9517  1165.79   16.907  1172.69   24.043  1159.04   23.780  1237.36   12.695  1230.14   12.630 7.215820 17.90720 
1 1 1    3   18   18 o  707.476   6.9375  383.153   7.5125  374.085   10.357  393.223   10.914  698.970   9.6805  716.617   9.9498 -17.64734 13.88201 
1 1 1    3   18   19 o   50.583   21.481   0.0144   2.8970   1.1287   4.1653  -1.0298   4.0320   64.854   26.492   56.003   24.556 8.850292 36.12196 
1 1 1    3   18   20 o  951.314   7.8174  692.851   11.383  702.959   16.287  683.199   15.915  958.058   11.107  944.503   11.009 13.55524 15.63813 
1 1 1    3   18   21 o  164.037   13.382   20.752   3.3306   21.623   4.6824   19.861   4.7384  166.881   18.650  159.689   19.811 7.191360 27.20870 
1 1 1    3   18   22 o  149.960   19.053   17.526   4.2745   16.183   4.9585   21.411   8.4342  143.327   23.411  163.584   34.757 -20.25652 41.90577 
1 1 1    3   18   23 o  449.204   11.393  154.562   7.8334  156.327   11.005  152.750   11.153  451.573   15.922  446.359   16.324 5.214722 22.80286 
1 1 1    3   18   24 o  522.463   7.6554  208.992   6.1220  207.331   8.6434  210.665   8.6723  520.273   10.854  524.441   10.804 -4.168335 15.31420 
1 1 1    3   18   25 o  834.093   7.9415  532.690   10.139  528.028   14.173  537.576   14.510  830.244   11.153  837.706   11.316 -7.461304 15.88835 
1 1 1    3   18   26 o  442.854   8.8769  150.188   6.0172  144.275   8.4352  156.314   8.5860  433.907   12.701  451.660   12.420 -17.75262 17.76390 
1 1 1    3   18   27 o  223.588   14.821   38.498   5.0436   32.498   7.0658   44.731   7.2014  204.337   22.991  240.561   19.732 -36.22409 30.29727 
1 1 1    3   18   28 o  456.158   9.2147  159.371   6.4338  160.575   9.1016  158.168   9.0958  457.703   12.992  454.255   13.082 3.448395 18.43693 
1 1 1    3   18   29 o  567.258   6.4499  246.366   5.6002  234.701   7.8261  258.608   8.0170  553.545   9.2369  581.066   9.0140 -27.52136 12.90629 
1 1 1    3   18   30 o  1082.48   8.5012  897.476   14.085  890.075   19.788  905.078   20.054  1077.58   11.997  1086.61   12.058 -9.035034 17.00938 
1 1 1    3   18   31 o  759.547   6.5002  441.750   7.5570  435.935   10.549  447.880   10.831  754.339   9.1362  764.594   9.2550 -10.25403 13.00484 
1 1 1    3   18   32 o  270.489   10.452   56.079   4.3272   58.803   5.1003   49.082   8.1749  276.911   12.033  251.541   21.437 25.37009 24.58349 
1 1 1    3   18   33 o  385.422   7.3359  113.784   4.3277  110.470   6.0583  117.239   6.1843  379.601   10.427  391.064   10.332 -11.46292 14.67866 
1 1 1    3   18   34 o  395.494   7.2732  119.820   4.4028  116.402   6.1425  123.432   6.3141  389.628   10.300  401.221   10.282 -11.59286 14.55323 
1 1 1    3   18   35 o  188.064   11.192   27.231   3.2071   26.764   4.3933   27.764   4.6925  185.909   15.583  189.266   16.359 -3.357330 22.59268 
1 1 1    3   18   36 o  248.913   9.2827   47.509   3.5367   43.416   4.8455   52.175   5.1738  237.327   13.394  260.612   12.970 -23.28461 18.64448 
1 1 1    3   18   37 o  596.877   6.8098  272.969   6.2214  277.149   8.8712  268.923   8.7275  601.079   9.6423  592.094   9.6300 8.985596 13.62761 
1 1 1    3   18   38 o  267.907   10.315   55.092   4.2299   60.606   6.1053   50.002   5.8659  280.260   14.280  254.358   15.135 25.90282 20.80809 
1 1 1    3   18   39 o  358.391   9.4723   98.569   5.1962  102.298   6.1821   89.593   9.5908  364.926   11.068  339.891   18.505 25.03500 21.56215 
1 1 1    3   18   40 o  221.757   10.485   37.775   3.5589   32.230   4.9655   43.631   5.1034  203.719   16.055  237.566   14.098 -33.84691 21.36583 
1 1 1    3   18   41 o  410.301   7.6383  129.118   4.7970  128.408   6.6730  129.877   6.9007  408.752   10.666  411.034   10.968 -2.281769 15.29923 
1 1 1    3   18   42 o  134.616   16.058   14.207   3.2434   15.537   4.6127   12.906   4.5616  139.425   22.371  126.301   24.480 13.12346 33.16193 
1 1 1    3   18   43 o  197.154   15.253   30.235   4.5670   37.139   9.7472   28.293   5.1695  213.899   30.647  190.075   17.982 23.82420 35.53344 
1 1 1    3   18   44 o  110.210   21.305   9.8097   3.4640   7.9979   5.1420   11.315   4.6872   99.611   30.692  117.320   26.702 -17.70885 40.68166 
1 1 1    3   18   45 o  420.172   8.0894  135.599   5.2025  140.279   7.4904  131.238   7.2314  426.586   11.472  412.617   11.450 13.96921 16.20815 
1 1 1    3   18   46 o  393.524   8.3346  119.007   5.0203  118.530   7.1843  119.463   7.0182  391.876   11.977  393.504   11.652 -1.628571 16.71018 
1 1 1    3   18   47 o  223.965   11.509   38.809   3.9320   39.621   5.4954   37.958   5.6284  225.162   16.050  220.134   16.832 5.028595 23.25783 
1 1 1    3   18   48 o  311.375   9.5726   74.664   4.5623   72.133   6.3073   77.441   6.6073  305.116   13.505  316.100   13.656 -10.98318 19.20639 
1 1 1    3   18   49 o  336.876   9.3496   87.405   4.8210   88.437   6.8993   86.420   6.7393  337.753   13.345  333.931   13.185 3.822723 18.76041 
1 1 1    3   18   50 f  103.876   25.070   8.9863   3.9405   13.314   5.7758   5.2178   5.3896  125.131   30.446   85.800   31.416 39.33084 43.74874 
1 1 1    3   18   51 o  213.202   14.572   35.563   4.7270   39.840   6.7739   31.504   6.5994  223.635   20.000  197.767   22.184 25.86836 29.86842 
1 1 1    3   18   52 o  119.531   29.317   12.203   5.3230   9.5145   6.0380   21.581   11.277  105.878   33.364  151.880   45.176 -46.00176 56.16063 
1 1 1    3   18   53 o  204.723   15.356   32.976   4.7768   39.235   6.8924   27.192   6.6263  221.093   20.604  182.005   24.400 39.08737 31.93579 
1 1 1    3   18   54 o  202.464   15.794   32.376   4.8558   37.444   7.0640   27.837   6.6859  214.940   21.772  183.746   24.374 31.19408 32.68183 
1 1 1    3   18   55 o  192.212   21.141   30.048   6.1170   15.209   10.949   36.781   7.3752  127.013   44.999  211.675   23.140 -84.66201 50.60005 
1 1 1    3   18   56 o  165.359   19.032   22.160   4.7293   19.643   7.2262   24.046   6.2549  147.933   32.776  169.172   24.901 -21.23936 41.16219 
1 1 1    3   18   57 o  127.247   22.960   13.639   4.3074   6.6271   6.0575   20.812   6.1261   90.485   33.280  155.632   26.677 -65.14653 42.65219 
1 1 1    3   18   58 o  182.155   20.368   27.321   5.5815   30.258   6.6492   20.317   10.270  189.746   23.390  139.882   43.422 49.86391 49.32087 
1 1 1    3   18   59 o   97.291   27.870   8.5403   4.3628   7.2936   6.1863   9.7739   6.1537   91.417   33.630  101.948   33.810 -10.53037 47.68813 
1 1 1    3   18   60 o   75.667   27.533   4.6855   4.1301   7.0535   5.6866   2.0418   6.0084   88.830   32.309   71.749   30.713 17.08138 44.57815 
1 1 1    3   18   61 o  136.644   23.572   16.357   4.7519   17.449   7.9905   15.759   5.9107  128.311   37.996  128.724   30.472 -0.4134521 48.70554 
1 1 1    3   19    1 o  875.969   14.155  587.848   18.978   0.0000   0.0000  587.848   18.978  ?   ?   875.969   14.155 0.000000 14.15476 
1 1 1    3   19    2 o  580.893   12.213  258.442   10.859   0.0000   0.0000  258.442   10.859  ?   ?   580.893   12.213 0.000000 12.21317 
1 1 1    3   19    3 o  759.920   13.209  442.345   15.364   0.0000   0.0000  442.345   15.364  ?   ?   759.920   13.209 0.000000 13.20906 
1 1 1    3   19    4 o  606.251   12.367  281.501   11.476   0.0000   0.0000  281.501   11.476  ?   ?   606.251   12.367 0.000000 12.36687 
1 1 1    3   19    5 o  538.071   12.149  221.737   10.006   0.0000   0.0000  221.737   10.006  ?   ?   538.071   12.149 0.000000 12.14931 
1 1 1    3   19    6 o  483.831   8.6070  179.220   6.3741  172.138   9.0290  186.255   8.9996  474.082   12.443  493.155   11.923 -19.07248 17.23287 
1 1 1    3   19    7 o  1120.85   9.5234  961.884   16.338  966.839   20.179  952.453   27.839  1123.60   11.733  1114.87   16.314 8.736328 20.09535 
1 1 1    3   19    8 o  668.987   7.4521  342.602   7.6308  338.602   9.3314  350.676   13.258  665.025   9.1673  676.649   12.801 -11.62408 15.74468 
1 1 1    3   19    9 o  679.215   6.5495  353.136   6.8090  366.611   9.9276  341.166   9.3566  691.979   9.3731  667.540   9.1574 24.43909 13.10391 
1 1 1    3   19   10 o  1312.21   10.649  1318.49   21.388  1336.42   26.589  1285.62   35.999  1320.91   13.151  1295.09   18.160 25.82568 22.42181 
1 1 1    3   19   11 o  1392.30   11.140  1484.43   23.741  1483.14   29.065  1487.03   41.155  1391.49   13.647  1392.71   19.306 -1.215698 23.64215 
1 1 1    3   19   12 o  1193.30   8.6823  1090.16   15.858  1086.91   22.341  1093.47   22.513  1191.30   12.252  1194.89   12.309 -3.585938 17.36780 
1 1 1    3   19   13 o  1697.21   11.297  2205.87   29.348  2196.61   41.268  2215.34   41.746  1693.14   15.924  1700.33   16.040 -7.189575 22.60228 
1 1 1    3   19   14 o  985.145   7.7770  742.966   11.727  741.967   16.580  743.966   16.588  984.337   11.005  985.663   10.995 -1.325684 15.55638 
1 1 1    3   19   15 o  1498.49   10.276  1719.40   23.568  1720.96   33.340  1717.85   33.322  1498.77   14.533  1497.41   14.538 1.354370 20.55663 
1 1 1    3   19   16 o  470.979   6.7746  169.803   4.8838  170.856   6.8542  168.718   6.9605  472.383   9.4796  469.412   9.6876 2.970642 13.55406 
1 1 1    3   19   17 o  297.903   7.9685   67.942   3.6335   67.705   5.1174   68.183   5.1598  297.333   11.245  298.379   11.298 -1.046082 15.93985 
1 1 1    3   19   18 o  1060.63   8.2269  861.253   13.356  875.325   19.114  847.829   18.669  1069.05   11.681  1052.13   11.593 16.91846 16.45733 
1 1 1    3   19   19 o  361.596   7.7346  100.102   4.2808   98.183   5.9638  102.141   6.1485  358.052   10.882  365.195   11.000 -7.143402 15.47278 
1 1 1    3   19   20 o  941.624   9.0645  678.916   13.064  669.993   15.770  698.434   23.325  935.303   11.016  954.553   15.964 -19.25061 19.39617 
1 1 1    3   19   21 o  993.078   11.524  755.407   17.517  747.280   24.545  763.844   25.008  987.301   16.242  998.170   16.368 -10.86902 23.05921 
1 1 1    3   19   22 o  368.876   9.8144  104.204   5.5413   87.038   9.4714  113.138   6.8328  336.341   18.468  384.312   11.616 -47.97055 21.81759 
1 1 1    3   19   23 o  644.416   7.5573  317.944   7.4542  329.593   10.711  307.003   10.380  655.981   10.668  633.100   10.712 22.88098 15.11780 
1 1 1    3   19   24 o  497.975   8.1182  189.878   6.1878  186.328   8.7485  193.431   8.7532  493.170   11.590  502.492   11.381 -9.322021 16.24308 
1 1 1    3   19   25 o  839.827   8.0223  540.065   10.312  548.479   14.677  531.862   14.492  846.124   11.333  833.206   11.364 12.91833 16.04893 
1 1 1    3   19   26 o  196.715   15.333   29.854   4.5804   27.294   6.4164   32.515   6.5407  187.050   22.889  204.641   21.189 -17.59036 31.19052 
1 1 1    3   19   27 o  477.634   8.9159  174.723   6.5182  163.647   9.0211  186.823   9.4287  462.068   12.755  493.720   12.477 -31.65216 17.84270 
1 1 1    3   19   28 o  736.579   9.5577  415.605   10.776  434.062   18.622  406.313   13.212  752.110   16.176  728.117   11.855 23.99286 20.05497 
1 1 1    3   19   29 o  221.649   12.810   37.793   4.3273   43.455   4.9969   20.809   8.6542  237.636   13.797  160.629   36.081 77.00665 38.62858 
1 1 1    3   19   30 o  585.516   7.2818  262.547   6.5260  262.731   8.0413  262.192   11.170  585.621   8.9710  584.744   12.480 0.8765259 15.36951 
1 1 1    3   19   31 f  850.200   6.6307  553.543   8.6288  540.883   11.953  567.322   12.469  840.169   9.2947  860.439   9.4680 -20.26947 13.26781 
1 1 1    3   19   32 o  456.036   6.7505  159.277   4.7120  155.207   6.6107  163.480   6.7181  450.006   9.5975  461.849   9.5033 -11.84311 13.50647 
1 1 1    3   19   33 o  157.187   12.206   19.073   2.9136   20.253   4.1248   17.898   4.1161  161.390   16.951  151.420   18.120 9.969788 24.81229 
1 1 1    3   19   34 o  410.857   7.0298  129.315   4.4208  126.827   6.1694  131.941   6.3381  406.687   9.9109  414.799   9.9827 -8.111938 14.06698 
1 1 1    3   19   35 o  441.401   6.9726  149.271   4.7108  148.262   6.5502  150.353   6.7800  439.680   9.7330  442.744   10.005 -3.063629 13.95799 
1 1 1    3   19   36 o  683.212   7.6083  357.745   7.9564  365.851   9.9724  343.549   13.197  690.643   9.4336  668.623   12.896 22.02020 15.97770 
1 1 1    3   19   37 o  161.621   14.486   20.264   3.5455   20.872   4.8185   19.546   5.2356  163.137   19.696  157.229   22.388 5.907883 29.81811 
1 1 1    3   19   38 o  598.867   7.7950  274.975   7.1452  262.865   8.5578  302.846   12.983  585.265   9.5530  627.339   13.521 -42.07404 16.55528 
1 1 1    3   19   39 o  534.487   6.8963  218.976   5.6419  222.474   7.9898  215.497   7.9679  538.326   9.6966  529.796   9.8257 8.530396 13.80466 
1 1 1    3   19   40 o  506.579   7.0998  196.757   5.5050  191.562   7.7526  202.041   7.8184  499.371   10.143  512.882   9.9594 -13.51102 14.21492 
1 1 1    3   19   41 o  233.081   10.450   41.759   3.7281   37.664   4.8778   47.511   5.7812  220.444   14.538  247.535   15.334 -27.09058 21.13027 
1 1 1    3   19   42 o  324.322   10.523   80.894   5.2240   67.041   9.9938   86.102   6.1278  291.898   22.543  334.359   11.974 -42.46127 25.52528 
1 1 1    3   19   43 o  149.725   14.789   17.502   3.3449   17.362   4.7106   17.644   4.7505  147.536   21.491  148.752   21.488 -1.215988 30.39029 
1 1 1    3   19   44 o  417.428   7.8722  133.797   5.0297  126.084   7.0399  141.839   7.1887  404.491   11.371  429.128   10.944 -24.63712 15.78208 
1 1 1    3   19   45 o  135.063   16.544   14.383   3.3486   10.944   4.8409   17.539   4.6370  114.836   27.832  148.135   21.042 -33.29927 34.89094 
1 1 1    3   19   46 o  184.998   12.880   26.584   3.6244   33.011   5.2742   20.834   4.9891  205.214   16.943  161.685   20.630 43.52934 26.69548 
1 1 1    3   19   47 f  321.921   9.1997   79.758   4.5331   80.556   6.5277   79.015   6.2998  322.568   13.221  319.560   12.880 3.007904 18.45759 
1 1 1    3   19   48 o  130.123   18.265   13.502   3.5376   14.969   5.0846   12.126   4.9251  134.806   25.578  120.533   27.326 14.27249 37.42908 
1 1 1    3   19   49 o  338.026   12.208   88.433   6.3165   97.431   7.5890   68.143   11.396  354.184   13.999  290.115   25.937 64.06888 29.47332 
1 1 1    3   19   50 o  109.106   24.373   9.8917   3.9676   13.592   5.5522   6.0302   5.6718  126.655   29.233   89.982   32.332 36.67282 43.58838 
1 1 1    3   19   51 o  300.676   13.854   70.345   6.3758   76.326   7.5978   56.106   11.723  311.980   15.964  259.421   30.081 52.55981 34.05452 
1 1 1    3   19   52 o  199.887   14.966   31.378   4.5457   32.793   6.6787   30.156   6.2045  201.477   22.015  193.442   21.308 8.034958 30.63854 
1 1 1    3   19   53 o   49.583   22.971  -3.0370   4.1408  -8.9455   5.9998   2.3372   5.7220   51.125   24.774   75.130   30.911 -24.00513 39.61346 
1 1 1    3   19   54 o  178.228   17.004   25.301   4.5824   23.202   6.6276   27.223   6.3429  165.833   27.043  181.945   23.312 -16.11189 35.70375 
1 1 1    3   19   55 o  132.086   31.219   15.462   6.2119   3.3355   15.816   17.673   6.7547  106.630   47.594  140.966   32.033 -34.33547 57.37018 
1 1 1    3   19   56 o  142.663   24.562   17.217   5.1699   19.516   5.9427   10.061   10.484  150.845   26.716  109.192   42.895 41.65320 50.53492 
1 1 1    3   19   57 o  266.679   14.648   56.331   5.9563   57.084   7.1360   54.601   10.815  266.491   17.594  251.059   28.658 15.43153 33.62715 
1 1 1    3   19   58 f  130.144   23.891   14.551   4.5837   11.497   7.1770   16.654   5.9568  109.441   36.524  135.807   29.500 -26.36673 46.94970 
1 1 1    3   19   59 o  134.325   21.534   15.318   4.2779   16.327   6.1834   14.392   5.9245  132.119   31.094  123.689   31.275 8.430145 44.10165 
1 1 1    3   19   60 o   82.145   27.713   5.9919   4.1325   5.9166   6.2777   6.0495   5.4898   84.729   33.222   83.938   31.525 0.7909698 45.79873 
1 1 1    3   20    1 f  1464.38   19.909  1644.20   44.624   0.0000   0.0000  1644.20   44.624  ?   ?   1464.38   19.909 0.000000 19.90865 
1 1 1    3   20    2 o  1406.74   19.308  1517.15   41.574   0.0000   0.0000  1517.15   41.574  ?   ?   1406.74   19.308 0.000000 19.30777 
1 1 1    3   20    3 o  557.926   12.258  238.395   10.468   0.0000   0.0000  238.395   10.468  ?   ?   557.926   12.258 0.000000 12.25847 
1 1 1    3   20    4 o  303.733   9.6383   70.634   4.4809   70.813   6.4273   70.465   6.2503  304.048   13.811  303.306   13.463 0.7418213 19.28712 
1 1 1    3   20    5 o  288.004   9.8029   63.509   4.3214   60.027   6.1400   66.926   6.0831  279.556   14.398  295.593   13.445 -16.03653 19.69969 
1 1 1    3   20    6 f  602.922   9.1990  278.313   8.4893  288.371   12.206  268.889   11.815  613.600   12.996  592.509   13.028 21.09058 18.40173 
1 1 1    3   20    7 o  907.852   10.445  631.087   14.515  631.087   14.515   0.0000   0.0000  907.852   10.445  ?   ?  0.000000 10.44528 
1 1 1    3   20    8 f  568.039   9.0325  247.036   7.8534  247.036   7.8534   0.0000   0.0000  568.039   9.0325  ?   ?  0.000000 9.032549 
1 1 1    3   20    9 o  1632.26   12.656  2040.55   31.620  2094.09   39.817  1949.14   52.029  1653.19   15.735  1594.18   21.323 59.01770 26.50015 
1 1 1    3   20   10 o  174.550   10.235   23.409   2.7226   24.069   3.8796   22.769   3.8218  176.661   14.475  171.772   14.677 4.888885 20.61388 
1 1 1    3   20   11 o  1165.97   8.5886  1040.81   15.328  1038.81   21.584  1042.85   21.771  1164.65   12.108  1166.90   12.189 -2.259399 17.18064 
1 1 1    3   20   12 o  1455.95   10.040  1623.11   22.373  1616.38   31.460  1630.00   31.825  1452.57   14.150  1458.67   14.254 -6.097290 20.08481 
1 1 1    3   20   13 o  846.565   7.3264  548.629   9.4933  539.251   13.158  558.810   13.711  839.189   10.244  854.262   10.486 -15.07269 14.65870 
1 1 1    3   20   14 o  899.027   7.5123  618.748   10.337  609.918   14.383  628.183   14.868  892.462   10.529  905.717   10.724 -13.25452 15.02934 
1 1 1    3   20   15 o  732.146   6.9934  410.347   7.8371  402.440   10.942  418.676   11.230  724.963   9.8608  739.440   9.9225 -14.47742 13.98898 
1 1 1    3   20   16 o  678.771   6.9200  352.699   7.1895  348.361   10.052  357.242   10.287  674.495   9.7370  683.034   9.8392 -8.539551 13.84267 
1 1 1    3   20   17 o  603.810   6.9228  279.101   6.3981  273.281   8.8736  285.404   9.2337  597.399   9.7044  610.500   9.8814 -13.10022 13.84982 
1 1 1    3   20   18 o  1104.64   9.7773  934.413   16.532  943.316   20.432  917.536   28.132  1109.73   12.029  1094.00   16.800 15.72998 20.66228 
1 1 1    3   20   19 o  424.337   8.6997  137.871   5.6505  139.454   6.8788  134.586   9.9079  426.718   10.532  419.033   15.448 7.685577 18.69632 
1 1 1    3   20   20 o  186.186   15.124   26.745   4.2728   29.910   7.5623   25.261   5.1786  195.570   25.900  180.466   19.035 15.10422 32.14237 
1 1 1    3   20   21 o  664.957   7.4525  338.530   7.5851  330.535   10.642  346.785   10.814  656.928   10.584  672.886   10.500 -15.95837 14.90834 
1 1 1    3   20   22 o  834.465   7.7898  533.153   9.9496  542.664   14.187  523.945   13.958  841.687   11.012  827.041   11.026 14.64532 15.58313 
1 1 1    3   20   23 o  787.437   7.7976  474.764   9.3982  474.959   13.276  474.569   13.306  787.412   11.015  787.086   11.045 0.3257446 15.59887 
1 1 1    3   20   24 o  763.502   7.8798  446.358   9.2087  446.897   13.028  445.820   13.018  763.766   11.144  762.845   11.149 0.9211426 15.76371 
1 1 1    3   20   25 o  831.648   8.1294  529.629   10.348  532.047   14.715  527.264   14.555  833.297   11.537  829.549   11.463 3.747314 16.26389 
1 1 1    3   20   26 o  480.524   8.7125  176.842   6.4080  186.643   9.3449  168.141   8.8040  493.480   12.372  468.388   12.280 25.09265 17.43171 
1 1 1    3   20   27 o  402.909   12.385  124.436   7.6378  108.139   10.643  141.738   10.967  375.229   18.532  429.731   16.673 -54.50162 24.92814 
1 1 1    3   20   28 o  606.475   9.4690  281.781   8.7899  295.991   11.353  260.513   13.889  621.390   11.936  582.626   15.574 38.76410 19.62232 
1 1 1    3   20   29 o  637.948   8.5857  311.761   8.3836  298.031   11.588  326.841   12.144  623.447   12.143  652.885   12.153 -29.43713 17.17962 
1 1 1    3   20   30 o  1038.48   7.8857  826.079   12.534  829.715   15.938  820.185   20.294  1040.47   10.008  1034.00   12.822 6.471069 16.26552 
1 1 1    3   20   31 o  716.341   7.3052  393.055   8.0098  395.498   9.9769  388.625   13.434  718.396   9.0732  711.727   12.332 6.669067 15.31029 
1 1 1    3   20   32 o  346.580   7.2743   92.015   3.8589   94.666   5.4146   89.280   5.5010  351.383   10.067  341.211   10.533 10.17200 14.57037 
1 1 1    3   20   33 o   97.012   19.000   7.5023   2.7204   7.5421   3.7398   7.4576   3.9644   96.862   25.041   96.469   26.180 0.3931885 36.22761 
1 1 1    3   20   34 o  186.995   10.662   26.916   3.0389   25.907   4.1904   28.035   4.4137  182.907   15.103  190.295   15.282 -7.387726 21.48573 
1 1 1    3   20   35 o  112.753   17.075   10.016   2.8547   7.1383   3.8749   13.433   4.2217   94.334   26.000  129.976   22.006 -35.64214 34.06278 
1 1 1    3   20   36 o  243.020   10.138   45.325   3.7710   42.936   5.2500   47.871   5.4201  235.729   14.623  249.008   14.280 -13.27960 20.43885 
1 1 1    3   20   37 o  141.472   17.183   15.673   3.6445   18.823   4.1428   4.8878   7.6647  155.119   17.769   95.192   36.879 59.92683 40.93646 
1 1 1    3   20   38 o  470.929   6.9746  169.997   5.0274  169.936   7.0850  170.060   7.1350  470.474   9.8386  470.636   9.9046 -0.1618042 13.96062 
1 1 1    3   20   39 o  592.887   6.8439  269.472   6.2108  271.727   8.8796  267.313   8.6902  594.848   9.7526  590.023   9.6225 4.824890 13.70059 
1 1 1    3   20   40 o  297.323   8.3461   67.840   3.7983   73.264   5.4043   62.546   5.3394  308.608   11.441  285.038   12.238 23.56982 16.75321 
1 1 1    3   20   41 o  468.952   8.6672  168.854   6.2212  161.575   11.321  172.003   7.4464  456.888   16.188  472.991   10.285 -16.10217 19.17909 
1 1 1    3   20   42 o  194.438   11.993   29.240   3.5519   32.619   4.9285   25.589   5.1235  204.635   15.859  180.409   18.832 24.22662 24.61957 
1 1 1    3   20   43 o  112.163   18.435   10.042   3.0550   6.5564   4.2710   13.694   4.3715   90.551   27.984  130.261   22.754 -39.71011 36.06721 
1 1 1    3   20   44 o  267.056   9.5534   54.865   3.9051   47.960   5.4412   62.200   5.6078  248.475   14.368  283.741   12.912 -35.26541 19.31764 
1 1 1    3   20   45 o  403.638   7.9877  125.169   4.9350  120.552   6.9636  129.828   6.9947  395.306   11.509  410.338   11.137 -15.03131 16.01500 
1 1 1    3   20   46 o  128.925   17.343   13.186   3.3355   13.996   4.8265   12.446   4.6149  130.638   25.049  122.933   25.367 7.705551 35.65066 
1 1 1    3   20   47 o   86.426   24.588   6.1161   3.4078   2.5181   4.9143   9.4489   4.7297   73.019   29.150  106.304   28.490 -33.28599 40.76017 
1 1 1    3   20   48 o  298.628   9.6867   68.723   4.4277   59.704   6.0763   78.932   6.4650  276.840   14.389  319.089   13.237 -42.24936 19.55179 
1 1 1    3   20   49 o  236.587   12.810   43.516   4.6215   50.103   6.6307   37.293   6.4449  252.350   17.271  216.651   19.649 35.69977 26.16001 
1 1 1    3   20   50 o  204.194   16.622   32.855   5.1501   32.065   5.8268   35.676   11.010  200.754   19.197  202.360   36.907 -1.606003 41.60090 
1 1 1    3   20   51 o   87.162   27.387   6.2239   4.0715   5.5847   5.7287   6.8762   5.7876   87.842   32.356   93.520   32.752 -5.677589 46.03906 
1 1 1    3   20   52 o  220.811   14.028   38.180   4.7166   41.346   6.6171   34.910   6.7246  227.637   19.170  207.986   21.430 19.65103 28.75312 
1 1 1    3   20   53 f   68.190   26.357   2.7845   3.9080   3.2324   5.4178   2.2986   5.6424   76.763   30.619   74.426   30.667 2.337013 43.33558 
1 1 1    3   20   54 o  137.511   28.201   16.285   5.7366   28.454   10.584   11.222   6.8262  173.973   40.503  111.981   35.495 61.99224 53.85545 
1 1 1    3   20   55 o  164.738   22.993   22.545   5.6397   33.761   6.9150   0.2647   9.7463  202.241   22.732   84.450   37.551 117.7919 43.89539 
1 1 1    3   20   56 o  102.254   27.540   9.1804   4.4067   13.342   6.1572   4.8098   6.3096  120.920   32.548   84.182   33.211 36.73724 46.50091 
1 1 1    3   20   57 o  158.194   18.838   20.481   4.4716   20.613   6.2819   20.346   6.3667  153.220   27.810  151.756   28.455 1.464218 39.78773 
1 1 1    3   20   58 o  219.201   13.851   38.211   4.6235   42.427   6.6441   34.252   6.4379  227.113   19.296  202.581   21.070 24.53189 28.57076 
1 1 1    3   20   59 o  210.583   15.553   35.790   4.9777   41.516   6.1507   24.920   8.4741  224.939   18.016  158.890   35.713 66.04955 39.99977 
1 1 1    3   20   60 o   84.595   27.832   6.4888   4.1730   7.0055   6.4110   6.1089   5.4970   88.502   33.874   83.853   31.535 4.649078 46.28103 
1 1 1    3   21    4 o  1262.44   18.160  1221.62   35.091  1221.62   35.091   0.0000   0.0000  1262.44   18.160  ?   ?  0.000000 18.15991 
1 1 1    3   21    5 o  426.008   13.377  139.009   8.7228  139.009   8.7228   0.0000   0.0000  426.008   13.377  ?   ?  0.000000 13.37729 
1 1 1    3   21    6 o  1166.99   12.135  1042.99   21.675  1054.10   31.060  1032.45   30.262  1172.76   17.303  1160.69   17.034 12.07861 24.28073 
1 1 1    3   21    7 o  359.338   7.9010   98.850   4.3456   99.792   5.3103   96.939   7.5611  361.021   9.6099  355.737   13.886 5.284454 16.88724 
1 1 1    3   21    8 o  927.456   8.7092  658.548   12.363  649.164   14.938  678.952   22.028  920.742   10.600  941.350   15.288 -20.60803 18.60304 
1 1 1    3   21    9 o  767.546   8.0801  451.014   9.4927  448.717   11.584  455.709   16.563  765.527   9.8861  771.277   14.030 -5.750244 17.16355 
1 1 1    3   21   10 o  267.603   8.0581   54.823   3.3006   57.763   4.6848   51.926   4.6509  274.643   11.144  260.387   11.669 14.25562 16.13599 
1 1 1    3   21   11 o  1380.95   9.6957  1460.18   20.494  1442.48   28.592  1478.89   29.390  1372.23   13.613  1389.41   13.820 -17.18604 19.39832 
1 1 1    3   21   12 o  994.280   7.9208  756.839   12.054  744.418   16.745  770.201   17.367  985.928   11.096  1002.84   11.314 -16.91565 15.84729 
1 1 1    3   21   13 o  474.899   6.8832  172.646   5.0034  170.278   6.9210  175.239   7.2415  471.573   9.5885  478.385   9.8897 -6.812653 13.77480 
1 1 1    3   21   14 o  1178.94   8.7577  1064.18   15.803  1051.52   22.025  1077.62   22.689  1171.66   12.281  1186.09   12.497 -14.43567 17.52184 
1 1 1    3   21   15 o  283.830   9.9668   61.690   4.3299   60.130   5.1780   65.316   7.8955  280.180   12.074  291.326   17.792 -11.14548 21.50193 
1 1 1    3   21   16 o  481.945   8.2332  177.834   6.0735  174.659   7.3059  184.938   10.927  477.576   9.9945  491.259   14.532 -13.68372 17.63724 
1 1 1    3   21   17 o  978.683   9.2204  733.432   13.812  731.428   16.881  737.492   24.025  977.212   11.286  980.852   16.003 -3.639099 19.58193 
1 1 1    3   21   18 o  287.388   10.715   63.257   4.7133   63.472   8.2645   63.153   5.7379  287.024   18.918  287.099   13.057 -0.7550049E-01 22.98647 
1 1 1    3   21   19 o  479.745   8.7187  176.234   6.4022  171.573   11.358  178.405   7.7509  473.078   15.686  482.633   10.492 -9.554260 18.87148 
1 1 1    3   21   20 o  230.872   11.304   40.831   3.9945   41.172   5.6443   40.489   5.6538  231.171   16.051  229.220   16.219 1.950790 22.81893 
1 1 1    3   21   21 o  931.141   8.1074  663.880   11.555  650.905   16.050  677.842   16.649  921.772   11.376  940.636   11.564 -18.86414 16.22112 
1 1 1    3   21   22 o  257.314   11.314   50.724   4.4560   48.917   6.3058   52.528   6.2978  252.010   16.437  261.242   15.824 -9.231934 22.81678 
1 1 1    3   21   23 o  871.689   8.0745  581.843   10.773  579.489   15.191  584.225   15.281  869.682   11.412  873.227   11.433 -3.544373 16.15363 
1 1 1    3   21   24 o  850.433   8.0994  553.836   10.543  561.242   14.997  546.600   14.824  855.844   11.449  844.604   11.467 11.23920 16.20372 
1 1 1    3   21   25 o  629.084   9.1527  303.122   8.8131  290.065   14.595  310.614   11.056  614.911   15.507  636.670   11.345 -21.75922 19.21427 
1 1 1    3   21   26 o  276.269   15.184   58.734   6.3962   54.757   9.0625   62.681   9.0289  265.824   22.484  284.764   20.860 -18.93961 30.67027 
1 1 1    3   21   27 o  871.515   9.5223  581.917   12.702  579.932   15.697  585.683   21.622  869.776   11.791  873.440   16.173 -3.663269 20.01436 
1 1 1    3   21   28 o  578.018   8.5288  255.943   7.5457  262.196   10.683  249.718   10.659  584.766   11.936  570.657   12.203 14.10907 17.07003 
1 1 1    3   21   29 o   74.933   29.045   2.7758   4.7561   10.053   6.7050  -4.5939   6.7476  113.602   35.056   65.431   29.951 48.17074 46.10832 
1 1 1    3   21   30 o  287.951   12.673   63.625   5.5857   57.329   7.8070   70.229   7.9950  272.255   18.850  301.678   17.388 -29.42291 25.64512 
1 1 1    3   21   31 o  362.433   10.997  100.753   6.1003   96.989   8.5348  104.685   8.7226  355.190   15.699  369.040   15.442 -13.84988 22.02051 
1 1 1    3   21   32 o  305.798   11.977   71.775   5.6059   67.221   7.8920   76.414   7.9645  294.931   17.562  314.672   16.595 -19.74130 24.16188 
1 1 1    3   21   33 o  700.652   7.3468  376.159   7.8790  382.602   9.8762  364.880   13.068  706.393   9.1342  689.297   12.386 17.09540 15.38951 
1 1 1    3   21   34 o  240.726   9.4761   44.448   3.4916   40.324   4.5554   50.322   5.4364  228.688   13.068  255.431   13.958 -26.74352 19.12050 
1 1 1    3   21   35 o  506.836   8.1004  196.947   6.2841  198.166   8.5446  195.511   9.2743  508.022   10.989  504.447   12.012 3.575165 16.27958 
1 1 1    3   21   36 o  172.739   21.297   23.478   5.5117   24.994   7.7918   21.960   7.7977  176.120   29.978  164.261   32.165 11.85912 43.96935 
1 1 1    3   21   37 o  490.915   6.7486  184.712   5.0709  193.020   7.2899  176.924   7.0585  501.469   9.4975  480.090   9.6054 21.37885 13.50803 
1 1 1    3   21   38 o  386.145   7.4154  114.338   4.3828  111.882   6.1080  116.946   6.2927  381.605   10.457  390.135   10.538 -8.530121 14.84583 
1 1 1    3   21   39 o  316.543   8.2076   76.885   3.9767   76.201   5.5432   77.611   5.7081  314.732   11.507  317.598   11.742 -2.866089 16.44026 
1 1 1    3   21   40 o  467.765   8.7276  168.001   6.2487  163.427   11.330  170.001   7.4909  459.555   16.108  470.217   10.408 -10.66141 19.17781 
1 1 1    3   21   41 o  210.508   10.747   34.185   3.4513   35.210   4.9552   33.220   4.8098  212.791   15.316  206.660   15.314 6.131470 21.65919 
1 1 1    3   21   42 o  307.330   8.6314   72.563   4.0603   69.996   5.7881   75.050   5.6972  301.201   12.555  312.008   11.929 -10.80698 17.31867 
1 1 1    3   21   43 o  146.026   14.050   16.647   3.1015   15.394   4.3687   17.919   4.4039  138.602   21.272  150.219   19.622 -11.61613 28.93996 
1 1 1    3   21   44 o  188.429   11.981   27.513   3.4375   21.090   4.8097   34.218   4.9147  163.046   19.670  209.426   15.441 -46.38039 25.00650 
1 1 1    3   21   45 o  300.404   9.4960   69.459   4.3663   67.584   5.8114   71.890   6.6165  295.625   12.843  304.546   14.194 -8.921753 19.14200 
1 1 1    3   21   46 o  167.556   13.058   21.861   3.3224   18.848   4.4770   25.553   4.9566  153.853   19.446  179.850   18.259 -25.99681 26.67414 
1 1 1    3   21   47 o  165.848   14.099   21.500   3.5452   18.627   5.0799   24.228   4.9499  151.778   22.552  174.776   18.799 -22.99774 29.35933 
1 1 1    3   21   48 o  148.164   17.453   17.415   3.8821   19.377   5.5561   15.543   5.4265  153.995   24.384  136.677   26.897 17.31813 36.30444 
1 1 1    3   21   49 o  298.991   18.107   70.506   8.2474   78.962   12.031   63.009   11.328  312.117   25.405  277.612   27.000 34.50443 37.07279 
1 1 1    3   21   50 o  113.623   28.115   10.956   4.8631   8.5674   5.4737   19.906   10.596  101.037   31.756  146.833   43.816 -45.79597 54.11320 
1 1 1    3   21   51 o  174.521   15.798   24.043   4.1742   29.686   5.8698   18.270   5.9372  192.296   20.247  147.445   27.314 44.85051 33.99969 
1 1 1    3   21   52 o   83.737   28.320   5.5961   4.3156   7.1552   6.0826   4.0157   6.1241   94.659   33.539   82.522   32.667 12.13740 46.81873 
1 1 1    3   21   53 o  130.221   40.838   15.889   9.0580   18.889   11.202   10.221   15.396  139.192   45.591  119.167   50.002 20.02491 67.66652 
1 1 1    3   21   54 o   78.561   30.524   4.0413   5.2624  -1.3095   6.2563   16.984   9.7303   66.480   29.785  132.293   42.426 -65.81332 51.83686 
1 1 1    3   21   55 o  193.629   25.307   31.610   7.3209   31.586   10.465   31.632   10.246  183.084   38.560  184.053   37.638 -0.9693298 53.88411 
1 1 1    3   21   56 o  234.439   16.815   44.082   5.9938   54.496   7.5738   26.631   9.8045  258.990   19.243  165.486   39.294 93.50455 43.75253 
1 1 1    3   21   57 o   68.176   26.651   3.0165   4.0307   4.3768   5.7356   1.6892   5.6656   79.553   31.576   70.266   29.945 9.287361 43.51680 
1 1 1    3   21   58 o  151.336   26.580   20.312   5.9324   19.410   8.2768   21.265   8.5072  137.916   37.995  144.689   37.945 -6.773056 53.69739 
1 1 1    3   21   59 o  139.616   20.112   16.455   4.1739   17.687   6.2696   15.474   5.5935  136.896   30.681  129.112   29.011 7.783859 42.22525 
1 1 1    3   22    1 o  835.411   14.423  534.672   18.442   0.0000   0.0000  534.672   18.442  ?   ?   835.411   14.423 0.000000 14.42275 
1 1 1    3   22    2 o  329.909   13.922   83.377   7.0302   0.0000   0.0000   83.377   7.0302  ?   ?   329.909   13.922 0.000000 13.92196 
1 1 1    3   22    3 o  1379.34   19.307  1458.80   40.762   0.0000   0.0000  1458.80   40.762  ?   ?   1379.34   19.307 0.000000 19.30700 
1 1 1    3   22    4 o  906.700   10.621  629.526   14.740  625.776   20.804  633.306   20.888  903.737   15.039  909.160   15.010 -5.422546 21.24796 
1 1 1    3   22    5 o  894.200   10.556  612.287   14.448  601.306   20.235  623.706   20.635  885.895   14.923  902.243   14.942 -16.34827 21.11799 
1 1 1    3   22    6 o  621.162   9.4978  295.428   9.0302  285.265   12.574  306.253   12.977  610.242   13.462  632.294   13.409 -22.05261 19.00015 
1 1 1    3   22    7 o  731.679   9.8169  409.920   10.994  415.804   15.745  404.322   15.359  736.721   13.963  726.485   13.812 10.23529 19.63985 
1 1 1    3   22    8 o  958.675   8.9430  703.668   13.123  694.923   15.902  722.339   23.235  952.601   10.906  970.885   15.635 -18.28461 19.06327 
1 1 1    3   22    9 o  311.881   8.9038   74.474   4.2504   76.279   5.2254   70.945   7.3071  315.605   10.817  303.854   15.765 11.75171 19.11950 
1 1 1    3   22   10 o  843.309   8.4846  544.487   10.952  543.798   13.402  545.872   19.000  842.691   10.391  844.041   14.707 -1.350525 18.00710 
1 1 1    3   22   11 o  656.970   6.8718  330.406   6.9101  329.226   9.7448  331.599   9.8001  655.707   9.7094  658.066   9.7296 -2.358276 13.74543 
1 1 1    3   22   12 o  683.242   8.1271  357.402   8.4993  355.266   10.367  361.781   14.842  681.130   9.9442  687.146   14.112 -6.015137 17.26359 
1 1 1    3   22   13 f  638.498   8.0286  312.125   7.8464  305.852   9.5261  325.359   13.837  631.987   9.8477  651.640   13.873 -19.65314 17.01266 
1 1 1    3   22   14 o  197.560   13.011   30.031   3.9125   32.696   4.7330   24.282   6.9528  205.994   15.117  175.768   26.682 30.22581 30.66646 
1 1 1    3   22   15 o  1207.07   8.9970  1115.65   16.623  1109.42   23.377  1122.03   23.642  1203.38   12.691  1210.19   12.763 -6.816040 17.99908 
1 1 1    3   22   16 o  1007.66   9.4708  777.558   14.607  748.974   24.711  792.910   18.110  988.382   16.334  1017.41   11.629 -29.02570 20.05130 
1 1 1    3   22   17 o  1299.82   10.959  1294.10   21.803  1295.98   38.058  1293.19   26.601  1299.64   19.131  1299.09   13.378 0.5493164 23.34486 
1 1 1    3   22   18 o  235.091   11.329   42.337   4.0767   44.123   5.8025   40.596   5.7287  239.364   15.929  229.505   16.416 9.859741 22.87384 
1 1 1    3   22   19 o  968.185   8.2120  717.761   12.170  705.501   16.984  730.698   17.446  959.638   11.563  976.616   11.671 -16.97760 16.42885 
1 1 1    3   22   20 o  1132.74   8.8400  982.584   15.327  972.231   21.445  993.396   21.914  1126.41   12.438  1138.59   12.574 -12.17896 17.68657 
1 1 1    3   22   21 o  437.963   8.3701  146.883   5.6109  140.472   7.7649  153.888   8.1169  428.173   11.848  448.153   11.833 -19.98050 16.74506 
1 1 1    3   22   22 o  454.699   8.3793  158.329   5.8318  165.496   8.3401  151.473   8.1577  464.736   11.725  444.599   11.987 20.13733 16.76794 
1 1 1    3   22   23 o  411.520   10.049  129.731   6.3298  136.656   10.833  126.140   7.7999  421.998   16.771  405.675   12.561 16.32224 20.95350 
1 1 1    3   22   24 o  316.333   11.701   76.691   5.6654   83.867   9.5163   72.752   7.0511  329.885   18.926  307.963   14.959 21.92197 24.12363 
1 1 1    3   22   25 o  261.431   13.278   52.545   5.2958   54.796   6.7067   48.818   8.6308  266.661   16.513  250.816   22.728 15.84482 28.09369 
1 1 1    3   22   26 o  1054.97   8.8756  852.610   14.332  847.388   20.142  857.966   20.398  1051.22   12.518  1057.75   12.599 -6.527100 17.76045 
1 1 1    3   22   27 o  806.801   8.3192  498.645   10.274  504.965   14.536  492.338   14.522  811.515   11.702  801.286   11.840 10.22900 16.64761 
1 1 1    3   22   28 o  311.540   11.519   74.431   5.4927   71.966   7.5759   77.164   7.9752  305.599   16.255  316.438   16.523 -10.83868 23.17824 
1 1 1    3   22   29 o  523.915   8.8886  210.353   7.1279  202.438   9.9175  218.809   10.252  513.613   12.615  533.985   12.543 -20.37213 17.78945 
1 1 1    3   22   30 o  220.575   15.885   37.604   5.3272   32.821   7.2620   43.176   7.8387  204.700   23.610  235.446   22.006 -30.74632 32.27589 
1 1 1    3   22   31 o  616.018   8.7377  290.881   8.2388  299.305   11.718  282.646   11.586  624.394   12.261  606.735   12.476 17.65918 17.49204 
1 1 1    3   22   32 o   77.349   29.296   3.3895   4.7638   2.8252   6.7777   3.9405   6.6972   84.963   34.122   88.390   34.409 -3.426254 48.45905 
1 1 1    3   22   33 o  323.370   10.921   80.268   5.4053   81.932   5.8863   71.312   13.653  326.626   11.774  300.449   30.092 26.17755 32.31379 
1 1 1    3   22   34 o  294.504   10.265   66.569   4.6274   68.952   5.5734   61.282   8.3022  299.555   12.156  280.875   19.431 18.68054 22.91961 
1 1 1    3   22   35 o  248.862   10.440   47.552   3.9767   48.767   4.5868   43.874   7.9799  251.900   11.896  236.683   22.290 15.21645 25.26577 
1 1 1    3   22   36 o  348.463   9.1949   93.186   4.9043   79.302   9.2819   98.563   5.7764  319.460   19.069  358.222   10.535 -38.76135 21.78598 
1 1 1    3   22   37 f  367.295   7.7894  103.469   4.3792  100.913   5.7388  107.032   6.7757  362.431   10.345  373.035   11.867 -10.60345 15.74288 
1 1 1    3   22   38 o  402.011   7.2778  123.939   4.4782  129.005   6.3888  119.046   6.2790  409.741   10.187  393.570   10.423 16.17108 14.57443 
1 1 1    3   22   39 o  212.451   12.826   34.909   4.1512   24.220   8.5126   38.244   4.7549  171.167   33.691  222.176   14.055 -51.00867 36.50511 
1 1 1    3   22   40 o  375.653   8.1016  108.327   4.6583  109.771   6.5413  106.842   6.6353  377.602   11.318  372.465   11.639 5.136597 16.23427 
1 1 1    3   22   41 o  443.729   7.2651  151.094   4.9344  149.113   6.8657  153.209   7.0966  440.239   10.189  446.197   10.391 -5.957794 14.55272 
1 1 1    3   22   42 o  131.909   15.260   13.660   3.0241   18.467   4.2650   8.7997   4.2886  152.819   18.618  103.284   26.871 49.53454 32.69113 
1 1 1    3   22   43 o  236.559   9.7681   43.067   3.5369   45.056   5.0767   41.190   4.9303  240.908   13.825  230.249   14.057 10.65845 19.71658 
1 1 1    3   22   44 o  265.133   9.5263   54.104   3.8660   59.641   5.5823   49.000   5.3590  277.667   13.135  251.124   13.998 26.54300 19.19538 
1 1 1    3   22   45 o  276.854   9.3353   59.000   3.9559   59.438   5.5621   58.552   5.6275  277.103   13.114  274.969   13.371 2.134003 18.72845 
1 1 1    3   22   46 o  302.259   9.3634   70.355   4.3319   68.918   6.0875   71.830   6.1659  298.207   13.337  304.472   13.231 -6.265533 18.78602 
1 1 1    3   22   47 o  129.055   19.024   13.351   3.6452   10.694   4.9899   16.391   5.3378  112.614   28.827  140.964   25.686 -28.35061 38.61000 
1 1 1    3   22   48 o  188.039   13.467   27.592   3.8503   22.300   5.3345   33.347   5.5631  166.414   21.442  205.382   17.875 -38.96754 27.91496 
1 1 1    3   22   49 o   46.514   22.152  -5.1846   4.3436  -4.3502   4.7752  -9.1844   10.455   51.388   24.090   74.148   35.034 -22.76046 42.51721 
1 1 1    3   22   50 o  283.528   11.216   62.240   4.8675   59.105   7.0494   65.097   6.7292  273.816   16.903  288.150   15.312 -14.33423 22.80697 
1 1 1    3   22   51 o   78.651   30.522   3.8262   5.2569   5.9355   5.9714  -3.4402   11.083   89.478   33.021   84.542   38.580 4.935791 50.78178 
1 1 1    3   22   52 o  256.933   15.625   52.068   6.1156   51.313   6.6251   56.422   15.902  254.303   17.120  244.682   44.082 9.620270 47.28954 
1 1 1    3   22   53 o   58.737   26.809  -2.4751   5.3550  -0.0442   15.027  -2.8287   5.7312   99.884   45.325   60.160   27.562 39.72415 53.04766 
1 1 1    3   22   54 o   68.518   26.781   2.8331   4.0697   3.5535   5.5579   2.0005   5.9754   77.521   30.982   73.978   31.102 3.543251 43.89977 
1 1 1    3   22   55 o  150.245   18.937   18.424   4.2581   20.211   6.0766   16.701   5.9686  152.929   26.944  137.308   29.293 15.62114 39.80001 
1 1 1    3   22   56 o   77.451   27.564   4.8440   4.1127   3.4558   5.8612   6.1904   5.7723   77.005   31.437   86.986   32.393 -9.981239 45.13993 
1 1 1    3   22   57 o  102.700   25.658   9.3913   4.0217   4.7305   5.5172   14.675   5.8746   79.750   31.179  125.519   30.807 -45.76817 43.83133 
1 1 1    3   22   58 o   40.255   19.678  -6.6320   4.0206 -11.9791   5.8164  -1.7390   5.5639   44.632   22.161   59.693   27.277 -15.06028 35.14455 
1 1 1    3   23    0 o  479.515   13.366  176.467   9.7927  176.467   9.7927  176.467   9.7927  479.515   13.366  479.515   13.366 0.000000 0.000000 
1 1 1    3   23    1 o  696.332   13.923  371.475   14.839   0.0000   0.0000  371.475   14.839  ?   ?   696.332   13.923 0.000000 13.92256 
1 1 1    3   23    2 o  964.973   15.601  713.587   23.043   0.0000   0.0000  713.587   23.043  ?   ?   964.973   15.601 0.000000 15.60118 
1 1 1    3   23    3 o  628.241   9.5644  302.211   9.1972  278.395   12.342  331.947   13.791  602.833   13.376  658.250   13.688 -55.41663 19.13866 
1 1 1    3   23    4 o  1247.65   12.798  1192.39   24.441  1184.92   34.437  1199.98   34.693  1243.17   18.098  1251.04   18.117 -7.871948 25.60800 
1 1 1    3   23    5 o  827.986   10.337  524.983   13.101  518.955   18.464  531.096   18.592  822.970   14.658  832.545   14.590 -9.575684 20.68136 
1 1 1    3   23    6 o  361.318   10.004   99.969   5.5328  107.951   8.1657   93.194   7.5230  375.357   14.213  348.762   14.093 26.59558 20.01516 
1 1 1    3   23    7 o  971.588   11.047  722.953   16.428  722.810   23.362  723.092   23.107  971.142   15.716  971.347   15.542 -0.2048950 22.10305 
1 1 1    3   23    8 o  1079.81   9.5779  892.834   15.830  888.403   19.344  901.818   27.544  1076.98   11.735  1084.65   16.591 -7.663330 20.32146 
1 1 1    3   23    9 o  1138.43   9.8928  992.446   17.238  999.693   21.332  978.805   29.265  1142.41   12.199  1129.94   16.921 12.46289 20.86012 
1 1 1    3   23   10 o  1077.93   9.6191  889.744   15.871  898.795   19.742  873.207   26.685  1083.23   11.907  1067.29   16.335 15.93933 20.21354 
1 1 1    3   23   11 o  721.728   8.2540  398.816   9.1181  406.986   11.319  383.710   15.390  729.003   10.144  707.631   14.209 21.37274 17.45809 
1 1 1    3   23   12 o  583.806   7.0656  260.925   6.3137  266.436   8.9985  255.582   8.8610  589.844   9.9670  577.703   10.021 12.14105 14.13363 
1 1 1    3   23   13 o  1150.34   10.104  1013.42   17.791  1008.92   30.918  1015.65   21.753  1147.00   17.611  1151.42   12.343 -4.418823 21.50556 
1 1 1    3   23   14 o  1554.09   12.372  1850.33   29.430  1832.44   50.623  1859.46   36.170  1544.94   21.407  1557.51   15.172 -12.56653 26.23869 
1 1 1    3   23   15 o  563.445   8.5744  243.092   7.3947  219.761   12.424  255.893   9.2024  535.427   15.159  578.019   10.401 -42.59229 18.38453 
1 1 1    3   23   16 o  470.183   7.7767  169.265   5.5967  173.966   7.9608  164.671   7.8698  476.564   10.914  463.651   11.089 12.91296 15.55882 
1 1 1    3   23   17 o  130.733   19.439   13.403   3.7715   19.792   5.3800   7.2299   5.2885  158.901   22.771   97.915   31.264 60.98621 38.67787 
1 1 1    3   23   18 o  599.122   7.6083  274.835   6.9770  269.807   9.7095  280.203   10.032  593.482   10.689  604.800   10.837 -11.31818 15.22155 
1 1 1    3   23   19 o  511.926   7.9196  200.670   6.2055  193.755   8.6290  208.077   8.9306  502.895   11.210  521.150   11.196 -18.25531 15.84336 
1 1 1    3   23   20 o  894.146   8.1425  612.228   11.144  611.705   15.676  612.763   15.844  893.505   11.462  894.267   11.576 -0.7623291 16.29051 
1 1 1    3   23   21 o  283.348   12.259   61.532   5.3169   76.234   9.4144   54.646   6.4428  314.429   19.660  266.426   15.871 48.00250 25.26664 
1 1 1    3   23   22 o  445.084   9.8893  151.760   6.7372  159.056   11.584  148.030   8.2820  455.243   16.624  439.460   12.313 15.78278 20.68698 
1 1 1    3   23   23 o  176.203   18.017   24.093   4.7909   21.965   5.9908   27.868   7.9796  167.191   24.106  187.882   28.655 -20.69099 37.44616 
1 1 1    3   23   24 o  564.250   9.2589  243.913   7.9966  241.086   9.9313  249.125   13.484  560.807   11.570  569.716   15.463 -8.909302 19.31259 
1 1 1    3   23   25 o  838.215   8.2498  538.202   10.584  548.444   14.998  528.040   14.939  845.780   11.585  829.875   11.761 15.90479 16.50898 
1 1 1    3   23   26 o  727.166   8.1440  405.072   9.0645  402.661   12.671  407.598   12.973  724.657   11.424  729.060   11.625 -4.403198 16.29852 
1 1 1    3   23   27 o  522.672   8.6765  209.328   6.9413  198.681   9.5268  221.377   10.134  508.899   12.230  537.170   12.326 -28.27081 17.36407 
1 1 1    3   23   28 o  496.318   8.8541  188.784   6.7262  183.501   9.3334  194.494   9.7020  488.987   12.470  503.408   12.591 -14.42072 17.72134 
1 1 1    3   23   29 o  134.881   23.120   14.453   4.6015   10.740   6.4463   18.311   6.5704  116.077   34.059  150.907   29.503 -34.82977 45.06047 
1 1 1    3   23   30 o  194.687   16.622   29.389   4.9058   38.732   6.9450   20.084   6.9308  223.031   20.576  158.045   29.742 64.98589 36.16560 
1 1 1    3   23   31 o  429.749   11.598  141.789   7.6288  129.062   8.8068  180.044   15.269  409.707   14.043  482.611   20.670 -72.90353 24.98913 
1 1 1    3   23   32 o  176.416   32.436   25.173   8.4359   31.341   11.538   18.089   12.365  195.164   39.969  149.936   47.799 45.22818 62.30803 
1 1 1    3   23   33 o  538.724   9.3487  222.652   7.7088  221.136   10.983  224.124   10.822  536.205   13.382  539.872   13.097 -3.667419 18.72457 
1 1 1    3   23   34 o  283.097   9.5448   61.504   4.1359   64.953   4.8409   52.184   7.9588  290.805   10.876  258.759   20.256 32.04575 22.99127 
1 1 1    3   23   35 o  340.740   9.0084   89.093   4.6983   67.750   8.4854   98.530   5.6420  295.222   18.877  358.185   10.291 -62.96259 21.49997 
1 1 1    3   23   36 o  259.845   8.3901   51.804   3.3369   55.482   4.7109   48.100   4.7275  268.619   11.458  250.016   12.354 18.60349 16.84899 
1 1 1    3   23   37 o  265.347   8.4895   54.037   3.4480   51.643   4.7790   56.635   4.9795  259.035   12.053  271.274   11.993 -12.23911 17.00307 
1 1 1    3   23   38 o  178.108   14.161   24.636   3.8287   43.378   10.454   21.733   4.1146  231.897   30.166  166.796   16.326 65.10097 34.30002 
1 1 1    3   23   39 o  465.493   7.6227  166.279   5.4311  159.817   7.5748  173.116   7.7914  455.727   10.859  474.340   10.731 -18.61319 15.26707 
1 1 1    3   23   40 o  185.242   10.827   26.507   3.0566   29.536   4.3543   23.564   4.2917  194.846   14.708  173.557   16.348 21.28908 21.99095 
1 1 1    3   23   41 o  571.388   8.3306  250.814   7.2858  262.817   8.9100  226.595   12.657  584.423   9.9605  540.674   15.294 43.74963 18.25153 
1 1 1    3   23   42 o  333.015   8.5363   85.231   4.3511   84.519   5.7852   86.159   6.6024  331.071   11.416  333.917   12.918 -2.846161 17.23965 
1 1 1    3   23   43 o  207.452   10.646   33.252   3.3692   34.006   4.7964   32.518   4.7336  208.802   15.110  204.122   15.261 4.680130 21.47578 
1 1 1    3   23   44 o  140.576   14.475   15.487   3.0701   13.101   4.3304   17.897   4.3533  126.834   23.160  149.922   19.428 -23.08842 30.22902 
1 1 1    3   23   45 o  140.864   15.041   15.592   3.1929   15.613   4.5672   15.573   4.4655  138.894   22.233  138.880   21.718 0.1344299E-01 31.08034 
1 1 1    3   23   46 o  436.292   13.011  147.518   8.6886   0.0000   0.0000  147.518   8.6886  ?   ?   436.292   13.011 0.000000 13.01083 
1 1 1    3   23   47 o  346.396   16.233   93.760   8.6068  105.407   12.255   82.424   12.091  363.491   22.132  319.534   24.918 43.95749 33.32735 
1 1 1    3   23   48 o  297.138   12.688   68.493   5.7704   78.407   6.7007   40.040   11.352  317.529   13.787  215.435   35.674 102.0933 38.24525 
1 1 1    3   23   49 o  136.943   18.833   15.061   3.8431   18.433   5.6062   12.072   5.2785  149.129   25.475  118.862   29.220 30.26669 38.76577 
1 1 1    3   23   50 o   54.854   25.140  -2.7474   4.7742  -3.4927   5.3296   0.2806   10.742   56.767   26.215   90.175   39.791 -33.40772 47.64999 
1 1 1    3   23   51 o  140.205   26.182   16.572   5.4120   18.487   5.8195   4.3209   14.722  148.028   26.665  107.889   47.124 40.13895 54.14497 
1 1 1    3   23   52 o  428.874   12.435  143.377   8.1632  119.715   18.399  149.176   9.1088  371.520   32.688  436.663   13.628 -65.14304 35.41531 
1 1 1    3   23   53 o  107.077   24.993   9.8212   4.0217   20.748   5.9928   0.8680   5.4246  156.362   25.949   68.009   29.150 88.35225 39.02660 
1 1 1    3   23   54 f  229.355   13.027   41.356   4.5543   44.976   6.5521   37.973   6.3348  236.255   18.261  216.327   19.335 19.92879 26.59521 
1 1 1    3   23   55 o   58.940   25.739   0.0258   4.3903   1.3293   6.1874  -1.2959   6.2305   71.911   30.982   65.347   29.463 6.563843 42.75448 
1 1 1    3   23   56 o   84.072   27.422   6.1748   4.0542   8.3544   5.7878   4.0750   5.6808   95.596   32.794   78.028   31.274 17.56798 45.31516 
1 1 1    3   23   57 o  101.798   25.273   9.2594   3.9198   4.3714   5.4201   14.619   5.6756   77.654   30.735  125.263   29.998 -47.60906 42.94786 
1 1 1    3   24    0 o   42.411   28.851  -3.2517   5.7094  -3.2517   5.7094  -3.2517   5.7094   42.411   28.851   42.411   28.851 0.000000 0.000000 
1 1 1    3   24    1 o  1043.29   16.276  834.337   25.990   0.0000   0.0000  834.337   25.990  ?   ?   1043.29   16.276 0.000000 16.27560 
1 1 1    3   24    2 o  1292.85   18.602  1281.86   36.811   0.0000   0.0000  1281.86   36.811  ?   ?   1292.85   18.602 0.000000 18.60197 
1 1 1    3   24    3 o  998.520   11.277  763.638   17.236  753.209   24.091  774.574   24.669  991.303   15.877  1005.25   16.033 -13.94543 22.56438 
1 1 1    3   24    4 o  403.152   10.086  124.465   6.2241  121.504   8.6655  127.621   8.9457  398.205   14.217  408.103   14.321 -9.897766 20.17976 
1 1 1    3   24    5 o  454.788   9.8066  158.385   6.8265  153.597   9.5081  163.479   9.8070  447.727   13.874  461.906   13.871 -14.17862 19.61899 
1 1 1    3   24    6 o  1133.35   12.130  983.944   21.043  986.334   29.999  981.629   29.525  1134.19   17.280  1131.51   17.048 2.680664 24.27410 
1 1 1    3   24    7 o  655.515   9.8550  329.058   9.8880  331.100   14.219  327.147   13.759  657.332   14.133  653.418   13.757 3.913940 19.72319 
1 1 1    3   24    8 o  705.462   10.029  381.126   10.829  387.193   15.628  375.522   15.019  710.812   14.364  700.040   14.017 10.77203 20.06995 
1 1 1    3   24    9 o  677.540   8.2824  351.484   8.5893  351.104   10.674  352.182   14.468  677.090   10.299  677.930   13.943 -0.8405762 17.33432 
1 1 1    3   24   10 o  512.408   10.145  201.082   7.9567  206.867   11.549  195.855   10.978  519.537   14.523  505.537   14.187 14.00015 20.30242 
1 1 1    3   24   11 o  182.126   17.596   25.676   4.8440   24.489   7.0805   26.719   6.6415  176.423   27.086  184.949   24.029 -8.525787 36.20810 
1 1 1    3   24   12 o  1016.70   9.5394  791.605   14.845  773.444   25.313  801.126   18.328  1004.33   16.466  1022.63   11.709 -18.30133 20.20493 
1 1 1    3   24   13 o  1110.10   8.6788  943.640   14.747  957.116   21.221  931.053   20.508  1117.68   12.404  1102.38   12.154 15.29785 17.36607 
1 1 1    3   24   14 o  381.315   8.5197  111.339   4.9725  110.744   7.0295  111.935   7.0349  380.190   12.080  382.230   12.024 -2.039703 17.04422 
1 1 1    3   24   15 o  580.904   7.4859  258.369   6.6561  269.791   9.5733  247.681   9.2607  593.478   10.539  568.634   10.640 24.84357 14.97579 
1 1 1    3   24   16 o  401.424   8.4283  123.395   5.1786  119.573   7.2154  127.455   7.4369  395.043   11.933  407.856   11.913 -12.81348 16.86151 
1 1 1    3   24   17 o  556.651   7.7321  237.262   6.5880  249.708   9.6063  226.211   9.0519  570.916   10.993  543.397   10.883 27.51923 15.46895 
1 1 1    3   24   18 o  309.439   9.8375   73.344   4.6594   72.799   6.5388   73.907   6.6411  308.154   13.863  310.486   13.974 -2.332428 19.68419 
1 1 1    3   24   19 o  700.940   8.8718  376.295   9.5183  382.487   16.406  373.153   11.686  706.172   15.179  697.871   10.940 8.300964 18.71041 
1 1 1    3   24   20 o  341.958   10.713   89.598   5.6073   91.509   9.4337   88.553   6.9727  344.759   17.939  339.847   13.404 4.911804 22.39381 
1 1 1    3   24   21 o  1197.88   10.656  1099.55   19.537  1113.95   24.255  1072.92   32.969  1205.31   13.147  1181.87   18.225 23.44531 22.47216 
1 1 1    3   24   22 o  856.350   9.3690  561.823   12.280  560.989   15.070  563.472   21.186  855.485   11.509  856.715   16.156 -1.230713 19.83643 
1 1 1    3   24   23 o  644.788   8.0023  318.448   7.8977  316.609   11.018  320.390   11.326  642.666   11.201  646.468   11.446 -3.802124 16.01498 
1 1 1    3   24   24 o  604.205   8.1300  279.654   7.5188  287.705   10.655  271.668   10.611  612.564   11.364  595.219   11.647 17.34528 16.27271 
1 1 1    3   24   25 o  273.847   11.681   57.515   4.8963   56.814   6.8284   58.257   7.0246  271.388   16.517  274.789   16.782 -3.400879 23.54662 
1 1 1    3   24   26 o  234.857   13.659   42.490   4.8890   41.602   6.6223   43.555   7.2483  231.695   18.837  236.892   20.182 -5.196884 27.60701 
1 1 1    3   24   27 o  688.279   8.3197  363.021   8.7648  362.175   12.216  363.919   12.582  687.054   11.617  688.657   11.937 -1.603271 16.65634 
1 1 1    3   24   28 o  249.981   12.996   48.118   4.9555   44.085   6.8258   52.612   7.2057  238.415   18.859  260.696   18.172 -22.28059 26.18905 
1 1 1    3   24   29 o  383.409   9.9166  112.750   5.8196  113.319   8.1538  112.159   8.3088  383.974   13.874  381.962   14.212 2.011566 19.86077 
1 1 1    3   24   30 o  401.170   11.697  123.577   7.1827  128.117   8.5686  112.845   13.173  408.221   13.713  380.965   22.693 27.25562 26.51499 
1 1 1    3   24   31 o  216.262   18.567   36.375   6.0864   32.310   11.089   38.128   7.2811  198.787   37.828  220.790   21.831 -22.00269 43.67531 
1 1 1    3   24   32 o  542.136   9.1042  225.464   7.5547  232.427   10.719  218.591   10.649  549.826   12.737  533.150   13.050 16.67639 18.23516 
1 1 1    3   24   33 o  573.216   9.2072  252.122   8.0783  242.167   11.248  262.728   11.610  561.037   13.098  584.398   12.979 -23.36011 18.43936 
1 1 1    3   24   34 o  471.882   9.8874  170.972   7.1415  167.699   10.067  174.288   10.132  466.558   14.097  475.677   13.916 -9.118530 19.80895 
1 1 1    3   24   35 o  303.748   12.733   71.025   5.9199   68.358   8.4194   73.633   8.3255  296.438   18.651  307.935   17.739 -11.49741 25.73923 
1 1 1    3   24   36 o  267.537   8.2435   54.925   3.3757   51.244   4.6564   59.004   4.9009  258.055   11.789  276.934   11.562 -18.87955 16.51217 
1 1 1    3   24   37 o  456.790   9.4659  160.304   6.6183  142.868   13.087  166.296   7.6717  428.411   19.957  464.984   10.779 -36.57370 22.68225 
1 1 1    3   24   38 o  240.835   9.1822   44.564   3.3848   45.353   4.7244   43.733   4.8519  242.180   12.790  237.685   13.391 4.494736 18.51792 
1 1 1    3   24   39 o  289.705   8.0918   64.446   3.5881   63.169   5.0354   65.764   5.1143  286.336   11.489  292.169   11.436 -5.833282 16.21075 
1 1 1    3   24   40 o  482.698   8.5455  179.027   6.3137  156.129   11.298  189.425   7.6135  448.366   16.463  496.147   10.025 -47.78119 19.27510 
1 1 1    3   24   41 o  186.417   10.922   26.868   3.1028   28.302   4.4398   25.500   4.3382  190.419   15.364  180.569   15.857 9.849884 22.07887 
1 1 1    3   24   42 o  194.941   11.049   29.393   3.2834   24.641   4.4520   35.061   4.8620  177.205   16.607  212.051   15.078 -34.84668 22.43100 
1 1 1    3   24   43 f  492.861   11.852  187.602   8.9410  173.329   12.706  201.601   12.584  471.169   17.618  508.948   16.154 -37.77847 23.90286 
1 1 1    3   24   44 o  120.471   16.861   11.531   3.0239   9.7110   4.0839   13.740   4.4989  108.268   25.128  129.733   23.523 -21.46500 34.41990 
1 1 1    3   24   45 o  227.823   11.575   40.215   4.0230   35.577   5.5607   45.308   5.8275  212.640   17.233  240.582   15.915 -27.94247 23.45798 
1 1 1    3   24   46 o  174.632   13.492   23.808   3.5784   18.065   4.9678   30.002   5.1590  149.255   22.440  194.944   17.475 -45.68930 28.44149 
1 1 1    3   24   47 o  157.037   19.452   19.734   4.5754   22.809   5.1171   7.4742   10.218  168.700   20.220  106.725   42.213 61.97479 46.80605 
1 1 1    3   24   48 o  262.914   13.566   53.906   5.4406   61.072   6.2069   30.137   11.304  279.499   14.559  182.146   41.473 97.35313 43.95436 
1 1 1    3   24   49 o  132.144   22.883   14.380   4.4608   14.256   4.8774   15.011   11.031  130.605   25.312  128.924   45.213 1.680481 51.81614 
1 1 1    3   24   50 o  196.628   13.501   30.295   4.0387   28.462   5.5546   32.350   5.8826  188.168   19.572  200.815   19.379 -12.64644 27.54302 
1 1 1    3   24   51 o  183.182   20.593   27.237   5.6738   29.562   15.836   26.895   6.0772  165.271   54.210  181.092   22.403 -15.82089 58.65684 
1 1 1    3   24   52 o   61.638   24.929   1.7387   3.6455   0.1301   5.3044   3.1785   5.0184   65.234   28.394   74.221   29.511 -8.986137 40.95314 
1 1 1    3   24   53 o  163.499   17.262   21.508   4.2546   20.032   6.2398   22.791   5.8163  152.104   27.827  164.966   23.717 -12.86226 36.56289 
1 1 1    3   24   54 o  121.160   23.489   12.524   4.1989   7.0527   6.0064   17.752   5.8721   91.463   33.215  142.058   28.001 -50.59503 43.44293 
1 1 1    3   24   55 f   90.827   27.587   7.3414   4.1731   6.5053   5.9556   8.1478   5.8491   88.178   32.891   94.981   32.945 -6.803627 46.55280 
1 1 1    3   24   56 o   62.293   26.881   0.8088   4.6729   4.0336   5.6891  -5.8782   8.1923   77.410   31.201   64.783   30.728 12.62675 43.79160 
1 1 1    3   24   57 o   85.454   28.618   6.5748   4.4064   6.7119   6.4347   6.4537   6.0465   88.017   33.877   86.509   32.948 1.507408 47.25681 
1 1 1    3   25    0 o  774.778   14.694  460.227   17.412  460.227   17.412  460.227   17.412  774.778   14.694  774.778   14.694 0.000000 0.000000 
1 1 1    3   25    1 o  866.605   15.005  575.613   19.903   0.0000   0.0000  575.613   19.903  ?   ?   866.605   15.005 0.000000 15.00454 
1 1 1    3   25    2 o  537.466   13.893  221.361   11.430   0.0000   0.0000  221.361   11.430  ?   ?   537.466   13.893 0.000000 13.89346 
1 1 1    3   25    3 f  1233.51   12.889  1165.77   24.335  1141.63   33.875  1191.51   34.981  1220.01   18.140  1246.35   18.337 -26.33838 25.79376 
1 1 1    3   25    4 o  534.009   10.103  218.392   8.2576  210.725   11.748  225.878   11.609  524.354   14.638  542.914   13.970 -18.56012 20.23441 
1 1 1    3   25    5 o  439.905   10.315  148.208   6.9455  150.868   9.9605  145.691   9.6900  443.669   14.667  435.998   14.520 7.671326 20.63893 
1 1 1    3   25    6 o  176.399   18.327   24.125   4.8760   28.216   6.9540   20.169   6.8388  190.069   24.471  159.423   29.098 30.64590 38.02042 
1 1 1    3   25    7 o  1317.56   13.491  1330.26   27.206  1334.56   38.770  1326.09   38.188  1318.82   19.206  1314.67   18.977 4.151489 27.00032 
1 1 1    3   25    8 o  348.517   11.587   93.048   6.1809   92.224   8.7663   93.862   8.7161  346.800   16.515  349.875   16.276 -3.075256 23.18687 
1 1 1    3   25    9 o  707.887   10.423  383.806   11.293  383.710   16.125  383.899   15.820  707.506   14.890  707.702   14.605 -0.1953125 20.85736 
1 1 1    3   25   10 o  360.100   11.929   99.346   6.5748   95.998   9.3746  102.586   9.2235  353.773   17.312  365.750   16.476 -11.97644 23.89909 
1 1 1    3   25   11 o  780.432   8.8024  466.411   10.515  470.845   13.037  458.156   17.787  784.011   10.864  773.055   15.032 10.95648 18.54697 
1 1 1    3   25   12 o  776.627   8.7567  461.879   10.409  467.133   12.850  451.850   17.753  780.912   10.751  767.690   15.108 13.22211 18.54271 
1 1 1    3   25   13 o  1168.22   8.9889  1045.14   16.073  1067.11   23.221  1024.93   22.271  1180.03   12.856  1156.50   12.581 23.52466 17.98800 
1 1 1    3   25   14 o  239.418   11.369   43.917   4.1662   46.080   5.8854   41.744   5.8985  244.613   15.804  232.680   16.672 11.93233 22.97228 
1 1 1    3   25   15 o  900.035   8.0428  620.308   11.080  622.786   15.811  617.916   15.532  901.566   11.458  898.048   11.299 3.517639 16.09183 
1 1 1    3   25   16 o  468.744   9.1664  168.287   6.5766  177.032   11.475  164.010   8.0254  480.413   15.606  462.654   11.333 17.75952 19.28656 
1 1 1    3   25   17 o  678.049   8.8487  352.125   9.1836  352.840   15.831  351.762   11.275  678.224   15.250  677.567   10.871 0.6570435 18.72797 
1 1 1    3   25   18 o  712.802   10.985  389.337   11.986   0.0000   0.0000  389.337   11.986  ?   ?   712.802   10.985 0.000000 10.98548 
1 1 1    3   25   19 o  444.164   9.5990  151.139   6.5259  156.633   8.1146  141.080   10.980  452.050   11.728  428.676   16.734 23.37399 20.43451 
1 1 1    3   25   20 o  240.217   13.813   44.410   5.0576   47.112   6.2931   39.482   8.4990  247.128   16.736  224.907   25.118 22.22156 30.18233 
1 1 1    3   25   21 o  393.599   9.1858  118.694   5.5340  108.185   7.5849  130.656   8.0923  375.550   13.195  412.740   12.809 -37.19052 18.38989 
1 1 1    3   25   22 o  354.201   9.6956   96.144   5.2565   95.695   7.2786   96.634   7.5994  353.153   13.465  354.845   13.992 -1.691742 19.41853 
1 1 1    3   25   23 o  628.527   8.1233  302.644   7.8150  293.076   10.751  313.362   11.380  618.211   11.362  639.218   11.631 -21.00775 16.25941 
1 1 1    3   25   24 o  799.724   8.2470  490.022   10.095  479.610   13.995  501.318   14.576  790.745   11.563  808.408   11.780 -17.66309 16.50622 
1 1 1    3   25   25 o  383.634   9.3975  112.817   5.5182  119.589   7.8586  106.230   7.7504  394.690   13.008  371.937   13.614 22.75241 18.82959 
1 1 1    3   25   26 o  518.567   8.5885  206.102   6.8169  204.005   9.5278  208.302   9.7575  515.555   12.074  520.935   12.237 -5.380493 17.19103 
1 1 1    3   25   27 o  655.936   8.3224  329.768   8.3557  324.689   11.621  335.204   12.022  650.397   11.674  660.810   11.886 -10.41272 16.66000 
1 1 1    3   25   28 o  630.080   9.8809  304.521   9.5294  291.651   11.241  337.405   17.967  616.303   11.916  661.558   17.744 -45.25531 21.37352 
1 1 1    3   25   29 o  244.524   21.851   46.664   8.0922   51.425   11.449   41.910   11.440  254.736   29.933  228.530   33.716 26.20531 45.08637 
1 1 1    3   25   30 o  759.652   10.048  442.847   11.683  464.932   21.514  433.611   13.913  775.988   18.113  751.227   12.100 24.76099 21.78255 
1 1 1    3   25   31 o  148.759   21.068   17.481   4.6629   17.735   6.5260   17.217   6.6648  147.816   29.872  145.369   30.905 2.446747 42.98196 
1 1 1    3   25   32 o  374.649   10.559  107.799   6.0548   95.083   8.2532  122.620   8.9101  351.172   15.354  398.938   14.592 -47.76569 21.18195 
1 1 1    3   25   33 o  301.274   12.461   69.833   5.7462   69.175   8.1260   70.491   8.1266  298.505   17.867  301.380   17.694 -2.875580 25.14602 
1 1 1    3   25   34 o  397.673   10.929  121.564   6.6523  128.956   9.4164  114.199   9.3991  408.782   15.050  384.479   15.971 24.30234 21.94484 
1 1 1    3   25   35 o  448.834   10.436  154.848   7.1696  150.029   10.105  159.734   10.174  440.779   14.977  454.910   14.612 -14.13116 20.92455 
1 1 1    3   25   36 o   51.218   24.885 -10.2929   6.1616  -5.2131   9.2995 -14.2680   8.2264   77.157   35.260   58.267   28.409 18.89029 45.28100 
1 1 1    3   25   37 o  381.967   7.9274  111.990   4.6348  115.140   6.8202  109.288   6.3178  386.664   11.524  376.823   10.954 9.841461 15.89895 
1 1 1    3   25   38 o  163.902   11.185   20.785   2.7894   22.457   3.9247   19.079   3.9651  169.628   15.280  155.883   16.888 13.74402 22.77490 
1 1 1    3   25   39 o  148.777   12.441   17.199   2.8071   21.157   3.8601   12.756   4.0894  164.492   15.515  125.747   22.051 38.74574 26.96188 
1 1 1    3   25   40 o  430.397   7.1578  142.185   4.7154  142.461   6.6426  141.904   6.6948  430.194   10.088  429.326   10.188 0.8671570 14.33732 
1 1 1    3   25   41 o  402.757   7.5155  124.573   4.6331  125.902   6.6248  123.301   6.4819  404.181   10.709  400.018   10.586 4.163940 15.05808 
1 1 1    3   25   42 o  459.499   7.3705  162.155   5.1838  165.666   7.4380  158.839   7.2285  463.619   10.482  453.990   10.402 9.629211 14.76728 
1 1 1    3   25   43 o  245.772   9.5285   46.517   3.5845   42.438   4.8603   51.381   5.3076  233.605   13.652  257.149   13.532 -23.54462 19.22275 
1 1 1    3   25   44 o  407.818   8.8657  128.015   5.5341  122.153   7.5647  134.766   8.1174  397.272   12.440  417.176   12.712 -19.90381 17.78671 
1 1 1    3   25   45 o  117.665   18.755   11.131   3.2645   10.457   4.4159   11.944   4.8476  111.846   26.246  119.387   27.142 -7.540054 37.75627 
1 1 1    3   25   46 o  319.832   11.171   79.093   5.4686   82.925   6.3409   67.971   10.804  327.010   12.668  289.989   24.571 37.02081 27.64493 
1 1 1    3   25   47 o   60.330   25.854   0.2219   4.2663   3.8247   4.7341 -15.3551   9.8437   77.019   29.197   63.822   31.109 13.19743 42.66371 
1 1 1    3   25   48 o   86.257   24.357   6.1924   3.3570   3.5022   4.5849   9.3011   4.9288   74.767   28.639  104.345   29.530 -29.57784 41.13713 
1 1 1    3   25   49 o   71.718   25.716   3.7411   3.5863   2.5247   5.2028   4.8421   4.9501   73.311   29.736   81.741   30.081 -8.430801 42.29791 
1 1 1    3   25   50 o  135.726   27.042   15.703   5.4206   14.889   14.838   15.829   5.8231  128.401   50.843  135.327   28.986 -6.926407 58.52484 
1 1 1    3   25   51 o   48.364   22.103  -1.9868   3.6551  -2.5677   5.2733  -1.4497   5.0709   57.969   26.514   59.530   26.733 -1.561771 37.65181 
1 1 1    3   25   52 o  221.744   12.613   38.560   4.2633   36.224   5.8200   41.265   6.2627  212.223   18.090  226.519   18.217 -14.29588 25.67281 
1 1 1    3   25   53 f   86.399   29.710   6.2965   4.7519  -7.4557   8.9577   11.682   5.6057   67.272   31.973  113.287   31.293 -46.01574 44.73834 
1 1 1    3   25   54 o  152.160   22.348   19.537   5.0498   6.5329   9.0170   25.479   6.0953   94.251   38.794  173.197   23.607 -78.94599 45.41204 
1 1 1    3   25   55 o  102.255   30.075   9.6967   5.0211   17.714   6.2678  -4.6650   8.3889  138.515   30.398   67.651   31.783 70.86419 43.97947 
1 1 1    3   26    2 o  473.866   15.016  172.138   10.891   0.0000   0.0000  172.138   10.891  ?   ?   473.866   15.016 0.000000 15.01625 
1 1 1    3   26    3 f  524.165   10.423  210.439   8.3627  210.631   11.941  210.255   11.715  524.183   14.883  523.730   14.614 0.4531250 20.85861 
1 1 1    3   26    4 o  1067.99   11.982  873.868   19.586  867.466   27.704  880.266   27.694  1063.49   17.019  1071.32   16.889 -7.835083 23.97679 
1 1 1    3   26    5 o  503.236   10.379  193.972   7.9943  197.455   11.645  190.867   10.995  507.508   14.991  499.003   14.395 8.505188 20.78290 
1 1 1    3   26    6 o  647.935   10.401  321.562   10.315  326.676   14.928  316.888   14.271  652.777   14.940  642.956   14.501 9.821777 20.82050 
1 1 1    3   26    7 o  379.568   11.871  110.382   6.8966   98.069   9.5251  123.951   9.9987  357.544   17.405  402.027   16.249 -44.48251 23.81068 
1 1 1    3   26    8 o  532.301   10.728  217.047   8.7404  213.643   12.304  220.514   12.418  527.864   15.229  536.291   15.128 -8.427063 21.46577 
1 1 1    3   26    9 o  394.213   11.697  119.066   7.0576  115.386   10.201  122.445   9.7750  387.822   17.184  399.573   15.983 -11.75137 23.46777 
1 1 1    3   26   10 o  862.721   9.2750  570.026   12.248  557.436   14.877  596.506   21.576  852.983   11.395  881.904   15.984 -28.92029 19.62949 
1 1 1    3   26   11 o  554.613   10.777  235.644   9.1484  243.572   13.341  228.607   12.569  563.564   15.466  546.008   15.040 17.55554 21.57273 
1 1 1    3   26   12 o   93.707   35.747   4.7143   7.1249   0.0000   0.0000   4.7143   7.1249  ?   ?    93.707   35.747 0.000000 35.74748 
1 1 1    3   26   13 o  606.250   10.691  281.585   9.9208  279.995   13.986  283.195   14.074  604.213   15.123  607.655   15.132 -3.441956 21.39371 
1 1 1    3   26   14 o  547.268   9.0112  229.397   7.5483  219.008   12.916  234.785   9.3021  534.291   15.794  553.552   10.979 -19.26086 19.23497 
1 1 1    3   26   15 f  202.411   13.231   31.546   4.0765   36.262   5.7424   26.754   5.7881  216.635   17.466  185.416   20.751 31.21931 27.12305 
1 1 1    3   26   16 o  369.218   9.0496  104.423   5.1142  105.759   7.0796  102.965   7.3960  371.422   12.453  366.447   13.186 4.975525 18.13692 
1 1 1    3   26   17 o  1266.68   11.016  1229.68   21.358  1232.34   26.237  1224.45   36.773  1267.59   13.523  1262.20   19.034 5.388550 23.34837 
1 1 1    3   26   18 o  672.441   9.0760  346.415   9.3416  338.153   11.401  363.287   16.294  664.194   11.215  687.945   15.474 -23.75183 19.11051 
1 1 1    3   26   19 o  342.184   9.6412   89.723   5.0497   86.205   7.0693   93.389   7.2156  335.189   13.779  348.893   13.512 -13.70425 19.29829 
1 1 1    3   26   20 o  332.712   9.8434   84.837   5.0128   87.690   7.1223   82.037   7.0565  338.033   13.766  326.934   14.101 11.09973 19.70629 
1 1 1    3   26   21 o  382.656   9.3113  112.213   5.4536  123.608   7.8619  101.645   7.5715  401.373   12.797  363.912   13.593 37.46063 18.66909 
1 1 1    3   26   22 o  105.386   25.650   8.9337   4.0985   9.5124   5.6441   8.2882   5.9612  109.440   31.801  104.061   33.190 5.379463 45.96570 
1 1 1    3   26   23 o  844.800   8.2735  546.874   10.698  548.203   15.061  545.519   15.199  845.313   11.640  843.217   11.777 2.096497 16.55844 
1 1 1    3   26   24 o  426.266   9.2142  139.290   6.0118  132.702   8.3985  146.214   8.6095  415.700   13.199  436.386   12.890 -20.68552 18.44891 
1 1 1    3   26   25 o  793.559   8.3140  482.648   10.099  467.648   13.998  498.928   14.583  780.571   11.716  806.234   11.817 -25.66296 16.64078 
1 1 1    3   26   26 o  133.660   25.601   14.323   5.0469   16.008   5.9522   10.014   9.5201  140.886   28.579  118.784   41.972 22.10179 50.77843 
1 1 1    3   26   27 o  428.883   10.872  141.179   7.1371  143.808   8.5941  135.339   12.812  432.591   12.979  418.480   20.002 14.11060 23.84390 
1 1 1    3   26   28 f  573.469   10.086  252.357   8.8530  252.795   15.753  252.154   10.703  572.314   17.983  572.886   12.206 -0.5717773 21.73384 
1 1 1    3   26   29 o  385.933   10.058  114.313   5.9415  117.650   8.4121  110.992   8.3929  390.998   14.056  379.714   14.441 11.28375 20.15195 
1 1 1    3   26   30 o  700.549   8.6282  376.439   9.2518  381.899   13.009  370.851   13.160  704.858   12.058  694.505   12.380 10.35284 17.28179 
1 1 1    3   26   31 o   55.567   25.082  -2.2766   4.5310   2.0816   6.4616  -6.4924   6.3552   80.563   32.962   58.770   27.628 21.79321 43.00935 
1 1 1    3   26   32 o   90.387   29.005   6.3168   4.5475   6.7817   6.2828   5.8053   6.5904   97.185   34.120   94.215   34.704 2.969391 48.66739 
1 1 1    3   26   33 o  325.723   11.532   81.606   5.7494   77.957   8.0497   85.405   8.2146  317.076   16.644  332.419   16.145 -15.34290 23.18812 
1 1 1    3   26   34 o  416.394   11.694  133.439   7.4533  132.515   12.026  134.016   9.4970  413.053   19.022  416.569   14.895 -3.515503 24.15985 
1 1 1    3   26   35 f  187.176   23.626   27.873   6.6181   27.378   9.3684   28.367   9.3504  181.638   34.966  185.239   34.239 -3.600708 48.93826 
1 1 1    3   26   36 o  186.779   19.680   27.478   5.5416   23.954   7.7603   31.146   7.9160  170.768   30.824  196.680   27.008 -25.91196 40.98203 
1 1 1    3   26   37 f  165.471   13.650   21.296   3.4263   20.779   3.8202   23.421   7.7473  163.061   15.492  168.421   31.202 -5.360016 34.83647 
1 1 1    3   26   38 o  360.432   8.9942   99.862   4.9620  104.008   5.8087   88.668   9.5442  367.582   10.324  336.733   18.590 30.84879 21.26410 
1 1 1    3   26   39 o  263.659   8.4970   53.422   3.4291   51.108   4.7921   55.850   4.9088  257.328   12.167  269.048   11.920 -11.72025 17.03279 
1 1 1    3   26   40 o  386.224   7.4356  114.547   4.3957  108.112   6.1137  121.434   6.3246  374.552   10.664  397.024   10.407 -22.47269 14.90091 
1 1 1    3   26   41 o  216.246   9.6867   36.005   3.2062   36.317   4.4497   35.668   4.6239  216.159   13.517  214.044   14.194 2.115417 19.60040 
1 1 1    3   26   42 o  150.515   12.939   17.661   2.9519   21.797   4.3034   13.987   4.0567  166.265   17.157  131.791   20.800 34.47443 26.96278 
1 1 1    3   26   43 o  317.948   13.451   78.385   6.5461   78.385   6.5461   0.0000   0.0000  317.948   13.451  ?   ?  0.000000 13.45111 
1 1 1    3   26   44 o   84.415   22.761   5.8645   3.0081   4.2411   4.1513   7.6591   4.3648   77.079   27.665   96.001   27.986 -18.92191 39.35129 
1 1 1    3   26   45 o  332.877   15.576   86.488   7.9359   71.457   11.419  100.530   11.037  296.925   25.368  355.926   20.344 -59.00180 32.51794 
1 1 1    3   26   46 o  324.701   11.447   81.612   5.6892   83.927   6.5760   74.723   11.343  328.710   13.070  303.691   24.615 25.01889 27.86951 
1 1 1    3   26   47 o   80.197   24.442   5.2611   3.2717   8.3138   4.5661   2.0403   4.6901   99.075   28.550   69.288   28.185 29.78677 40.11844 
1 1 1    3   26   48 o   71.090   25.371   3.6882   3.4869  -0.0230   4.9408   7.3707   4.9216   63.356   27.490   93.894   30.179 -30.53791 40.82275 
1 1 1    3   26   49 o   96.685   30.017   7.9938   4.9076 -19.4067   13.656   12.058   5.2589   74.143   36.248  117.756   29.296 -43.61324 46.60675 
1 1 1    3   26   50 o  120.206   20.517   11.906   3.6394   11.284   5.2544   12.479   5.0457  113.249   29.879  119.911   27.999 -6.661674 40.94795 
1 1 1    3   26   51 o  201.443   13.952   32.003   4.2754   33.111   6.4651   31.141   5.6996  201.059   21.334  196.131   19.233 4.927658 28.72363 
1 1 1    3   26   52 o   63.347   25.634   1.9662   3.8566   0.3646   5.2897   3.7837   5.6348   65.268   28.382   78.078   31.199 -12.81004 42.17696 
1 1 1    3   26   53 o  202.371   31.640   37.059   9.4796   0.0000   0.0000   37.059   9.4796  ?   ?   202.371   31.640 0.000000 31.63969 
1 1 1    3   26   54 o   78.568   26.560   5.2521   3.7958  -0.0649   5.4197   10.371   5.3178   63.720   28.183  105.447   30.933 -41.72688 41.84674 
1 1 1    3   26   55 o  164.542   25.968   23.877   6.3232   0.0000   0.0000   23.877   6.3232  ?   ?   164.542   25.968 0.000000 25.96807 
1 1 1    3   27    0 o  125.576   42.274   15.633   7.2613   15.633   7.2613   15.633   7.2613  125.576   42.274  125.576   42.274 0.000000 0.000000 
1 1 1    3   27    3 o  937.221   11.566  673.000   16.592  684.787   23.732  661.729   23.208  944.851   16.410  928.818   16.324 16.03290 23.14622 
1 1 1    3   27    4 o  642.463   10.657  316.197   10.480  313.029   14.746  319.429   14.896  638.927   15.078  645.425   15.079 -6.498291 21.32402 
1 1 1    3   27    5 o  964.349   11.559  712.542   17.061  716.034   24.328  709.163   23.933  966.135   16.451  961.515   16.262 4.620483 23.13223 
1 1 1    3   27    6 o  254.653   15.360   49.912   5.9592   49.947   8.6947   49.881   8.1836  253.904   22.609  253.915   21.252 -0.1104736E-01 31.02915 
1 1 1    3   27    7 o  726.015   15.142  404.228   16.827   0.0000   0.0000  404.228   16.827  ?   ?   726.015   15.142 0.000000 15.14229 
1 1 1    3   27    8 o  419.876   16.092  135.245   10.342   0.0000   0.0000  135.245   10.342  ?   ?   419.876   16.092 0.000000 16.09229 
1 1 1    3   27    9 o  767.992   15.446  452.415   18.157   0.0000   0.0000  452.415   18.157  ?   ?   767.992   15.446 0.000000 15.44588 
1 1 1    3   27   10 o  585.396   15.258  262.866   13.672   0.0000   0.0000  262.866   13.672  ?   ?   585.396   15.258 0.000000 15.25835 
1 1 1    3   27   11 o  498.830   9.2851  190.602   7.0894  178.897   8.6262  214.961   12.444  483.147   11.665  529.342   15.358 -46.19492 19.28583 
1 1 1    3   27   12 o  881.708   9.4216  595.526   12.715  583.997   15.496  619.282   22.244  872.918   11.598  898.293   16.178 -25.37482 19.90596 
1 1 1    3   27   13 o  334.133   13.549   85.619   6.9295   76.497   9.7174   95.057   9.8842  314.788   20.276  351.280   18.448 -36.49222 27.41211 
1 1 1    3   27   14 o  133.428   28.398   14.269   5.6216   9.1829   8.2767   18.626   7.6594  113.696   39.204  152.067   33.785 -38.37122 51.75269 
1 1 1    3   27   15 o  1086.65   10.199  904.869   16.963  914.729   21.043  886.572   28.665  1092.19   12.587  1074.27   17.433 17.91626 21.50228 
1 1 1    3   27   16 o  751.729   7.9328  432.838   9.1277  450.553   13.238  416.781   12.603  766.630   11.281  737.351   11.167 29.27942 15.87317 
1 1 1    3   27   17 o  544.716   7.9972  227.286   6.6677  217.762   9.2462  237.604   9.6244  532.939   11.335  556.693   11.295 -23.75403 16.00178 
1 1 1    3   27   18 o  220.528   13.090   37.446   4.3986   33.659   5.9647   41.960   6.5126  208.312   18.913  232.841   18.424 -24.52902 26.40365 
1 1 1    3   27   19 f  809.413   8.0911  501.923   10.024  521.029   14.557  484.691   13.824  824.227   11.538  794.992   11.361 29.23529 16.19274 
1 1 1    3   27   20 o  381.271   9.1210  111.411   5.3229  119.813   7.6462  103.510   7.4144  395.128   12.643  367.217   13.191 27.91083 18.27149 
1 1 1    3   27   21 o  1068.77   8.8797  875.465   14.526  884.734   20.684  866.446   20.405  1073.64   12.587  1062.49   12.547 11.14453 17.77238 
1 1 1    3   27   22 o  453.229   8.6714  157.440   6.0156  166.435   8.6312  148.944   8.3885  465.670   12.109  440.487   12.442 25.18268 17.36192 
1 1 1    3   27   23 o   44.126   21.035  -5.1486   3.9362  -8.5891   5.5138  -1.5728   5.6211   49.820   24.046   65.260   28.791 -15.43969 37.51164 
1 1 1    3   27   24 o  381.374   10.975  111.614   6.4065  111.523   7.7628  111.810   11.344  380.974   13.312  380.097   19.565 0.8770142 23.66486 
1 1 1    3   27   25 o  287.757   13.471   63.649   5.9334   55.726   6.8729   86.831   11.756  268.411   16.814  333.915   23.145 -65.50455 28.60756 
1 1 1    3   27   26 o  492.440   10.522  186.114   7.9312  198.773   14.211  180.387   9.5583  507.458   18.296  484.461   12.890 22.99747 22.38046 
1 1 1    3   27   27 o   62.672   27.646  -1.4030   5.1813  -4.9543   9.6395   0.0398   6.1444   80.153   36.345   72.800   31.108 7.353455 47.84035 
1 1 1    3   27   28 f  747.426   8.4300  428.432   9.6442  408.343   13.195  451.473   14.131  728.956   11.826  766.428   12.046 -37.47156 16.88053 
1 1 1    3   27   29 o  299.129   11.333   68.756   5.1891   65.640   7.1955   72.134   7.4904  291.217   16.207  305.350   16.083 -14.13318 22.83252 
1 1 1    3   27   30 o  253.590   13.143   49.634   5.0838   48.724   7.1494   50.565   7.2305  250.143   18.811  254.885   18.663 -4.742523 26.49825 
1 1 1    3   27   31 f  173.973   18.359   23.697   4.8150   27.592   6.7691   19.707   6.8504  186.424   24.300  155.575   29.854 30.84888 38.49346 
1 1 1    3   27   32 o  105.024   28.617   8.9978   4.7256   12.839   6.6603   5.1041   6.7060  124.647   33.978   91.759   34.758 32.88750 48.60655 
1 1 1    3   27   33 o  292.522   14.295   66.052   6.4006   72.968   10.107   61.420   8.2706  305.009   21.792  280.442   19.386 24.56723 29.16700 
1 1 1    3   27   34 f  187.031   20.375   27.579   5.7385   30.124   7.4512   23.868   8.9965  193.963   25.733  168.885   35.908 25.07826 44.17670 
1 1 1    3   27   35 o  164.821   21.058   21.562   5.1911   10.340   7.1706   33.920   7.5249  113.202   36.432  206.265   24.301 -93.06290 43.79319 
1 1 1    3   27   36 o  257.445   14.986   51.485   5.8799   56.894   8.2267   45.836   8.4070  269.125   20.117  240.382   23.135 28.74312 30.65770 
1 1 1    3   27   37 f  332.314   13.025   85.301   6.6252   93.293   9.3164   77.124   9.4233  345.774   17.662  313.542   19.736 32.23242 26.48495 
1 1 1    3   27   38 o  144.436   16.127   16.397   3.5045   14.315   3.8472   26.546   8.4943  134.046   19.308  178.656   32.250 -44.60944 37.58753 
1 1 1    3   27   39 o  351.227   13.365   95.442   7.1849  107.795   10.410   84.203   9.9293  371.509   18.306  327.186   19.922 44.32379 27.05524 
1 1 1    3   27   40 o  278.145   8.4248   59.480   3.5867   58.565   5.0013   60.450   5.1467  275.378   11.865  279.741   12.020 -4.362579 16.88977 
1 1 1    3   27   41 o  219.419   10.248   37.110   3.4416   40.893   4.6097   32.346   5.1734  229.431   13.182  202.979   16.803 26.45245 21.35629 
1 1 1    3   27   42 o  180.154   18.359   25.689   4.9918   0.0000   0.0000   25.689   4.9918  ?   ?   180.154   18.359 0.000000 18.35941 
1 1 1    3   27   43 o  163.954   17.049   21.241   4.2158   19.822   4.6774   27.386   9.7322  157.444   19.851  177.459   37.027 -20.01460 42.01249 
1 1 1    3   27   44 o  239.973   13.005   44.804   4.7592   45.451   5.4246   42.642   9.9177  241.138   14.768  226.809   29.250 14.32927 32.76657 
1 1 1    3   27   45 o   82.439   24.010   5.5888   3.2141   4.7262   4.4781   6.5054   4.6158   80.298   28.742   89.636   29.261 -9.337456 41.01607 
1 1 1    3   27   46 o  132.352   17.047   13.978   3.3731   14.197   4.7639   13.758   4.7768  130.659   24.726  128.392   25.207 2.267303 35.30954 
1 1 1    3   27   47 o   38.734   18.649  -4.6782   3.2687  -4.0986   4.6375  -5.2504   4.6078   50.707   23.762   48.107   22.884 2.599964 32.98918 
1 1 1    3   27   48 o  159.026   22.371   20.768   5.2947   16.150   14.025   21.535   5.7178  131.284   50.137  161.245   23.890 -29.96091 55.53794 
1 1 1    3   27   49 o  202.375   12.948   32.109   3.9899   25.065   5.5971   39.386   5.6892  175.099   21.324  222.464   16.833 -47.36473 27.16715 
1 1 1    3   27   50 o   67.415   25.440   3.0413   3.5839  -2.3700   5.1243   8.2228   5.0144   57.391   26.206   97.125   30.373 -39.73386 40.11578 
1 1 1    3   27   51 o  129.571   20.703   13.930   3.9677   15.522   5.7721   12.503   5.4631  132.251   29.287  117.996   30.140 14.25550 42.02527 
1 1 1    3   27   52 o  238.923   16.866   45.947   6.1284   65.175   7.9381   17.581   9.6417  283.453   18.396  130.284   42.279 153.1689 46.10760 
1 1 1    3   27   53 o  159.008   18.226   20.742   4.3559   22.397   6.2125   19.142   6.1091  159.887   26.300  146.124   28.337 13.76305 38.66100 
1 1 1    3   27   54 f   61.604   26.026   1.3126   4.2173   5.8342   6.0370  -2.9972   5.8938   84.719   32.755   58.896   27.328 25.82275 42.65801 
1 1 1    3   28    0 o  676.209   15.115  350.864   15.627  350.864   15.627  350.864   15.627  676.209   15.115  676.209   15.115 0.000000 0.000000 
1 1 1    3   28    1 o  378.938   17.058  110.210   9.8939   0.0000   0.0000  110.210   9.8939  ?   ?   378.938   17.058 0.000000 17.05803 
1 1 1    3   28    2 o  439.362   16.590  148.138   11.156   0.0000   0.0000  148.138   11.156  ?   ?   439.362   16.590 0.000000 16.58953 
1 1 1    3   28    5 o   96.652   31.988   6.8746   5.5092   3.1924   7.8774   10.400   7.7078   91.900   36.829  117.245   37.776 -25.34546 52.75848 
1 1 1    3   28    6 o  810.333   11.030  503.179   13.681  497.308   19.407  508.979   19.288  805.057   15.749  814.485   15.472 -9.428467 22.07733 
1 1 1    3   28    7 o  217.400   17.348   36.518   5.7247   35.491   8.1956   37.496   7.9997  213.090   25.642  219.340   24.233 -6.249817 35.28099 
1 1 1    3   28    8 o  859.582   11.322  566.282   14.896  575.330   21.431  557.825   20.719  865.781   16.172  852.552   15.878 13.22870 22.66329 
1 1 1    3   28    9 o  959.079   11.719  705.073   17.204  702.198   24.349  707.940   24.311  956.357   16.634  960.276   16.540 -3.918579 23.45738 
1 1 1    3   28   10 o  479.025   11.431  175.886   8.3817  180.608   11.759  171.009   11.951  485.066   15.837  471.934   16.544 13.13147 22.90259 
1 1 1    3   28   11 o   92.185   35.932   4.1035   7.3102   4.1035   7.3102   0.0000   0.0000   92.185   35.932  ?   ?  0.000000 35.93161 
1 1 1    3   28   12 o  293.366   14.118   66.036   6.3397   66.036   6.3397   0.0000   0.0000  293.366   14.118  ?   ?  0.000000 14.11843 
1 1 1    3   28   13 o  191.060   17.421   28.283   5.0387   31.594   6.1777   21.703   8.7086  201.612   20.295  163.905   35.721 37.70717 41.08417 
1 1 1    3   28   14 o  310.677   12.087   74.023   5.7477   78.839   7.1799   65.429   9.5908  320.468   14.637  290.619   21.718 29.84946 26.18983 
1 1 1    3   28   15 o  299.430   11.870   68.763   5.4400   62.484   9.5947   71.737   6.6041  283.822   22.265  305.704   14.114 -21.88251 26.36120 
1 1 1    3   28   16 o  633.725   9.2075  307.770   8.9313  317.641   15.988  303.293   10.768  642.892   16.248  628.897   11.186 13.99530 19.72622 
1 1 1    3   28   17 o  348.912   9.4585   93.309   5.0513   85.292   7.0507  101.764   7.2404  333.302   13.820  364.133   12.991 -30.83121 18.96748 
1 1 1    3   28   18 o  342.100   9.4719   89.710   4.9597   89.129   7.0090   90.292   7.0192  340.715   13.440  342.937   13.372 -2.222473 18.95910 
1 1 1    3   28   19 o  389.280   9.0539  116.154   5.3947  128.344   7.8818  105.410   7.3995  408.901   12.593  370.531   13.047 38.37061 18.13326 
1 1 1    3   28   20 o  452.690   8.5859  157.067   5.9492  156.468   8.3063  157.697   8.5248  451.507   12.019  453.246   12.288 -1.739319 17.18881 
1 1 1    3   28   21 o   52.751   23.637  -1.7527   3.9419   1.9769   5.5318  -5.6003   5.6186   75.813   30.693   55.850   26.166 19.96268 40.33260 
1 1 1    3   28   22 o  334.302   11.589   85.791   5.9302   84.654   7.1743   88.243   10.537  331.835   14.125  337.352   20.504 -5.516937 24.89820 
1 1 1    3   28   23 o  596.359   9.5583  272.779   8.7249  275.060   10.655  268.136   15.201  598.531   11.630  589.900   16.836 8.631104 20.46210 
1 1 1    3   28   24 o  347.222   11.924   92.604   6.3371   94.586   11.242   91.680   7.6722  348.950   21.148  345.184   14.521 3.765106 25.65314 
1 1 1    3   28   25 o  839.935   9.8644  541.349   12.682  529.496   21.835  547.382   15.579  828.456   17.220  844.053   12.059 -15.59631 21.02193 
1 1 1    3   28   26 o  632.332   8.4499  306.639   8.1784  298.613   11.369  315.246   11.773  623.366   11.916  640.472   12.010 -17.10590 16.91780 
1 1 1    3   28   27 o  196.447   15.820   29.951   4.7164   29.133   6.4297   30.904   6.9395  192.420   22.241  197.987   23.348 -5.566422 32.24580 
1 1 1    3   28   28 o  154.264   19.113   18.703   4.4164   15.771   6.1081   21.914   6.3932  139.067   29.604  165.489   26.105 -26.42245 39.46943 
1 1 1    3   28   29 f  463.129   9.2783  164.650   6.5772  164.294   9.1845  165.025   9.4232  461.957   12.989  462.918   13.299 -0.9609680 18.58999 
1 1 1    3   28   30 o  296.885   11.880   67.816   5.3987   63.270   7.5847   72.484   7.6862  285.371   17.448  305.753   16.485 -20.38150 24.00381 
1 1 1    3   28   31 o  285.653   14.109   62.953   6.1688   61.947   9.7461   63.625   7.9681  280.662   22.886  285.831   18.309 -5.168457 29.30873 
1 1 1    3   28   32 o  341.727   12.957   90.025   6.7772   92.618   8.7327   86.097   10.747  345.835   16.497  331.508   21.292 14.32700 26.93489 
1 1 1    3   28   33 o   68.016   28.452   0.9142   4.9611  -2.5466   6.9313   4.5495   7.1039   69.924   31.338   90.870   35.420 -20.94637 47.29327 
1 1 1    3   28   34 o  247.620   14.865   47.610   5.6081   46.003   7.8787   49.261   7.9845  241.489   21.541  250.114   21.052 -8.625183 30.12018 
1 1 1    3   28   35 o  104.783   31.349   8.9850   5.4187   16.434   7.6751   1.5819   7.6512  139.322   35.799   83.770   35.205 55.55190 50.20871 
1 1 1    3   28   36 o  180.975   20.260   25.928   5.5159   28.306   7.7979   23.546   7.8035  186.461   28.203  168.553   31.402 17.90794 42.20819 
1 1 1    3   28   37 o  198.600   19.726   31.154   5.9171   29.136   8.4309   33.113   8.3065  188.132   30.308  201.943   27.595 -13.81088 40.98849 
1 1 1    3   28   38 o  364.118   12.791  102.487   7.1290   96.054   9.7925  109.741   10.398  350.225   18.331  374.910   18.121 -24.68536 25.77571 
1 1 1    3   28   39 o  208.755   12.054   33.775   3.8353   32.958   4.2594   37.280   8.8169  205.852   13.595  213.994   27.558 -8.141953 30.72934 
1 1 1    3   28   40 o   78.894   22.204   5.0645   2.7946   1.4228   3.6702   10.089   4.3110   61.535   24.970  110.210   25.980 -48.67491 36.03390 
1 1 1    3   28   41 o  165.434   13.317   21.347   3.3436   25.404   4.7741   17.441   4.6843  179.376   17.615  147.143   21.428 32.23305 27.73913 
1 1 1    3   28   42 o  273.763   11.351   57.926   4.7565   59.738   5.4526   52.155   9.7292  277.635   12.831  253.764   25.389 23.87085 28.44708 
1 1 1    3   28   43 o  302.729   10.979   70.824   5.0875   74.228   5.8313   59.978   10.410  309.533   12.308  271.974   25.296 37.55927 28.13151 
1 1 1    3   28   44 o  244.264   10.375   46.091   3.8789   48.913   5.5959   43.481   5.3817  250.061   14.685  235.607   15.001 14.45413 20.99219 
1 1 1    3   28   45 o  234.016   10.966   42.385   3.9279   50.779   5.9507   35.904   5.2289  254.350   15.357  213.441   16.124 40.90887 22.26723 
1 1 1    3   28   46 o  144.616   17.249   16.703   3.7429   14.711   5.3758   18.577   5.2143  131.541   27.581  150.141   23.457 -18.60042 36.20703 
1 1 1    3   28   47 o  160.757   21.616   21.122   5.1840   18.070   13.706   21.631   5.6000  136.233   50.067  161.929   23.262 -25.69565 55.20734 
1 1 1    3   28   48 o  159.686   15.540   20.258   3.7502   22.209   5.3521   18.377   5.2563  164.497   21.794  148.385   23.959 16.11140 32.38818 
1 1 1    3   28   49 o  241.845   14.905   46.225   5.4905   55.580   6.5940   25.078   9.9141  264.423   16.373  161.936   40.188 102.4872 43.39520 
1 1 1    3   28   50 o  248.429   15.633   49.095   5.9143   56.407   7.1815   33.685   10.426  264.874   17.817  189.608   37.254 75.26631 41.29571 
1 1 1    3   28   51 o  107.474   24.487   10.030   3.9384   12.457   5.8675   8.0406   5.3131  115.974   32.007   94.866   31.414 21.10857 44.84753 
1 1 1    3   28   52 o  106.808   25.234   10.061   4.0598   9.6313   6.1233   10.397   5.4230  101.368   33.732  105.672   31.304 -4.303009 46.01951 
1 1 1    3   28   53 o   58.120   25.342   0.2498   4.2418   2.8296   6.2494  -1.9541   5.7761   75.281   31.736   60.604   27.731 14.67662 42.14463 
1 1 1    3   29    0 o   93.342   44.387   9.8822   7.2329   9.8822   7.2329   9.8822   7.2329   93.342   44.387   93.342   44.387 0.000000 0.000000 
1 1 1    3   29    1 o  305.421   19.552   72.008   9.0921   0.0000   0.0000   72.008   9.0921  ?   ?   305.421   19.552 0.000000 19.55162 
1 1 1    3   29    2 o  420.173   15.907  135.527   10.230   0.0000   0.0000  135.527   10.230  ?   ?   420.173   15.907 0.000000 15.90683 
1 1 1    3   29    3 o  920.727   11.597  649.854   16.343  624.929   22.547  677.446   23.723  902.169   16.328  939.279   16.501 -37.11035 23.21367 
1 1 1    3   29    4 o  595.575   11.145  271.883   10.160  287.148   14.421  256.842   14.315  611.637   15.404  578.375   16.170 33.26227 22.33327 
1 1 1    3   29    5 o  591.231   15.439  268.324   13.971  268.324   13.971   0.0000   0.0000  591.231   15.439  ?   ?  0.000000 15.43861 
1 1 1    3   29    6 o  389.909   17.256  116.798   10.298  116.798   10.298   0.0000   0.0000  389.909   17.256  ?   ?  0.000000 17.25558 
1 1 1    3   29    7 o  426.555   16.697  139.762   10.902  139.762   10.902   0.0000   0.0000  426.555   16.697  ?   ?  0.000000 16.69725 
1 1 1    3   29    8 o  700.388   15.530  376.652   16.648  376.652   16.648   0.0000   0.0000  700.388   15.530  ?   ?  0.000000 15.52956 
1 1 1    3   29    9 o  759.353   15.687  442.815   18.233  442.815   18.233   0.0000   0.0000  759.353   15.687  ?   ?  0.000000 15.68679 
1 1 1    3   29   10 o  614.634   11.101  289.633   10.443  284.042   14.638  295.430   14.904  608.126   15.726  620.201   15.700 -12.07465 22.22100 
1 1 1    3   29   11 o  842.667   11.396  544.504   14.698  543.802   20.731  545.213   20.842  841.306   16.099  842.384   16.164 -1.078064 22.81352 
1 1 1    3   29   12 o  315.890   11.369   76.523   5.4970   77.017   6.6956   75.500   9.6279  316.757   13.810  312.445   20.241 4.311890 24.50318 
1 1 1    3   29   13 o  388.483   10.094  115.693   6.0019  112.744   7.3493  121.598   10.400  383.327   12.526  397.657   17.086 -14.32983 21.18553 
1 1 1    3   29   14 o  208.658   15.350   33.634   4.8682   30.454   5.9730   39.924   8.4018  197.817   20.002  225.921   24.699 -28.10396 31.78214 
1 1 1    3   29   15 o  625.529   9.1107  299.902   8.7231  297.391   10.679  304.935   15.121  622.668   11.205  629.838   15.684 -7.170593 19.27591 
1 1 1    3   29   16 o  104.986   24.817   8.8716   3.9250   10.370   5.8232   7.6242   5.3132  113.754   32.065   99.413   31.293 14.34061 44.80468 
1 1 1    3   29   17 o  749.322   9.2909  430.446   10.656  435.192   18.956  428.253   12.885  752.069   16.467  747.111   11.267 4.958008 19.95310 
1 1 1    3   29   18 o  230.404   14.514   40.966   5.0923   38.578   8.7684   42.181   6.2553  221.415   26.393  233.357   17.643 -11.94171 31.74683 
1 1 1    3   29   19 o  100.362   28.586   8.0450   4.6032   7.1947   5.6199   9.7786   8.0241   97.895   32.303  114.511   38.617 -16.61579 50.34677 
1 1 1    3   29   20 o  442.305   10.165  150.081   6.8819  153.926   8.5605  143.056   11.571  447.661   12.493  430.808   17.548 16.85239 21.54110 
1 1 1    3   29   21 f  222.447   13.393   38.172   4.5389   35.483   6.2655   41.142   6.5842  213.490   19.385  230.107   18.860 -16.61714 27.04567 
1 1 1    3   29   22 o  339.132   11.908   88.341   6.1812   78.210   10.750   93.346   7.5552  316.897   22.304  348.342   14.170 -31.44455 26.42444 
1 1 1    3   29   23 o  478.254   10.275  175.553   7.5219  175.526   13.330  175.565   9.1109  476.741   18.268  477.949   12.454 -1.208282 22.10909 
1 1 1    3   29   24 o  694.118   8.3064  369.464   8.8250  364.043   12.363  375.097   12.602  688.325   11.734  698.685   11.783 -10.35968 16.62951 
1 1 1    3   29   25 f  116.905   24.201   11.025   4.1878   9.3324   5.8877   12.759   5.9578  108.121   32.752  124.865   31.248 -16.74481 45.26725 
1 1 1    3   29   26 o  362.651   10.192  100.992   5.6573  103.138   8.0043   98.851   7.9969  365.884   14.292  358.151   14.588 7.733704 20.42240 
1 1 1    3   29   27 o  215.241   14.730   35.886   4.8236   42.114   6.9433   30.077   6.7062  232.215   19.721  195.218   22.877 36.99794 30.20409 
1 1 1    3   29   28 o  288.592   11.869   64.072   5.2428   66.542   7.3402   61.500   7.4909  292.957   16.436  281.362   17.480 11.59521 23.99381 
1 1 1    3   29   29 o  255.518   15.047   50.586   5.8588   47.350   9.2975   52.717   7.5454  244.477   25.208  259.911   19.100 -15.43323 31.62686 
1 1 1    3   29   30 o  166.926   23.817   22.240   5.9128   19.849   8.3381   24.658   8.3859  154.018   36.013  173.064   32.859 -19.04568 48.75127 
1 1 1    3   29   31 o  117.724   28.634   11.420   5.1100   8.4275   6.5765   15.981   8.1179  104.311   34.962  137.808   37.490 -33.49677 51.26216 
1 1 1    3   29   32 o  146.509   23.462   17.249   5.0838   22.836   7.2792   11.930   7.1031  167.061   29.548  120.040   35.887 47.02015 46.48631 
1 1 1    3   29   33 o  229.519   15.609   40.998   5.4511   42.877   7.7501   39.158   7.6687  232.880   22.003  222.175   22.878 10.70529 31.74144 
1 1 1    3   29   34 o  285.896   13.452   63.157   5.8866   63.415   8.3425   62.902   8.3075  284.440   19.276  283.283   19.274 1.157562 27.25864 
1 1 1    3   29   35 o   64.316   28.147  -0.7860   5.2752 -11.8690   7.5823   9.6111   7.3439   57.334   27.799  109.940   36.945 -52.60589 46.23534 
1 1 1    3   29   36 o  244.212   16.388   46.565   6.0905   36.891   8.4815   56.864   8.7513  213.747   26.492  268.154   21.502 -54.40707 34.11974 
1 1 1    3   29   37 o  261.647   16.179   53.438   6.4476   56.376   9.2632   50.677   8.9799  266.194   22.960  252.035   23.551 14.15878 32.89030 
1 1 1    3   29   38 o  102.776   36.178   8.1146   7.0664   9.5441   7.8983   2.3811   15.818  109.921   38.275  112.902   49.087 -2.981194 62.24555 
1 1 1    3   29   39 o   93.156   40.582   0.4465   10.855   16.103   14.496 -19.5385   16.378  138.879   51.411   86.351   41.618 52.52771 66.14480 
1 1 1    3   29   40 o  239.466   12.194   44.475   4.4547   47.455   5.0622   34.244   9.3783  247.034   13.439  202.566   31.253 44.46808 34.01974 
1 1 1    3   29   41 o  107.067   23.658   9.4787   3.7738   8.7595   4.1786   12.660   8.7886  102.357   26.473  121.737   40.407 -19.37992 48.30705 
1 1 1    3   29   42 o  140.900   15.171   15.646   3.2202   15.744   4.3972   15.533   4.7291  139.471   21.271  137.818   23.245 1.652283 31.50887 
1 1 1    3   29   43 o  364.459   14.716  103.588   8.2096  102.404   11.720  104.728   11.503  358.055   21.485  362.569   20.815 -4.514618 29.91427 
1 1 1    3   29   44 o  154.985   14.141   18.876   3.3178   19.759   4.7499   18.035   4.6362  156.513   20.306  149.209   20.871 7.304138 29.11939 
1 1 1    3   29   45 o  235.373   11.560   42.981   4.1648   48.133   6.0738   38.410   5.7217  247.007   16.154  220.132   17.116 26.87453 23.53518 
1 1 1    3   29   46 o  271.955   13.759   57.949   5.7088   37.296   11.014   65.536   6.6754  203.992   36.621  288.539   15.168 -84.54709 39.63795 
1 1 1    3   29   47 o  128.378   18.887   13.397   3.6004   17.720   5.2135   9.4561   4.9780  145.520   24.261  104.049   29.758 41.47034 38.39462 
1 1 1    3   29   48 o  135.248   35.078   16.819   7.3231   18.511   10.612   15.281   10.118  136.342   44.361  125.688   43.346 10.65328 62.02237 
1 1 1    3   29   49 o  163.891   16.141   21.522   3.9966   25.503   5.6727   17.598   5.6316  175.621   21.556  142.614   26.782 33.00711 34.37929 
1 1 1    3   29   50 o  112.906   24.034   10.998   4.0260   6.1023   5.8188   15.495   5.5761   86.913   32.493  131.889   28.457 -44.97589 43.19236 
1 1 1    3   29   51 f  280.546   11.335   61.627   4.8672   63.009   7.6655   60.693   6.3003  278.373   18.089  275.738   14.984 2.634674 23.48856 
1 1 1    3   29   52 o  150.504   19.545   18.851   4.3963   22.928   6.6862   15.747   5.8349  159.658   28.401  130.661   29.832 28.99751 41.18913 
1 1 1    3   30    2 o  398.159   17.567  121.880   10.706  121.880   10.706   0.0000   0.0000  398.159   17.567  ?   ?  0.000000 17.56744 
1 1 1    3   30    3 o  930.627   16.739  665.588   23.843  665.588   23.843   0.0000   0.0000  930.627   16.739  ?   ?  0.000000 16.73878 
1 1 1    3   30    4 o  398.234   12.327  121.650   7.5139  133.550   10.688  110.021   10.566  416.854   16.751  378.206   18.252 38.64795 24.77333 
1 1 1    3   30    5 o  477.969   11.311  175.183   8.2747  183.902   11.950  167.150   11.470  489.246   15.957  466.417   16.066 22.82843 22.64387 
1 1 1    3   30    6 o  904.021   11.683  626.792   16.166  628.976   22.724  624.553   23.003  904.659   16.411  901.411   16.672 3.247437 23.39365 
1 1 1    3   30    7 o  756.054   15.919  439.239   18.422  439.239   18.422   0.0000   0.0000  756.054   15.919  ?   ?  0.000000 15.91859 
1 1 1    3   30    8 o  297.956   20.072   68.695   9.1007   68.695   9.1007   0.0000   0.0000  297.956   20.072  ?   ?  0.000000 20.07206 
1 1 1    3   30    9 o  534.604   11.180  219.189   9.1481  217.219   12.770  221.266   13.112  531.653   15.692  536.544   15.966 -4.890625 22.38639 
1 1 1    3   30   10 o  484.053   11.338  179.719   8.4004  177.126   12.123  182.114   11.651  479.950   16.502  486.778   15.637 -6.828125 22.73417 
1 1 1    3   30   11 o  510.696   11.363  200.065   8.8824  195.290   12.411  205.079   12.718  503.979   16.089  516.455   16.088 -12.47549 22.75261 
1 1 1    3   30   12 o  188.383   20.681   27.697   5.8650   35.218   8.3815   20.480   8.2100  211.561   26.462  158.849   34.735 52.71263 43.66617 
1 1 1    3   30   13 o  671.847   9.0826  345.999   9.3401  356.040   11.604  327.523   15.740  681.255   11.128  652.618   15.757 28.63629 19.29046 
1 1 1    3   30   14 o  351.424   10.716   94.734   5.7639   89.875   7.0575  104.469   9.9886  342.061   13.480  368.299   17.719 -26.23810 22.26335 
1 1 1    3   30   15 o  444.911   9.8533  151.801   6.7100  144.538   8.1364  167.244   11.864  433.895   12.251  466.116   16.629 -32.22034 20.65465 
1 1 1    3   30   16 o  508.536   9.5374  198.314   7.4237  205.538   9.1905  184.749   12.593  517.468   11.603  489.810   16.797 27.65826 20.41521 
1 1 1    3   30   17 o  610.400   9.3768  285.724   8.7607  298.937   10.972  262.489   14.551  624.038   11.487  583.868   16.282 40.17029 19.92608 
1 1 1    3   30   18 o  766.243   8.2424  450.070   9.6670  450.298   13.810  449.852   13.536  765.785   11.782  765.455   11.553 0.3300781 16.50155 
1 1 1    3   30   19 o  442.859   10.358  150.502   7.0211  153.785   12.521  148.996   8.4797  446.387   18.326  440.357   12.581 6.030151 22.22845 
1 1 1    3   30   20 f  352.577   11.427   95.465   6.1667   99.104   10.950   93.775   7.4624  357.404   20.099  349.146   13.964 8.257599 24.47346 
1 1 1    3   30   21 o  555.445   9.7707  236.741   8.3068  264.560   15.313  225.142   9.8881  585.579   17.085  541.314   11.934 44.26514 20.84033 
1 1 1    3   30   22 o  582.636   8.3823  260.332   7.4753  267.076   10.690  253.878   10.457  589.529   11.846  574.771   11.887 14.75806 16.78190 
1 1 1    3   30   23 o  388.374   9.5952  115.765   5.7039  119.115   8.1133  112.490   8.0207  393.411   13.473  382.277   13.708 11.13394 19.22075 
1 1 1    3   30   24 o  308.932   10.984   73.329   5.1937   65.607   7.3384   81.079   7.3516  291.032   16.542  324.325   14.809 -33.29352 22.20243 
1 1 1    3   30   25 o  464.984   8.9513  165.928   6.3708  165.613   8.9903  166.246   9.0291  463.899   12.661  464.780   12.692 -0.8802490 17.92749 
1 1 1    3   30   26 o  501.629   8.9888  193.151   6.9017  178.739   9.5979  208.582   9.9315  481.768   13.016  520.570   12.464 -38.80200 18.02128 
1 1 1    3   30   27 o  304.416   12.868   71.381   5.9960   65.109   9.6236   75.360   7.6658  288.170   21.984  311.812   16.117 -23.64178 27.25911 
1 1 1    3   30   28 o  437.143   9.9812  146.853   6.6784  165.017   9.8218  131.233   9.1080  462.502   13.874  412.315   14.432 50.18680 20.01932 
1 1 1    3   30   29 o  419.584   11.166  135.481   7.1709  133.327   9.0130  139.197   11.837  415.536   14.171  423.347   18.268 -7.811768 23.11963 
1 1 1    3   30   30 o  509.503   9.3772  199.496   7.3129  208.089   10.502  191.406   10.189  519.304   13.212  498.003   13.368 21.30081 18.79470 
1 1 1    3   30   31 o  278.978   13.201   60.080   5.6369   58.014   7.9870   62.130   7.9565  272.170   19.297  281.947   18.540 -9.776764 26.76069 
1 1 1    3   30   32 o  138.603   24.889   15.591   5.0862   17.178   7.2753   14.074   7.1133  142.991   33.778  129.313   35.058 13.67824 48.68313 
1 1 1    3   30   33 o   98.618   30.700   7.8438   5.1295   7.1957   7.0582   8.5693   7.4675   99.888   36.047  106.178   37.202 -6.289619 51.80127 
1 1 1    3   30   34 o  246.669   15.803   47.416   5.9351   52.920   8.4230   41.988   8.3643  258.752   21.461  229.277   24.200 29.47537 32.34504 
1 1 1    3   30   35 o  107.322   31.026   9.5589   5.3847   5.3730   7.3696   14.353   7.8869   93.883   36.221  129.744   37.561 -35.86076 52.17984 
1 1 1    3   30   36 o  195.098   19.945   30.146   5.8724   26.162   8.1996   34.341   8.4141  177.295   31.363  205.460   27.441 -28.16553 41.67300 
1 1 1    3   30   37 f  127.435   34.480   13.866   6.8888   12.851   7.8416   17.299   14.419  122.930   37.907  142.509   51.507 -19.57902 63.95255 
1 1 1    3   30   38 o   80.895   34.284   1.3430   7.3556  -0.0216   14.445   1.8207   8.5467  104.285   46.073   87.269   36.969 17.01561 59.07158 
1 1 1    3   30   39 o  106.141   33.423   9.3749   6.0603   9.5304   8.2292   9.1905   8.9584  109.813   38.999  109.999   40.469 -0.1865540 56.20248 
1 1 1    3   30   40 o  268.064   16.689   56.384   6.8137   47.853   9.2018   66.740   10.138  243.086   25.092  288.556   23.149 -45.46956 34.13900 
1 1 1    3   30   41 o  326.669   14.848   83.154   7.4240   78.979   10.145   87.967   10.893  314.844   21.174  332.114   21.546 -17.27029 30.20871 
1 1 1    3   30   42 o  382.597   10.520  113.123   6.1604   88.017   10.785  125.283   7.5055  331.904   21.342  401.964   12.199 -70.05939 24.58221 
1 1 1    3   30   43 o  217.645   11.260   36.787   3.7382   38.813   5.2472   34.698   5.3269  222.145   15.530  209.520   16.751 12.62569 22.84185 
1 1 1    3   30   44 o   50.678   22.312  -0.6208   3.3592  -4.7524   4.7023   3.6849   4.8004   49.763   23.507   76.171   29.275 -26.40807 37.54447 
1 1 1    3   30   45 o  195.767   15.424   30.290   4.5842   25.677   10.353   31.415   5.1127  165.206   41.109  198.738   16.970 -33.53223 44.47410 
1 1 1    3   30   46 o   85.594   24.249   6.1841   3.3216   6.1127   4.6797   6.2566   4.7154   86.506   29.490   87.292   29.603 -0.7853241 41.78461 
1 1 1    3   30   47 o  182.041   18.582   26.748   5.1050   8.7355   11.053   31.632   5.7557  107.054   43.370  197.732   19.262 -90.67760 47.45491 
1 1 1    3   30   48 o  219.584   12.549   37.873   4.2004   41.356   6.0830   34.699   5.8071  226.700   17.670  207.053   18.519 19.64682 25.59650 
1 1 1    3   30   49 o  156.377   17.028   19.798   4.0099   19.347   5.8923   20.188   5.4728  148.882   26.844  153.998   24.000 -5.115585 36.00850 
1 1 1    3   30   50 o   93.278   25.611   7.6953   3.7682   6.2828   5.4963   8.9481   5.1761   86.424   31.714   98.743   30.855 -12.31867 44.24712 
1 1 1    3   30   51 o   67.381   26.503   2.9449   4.0071   8.3717   5.8848  -1.7465   5.4715   95.246   33.045   59.579   27.157 35.66776 42.77187 
1 1 1    3   31    0 o  204.643   26.186   33.769   7.8349   33.769   7.8349   33.769   7.8349  204.643   26.186  204.643   26.186 0.000000 0.000000 
1 1 1    3   31    1 o  529.637   10.966  215.139   8.8897  210.255   12.443  220.231   12.705  523.031   15.542  535.302   15.507 -12.27002 21.95498 
1 1 1    3   31    2 o  251.414   15.620   48.769   5.9811   54.079   8.7976   44.206   8.1558  263.803   21.988  238.211   22.641 25.59200 31.56073 
1 1 1    3   31    3 o  479.716   11.336  176.525   8.3237  168.279   11.681  185.032   11.864  467.803   16.313  490.609   15.799 -22.80530 22.71003 
1 1 1    3   31    4 o  145.122   24.409   16.722   5.2294   18.814   7.4948   14.739   7.2999  152.454   33.070  134.801   35.052 17.65367 48.18971 
1 1 1    3   31    5 o  831.596   11.261  530.486   14.334  530.061   20.312  530.908   20.229  830.285   15.983  830.967   15.905 -0.6820679 22.54822 
1 1 1    3   31    6 o  581.730   10.969  259.572   9.7671  254.301   13.813  264.842   13.813  575.119   15.691  586.971   15.374 -11.85223 21.96773 
1 1 1    3   31    7 f  609.675   10.888  285.112   10.160  282.065   14.453  288.089   14.285  605.692   15.590  612.187   15.245 -6.494690 21.80529 
1 1 1    3   31    8 o  585.004   11.214  262.555   10.041  283.759   14.590  243.478   13.839  607.456   15.692  562.625   16.070 44.83136 22.46101 
1 1 1    3   31    9 o  240.176   22.841   44.997   8.2956   44.997   8.2956   0.0000   0.0000  240.176   22.841  ?   ?  0.000000 22.84052 
1 1 1    3   31   10 o  319.204   19.952   78.916   9.6994   78.916   9.6994   0.0000   0.0000  319.204   19.952  ?   ?  0.000000 19.95212 
1 1 1    3   31   11 o  1095.19   12.821  921.148   21.492  967.511   31.533  880.925   29.371  1120.36   18.388  1069.23   17.947 51.12708 25.69455 
1 1 1    3   31   12 o  309.427   14.244   73.600   6.7463   76.027   9.9156   71.509   9.2054  313.031   20.814  303.725   19.911 9.305176 28.80401 
1 1 1    3   31   13 o  602.432   11.160  278.535   10.290  280.277   14.765  276.889   14.349  603.422   15.986  599.840   15.629 3.581970 22.35678 
1 1 1    3   31   14 o  709.590   9.2770  386.125   10.076  387.706   12.399  383.052   17.290  710.678   11.398  705.359   16.015 5.318176 19.65680 
1 1 1    3   31   15 o  256.715   13.719   50.809   5.3713   44.969   6.4912   63.491   9.5658  240.849   17.733  285.527   22.059 -44.67789 28.30272 
1 1 1    3   31   16 o  583.721   9.4007  261.346   8.3992  264.079   10.355  256.089   14.360  586.436   11.536  576.543   16.273 9.892578 19.94710 
1 1 1    3   31   17 o  534.057   9.6746  218.817   7.9084  209.878   13.693  223.291   9.6877  521.667   17.148  539.177   11.739 -17.50970 20.78133 
1 1 1    3   31   18 o  270.168   13.153   56.126   5.4391   51.105   9.7601   58.388   6.5505  254.983   25.343  274.855   15.635 -19.87190 29.77827 
1 1 1    3   31   19 o  235.779   13.072   42.883   4.6992   47.768   6.7141   38.193   6.5794  248.084   17.800  221.333   19.625 26.75079 26.49444 
1 1 1    3   31   20 o  177.905   15.915   24.597   4.2879   22.394   6.1311   26.707   5.9991  167.861   24.592  184.293   21.682 -16.43178 32.78508 
1 1 1    3   31   21 o  310.352   12.504   74.079   5.9400   68.742   10.307   76.732   7.2684  296.414   22.895  315.513   15.051 -19.09918 27.39900 
1 1 1    3   31   22 f  514.945   10.249  203.646   8.0783  187.667   14.078  211.490   9.8639  492.346   18.681  524.370   12.290 -32.02325 22.36121 
1 1 1    3   31   23 o  226.729   13.751   39.745   4.7495   39.183   6.8785   40.257   6.5660  223.780   20.303  227.140   19.062 -3.359787 27.84904 
1 1 1    3   31   24 o  447.795   10.492  154.088   7.1915  137.033   11.570  164.824   9.1800  420.635   17.971  462.637   12.964 -42.00238 22.15904 
1 1 1    3   31   25 o  103.652   29.468   8.7288   4.8964   8.0638   8.3214   9.0809   6.0557  107.533   39.088  106.693   33.380 0.8395996 51.40127 
1 1 1    3   31   26 o  172.455   17.437   23.274   4.5395   30.328   6.6321   17.055   6.2266  195.809   22.540  144.367   29.182 51.44284 36.87281 
1 1 1    3   31   27 o  143.519   24.392   16.590   5.1666   15.069   6.6538   18.898   8.1992  134.633   32.629  150.063   36.130 -15.42979 48.68308 
1 1 1    3   31   28 o  297.286   12.049   68.096   5.4827   68.702   7.7697   67.494   7.7376  297.107   17.158  294.453   17.243 2.654633 24.32577 
1 1 1    3   31   29 o  182.368   18.231   26.110   5.0207   23.320   7.1928   28.761   7.0113  169.079   28.827  189.587   24.752 -20.50827 37.99542 
1 1 1    3   31   30 o  462.677   10.057  164.673   7.1222  160.913   9.9678  168.595   10.180  456.181   14.275  466.955   14.243 -10.77341 20.16596 
1 1 1    3   31   31 f  340.376   12.251   89.371   6.3826   88.805   9.0893   89.922   8.9646  337.427   17.660  339.675   17.300 -2.248016 24.72159 
1 1 1    3   31   32 o  247.650   15.419   47.736   5.8158   49.647   8.2049   45.806   8.2449  250.600   21.602  240.243   22.690 10.35768 31.32844 
1 1 1    3   31   33 o  153.448   24.258   19.040   5.5082   15.800   7.5089   22.814   8.1045  136.248   35.610  164.910   33.256 -28.66267 48.72347 
1 1 1    3   31   34 o   72.948   29.868   1.8840   5.3104  -0.1547   7.3268   4.1403   7.7078   77.226   33.492   91.009   36.445 -13.78294 49.49729 
1 1 1    3   31   35 o  119.988   34.699   12.187   6.7341   17.495   7.6945  -5.1801   13.919  142.928   35.365   95.008   43.309 47.91982 55.91370 
1 1 1    3   31   36 o  125.838   42.422   13.322   9.6833   15.068   13.622   11.539   13.768  135.466   49.893  126.606   49.322 8.859886 70.15677 
1 1 1    3   31   37 o  177.231   29.522   26.071   7.7269   53.185   14.993   16.264   9.0166  247.081   41.086  136.219   40.367 110.8617 57.59831 
1 1 1    3   31   38 o   91.514   33.484   6.0169   6.1208   4.6744   8.1413   7.7623   9.2830   93.361   37.432  106.083   40.724 -12.72193 55.31334 
1 1 1    3   31   39 o  161.057   26.280   21.370   6.2549   17.532   8.5212   25.854   9.2106  140.887   38.444  172.699   36.010 -31.81221 52.67534 
1 1 1    3   31   40 f  472.619   16.705  174.949   12.085  174.949   12.085   0.0000   0.0000  472.619   16.705  ?   ?  0.000000 16.70550 
1 1 1    3   31   41 o  310.099   15.897   75.446   7.5199   81.753   10.486   68.769   10.790  319.597   21.563  291.197   24.433 28.39957 32.58735 
1 1 1    3   31   42 o  369.454   20.446  108.993   11.517   0.0000   0.0000  108.993   11.517  ?   ?   369.454   20.446 0.000000 20.44578 
1 1 1    3   31   43 o  113.450   44.744   9.8916   11.449   9.8916   11.449   0.0000   0.0000  113.450   44.744  ?   ?  0.000000 44.74396 
1 1 1    3   31   44 o  225.299   14.975   40.000   5.1349   25.000   10.004   45.366   5.9832  163.504   40.244  239.304   16.434 -75.79945 43.47021 
1 1 1    3   31   45 o  207.935   12.268   33.806   3.8872   31.935   5.2869   36.007   5.7351  199.931   17.451  212.186   17.823 -12.25529 24.94434 
1 1 1    3   31   46 o  121.955   19.613   12.217   3.5370   12.713   5.0476   11.738   4.9577  120.711   27.881  115.750   28.235 4.961777 39.68088 
1 1 1    3   31   47 o  155.329   16.769   19.432   3.9236   22.392   5.6486   16.672   5.4540  163.358   23.246  138.690   26.661 24.66792 35.37225 
1 1 1    3   31   48 o  131.879   23.776   14.870   4.6228  -0.7628   9.5154   19.700   5.2889   79.787   36.151  152.426   23.418 -72.63895 43.07324 
1 1 1    3   31   49 o  313.898   13.149   77.741   6.3176   36.742   10.465  101.249   7.9244  195.987   36.220  357.072   14.499 -161.0844 39.01442 
1 1 1    3   32    0 o  519.478   16.350  207.714   12.971  207.714   12.971  207.714   12.971  519.478   16.350  519.478   16.350 0.000000 0.000000 
1 1 1    3   32    1 o  410.807   11.912  129.540   7.4901  120.468   10.431  139.197   10.762  395.522   17.230  425.261   16.534 -29.73944 23.87952 
1 1 1    3   32    2 o   90.655   31.054   5.9101   5.1897   4.5571   7.4262   7.2017   7.2556   93.686   36.299  102.624   36.601 -8.938400 51.54864 
1 1 1    3   32    3 o  418.553   12.090  134.488   7.7452  122.727   10.766  147.103   11.151  399.141   17.623  437.137   16.665 -37.99551 24.25456 
1 1 1    3   32    4 o  453.544   11.910  157.904   8.2680  165.456   12.078  151.244   11.343  463.531   17.023  443.225   16.719 20.30566 23.86018 
1 1 1    3   32    5 o  268.640   14.919   55.666   6.1103   47.030   8.5145   64.836   8.7740  245.467   22.927  289.150   19.947 -43.68353 30.38955 
1 1 1    3   32    6 o  606.910   11.189  282.672   10.394  294.959   15.279  272.089   14.180  619.045   16.125  594.675   15.579 24.37085 22.42125 
1 1 1    3   32    7 o  234.395   17.081   42.542   6.0862   51.368   8.9489   34.945   8.3018  256.564   23.033  210.497   26.343 46.06691 34.99289 
1 1 1    3   32    8 o  570.339   11.298  249.670   9.8631  261.454   14.430  239.337   13.512  582.758   16.177  557.635   15.831 25.12341 22.63461 
1 1 1    3   32    9 o  727.970   11.319  406.779   12.612  409.028   18.194  404.698   17.499  728.816   16.309  725.095   15.767 3.721558 22.68449 
1 1 1    3   32   10 o  129.150   28.491   13.503   5.4809   9.9104   7.7790   17.044   7.7237  114.359   38.018  144.324   35.264 -29.96446 51.85499 
1 1 1    3   32   11 o  750.349   16.571  433.780   19.031  433.780   19.031   0.0000   0.0000  750.349   16.571  ?   ?  0.000000 16.57055 
1 1 1    3   32   12 o  342.561   19.762   90.982   10.318   90.982   10.318   0.0000   0.0000  342.561   19.762  ?   ?  0.000000 19.76167 
1 1 1    3   32   13 o  368.039   13.570  104.159   7.6445  110.210   10.793   98.069   10.829  377.777   18.666  355.588   19.976 22.18909 27.34012 
1 1 1    3   32   14 o  189.202   21.957   28.107   6.2404   23.529   9.0632   32.235   8.6051  169.416   36.058  201.113   28.774 -31.69673 46.13168 
1 1 1    3   32   15 o  213.447   19.351   35.510   6.2535   31.745   9.1541   38.804   8.5630  198.827   31.098  221.744   25.706 -22.91681 40.34731 
1 1 1    3   32   16 o  205.391   16.292   32.732   5.0798   30.814   6.2648   36.413   8.6795  198.340   20.953  214.284   27.066 -15.94403 34.22915 
1 1 1    3   32   17 o  425.603   10.304  139.070   6.7123  140.390   8.1464  136.280   11.846  427.304   12.455  419.845   18.433 7.459381 22.24699 
1 1 1    3   32   18 o  242.938   12.652   45.516   4.6884   43.841   6.6304   47.191   6.6306  237.398   18.390  246.497   17.692 -9.098465 25.51867 
1 1 1    3   32   19 o  588.141   8.4136  265.342   7.5742  269.354   10.712  261.331   10.711  591.905   11.824  582.982   12.003 8.923584 16.84871 
1 1 1    3   32   20 o  150.830   19.371   17.912   4.3687   17.732   6.3199   18.076   6.0458  147.726   28.985  149.585   27.416 -1.858917 39.89698 
1 1 1    3   32   21 o  162.338   18.566   20.674   4.5302   18.612   6.3805   22.770   6.4332  151.443   28.573  168.707   25.727 -17.26334 38.44862 
1 1 1    3   32   22 o  207.071   16.624   33.364   5.2245   32.668   8.8364   33.739   6.4781  201.393   29.544  207.313   20.691 -5.920670 36.06930 
1 1 1    3   32   23 o  333.776   15.350   86.058   7.8420   0.0000   0.0000   86.058   7.8420  ?   ?   333.776   15.350 0.000000 15.34987 
1 1 1    3   32   24 o  231.192   16.722   41.593   5.8774   64.818   11.409   33.203   6.8573  285.774   26.381  205.059   22.202 80.71545 34.48061 
1 1 1    3   32   25 o  512.278   13.169  202.382   10.326  195.385   15.703  207.714   13.706  500.640   20.492  517.552   17.301 -16.91193 26.81873 
1 1 1    3   32   26 o  302.839   11.886   70.650   5.5097   71.563   7.7683   69.725   7.8156  303.360   16.796  299.332   17.130 4.028381 23.98994 
1 1 1    3   32   27 o  461.590   9.8328  163.825   6.9471  165.252   9.8507  162.413   9.7988  462.517   13.915  458.512   13.962 4.004791 19.71181 
1 1 1    3   32   28 o   91.369   29.896   6.4973   4.8174   8.0534   7.0016   5.0984   6.6385  103.384   36.034   90.902   34.547 12.48235 49.91921 
1 1 1    3   32   29 o   57.480   25.973  -2.3349   4.8735   3.8286   7.0806  -7.8832   6.7179   88.076   35.044   58.153   27.654 29.92332 44.64052 
1 1 1    3   32   30 o  158.285   22.759   20.083   5.3553   17.436   7.7920   22.452   7.3724  143.347   35.660  164.921   30.323 -21.57411 46.80882 
1 1 1    3   32   31 o  216.071   17.044   36.534   5.5911   34.320   7.7148   38.984   8.1143  206.832   24.867  220.769   24.422 -13.93747 34.85411 
1 1 1    3   32   32 o   69.440   29.170   0.9478   5.2492   2.1608   7.4412  -0.2537   7.4059   84.094   34.982   77.431   33.627 6.662811 48.52340 
1 1 1    3   32   33 o  273.320   17.793   58.532   7.4030   54.771   8.5111   70.220   15.004  263.024   21.324  290.817   34.373 -27.79297 40.44988 
1 1 1    3   32   34 o  227.654   21.201   41.150   7.3026   39.450   8.3719   46.559   14.933  221.249   25.169  229.806   44.057 -8.556717 50.73986 
1 1 1    3   32   35 o  278.557   18.658   61.057   7.9090   76.996   15.066   54.994   9.2923  304.731   32.819  262.248   23.395 42.48285 40.30434 
1 1 1    3   32   36 o  135.336   29.561   15.401   5.9522   14.368   8.1511   16.580   8.7122  128.719   38.435  137.495   39.382 -8.775970 55.02911 
1 1 1    3   32   37 o  182.414   22.400   26.775   6.1229   20.402   8.2266   34.689   9.1677  153.382   35.709  204.227   30.242 -50.84595 46.79407 
1 1 1    3   32   38 o  246.055   17.749   47.729   6.6398   53.298   9.2300   41.757   9.5589  257.225   23.710  225.015   28.386 32.21021 36.98540 
1 1 1    3   32   39 o   98.574   34.503   7.6964   6.4225   0.3528   8.4900   17.522   9.8202   82.566   35.930  139.054   42.338 -56.48792 55.52952 
1 1 1    3   32   40 o   83.292   36.579  -0.0612   8.9779  -0.0612   8.9779   0.0000   0.0000   83.292   36.579  ?   ?  0.000000 36.57853 
1 1 1    3   32   41 o  112.256   38.184   10.852   7.8456   9.2271   11.226   12.404   10.970  112.033   44.266  120.577   44.705 -8.543839 62.91286 
1 1 1    3   32   42 o  261.575   20.207   54.950   8.0278   38.793   10.133   82.191   13.157  211.967   32.247  314.093   27.649 -102.1262 42.47770 
1 1 1    3   32   43 o  144.190   20.391   16.947   4.3748   18.503   4.9849   11.734   9.1265  149.860   22.421  115.099   41.050 34.76113 46.77387 
1 1 1    3   32   44 o   50.632   22.025  -0.2027   3.1876  -2.0937   4.2853   2.1396   4.7695   52.737   24.036   69.265   28.327 -16.52821 37.15044 
1 1 1    3   32   45 f  146.586   16.374   17.232   3.6109   16.285   5.1792   18.129   5.0370  138.221   25.417  147.245   23.110 -9.024887 34.35285 
1 1 1    3   32   46 o   99.260   23.262   8.4445   3.4725   9.7569   4.9296   7.1519   4.8923  104.381   29.530   90.822   30.148 13.55860 42.20095 
1 1 1    3   32   47 o  222.072   12.865   38.897   4.3542   34.707   5.8153   44.245   6.5688  206.411   18.606  233.258   18.552 -26.84665 26.27480 
1 1 1    3   32   48 o  117.059   21.722   11.648   3.7487   5.2278   5.2497   18.329   5.3549   81.470   30.779  145.445   24.952 -63.97530 39.62239 
1 1 1    3   33    0 o   60.260   37.899   1.4833   7.3368   1.4833   7.3368   1.4833   7.3368   60.260   37.899   60.260   37.899 0.000000 0.000000 
1 1 1    3   33    1 o  450.327   12.071  155.749   8.3203  160.091   11.784  151.432   11.749  455.793   16.891  443.218   17.319 12.57532 24.19208 
1 1 1    3   33    2 o  672.680   11.292  347.377   11.627  350.582   16.579  344.276   16.310  674.712   16.054  668.646   15.937 6.065247 22.62070 
1 1 1    3   33    3 o  355.270   12.830   96.984   6.9767  101.833   10.207   92.732   9.5580  362.812   18.441  346.247   18.098 16.56500 25.83762 
1 1 1    3   33    4 o  283.215   14.966   61.895   6.4648   55.001   9.0406   69.109   9.2481  265.521   22.455  298.304   20.377 -32.78281 30.32232 
1 1 1    3   33    5 o  670.159   11.381  344.825   11.674  347.288   16.564  342.394   16.456  671.461   16.117  666.711   16.126 4.750549 22.79903 
1 1 1    3   33    6 o  516.264   11.625  204.676   9.1864  204.232   13.329  205.079   12.679  514.723   16.918  515.974   16.054 -1.251099 23.32238 
1 1 1    3   33    7 o  697.074   11.470  373.136   12.238  366.111   17.444  379.946   17.174  689.226   16.536  702.291   15.977 -13.06512 22.99321 
1 1 1    3   33    8 o  471.744   11.987  170.957   8.6553  165.079   12.443  176.467   12.048  462.566   17.574  478.493   16.450 -15.92715 24.07157 
1 1 1    3   33    9 o  485.475   11.868  181.054   8.8186  182.303   12.871  179.950   12.107  486.121   17.297  483.173   16.371 2.947052 23.81606 
1 1 1    3   33   10 o  210.765   19.118   34.610   6.1003   34.296   9.1582   34.861   8.1789  207.248   29.721  209.981   26.004 -2.732712 39.49075 
1 1 1    3   33   11 o  563.163   11.561  243.635   9.9655  238.301   14.455  248.466   13.757  555.756   16.993  567.788   15.830 -12.03168 23.22390 
1 1 1    3   33   12 o  469.680   12.203  169.555   8.7728  179.950   12.845  160.468   12.010  482.798   17.382  455.954   17.209 26.84415 24.46006 
1 1 1    3   33   13 o  323.500   20.606   81.420   10.150   81.420   10.150   0.0000   0.0000  323.500   20.606  ?   ?  0.000000 20.60566 
1 1 1    3   33   14 o  356.281   20.593   98.728   11.182   98.728   11.182   0.0000   0.0000  356.281   20.593  ?   ?  0.000000 20.59256 
1 1 1    3   33   15 o  105.797   28.584   9.0840   4.7383   10.016   5.7860   7.1857   8.2563  111.280   32.158  104.864   38.802 6.415894 50.39637 
1 1 1    3   33   16 o  668.173   9.5362  342.704   9.7529  349.425   12.118  330.347   16.432  674.172   11.743  654.099   16.413 20.07336 20.18122 
1 1 1    3   33   17 o  510.647   9.9541  200.243   7.7802  195.911   9.5231  208.937   13.492  504.637   12.329  519.943   16.953 -15.30539 20.96220 
1 1 1    3   33   18 o  341.841   21.072   91.179   10.972   0.0000   0.0000   91.179   10.972  ?   ?   341.841   21.072 0.000000 21.07157 
1 1 1    3   33   19 o  117.395   26.847   11.243   4.7191   20.178   7.9723   6.4237   5.8551  156.184   34.288   94.292   32.947 61.89181 47.55232 
1 1 1    3   33   20 o  299.725   12.931   69.199   5.9323   72.140   9.8355   67.518   7.4374  303.646   21.297  295.007   16.538 8.638519 26.96379 
1 1 1    3   33   21 o  270.490   12.445   56.348   5.1526   65.077   7.4127   48.188   7.1671  289.470   16.803  248.411   18.994 41.05908 25.35912 
1 1 1    3   33   22 o  171.334   20.504   23.177   5.2703   21.585   6.6097   25.957   8.7327  163.321   27.412  177.434   33.379 -14.11302 43.19236 
1 1 1    3   33   23 o  143.846   24.097   16.651   5.1180   13.801   6.3655   21.863   8.6072  128.859   32.328  161.606   35.745 -32.74669 48.19519 
1 1 1    3   33   24 o  340.022   11.360   89.015   5.9121   88.563   8.2131   89.502   8.5171  338.195   15.866  339.856   16.373 -1.660156 22.79919 
1 1 1    3   33   25 f  246.912   16.747   47.498   6.2918   62.521   12.029   41.840   7.3821  279.092   28.560  230.427   21.167 48.66484 35.54908 
1 1 1    3   33   26 o  225.193   18.726   39.746   6.3960   48.517   11.673   35.983   7.6460  243.855   32.050  212.602   23.911 31.25310 39.98662 
1 1 1    3   33   27 o  299.510   14.871   69.442   6.8176   73.486   12.683   67.799   8.0849  302.796   27.672  294.644   18.014 8.152039 33.01829 
1 1 1    3   33   28 o  103.447   30.734   8.7690   5.2217   8.0243   7.6267   9.4261   7.1641  104.478   37.498  109.015   36.490 -4.536835 52.32224 
1 1 1    3   33   29 o  480.836   10.422  178.024   7.6701  180.277   10.882  175.799   10.813  482.408   14.737  476.343   14.830 6.065338 20.90743 
1 1 1    3   33   30 o  145.004   25.138   17.112   5.3771   7.5666   7.3299   28.235   7.9121  101.716   36.730  185.758   28.757 -84.04222 46.64771 
1 1 1    3   33   31 o  107.085   34.733   9.3135   6.5076   7.8377   7.5063   13.779   13.057  103.001   37.173  132.208   48.821 -29.20771 61.36186 
1 1 1    3   33   32 o  100.767   34.476   7.9423   6.3963   2.5758   7.1915   28.263   13.994   83.987   34.616  175.512   49.789 -91.52582 60.64023 
1 1 1    3   33   33 o  234.039   20.909   43.459   7.4114   20.075   13.724   53.085   8.8057  149.790   50.505  258.135   22.512 -108.3452 55.29477 
1 1 1    3   33   34 o  386.190   15.056  115.956   8.8999  102.116   15.930  122.235   10.731  353.479   29.720  395.313   17.735 -41.83405 34.60870 
1 1 1    3   33   35 o  317.521   14.356   78.326   6.9770   82.552   9.8640   74.094   9.8700  323.135   20.042  305.470   21.242 17.66522 29.20453 
1 1 1    3   33   36 o  147.906   27.998   18.241   6.1063   10.063   8.2409   28.197   9.0932  111.476   39.080  181.766   33.932 -70.28999 51.75531 
1 1 1    3   33   37 o   84.765   32.572   4.5472   5.9421   4.5949   8.0306   4.4895   8.8335   92.250   37.109   94.621   38.607 -2.370872 53.54995 
1 1 1    3   33   38 o  294.999   16.120   68.309   7.2513   80.481   10.308   56.383   10.203  317.367   21.343  262.888   25.684 54.47906 33.39476 
1 1 1    3   33   39 o  278.482   18.027   61.404   7.6427   59.029   11.704   63.170   10.091  265.985   29.230  279.035   23.857 -13.05051 37.72988 
1 1 1    3   33   40 o  103.129   35.979   8.8313   6.9808   12.065   9.0247   4.0140   11.014  117.372   40.910   98.548   41.869 18.82454 58.53772 
1 1 1    3   33   41 o   77.313   32.258   2.2400   6.3545   11.492   8.9359  -7.2248   9.0381  114.620   40.647   69.628   32.799 44.99229 52.22945 
1 1 1    3   33   42 o  220.868   20.792   39.501   6.9463   47.053   9.8105   31.908   9.8366  236.505   27.621  188.998   35.301 47.50768 44.82307 
1 1 1    3   33   43 o  143.554   20.597   16.893   4.3960   19.626   4.9873   7.3756   9.3074  154.376   21.706  100.657   40.137 53.71901 45.63077 
1 1 1    3   33   44 o  130.581   17.860   13.849   3.4761   16.251   5.0928   11.753   4.7562  138.144   25.006  115.992   27.252 22.15132 36.98602 
1 1 1    3   33   45 o  167.865   15.079   22.483   3.8330   25.313   5.5402   19.885   5.3086  174.929   21.119  153.567   23.318 21.36163 31.46005 
1 1 1    3   33   46 o  263.601   13.606   54.963   5.4708   42.612   9.6075   60.890   6.6551  219.544   29.323  275.924   15.824 -56.38074 33.32042 
1 1 1    3   33   47 o  195.600   21.295   31.939   6.2725   31.939   6.2725   0.0000   0.0000  195.600   21.295  ?   ?  0.000000 21.29486 
1 1 1    3   34    0 o  342.573   19.401   91.142   10.098   91.142   10.098   91.142   10.098  342.573   19.401  342.573   19.401 0.000000 0.000000 
1 1 1    3   34    1 o  676.899   11.348  351.927   11.757  345.970   16.601  357.923   16.654  669.900   16.190  681.442   15.967 -11.54156 22.73911 
1 1 1    3   34    2 o  587.173   11.474  264.836   10.312  268.230   14.927  261.736   14.263  589.754   16.536  582.715   15.991 7.038818 23.00351 
1 1 1    3   34    3 o  384.597   12.926  113.736   7.6093  114.163   10.796  113.315   10.726  384.400   18.350  382.981   18.298 1.418518 25.91372 
1 1 1    3   34    4 o  323.084   13.718   80.315   6.7836   75.980   9.7843   84.328   9.4135  312.554   20.567  329.783   18.726 -17.22937 27.81479 
1 1 1    3   34    5 o  312.470   13.750   75.131   6.5764   65.185   9.2842   85.147   9.3167  289.251   21.116  331.433   18.438 -42.18213 28.03314 
1 1 1    3   34    6 o  240.993   16.622   45.014   6.0940   47.331   8.9167   42.983   8.3479  245.510   24.036  233.956   23.636 11.55478 33.71054 
1 1 1    3   34    7 o  770.658   11.587  456.342   13.668  470.485   19.958  443.850   18.757  780.842   16.699  758.618   16.153 22.22424 23.23309 
1 1 1    3   34    8 o  568.500   11.594  248.348   10.088  250.160   14.793  246.772   13.794  569.256   16.977  565.680   15.931 3.576599 23.28160 
1 1 1    3   34    9 o  402.034   12.908  124.333   7.9430  129.221   11.520  119.904   10.967  408.783   18.411  393.818   18.193 14.96545 25.88388 
1 1 1    3   34   10 o  410.621   13.076  129.733   8.2186  130.633   12.000  128.939   11.279  410.802   19.085  408.375   18.044 2.426941 26.26461 
1 1 1    3   34   11 f  648.032   11.636  322.794   11.542  329.970   16.826  316.418   15.861  653.649   16.818  640.299   16.184 13.35004 23.34029 
1 1 1    3   34   12 o  173.337   22.715   23.764   5.8816   23.792   8.3341   23.736   8.3017  170.594   33.111  170.413   33.019 0.1804657 46.76137 
1 1 1    3   34   13 o  186.147   22.155   27.323   6.1884   31.350   8.8191   23.416   8.6859  197.304   30.160  168.641   34.804 28.66272 46.05392 
1 1 1    3   34   14 o  526.069   12.342  212.939   9.9378  198.490   13.838  228.325   14.280  506.430   17.852  543.385   17.170 -36.95535 24.76905 
1 1 1    3   34   16 o  421.644   18.337  137.786   11.834  137.786   11.834   0.0000   0.0000  421.644   18.337  ?   ?  0.000000 18.33656 
1 1 1    3   34   17 o  185.753   23.949   27.411   6.6505   25.082   8.6369   30.804   10.424  174.623   33.532  192.851   36.652 -18.22787 49.67687 
1 1 1    3   34   18 o  509.497   10.491  199.557   8.1815  212.823   10.345  177.408   13.368  525.569   12.860  478.227   18.262 47.34171 22.33597 
1 1 1    3   34   19 o  227.603   14.129   40.132   4.8980   45.036   6.8939   35.133   6.9601  240.054   18.916  211.066   21.861 28.98860 28.90861 
1 1 1    3   34   20 o  619.270   10.182  294.838   9.6512  289.786   11.668  305.783   17.174  613.258   12.430  627.690   17.876 -14.43237 21.77270 
1 1 1    3   34   21 o  107.311   30.391   9.4411   5.2184   17.052   6.3860  -5.8568   9.0536  143.903   29.966   74.693   34.376 69.21026 45.60332 
1 1 1    3   34   22 o  224.478   14.781   39.124   5.0503   31.864   6.9597   47.200   7.3398  200.315   23.124  245.359   19.710 -45.04453 30.38440 
1 1 1    3   34   23 o  514.948   9.3299  203.796   7.3538  211.661   10.570  196.417   10.238  523.695   13.186  504.460   13.259 19.23517 18.69967 
1 1 1    3   34   24 o  415.947   10.461  133.134   6.6599  146.888   9.7328  121.024   9.1327  435.783   14.591  395.415   15.090 40.36813 20.99059 
1 1 1    3   34   25 o  529.903   9.6152  215.935   7.7987  224.465   11.171  207.824   10.893  538.997   13.540  518.566   13.723 20.43115 19.27871 
1 1 1    3   34   26 o   78.798   29.708   3.8332   4.8844   5.8876   7.0278   1.9136   6.7932   94.911   35.665   80.688   33.483 14.22324 48.91919 
1 1 1    3   34   27 o   73.928   30.881   1.3082   5.8328   17.016   10.674  -5.3799   6.9647  140.777   44.360   63.916   29.674 76.86096 53.36994 
1 1 1    3   34   28 o  164.084   25.824   21.857   6.2714   30.164   11.641   18.460   7.4440  186.161   41.870  147.862   33.648 38.29935 53.71480 
1 1 1    3   34   29 o  352.113   19.153   97.260   10.284   99.104   14.397   95.339   14.694  351.294   26.982  343.803   28.169 7.491089 39.00672 
1 1 1    3   34   30 o  254.525   19.127   50.992   7.3970   53.475   8.7292   44.667   13.931  259.461   22.194  226.908   41.645 32.55305 47.18972 
1 1 1    3   34   31 o   68.497   30.613  -1.9940   6.5658  -6.8403   12.567  -0.1744   7.7004   87.382   40.318   78.761   34.247 8.621773 52.89979 
1 1 1    3   34   32 o  144.928   31.639   17.751   6.8217   21.214   13.502   16.564   7.9048  152.884   50.052  138.324   36.722 14.55984 62.07839 
1 1 1    3   34   33 o  301.954   14.540   70.837   6.7201   71.772   9.4893   69.897   9.5181  300.983   20.724  296.834   21.086 4.149292 29.56557 
1 1 1    3   34   34 f   48.791   23.811 -10.0802   5.8160 -22.7889   8.4238   1.4964   8.0399   50.453   25.297   84.029   35.737 -33.57589 43.78469 
1 1 1    3   34   35 o  527.323   11.032  214.880   8.9041  213.566   12.588  216.196   12.596  523.116   15.722  526.384   15.634 -3.268005 22.17200 
1 1 1    3   34   36 o  158.434   26.584   20.809   6.2184   17.807   8.6690   23.990   8.9250  141.196   38.879  165.480   36.240 -24.28433 53.14970 
1 1 1    3   34   37 o  100.835   35.158   8.2133   6.6655   0.7590   10.253   13.670   8.7723   89.981   39.313  124.218   40.329 -34.23684 56.31946 
1 1 1    3   34   38 o  302.092   19.704   72.766   9.0608   87.556   13.242   59.745   12.425  326.128   26.763  265.789   31.131 60.33881 41.05366 
1 1 1    3   34   39 o   43.092   21.719 -19.8634   6.6408 -20.6843   8.5137 -18.5879   10.612   52.025   25.988   63.430   31.202 -11.40432 40.60693 
1 1 1    3   34   40 o   81.278   32.528   3.7465   6.1357   0.7567   8.5749   6.8834   8.7834   82.412   35.981   99.233   39.173 -16.82117 53.18970 
1 1 1    3   34   41 o   87.735   33.753   5.4242   6.3854  -1.3486   8.8215   12.879   9.2548   78.453   35.243  118.681   41.425 -40.22829 54.38837 
1 1 1    3   34   42 o  144.389   31.542   18.556   6.7760   18.306   9.7553   18.789   9.4191  136.678   42.302  139.041   41.271 -2.362732 59.09947 
1 1 1    3   34   43 o  140.465   30.902   17.679   6.4634   25.737   9.3888   10.420   8.9113  164.522   38.043  107.822   40.230 56.69952 55.36850 
1 1 1    3   34   44 o  118.832   25.188   12.238   4.4392   13.836   5.2052   7.9751   8.5012  125.015   27.909   98.544   38.654 26.47146 47.67616 
1 1 1    3   34   45 o  146.131   39.169   21.348   8.9395   21.348   8.9395   0.0000   0.0000  146.131   39.169  ?   ?  0.000000 39.16924 
1 1 1    3   35    0 o  1127.36   18.489  978.805   31.885  978.805   31.885  978.805   31.885  1127.36   18.489  1127.36   18.489 0.000000 0.000000 
1 1 1    3   35    1 o  342.226   11.043   89.985   5.7846   95.016   7.1680   80.591   9.7955  351.347   13.329  321.845   19.983 29.50266 24.02032 
1 1 1    3   35    2 o  264.708   13.416   54.074   5.4181   53.705   6.6641   54.794   9.3058  263.218   16.626  264.310   23.238 -1.092560 28.57362 
1 1 1    3   35    3 o  441.824   12.552  150.162   8.4889  150.115   12.071  150.209   11.940  440.593   17.900  440.782   17.697 -0.1894531 25.17130 
1 1 1    3   35    4 f  384.330   13.327  113.704   7.8401  119.151   11.333  108.704   10.858  392.286   18.874  374.197   19.020 18.08902 26.79477 
1 1 1    3   35    5 o  268.263   15.668   55.709   6.4053   57.373   9.2160   54.154   8.9087  270.663   22.448  262.937   22.347 7.725250 31.67545 
1 1 1    3   35    6 o  615.070   11.725  290.866   11.039  299.947   16.104  282.818   15.161  623.059   16.886  605.182   16.367 17.87781 23.51615 
1 1 1    3   35    7 o  311.009   14.528   74.561   6.9159   79.810   10.256   70.182   9.3660  319.851   21.066  300.004   20.520 19.84756 29.40812 
1 1 1    3   35    8 o  155.997   26.407   19.562   6.0802   16.527   8.8007   22.334   8.4100  140.999   39.305  164.643   34.477 -23.64444 52.28357 
1 1 1    3   35    9 o  146.374   27.332   17.334   5.8983   14.127   8.8609   19.887   7.9038  131.451   40.255  155.206   34.194 -23.75510 52.81755 
1 1 1    3   35   10 o  101.922   36.994   7.1293   7.4498   0.0000   0.0000   7.1293   7.4498  ?   ?   101.922   36.994 0.000000 36.99437 
1 1 1    3   35   11 o  548.003   16.965  232.278   14.230   0.0000   0.0000  232.278   14.230  ?   ?   548.003   16.965 0.000000 16.96490 
1 1 1    3   35   12 o  228.715   26.480   41.599   9.0986   0.0000   0.0000   41.599   9.0986  ?   ?   228.715   26.480 0.000000 26.47998 
1 1 1    3   35   13 o  409.509   13.989  129.324   8.7683  129.598   13.541  129.127   11.506  407.186   21.806  408.060   18.422 -0.8731995 28.54603 
1 1 1    3   35   14 f  149.959   28.523   18.311   6.3077   25.872   9.1304   11.407   8.7243  176.823   34.974  120.419   40.269 56.40350 53.33614 
1 1 1    3   35   15 o   75.791   31.399   1.5151   5.9594   2.5016   8.6938   0.6407   8.1850   91.457   37.909   84.343   35.969 7.113998 52.25800 
1 1 1    3   35   16 o  123.993   42.075   12.113   9.5258   12.113   9.5258   0.0000   0.0000  123.993   42.075  ?   ?  0.000000 42.07467 
1 1 1    3   35   17 o   99.652   34.647   7.3684   6.4711   7.3684   6.4711   0.0000   0.0000   99.652   34.647  ?   ?  0.000000 34.64726 
1 1 1    3   35   18 o  197.873   22.569   31.024   6.7133   31.024   6.7133   0.0000   0.0000  197.873   22.569  ?   ?  0.000000 22.56941 
1 1 1    3   35   19 o  597.258   12.793  275.081   11.695  275.081   11.695   0.0000   0.0000  597.258   12.793  ?   ?  0.000000 12.79303 
1 1 1    3   35   20 o  126.762   24.570   13.049   4.5951   14.570   6.6825   11.686   6.3289  132.071   33.117  118.671   33.420 13.40026 47.04953 
1 1 1    3   35   21 o  348.504   11.038   93.508   5.8879   89.305   8.2821   97.803   8.3721  339.487   15.939  355.421   15.389 -15.93353 22.15557 
1 1 1    3   35   22 o  135.473   24.281   14.866   4.8499   12.067   6.7123   17.924   7.0152  120.315   34.599  146.645   32.141 -26.32941 47.22416 
1 1 1    3   35   23 o  562.566   9.3185  243.313   8.0239  247.368   11.334  239.239   11.361  565.986   13.083  556.512   13.337 9.474304 18.68307 
1 1 1    3   35   24 o  156.697   21.989   19.626   5.1287   17.641   7.0708   21.830   7.4501  145.096   32.629  162.326   31.118 -17.23026 45.08873 
1 1 1    3   35   25 o  213.256   16.747   35.560   5.4225   39.149   7.4744   31.573   7.8786  222.072   22.290  197.614   26.733 24.45787 34.80701 
1 1 1    3   35   26 o  144.338   23.661   16.848   5.0463   14.690   7.1674   18.968   7.1059  131.566   34.986  150.549   31.832 -18.98244 47.30025 
1 1 1    3   35   27 o  419.955   12.854  136.320   8.2624  138.364   9.7993  131.292   15.367  422.277   15.161  406.010   24.848 16.26727 29.10775 
1 1 1    3   35   28 o  445.203   12.666  153.223   8.6314  148.030   10.326  165.268   15.726  436.528   15.454  457.491   22.458 -20.96283 27.26114 
1 1 1    3   35   29 o  406.858   13.536  128.204   8.4293  149.550   16.241  120.334   9.8615  432.938   24.610  393.088   16.390 39.84958 29.56836 
1 1 1    3   35   30 o  426.194   13.547  140.747   8.8373  150.115   17.251  137.414   10.290  432.234   26.198  420.096   16.003 12.13879 30.69927 
1 1 1    3   35   31 o  313.183   17.308   76.874   8.2645   94.116   16.131   70.738   9.6235  337.810   31.564  298.633   21.191 39.17719 38.01763 
1 1 1    3   35   32 o   57.806   26.783  -4.1450   5.6314   8.1070   8.3495 -14.3694   7.6274  105.008   38.988   54.177   26.611 50.83147 47.20378 
1 1 1    3   35   33 o   64.039   28.722  -1.9361   5.8338  -0.9353   8.4851  -2.8332   8.0339   80.012   35.333   73.865   33.365 6.146828 48.59657 
1 1 1    3   35   34 o  115.351   32.482   11.420   5.9787   19.168   8.4468   3.6406   8.4635  147.246   37.405   90.955   37.528 56.29086 52.98552 
1 1 1    3   35   35 o  405.638   14.031  128.124   8.7115  145.409   14.333  117.997   10.970  426.311   22.040  386.818   18.529 39.49335 28.79387 
1 1 1    3   35   36 o  251.114   20.030   50.372   7.6346   59.867   12.220   44.294   9.7777  266.935   30.454  230.667   28.287 36.26860 41.56411 
1 1 1    3   35   37 o  170.018   28.532   24.436   7.1620   25.076   9.0708   23.378   11.671  167.590   36.403  155.759   45.865 11.83105 58.55534 
1 1 1    3   35   38 f   80.076   32.360   3.3482   6.1371   10.860   8.6374  -4.3110   8.7215  112.286   39.947   73.006   33.651 39.28037 52.23125 
1 1 1    3   35   39 o  147.310   29.576   18.756   6.4371   16.757   8.9525   20.895   9.2624  133.702   40.361  149.425   39.789 -15.72289 56.67616 
1 1 1    3   35   40 o  143.213   29.996   17.940   6.3646   25.775   9.3252   11.107   8.7081  167.144   37.386  111.755   40.072 55.38954 54.80431 
1 1 1    3   35   41 o  109.796   34.101   10.957   6.3332   12.092   9.1591   9.9174   8.7666  114.238   41.083  106.693   39.884 7.544868 57.25806 
1 1 1    3   35   42 o  104.407   33.903   9.9237   6.1995   3.6496   8.7047   16.382   8.8317   87.530   37.205  128.853   40.311 -41.32275 54.85596 
1 1 1    3   35   43 o  149.877   28.332   19.834   6.2615   23.018   8.7488   16.491   8.9653  154.373   37.416  127.885   40.693 26.48774 55.28041 
1 1 1    3   35   44 o  201.724   24.627   34.729   7.4460   37.434   9.1902   29.562   12.703  204.421   30.288  162.396   47.859 42.02510 56.63794 
1 1 1    3   36    0 o   51.393   34.366  -2.3934   7.4632  -2.3934   7.4632  -2.3934   7.4632   51.393   34.366   51.393   34.366 0.000000 0.000000 
1 1 1    3   36    1 o  177.672   22.351   24.970   5.9439   19.435   8.1651   31.209   8.6693  152.950   35.553  196.764   29.711 -43.81454 46.33248 
1 1 1    3   36    2 o  733.528   11.814  413.927   13.264  442.627   19.739  390.299   17.910  756.417   17.048  710.553   16.468 45.86389 23.70309 
1 1 1    3   36    3 o  321.365   20.995   80.667   10.271   0.0000   0.0000   80.667   10.271  ?   ?   321.365   20.995 0.000000 20.99541 
1 1 1    3   36    4 o  412.207   18.218  131.668   11.494   0.0000   0.0000  131.668   11.494  ?   ?   412.207   18.218 0.000000 18.21810 
1 1 1    3   36    5 o  184.500   29.249   27.491   7.9845   0.0000   0.0000   27.491   7.9845  ?   ?   184.500   29.249 0.000000 29.24940 
1 1 1    3   36    6 o  300.303   21.023   70.521   9.6024   0.0000   0.0000   70.521   9.6024  ?   ?   300.303   21.023 0.000000 21.02311 
1 1 1    3   36    7 o  184.807   30.255   27.698   8.2621   0.0000   0.0000   27.698   8.2621  ?   ?   184.807   30.255 0.000000 30.25537 
1 1 1    3   36    8 o  227.989   19.086   40.628   6.5992   43.350   9.7580   38.333   8.9585  232.894   27.931  219.029   27.315 13.86487 39.06738 
1 1 1    3   36    9 o   68.923   29.494   0.0775   5.5373  -0.7197   8.3347   0.7074   7.4086   81.777   35.594   80.837   34.341 0.9402847 49.45926 
1 1 1    3   36   10 o  414.040   13.125  132.133   8.3181  144.186   12.209  121.692   11.364  431.004   18.506  395.886   18.754 35.11862 26.34719 
1 1 1    3   36   11 o  100.942   33.611   7.8539   6.0790   3.7919   8.7453   11.652   8.4561   95.174   38.570  120.774   39.614 -25.59990 55.28939 
1 1 1    3   36   12 o   97.746   33.557   7.1539   6.0609   11.793   8.7993   2.9665   8.3602  121.707   40.433   91.247   37.432 30.46026 55.09992 
1 1 1    3   36   13 o  209.618   31.235   35.726   9.7157   35.726   9.7157   0.0000   0.0000  209.618   31.235  ?   ?  0.000000 31.23525 
1 1 1    3   36   14 o  349.930   22.403   96.186   11.936   96.186   11.936   0.0000   0.0000  349.930   22.403  ?   ?  0.000000 22.40323 
1 1 1    3   36   15 f   90.351   38.624   0.8532   9.4785   0.8532   9.4785   0.0000   0.0000   90.351   38.624  ?   ?  0.000000 38.62369 
1 1 1    3   36   16 o  448.628   13.949  155.430   9.5787  166.303   14.159  146.256   13.007  461.854   20.029  433.288   19.612 28.56625 28.03211 
1 1 1    3   36   17 o   67.115   30.382  -3.2012   6.7031  -2.6315   9.8128  -3.6997   9.1781   84.203   37.544   79.168   35.720 5.035141 51.82134 
1 1 1    3   36   18 o  225.528   16.976   39.690   5.8171   31.263   6.9242   59.905   10.725  198.254   23.260  274.216   25.857 -75.96182 34.77964 
1 1 1    3   36   19 o   95.846   35.072   6.3443   6.7153   6.3443   6.7153   0.0000   0.0000   95.846   35.072  ?   ?  0.000000 35.07230 
1 1 1    3   36   20 o  253.410   19.759   50.425   7.6036   50.425   7.6036   0.0000   0.0000  253.410   19.759  ?   ?  0.000000 19.75945 
1 1 1    3   36   21 o  444.577   11.369  152.306   7.7366  157.542   9.5808  142.491   13.116  451.403   13.867  426.935   20.071 24.46835 24.39544 
1 1 1    3   36   22 o  313.681   12.152   75.916   5.8345   78.185   8.1888   73.577   8.3151  316.697   16.954  306.918   17.776 9.778839 24.56515 
1 1 1    3   36   23 o  286.654   13.022   63.492   5.7135   56.226   7.8157   71.831   8.3734  267.615   19.208  303.033   18.136 -35.41852 26.41718 
1 1 1    3   36   24 o  233.801   18.252   42.893   6.4798   40.373   7.8333   48.357   11.532  225.136   23.057  242.581   31.827 -17.44472 39.30133 
1 1 1    3   36   25 o  131.573   31.107   14.541   6.1660   20.327   7.4755   2.2268   10.906  155.559   32.446   97.847   41.619 57.71222 52.77189 
1 1 1    3   36   26 o  178.609   20.633   25.372   5.5369   23.209   7.6677   27.729   8.0038  166.840   31.172  183.456   29.503 -16.61584 42.92004 
1 1 1    3   36   27 o  117.196   33.165   11.601   6.2170   11.482   12.124   11.643   7.2414  123.825   46.776  117.651   36.452 6.173836 59.30209 
1 1 1    3   36   28 o   80.967   32.945   2.7571   6.4101   13.750   12.313  -1.3297   7.5077  130.167   47.513   74.991   33.169 55.17603 57.94547 
1 1 1    3   36   29 o  177.090   21.623   25.115   5.7395   32.596   8.2436   18.077   7.9957  199.467   27.753  144.510   36.219 54.95627 45.62976 
1 1 1    3   36   30 o   97.462   32.738   7.5795   5.7666   12.260   8.2047   3.0106   8.1067  120.107   39.002   88.470   36.634 31.63768 53.50898 
1 1 1    3   36   31 o  306.890   14.474   73.249   6.7989   70.412   9.7911   75.892   9.4484  297.254   21.669  309.529   20.051 -12.27478 29.52229 
1 1 1    3   36   32 o  156.575   32.342   20.962   7.4945  -4.2418   14.199   30.695   8.8238   95.639   43.653  190.866   31.288 -95.22677 53.70771 
1 1 1    3   36   33 o  100.347   38.541   7.0247   8.3172   0.0000   0.0000   7.0247   8.3172  ?   ?   100.347   38.541 0.000000 38.54136 
1 1 1    3   36   34 o  117.514   34.995   12.072   6.7641   4.7500   10.766   16.848   8.6946  100.358   41.940  136.510   39.413 -36.15257 57.55334 
1 1 1    3   36   35 o  230.198   21.471   42.728   7.4780   60.788   9.4815   13.007   12.164  274.015   22.814  123.518   46.806 150.4971 52.06958 
1 1 1    3   36   36 o   82.419   32.932   3.8411   6.2780  -5.6735   8.6815   14.271   9.0894   70.620   32.901  125.118   41.072 -54.49831 52.62492 
1 1 1    3   36   37 o   97.590   33.886   7.8874   6.1889  -4.2032   8.4908   21.592   9.0399   72.016   33.197  153.065   38.594 -81.04861 50.90724 
1 1 1    3   36   38 o  284.039   16.094   63.842   6.9682   68.823   10.065   59.258   9.6567  290.216   22.843  268.509   23.741 21.70782 32.94602 
1 1 1    3   36   39 o  202.655   20.782   33.498   6.3552   42.249   9.0622   25.030   8.9149  223.285   27.069  164.825   36.317 58.46025 45.29491 
1 1 1    3   36   40 o   78.893   31.719   3.7213   5.8639   3.8207   8.4487   3.6289   8.1452   87.607   36.915   86.181   36.276 1.425812 51.75576 
1 1 1    3   36   41 o  132.271   30.206   15.737   5.9811   15.500   8.6517   15.954   8.2777  125.245   39.988  127.624   38.874 -2.378883 55.76968 
1 1 1    3   36   42 o  173.846   27.376   26.375   7.0436   25.246   8.6974   28.527   12.007  163.096   35.820  162.609   46.115 0.4868011 58.39249 
1 1 1    3   37    0 o   80.045   45.624   6.8196   8.7497   6.8196   8.7497   6.8196   8.7497   80.045   45.624   80.045   45.624 0.000000 0.000000 
1 1 1    3   37    1 o  366.116   11.547  103.163   6.4708  100.274   7.9810  108.704   11.054  360.378   14.469  373.432   19.407 -13.05374 24.20686 
1 1 1    3   37    2 o   59.261   26.233  -1.3436   4.7052   5.0578   5.9298 -12.2256   7.7313   88.540   32.860   58.053   28.129 30.48711 43.25510 
1 1 1    3   37    3 o  120.648   32.061   12.036   6.0216   23.397   8.6958   1.5699   8.3466  167.744   35.000   87.426   36.757 80.31795 50.75504 
1 1 1    3   37    4 o  156.809   26.455   19.863   6.1238   27.096   9.1338   13.957   8.2536  181.086   34.207  129.680   38.665 51.40680 51.62484 
1 1 1    3   37    5 o  662.976   11.996  338.471   12.173  337.311   17.449  339.570   16.992  659.656   17.281  662.109   16.766 -2.452209 24.07801 
1 1 1    3   37    6 o  287.890   16.092   64.337   7.0628   57.872   10.348   69.975   9.6639  270.165   25.319  298.745   21.273 -28.57904 33.06924 
1 1 1    3   37    7 o  306.301   16.006   72.799   7.4780   68.686   10.790   76.601   10.373  294.936   24.113  312.409   21.830 -17.47324 32.52678 
1 1 1    3   37    8 o  320.463   21.936   80.620   10.695   80.620   10.695   0.0000   0.0000  320.463   21.936  ?   ?  0.000000 21.93645 
1 1 1    3   37    9 o  113.215   39.436   9.7316   8.3853   9.7316   8.3853   0.0000   0.0000  113.215   39.436  ?   ?  0.000000 39.43601 
1 1 1    3   37   10 f  340.893   21.493   91.132   11.157   91.132   11.157   0.0000   0.0000  340.893   21.493  ?   ?  0.000000 21.49328 
1 1 1    3   37   11 o  254.835   27.203   51.905   10.447   51.905   10.447   0.0000   0.0000  254.835   27.203  ?   ?  0.000000 27.20253 
1 1 1    3   37   12 o  313.743   16.442   76.484   7.8683   73.514   11.026   79.566   11.231  305.073   23.802  317.665   23.260 -12.59140 33.28040 
1 1 1    3   37   13 o  372.832   14.971  107.518   8.5433  117.363   12.511   98.916   11.695  386.934   21.205  354.962   21.628 31.97232 30.28863 
1 1 1    3   37   14 o  187.594   25.159   28.205   7.0420   42.672   10.509   16.414   9.4873  229.169   30.733  139.160   41.446 90.00880 51.59755 
1 1 1    3   37   15 o  220.282   22.010   38.380   7.3217   43.999   10.530   33.119   10.188  232.852   30.259  199.798   34.564 33.05455 45.93742 
1 1 1    3   37   16 o  560.248   13.371  242.397   11.466  246.584   16.402  238.395   16.036  562.463   19.051  553.103   18.942 9.360107 26.86502 
1 1 1    3   37   17 o  128.475   35.207   13.888   7.1289   4.5533   10.346   22.324   9.8363  102.244   41.757  161.234   40.040 -58.98969 57.85208 
1 1 1    3   37   18 o  205.669   23.340   33.697   7.2174   35.585   10.445   31.971   9.9847  207.073   34.144  195.870   34.568 11.20364 48.58741 
1 1 1    3   37   19 o  159.450   24.119   20.479   5.7025   21.405   6.9483   18.569   9.9807  161.346   29.211  146.565   42.202 14.78072 51.32518 
1 1 1    3   37   20 o   74.722   30.411   2.1149   5.4638   2.5344   6.5342   1.1397   9.9628   81.320   33.195   92.248   39.520 -10.92778 51.61172 
1 1 1    3   37   21 o  443.154   14.339  152.082   9.7263  152.082   9.7263   0.0000   0.0000  443.154   14.339  ?   ?  0.000000 14.33919 
1 1 1    3   37   22 o  129.360   34.546   14.198   6.9692   14.198   6.9692   0.0000   0.0000  129.360   34.546  ?   ?  0.000000 34.54616 
1 1 1    3   37   23 o  284.560   15.466   63.061   6.7112   69.112   8.3869   52.291   11.190  296.832   18.553  253.307   29.409 43.52501 34.77201 
1 1 1    3   37   24 o  278.099   14.464   60.130   6.1356   56.577   8.5888   63.833   8.7680  267.356   21.161  284.454   20.271 -17.09808 29.30340 
1 1 1    3   37   25 o  126.885   31.425   13.601   6.0714   23.576   11.585   9.8249   7.1286  162.135   45.061  109.829   36.389 52.30550 57.91947 
1 1 1    3   37   26 o  208.382   21.580   34.610   6.7833   64.780   13.365   24.142   7.8726  280.109   31.733  169.773   31.454 110.3361 44.68064 
1 1 1    3   37   27 o  241.651   23.531   46.815   8.5932   46.815   8.5932   0.0000   0.0000  241.651   23.531  ?   ?  0.000000 23.53096 
1 1 1    3   37   28 o  229.330   17.288   41.355   6.0236   51.384   8.7586   32.354   8.2975  253.375   22.829  198.283   28.128 55.09212 36.22665 
1 1 1    3   37   29 o  233.549   17.799   42.996   6.3149   42.852   9.3130   43.119   8.5917  228.887   27.109  230.849   24.699 -1.962463 36.67345 
1 1 1    3   37   30 o  259.018   16.607   52.701   6.5492   63.151   9.5160   43.297   9.0271  280.821   22.323  230.331   26.064 50.49071 34.31681 
1 1 1    3   37   31 f  216.077   21.771   37.522   7.1022   35.049   11.157   39.208   9.2090  199.658   37.895  217.470   28.339 -17.81194 47.31976 
1 1 1    3   37   32 o  194.740   24.475   31.015   7.1343   27.491   11.165   33.446   9.2750  172.704   42.520  198.334   31.614 -25.63037 52.98447 
1 1 1    3   37   33 o   82.159   33.931   2.8852   6.9282  -1.2385   8.8381   9.4586   11.159   79.869   35.619  112.634   44.252 -32.76542 56.80624 
1 1 1    3   37   34 o  190.095   34.117   31.583   9.5620   36.592   16.105   28.856   11.883  188.434   53.398  174.132   44.437 14.30168 69.46994 
1 1 1    3   37   35 o   93.247   36.813   5.7271   7.7575   33.684   14.810  -4.8436   9.1068  181.581   51.120   73.777   34.139 107.8047 61.47113 
1 1 1    3   37   36 o  136.964   30.707   16.432   6.2783   14.850   9.0307   17.913   8.7346  126.112   40.917  138.358   39.366 -12.24648 56.77898 
1 1 1    3   37   37 o   76.838   31.404   2.9560   5.8571   9.9420   8.3240  -3.8949   8.2431  107.094   39.069   70.755   32.649 36.33981 50.91498 
1 1 1    3   37   38 o   75.240   31.397   2.3947   6.0210  -5.2390   8.8352   9.0138   8.2271   70.618   32.997  102.920   38.605 -32.30163 50.78527 
1 1 1    3   37   39 o   59.509   27.337  -2.7382   5.6899  -7.2958   8.1029   1.6952   7.9918   63.772   30.339   80.451   34.935 -16.67940 46.26983 
1 1 1    3   37   40 o  117.778   35.450   13.181   6.9139   6.0659   8.3242   29.007   12.415   92.414   37.566  163.755   47.043 -71.34113 60.20163 
1 1 1    3   37   41 o  159.786   30.170   22.962   7.1084   23.571   8.6262   21.675   12.547  156.424   36.667  138.509   48.240 17.91559 60.59374 
1 1 1    3   38    0 o  218.617   34.026   39.971   10.564   39.971   10.564   39.971   10.564  218.617   34.026  218.617   34.026 0.000000 0.000000 
1 1 1    3   38    1 o  284.493   24.997   64.159   10.775   64.159   10.775   0.0000   0.0000  284.493   24.997  ?   ?  0.000000 24.99712 
1 1 1    3   38    2 o  205.785   31.980   34.606   9.7461   34.606   9.7461   0.0000   0.0000  205.785   31.980  ?   ?  0.000000 31.98006 
1 1 1    3   38    3 o  317.429   22.906   79.359   11.055   79.359   11.055   0.0000   0.0000  317.429   22.906  ?   ?  0.000000 22.90638 
1 1 1    3   38    4 o  292.574   24.394   67.745   10.824   67.745   10.824   0.0000   0.0000  292.574   24.394  ?   ?  0.000000 24.39365 
1 1 1    3   38    5 o  178.110   37.102   26.654   9.7864   26.654   9.7864   0.0000   0.0000  178.110   37.102  ?   ?  0.000000 37.10229 
1 1 1    3   38    6 o  411.332   14.273  130.732   8.9864  143.621   13.268  119.810   12.214  429.087   20.203  391.311   20.464 37.77606 28.75606 
1 1 1    3   38    7 o  112.782   33.879   10.431   6.3191   4.6183   9.1351   15.764   8.7505   98.564   39.604  136.644   39.565 -38.08015 55.98085 
1 1 1    3   38    8 o  344.889   15.644   92.110   8.2584  102.304   12.022   83.001   11.364  360.852   21.869  324.432   23.035 36.41913 31.76225 
1 1 1    3   38    9 o  507.748   13.308  199.012   10.343  211.667   15.076  187.761   14.215  521.376   18.892  491.043   18.913 30.33331 26.73243 
1 1 1    3   38   10 o  218.692   22.060   37.832   7.2834   31.548   10.194   44.385   10.410  194.514   35.549  234.152   29.715 -39.63763 46.33241 
1 1 1    3   38   11 o  378.793   15.256  111.090   8.8454   99.669   12.378  123.009   12.645  355.574   22.865  396.072   20.932 -40.49838 30.99894 
1 1 1    3   38   12 o  688.148   12.822  365.445   13.505  359.052   18.886  372.134   19.319  679.271   18.165  691.480   18.253 -12.20825 25.75139 
1 1 1    3   38   13 o  120.315   34.988   12.073   6.8298   8.4723   9.2022   16.489   10.191  110.122   40.922  139.268   43.258 -29.14626 59.54729 
1 1 1    3   38   14 o  167.816   28.211   22.989   6.9893   16.574   9.6403   30.098   10.148  139.316   41.844  189.172   36.368 -49.85684 55.43957 
1 1 1    3   38   15 o  481.220   13.898  179.075   10.237  181.644   14.700  176.656   14.264  482.042   19.923  475.539   19.597 6.503021 27.94593 
1 1 1    3   38   16 o  277.431   18.863   60.319   7.9625   77.890   11.852   45.863   10.750  312.805   24.962  237.256   30.293 75.54858 39.25294 
1 1 1    3   38   17 o  415.255   14.768  133.591   9.3866  128.845   13.079  138.633   13.479  404.708   21.188  420.443   20.945 -15.73474 29.79300 
1 1 1    3   38   18 o  494.143   13.808  188.937   10.444  205.267   15.351  174.867   14.249  512.234   19.580  472.725   19.693 39.50891 27.77037 
1 1 1    3   38   19 o  316.253   13.955   77.431   6.7552   70.630   8.3128   90.652   11.591  300.339   18.168  338.427   22.505 -38.08838 28.92309 
1 1 1    3   38   20 o  362.117   13.706  101.506   7.5967  110.130   9.6427   87.396   12.334  376.135   16.749  331.102   24.512 45.03381 29.68743 
1 1 1    3   38   21 o  204.869   20.675   33.286   6.3946   30.406   7.5873   40.347   11.881  193.652   26.276  218.232   36.884 -24.58061 45.28622 
1 1 1    3   38   22 o  230.033   23.780   42.365   8.2519   30.955   11.638   53.900   11.702  187.940   41.561  256.384   30.411 -68.44441 51.49963 
1 1 1    3   38   23 o  143.094   34.482   17.512   7.4634   14.955   11.112   19.614   10.074  132.705   45.440  148.986   42.238 -16.28177 62.03877 
1 1 1    3   38   24 o  234.981   18.494   43.496   6.5981   40.353   8.3871   48.601   10.688  223.705   24.918  243.519   29.260 -19.81451 38.43219 
1 1 1    3   38   25 o  240.543   18.809   45.657   6.8700   45.951   8.5673   45.129   11.499  239.237   23.708  231.986   33.341 7.250488 40.91067 
1 1 1    3   38   26 o  394.508   11.955  120.383   7.2187  130.695   10.460  111.005   9.9749  409.003   16.708  376.658   17.302 32.34512 24.05243 
1 1 1    3   38   27 o  143.632   28.074   17.243   5.9507   15.338   8.2059   19.357   8.6422  132.127   38.330  148.181   37.940 -16.05357 53.93192 
1 1 1    3   38   28 o  176.410   23.604   25.284   6.2139   13.182   8.9030   36.778   8.6768  123.240   40.658  211.303   27.478 -88.06345 49.07243 
1 1 1    3   38   29 o  163.438   28.424   22.371   6.8524   38.164   11.207   12.943   8.6596  209.622   36.241  121.811   40.094 87.81131 54.04570 
1 1 1    3   38   30 o  167.051   25.695   23.078   6.3596   32.207   9.1841   14.668   8.8148  194.307   31.994  127.895   40.313 66.41228 51.46631 
1 1 1    3   38   31 o  168.769   29.221   24.112   7.2750   19.839   9.1572   31.425   11.979  147.331   39.708  183.650   43.316 -36.31883 58.76236 
1 1 1    3   38   32 o  131.829   34.091   15.403   6.9301   24.295   8.6986  -0.0467   11.466  165.499   35.409   91.737   40.763 73.76221 53.99461 
1 1 1    3   38   33 o   63.290   28.777  -2.5529   6.0958  -5.8445   8.6121   0.7521   8.6296   69.907   32.636   82.836   36.133 -12.92922 48.68943 
1 1 1    3   38   34 o  212.821   19.937   36.522   6.4187   36.925   8.9921   36.102   9.1651  208.393   28.975  205.275   30.061 3.118591 41.75132 
1 1 1    3   38   35 o  248.059   18.167   49.271   6.8497   50.030   9.9583   48.590   9.4365  243.543   27.178  240.907   26.004 2.636658 37.61394 
1 1 1    3   38   36 o  112.601   36.035   11.646   7.0224   13.713   13.149   10.822   8.3063  121.250   47.908  109.528   39.151 11.72204 61.87116 
1 1 1    3   38   37 o  288.691   18.040   67.027   7.9317   87.104   14.604   58.627   9.4463  315.613   30.616  265.524   23.485 50.08902 38.58592 
1 1 1    3   38   38 o   69.652   30.902  -0.2570   6.5647  -4.4112   11.712   1.6460   7.9270   81.701   38.114   79.802   34.723 1.898613 51.55937 
1 1 1    3   38   39 o  127.689   33.925   15.345   6.7431   20.850   8.3913   5.3091   11.329  146.635   37.299   96.759   41.805 49.87611 56.02579 
1 1 1    3   39    0 o  671.837   12.581  347.166   12.928  347.166   12.928  347.166   12.928  671.837   12.581  671.837   12.581 0.000000 0.000000 
1 1 1    3   39    1 o  478.732   10.805  176.424   7.9177  174.795   9.7525  179.573   13.561  475.775   13.392  480.318   18.446 -4.542786 22.79464 
1 1 1    3   39    2 o  327.921   12.957   82.990   6.5035   89.803   8.1082   70.700   10.890  340.488   15.558  298.763   24.017 41.72485 28.61579 
1 1 1    3   39    3 o  173.388   21.462   23.872   5.5741   14.289   6.7424   44.564   9.9076  130.557   33.557  235.219   28.073 -104.6617 43.75122 
1 1 1    3   39    4 o  568.576   12.802  249.464   11.141  259.478   16.332  240.748   15.237  577.303   18.482  556.375   17.892 20.92725 25.72368 
1 1 1    3   39    5 o  137.393   31.130   15.708   6.3950   18.343   9.1534   13.195   8.9382  146.451   39.796  126.392   40.675 20.05845 56.90530 
1 1 1    3   39    6 o  158.684   28.602   20.618   6.6915   24.931   10.354   17.524   8.7689  170.429   40.320  143.329   38.953 27.09947 56.06237 
1 1 1    3   39    7 o  344.152   15.437   91.766   8.1317   81.109   11.585  102.116   11.417  320.059   23.819  360.704   20.766 -40.64493 31.60024 
1 1 1    3   39    8 o  323.843   16.727   81.647   8.2629   78.973   11.659   84.347   11.712  315.516   24.329  326.468   23.598 -10.95160 33.89354 
1 1 1    3   39    9 o  390.158   14.955  117.882   8.9311  125.080   12.671  110.774   12.591  399.204   20.809  375.053   22.029 24.15097 30.30323 
1 1 1    3   39   10 o  102.427   35.191   8.0579   6.6660   0.7197   9.2203   16.094   9.6487   88.406   37.951  137.418   41.994 -49.01205 56.60196 
1 1 1    3   39   11 o  268.285   18.925   56.421   7.7218   69.467   11.523   45.787   10.403  294.983   25.780  237.606   29.221 57.37653 38.96745 
1 1 1    3   39   12 o  512.659   13.497  203.170   10.591  198.302   14.938  208.090   15.018  503.818   19.371  516.300   19.003 -12.48175 27.13582 
1 1 1    3   39   13 f  116.016   34.697   11.210   6.6387   12.320   9.3839   10.099   9.3930  123.119   41.760  115.459   41.595 7.660393 58.94142 
1 1 1    3   39   14 o  252.444   20.128   50.203   7.7127   54.597   10.771   45.580   11.049  260.245   27.454  235.726   31.405 24.51863 41.71321 
1 1 1    3   39   15 o  157.594   30.552   20.631   7.1037   24.517   10.199   16.969   9.8998  168.167   40.175  140.123   42.475 28.04395 58.46471 
1 1 1    3   39   16 o  252.475   20.188   50.270   7.7363   53.138   11.283   47.726   10.628  255.553   29.380  242.096   29.275 13.45715 41.47544 
1 1 1    3   39   17 o  163.141   30.819   22.144   7.4138   29.185   10.942   16.169   10.080  183.529   40.076  136.931   43.103 46.59798 58.85504 
1 1 1    3   39   18 o  203.594   25.076   33.403   7.6491   30.183   11.022   36.395   10.624  186.673   39.790  208.257   34.539 -21.58344 52.68995 
1 1 1    3   39   19 o  131.549   36.503   14.846   7.6088   11.153   11.281   17.929   10.306  121.496   45.277  142.945   43.339 -21.44873 62.67642 
1 1 1    3   39   20 o  421.622   16.123  138.376   10.405  141.268   14.897  135.621   14.540  421.674   23.169  413.196   23.081 8.478729 32.70432 
1 1 1    3   39   21 o  364.330   14.052  102.952   7.8364  100.669   9.5465  107.669   13.721  359.011   17.373  366.885   24.576 -7.874542 30.09614 
1 1 1    3   39   22 o  259.156   18.301   52.859   7.2127   54.624   8.7431   49.100   12.762  261.876   22.017  240.774   35.710 21.10262 41.95181 
1 1 1    3   39   23 o  287.765   17.103   64.948   7.4994   64.851   9.2161   65.138   12.902  285.701   21.227  281.007   30.486 4.693268 37.14802 
1 1 1    3   39   24 o  166.624   22.694   22.435   5.6374   18.251   7.9868   26.590   7.9581  144.704   36.161  178.298   30.241 -33.59354 47.13982 
1 1 1    3   39   25 o  134.161   29.344   15.215   5.8580   10.948   8.2221   19.615   8.3482  114.510   39.088  149.499   36.744 -34.98830 53.64701 
1 1 1    3   39   26 o  495.253   14.552  191.054   11.031  185.126   15.256  197.549   15.969  483.265   20.624  498.978   20.909 -15.71283 29.36877 
1 1 1    3   39   27 o  132.218   36.582   15.474   7.6536   28.131   11.011   3.6413   10.646  175.824   41.568   97.793   41.335 78.03167 58.62148 
1 1 1    3   39   28 f  203.920   21.083   33.451   6.4855   37.471   9.0492   29.205   9.2996  211.830   28.644  183.311   34.408 28.51892 44.77058 
1 1 1    3   39   29 o   85.139   34.296   3.8961   6.8694   2.0556   8.5873   7.1669   11.448   86.364   36.837  107.449   43.908 -21.08463 57.31397 
1 1 1    3   39   30 o   84.341   34.284   3.6440   6.9335  -0.0853   8.7893   9.7881   11.282   81.904   36.075  113.306   44.502 -31.40147 57.28682 
1 1 1    3   39   31 o  216.951   20.907   38.012   6.8567   36.532   9.6872   39.498   9.7066  205.963   31.749  215.314   30.290 -9.350906 43.88013 
1 1 1    3   39   32 o  195.732   22.158   31.306   6.5214   31.903   9.0779   30.669   9.3744  191.332   32.137  186.090   34.171 5.241592 46.90902 
1 1 1    3   39   33 o  351.953   13.850   97.078   7.4611   93.072   10.432  101.273   10.675  339.688   20.154  354.746   19.738 -15.05798 28.20985 
1 1 1    3   39   34 o   53.745   25.622  -6.3089   5.8432   0.6783   8.4360 -12.7522   8.1011   80.466   35.394   57.077   27.907 23.38862 45.07319 
1 1 1    3   39   35 o  160.528   26.669   22.126   6.3228   15.007   8.7912   29.754   9.1005  124.259   40.373  180.889   34.120 -56.62968 52.85998 
1 1 1    3   39   36 o   88.338   32.651   6.3129   5.8427   1.3349   8.2205   11.395   8.3059   80.269   35.132  110.276   39.179 -30.00742 52.62376 
1 1 1    3   39   37 o  260.376   19.018   55.120   7.5269   50.071   9.1495   65.693   13.239  243.088   24.944  269.832   32.724 -26.74480 41.14660 
1 1 1    3   40    0 o   55.641   34.838   1.5917   6.1232   1.5917   6.1232   1.5917   6.1232   55.641   34.838   55.641   34.838 0.000000 0.000000 
1 1 1    3   40    1 o  569.282   10.458  249.510   9.1124  245.028   11.207  258.254   15.654  563.233   12.999  575.953   17.758 -12.71942 22.00712 
1 1 1    3   40    2 o  279.088   14.309   60.433   6.0919   65.757   7.7479   51.811   9.8592  290.185   17.526  254.484   25.662 35.70129 31.07523 
1 1 1    3   40    3 o   66.476   28.184   0.5025   4.9739   0.9557   6.1926  -0.3213   8.3496   74.761   31.558   82.015   35.661 -7.253983 47.61998 
1 1 1    3   40    4 o  288.791   18.091   65.224   7.9564   59.566   11.216   70.954   11.288  272.237   27.285  298.457   24.938 -26.22009 36.96461 
1 1 1    3   40    5 o  262.588   19.319   54.139   7.7101   58.437   11.236   50.314   10.599  269.422   27.637  249.541   28.248 19.88127 39.51930 
1 1 1    3   40    6 o  195.932   23.692   30.700   6.9609   23.764   10.006   37.204   9.6901  165.946   39.887  213.141   30.578 -47.19496 50.25934 
1 1 1    3   40    7 f  431.666   14.348  144.270   9.4798  143.056   13.624  145.409   13.199  427.120   20.840  431.025   20.006 -3.904816 28.88830 
1 1 1    3   40    8 f  120.197   34.879   12.131   6.7938   13.515   9.6261   10.757   9.5897  127.572   42.286  117.970   42.078 9.602531 59.65466 
1 1 1    3   40    9 o  148.540   31.603   18.452   6.9645   22.390   10.397   15.247   9.3797  160.135   41.926  133.699   41.496 26.43629 58.98908 
1 1 1    3   40   10 o  305.711   17.779   73.083   8.2833   70.079   11.728   76.074   11.701  295.699   26.182  308.787   24.970 -13.08832 36.18076 
1 1 1    3   40   11 o  513.828   13.785  204.338   10.842  208.937   15.472  199.902   15.197  516.661   19.565  505.319   19.648 11.34192 27.72768 
1 1 1    3   40   12 o  158.768   30.835   20.985   7.2234   27.011   10.464   15.501   9.9833  176.712   39.662  134.603   42.953 42.10915 58.46391 
1 1 1    3   40   13 o  204.782   24.780   33.725   7.6092   35.585   10.752   31.858   10.770  205.571   35.452  193.107   37.791 12.46356 51.81649 
1 1 1    3   40   14 o  146.153   33.879   18.135   7.4312   17.073   10.505   19.200   10.514  140.102   43.985  147.729   43.540 -7.626709 61.89064 
1 1 1    3   40   15 o  134.537   36.263   15.530   7.6368   9.7033   10.537   21.976   11.084  115.836   43.642  157.223   44.210 -41.38728 62.12215 
1 1 1    3   40   16 o  283.436   19.820   63.332   8.5447   64.309   12.573   62.493   11.648  280.649   29.721  277.713   27.775 2.936249 40.67884 
1 1 1    3   40   17 o  226.887   23.686   41.260   8.1045   43.049   11.670   39.595   11.264  226.199   34.824  216.574   35.187 9.624619 49.50541 
1 1 1    3   40   18 o  115.934   37.340   11.252   7.5313   17.807   11.090   5.6432   10.260  141.873   45.272  103.256   41.801 38.61708 61.61872 
1 1 1    3   40   19 o  242.012   23.401   46.944   8.5603   41.307   12.343   52.168   11.882  218.980   38.215  250.765   31.663 -31.78508 49.62800 
1 1 1    3   40   20 o  198.730   30.206   32.812   8.8988   33.468   13.368   32.291   11.925  191.464   46.156  190.551   42.015 0.9137115 62.41528 
1 1 1    3   40   21 o  237.951   19.183   44.809   6.9273   43.921   8.3149   46.823   12.525  233.633   23.574  234.073   36.120 -0.4402008 43.13205 
1 1 1    3   40   22 o  323.275   16.126   81.634   7.9792   90.664   9.6823   62.521   14.087  339.018   18.731  271.581   34.679 67.43701 39.41475 
1 1 1    3   40   23 o   90.386   36.603   4.1711   7.8695   1.3788   9.8095   9.2130   13.181   90.283   38.954  117.756   47.482 -27.47352 61.41612 
1 1 1    3   40   24 o  174.166   33.376   26.088   8.5736   30.296   10.744   18.710   14.227  184.377   39.272  142.453   51.205 41.92424 64.53067 
1 1 1    3   40   25 o   67.275   29.771  -1.0139   6.0558   4.0033   8.5184  -6.1404   8.6106   91.611   37.706   70.066   32.684 21.54485 49.90011 
1 1 1    3   40   26 o  214.847   21.943   37.262   7.1147   42.927   8.9266   27.397   11.780  228.453   25.991  170.636   44.604 57.81773 51.62403 
1 1 1    3   40   27 o  117.874   34.702   12.229   6.6820   14.478   8.3584   8.2464   11.123  126.711   39.146  109.327   43.781 17.38387 58.72975 
1 1 1    3   40   28 o  164.015   30.081   23.023   7.2735   25.827   9.0742   17.986   12.165  170.340   35.934  137.501   47.522 32.83908 59.57807 
1 1 1    3   40   29 o  397.254   14.977  123.740   9.1070  117.448   11.080  136.844   15.990  384.356   18.833  407.676   25.758 -23.31992 31.90837 
1 1 1    3   40   30 o  282.993   16.358   63.412   7.0554   70.391   9.9809   56.441   9.9749  294.050   22.343  260.964   25.290 33.08575 33.74567 
1 1 1    3   40   31 o   81.347   32.900   3.7247   6.3492   1.2518   9.2179   5.9572   8.7581   85.039   37.212   95.392   38.620 -10.35291 53.63015 
1 1 1    3   40   32 o   81.931   32.685   4.1809   6.1747   6.3809   8.7882   2.0361   8.6774   96.077   38.760   84.458   36.538 11.61885 53.26699 
1 1 1    3   40   33 o  100.998   33.465   9.0834   6.0292   6.6064   8.5887   11.490   8.4659   95.701   38.419  111.439   39.558 -15.73804 55.14453 
1 1 1    3   40   34 o  127.385   35.294   15.278   7.1189   17.208   8.8862   11.821   11.894  131.899   40.300  113.810   45.377 18.08852 60.68859 
1 1 1    3   41    0 o  195.817   23.657   31.059   6.8158   31.059   6.8158   31.059   6.8158  195.817   23.657  195.817   23.657 0.000000 0.000000 
1 1 1    3   41    1 o   82.344   30.939   4.3217   5.2888   8.8768   6.4729  -4.8263   9.1732  105.219   34.666   76.433   34.963 28.78658 49.23574 
1 1 1    3   41    2 o  307.708   13.679   73.273   6.4424   63.605   7.7568   94.775   11.567  285.053   17.868  346.329   21.935 -61.27576 28.29151 
1 1 1    3   41    3 o  460.483   11.254  163.513   7.9320  168.882   9.8986  153.880   13.259  467.079   13.846  443.362   19.538 23.71732 23.94664 
1 1 1    3   41    4 o  119.032   29.876   11.850   5.4348   9.2163   6.6460   17.167   9.4423  106.925   35.121  140.753   41.199 -33.82888 54.13726 
1 1 1    3   41    5 o  225.208   21.258   40.200   7.2411   47.613   10.781   34.108   9.7738  241.494   29.799  202.615   32.623 38.87901 44.18398 
1 1 1    3   41    6 o  422.615   14.786  138.512   9.5648  141.927   13.782  135.339   13.285  424.853   21.194  414.488   21.008 10.36517 29.84190 
1 1 1    3   41    7 o  327.424   17.274   83.771   8.6267   97.786   12.827   72.196   11.657  350.532   24.052  300.182   25.615 50.34988 35.13784 
1 1 1    3   41    8 o  198.042   24.608   31.561   7.2987   31.284   10.498   31.821   10.155  191.551   37.146  194.047   35.497 -2.496292 51.37949 
1 1 1    3   41    9 o  322.895   17.363   81.523   8.5497   66.455   12.078   96.657   12.105  286.611   27.884  349.072   22.780 -62.46072 36.00633 
1 1 1    3   41   10 o  264.797   20.295   55.363   8.1632  102.963   12.580   20.743   10.729  360.153   22.940  153.054   43.657 207.0988 49.31742 
1 1 1    3   41   11 o  330.792   17.534   85.636   8.8462   87.594   12.555   83.707   12.466  330.859   24.976  323.153   25.408 7.706238 35.62807 
1 1 1    3   41   12 o  557.372   14.242  240.945   12.150  231.337   17.107  250.725   17.259  542.231   20.612  564.978   19.958 -22.74695 28.69104 
1 1 1    3   41   13 o  447.745   15.251  155.840   10.452  161.973   15.042  150.115   14.534  452.892   21.699  435.948   21.781 16.94482 30.74468 
1 1 1    3   41   14 o  300.697   19.517   71.293   8.9341   63.114   12.429   80.036   12.851  277.538   29.720  314.609   26.947 -37.07181 40.11753 
1 1 1    3   41   15 o   82.297   34.641   1.7464   7.4272   13.590   10.859  -8.6634   10.181  127.524   44.852   74.428   34.982 53.09564 56.88152 
1 1 1    3   41   16 o  297.759   20.355   70.192   9.2212   63.293   13.036   77.100   13.045  276.474   31.360  307.690   28.006 -31.21533 42.04507 
1 1 1    3   41   17 o  158.157   35.946   21.686   8.5044   24.141   12.378   19.491   11.704  161.751   47.121  146.613   46.479 15.13828 66.18664 
1 1 1    3   41   18 o  188.386   32.196   29.960   8.9501   38.559   12.621   21.261   12.694  208.756   40.962  151.657   48.439 57.09875 63.43671 
1 1 1    3   41   19 o  303.520   29.274   75.895   13.431   0.0000   0.0000   75.895   13.431  ?   ?   303.520   29.274 0.000000 29.27421 
1 1 1    3   41   20 o  323.125   29.524   86.267   14.441   0.0000   0.0000   86.267   14.441  ?   ?   323.125   29.524 0.000000 29.52440 
1 1 1    3   41   21 o  118.867   46.994   10.325   12.658   0.0000   0.0000   10.325   12.658  ?   ?   118.867   46.994 0.000000 46.99404 
1 1 1    3   41   22 o  123.551   35.271   13.402   7.0000   10.764   8.2043   20.461   13.421  112.960   39.027  146.790   49.941 -33.82986 63.38134 
1 1 1    3   41   23 o  135.751   34.068   16.182   7.0677   14.307   8.3243   21.025   13.377  126.507   39.064  147.949   49.862 -21.44281 63.34170 
1 1 1    3   41   24 o  346.122   19.390   95.282   10.231   95.282   10.231   0.0000   0.0000  346.122   19.390  ?   ?  0.000000 19.38969 
1 1 1    3   41   25 o  256.612   24.417   53.812   9.4747   53.812   9.4747   0.0000   0.0000  256.612   24.417  ?   ?  0.000000 24.41667 
1 1 1    3   41   26 o  233.271   19.285   43.547   6.8241   35.725   9.4869   51.933   9.8234  204.020   31.385  250.608   25.987 -46.58836 40.74752 
1 1 1    3   41   27 o  272.196   16.699   58.695   6.9238   62.252   9.9296   55.329   9.6596  275.676   23.764  259.159   24.648 16.51666 34.23857 
1 1 1    3   41   28 o   89.082   33.244   6.0007   6.0857   6.4604   8.7139   5.5631   8.5029   97.105   38.799   93.971   38.050 3.134315 54.34279 
1 1 1    3   41   29 o   55.438   26.340  -6.1762   6.0697  -3.4941   8.6411  -8.7884   8.5277   73.197   33.649   64.297   30.736 8.899361 45.57356 
1 1 1    3   41   30 o   81.000   34.009   2.8400   7.1299  -0.4640   9.1487   7.9509   11.379   80.641   36.082  105.265   43.479 -24.62336 56.50084 
1 1 1    3   41   31 o   55.267   26.706  -8.9189   6.8493 -21.6871   8.4121   16.197   11.798   50.033   25.113  126.589   46.463 -76.55627 52.81507 
1 1 1    3   41   32 f   81.989   35.999   1.3110   8.6919   1.3110   8.6919   0.0000   0.0000   81.989   35.999  ?   ?  0.000000 35.99896 
1 1 1    3   42    0 o  294.031   17.627   67.540   7.8677   67.540   7.8677   67.540   7.8677  294.031   17.627  294.031   17.627 0.000000 0.000000 
1 1 1    3   42    1 o  263.300   13.157   53.661   5.3025   63.446   7.6085   44.421   7.3939  284.548   17.555  236.816   20.604 47.73158 27.06812 
1 1 1    3   42    2 f  533.290   10.865  219.349   8.8687  221.963   10.860  214.114   15.367  535.451   13.250  522.612   19.211 12.83978 23.33732 
1 1 1    3   42    3 o  155.072   23.909   19.488   5.4927   23.050   6.7085   12.244   9.5669  167.720   27.052  122.086   42.146 45.63447 50.08075 
1 1 1    3   42    4 o  458.372   11.517  162.216   8.0800  160.805   9.8721  165.079   14.063  455.354   14.164  458.345   20.046 -2.991272 24.54515 
1 1 1    3   42    5 o  215.271   22.581   37.034   7.3297   29.524   10.352   44.583   10.379  185.067   37.823  232.984   29.787 -47.91719 48.14407 
1 1 1    3   42    6 o  289.713   18.396   65.951   8.1151   57.778   11.783   73.326   11.193  265.733   29.466  302.652   24.367 -36.91849 38.23619 
1 1 1    3   42    7 o  183.793   27.547   27.688   7.5108   28.875   10.851   26.597   10.407  181.624   40.103  174.264   39.879 7.360596 56.55596 
1 1 1    3   42    8 o   63.115   29.232  -4.7938   6.6987  -2.9571   9.7666  -6.4253   9.2050   82.072   36.956   73.385   34.085 8.686623 50.27485 
1 1 1    3   42    9 o   93.945   36.169   5.6081   7.3365  -7.4380   10.431   18.381   10.321   77.389   36.058  143.828   43.318 -66.43913 56.36138 
1 1 1    3   42   10 o   94.805   36.718   5.6390   7.5959   15.971   10.925  -4.0291   10.568  135.266   45.059   83.419   37.914 51.84734 58.88834 
1 1 1    3   42   11 o   99.587   36.675   7.2253   7.3599   0.4137   10.256   14.456   10.567   90.559   39.449  129.815   44.314 -39.25604 59.32943 
1 1 1    3   42   12 o  162.789   33.165   22.579   7.9831   19.190   10.935   26.447   11.681  145.891   44.728  170.648   44.323 -24.75719 62.96918 
1 1 1    3   42   13 o   76.728   33.390  -0.0921   7.3323   4.5232   10.776  -4.0705   10.005  101.339   42.123   80.668   36.751 20.67146 55.90135 
1 1 1    3   42   14 o  213.798   27.222   37.490   8.7062   35.623   12.469   39.265   12.161  199.571   42.142  211.973   38.917 -12.40196 57.36277 
1 1 1    3   42   15 o  391.096   24.831  123.292   14.787   0.0000   0.0000  123.292   14.787  ?   ?   391.096   24.831 0.000000 24.83116 
1 1 1    3   42   16 o  149.004   47.379   20.649   12.155   0.0000   0.0000   20.649   12.155  ?   ?   149.004   47.379 0.000000 47.37915 
1 1 1    3   42   17 o  302.781   32.122   77.006   14.659   0.0000   0.0000   77.006   14.659  ?   ?   302.781   32.122 0.000000 32.12186 
1 1 1    3   42   18 o  250.878   24.899   51.218   9.4351   54.907   13.352   47.538   13.334  252.493   35.532  232.228   38.888 20.26445 52.67648 
1 1 1    3   42   19 o  419.688   17.506  138.557   11.245  123.574   15.523  155.103   16.312  389.137   26.215  437.879   24.436 -48.74225 35.83783 
1 1 1    3   42   20 o  217.510   29.458   39.664   9.5551   73.006   14.065   11.087   13.021  294.066   31.752  120.496   47.655 173.5701 57.26414 
1 1 1    3   42   21 o  459.931   24.614  171.762   17.265  171.762   17.265   0.0000   0.0000  459.931   24.614  ?   ?  0.000000 24.61381 
1 1 1    3   42   23 o  398.271   15.128  124.339   9.2222  118.177   10.959  139.292   17.071  385.982   18.550  409.961   27.362 -23.97940 33.05685 
1 1 1    3   42   24 o  128.960   35.297   15.016   7.1704   15.087   8.6742   14.861   12.742  127.649   39.952  127.261   47.982 0.3878784 62.43771 
1 1 1    3   42   25 o  397.005   15.088  123.889   9.1685  124.005   11.327  123.668   15.613  394.358   18.766  385.366   26.633 8.992615 32.58015 
1 1 1    3   42   26 o  132.629   36.003   16.206   7.4961   17.657   9.1210   13.186   13.158  135.835   40.680  121.425   47.942 14.41010 62.87518 
1 1 1    3   42   27 o  232.467   19.143   43.603   6.7508   41.001   9.5540   46.197   9.5401  218.115   29.363  233.448   27.209 -15.33342 40.03193 
1 1 1    3   42   28 o   88.006   33.504   5.8337   6.2509   13.665   9.2133  -0.8461   8.5089  119.604   41.355   77.289   34.674 42.31506 53.96805 
1 1 1    3   42   29 o  105.959   36.955   10.168   7.3644   15.426   9.2173   0.8858   12.246  125.328   41.371   92.266   41.480 33.06223 58.58391 
1 1 1    3   43    0 o   62.734   37.959   3.3527   6.7117   3.3527   6.7117   3.3527   6.7117   62.734   37.959   62.734   37.959 0.000000 0.000000 
1 1 1    3   43    1 o  183.453   18.321   26.641   5.0756   23.132   6.9750   30.591   7.3997  167.034   28.292  193.844   25.563 -26.81056 38.13011 
1 1 1    3   43    2 o  180.573   22.089   26.201   5.9779   24.688   7.1598   29.684   10.862  172.779   28.034  183.591   39.801 -10.81226 48.68257 
1 1 1    3   43    3 o   58.356   27.032  -4.1776   5.7320  -3.9327   6.8952  -4.7256   10.313   65.779   30.172   80.930   37.040 -15.15139 47.77315 
1 1 1    3   43    4 o  304.789   14.675   72.253   6.8462   77.715   8.4601   61.891   11.653  314.521   17.645  275.128   28.065 39.39319 33.15119 
1 1 1    3   43    5 o  138.372   36.093   16.680   7.7242   29.025   11.372   6.1062   10.525  180.017   42.034  104.552   42.333 75.46482 59.65665 
1 1 1    3   43    6 o  246.128   22.425   48.503   8.3554   50.512   11.843   46.512   11.789  245.662   32.278  234.671   33.796 10.99179 46.73416 
1 1 1    3   43    7 o  275.986   20.689   60.539   8.6761   51.001   12.491   69.429   12.060  245.522   34.165  291.768   27.322 -46.24623 43.74640 
1 1 1    3   43    8 o  144.912   35.591   18.305   7.8370   13.440   11.644   22.334   10.597  126.864   46.219  156.868   42.898 -30.00403 63.05892 
1 1 1    3   43    9 o  189.521   41.614   32.206   11.741   0.0000   0.0000   32.206   11.741  ?   ?   189.521   41.614 0.000000 41.61354 
1 1 1    3   43   10 o  269.270   28.946   59.839   11.743   0.0000   0.0000   59.839   11.743  ?   ?   269.270   28.946 0.000000 28.94571 
1 1 1    3   43   11 o  306.180   28.059   76.996   13.004   0.0000   0.0000   76.996   13.004  ?   ?   306.180   28.059 0.000000 28.05927 
1 1 1    3   43   12 o  326.515   27.447   87.330   13.590   0.0000   0.0000   87.330   13.590  ?   ?   326.515   27.447 0.000000 27.44744 
1 1 1    3   43   13 o  397.881   17.196  124.279   10.473  127.527   14.709  120.939   14.915  397.485   24.293  386.142   25.376 11.34244 35.12962 
1 1 1    3   43   14 o  170.118   33.459   24.976   8.4020   25.741   11.692   24.160   12.083  165.945   44.928  159.884   46.549 6.060959 64.69357 
1 1 1    3   43   15 o  338.511   18.930   90.806   9.7688   85.401   14.022   95.904   13.618  321.135   28.833  342.683   26.160 -21.54819 38.93184 
1 1 1    3   43   16 o  173.131   33.396   25.931   8.5291   29.364   11.841   22.230   12.296  177.619   43.824  152.541   47.538 25.07748 64.65620 
1 1 1    3   43   17 o  206.608   40.260   38.512   12.274   38.512   12.274   0.0000   0.0000  206.608   40.260  ?   ?  0.000000 40.25954 
1 1 1    3   43   18 o  121.390   45.516   12.508   11.434   12.508   11.434   0.0000   0.0000  121.390   45.516  ?   ?  0.000000 45.51559 
1 1 1    3   43   19 o  383.104   28.370  122.162   16.518  122.162   16.518   0.0000   0.0000  383.104   28.370  ?   ?  0.000000 28.37033 
1 1 1    3   43   20 o  298.755   22.037   72.233   10.006   71.330   14.682   73.015   13.672  286.428   34.163  292.878   30.969 -6.449951 46.11090 
1 1 1    3   43   21 o  252.905   25.826   53.079   9.8572   43.802   14.073   62.013   13.811  214.212   44.381  265.592   34.811 -51.38065 56.40505 
1 1 1    3   43   22 o  285.174   22.973   66.505   9.9425   58.982   14.684   72.874   13.511  254.081   39.004  291.469   30.748 -37.38808 49.66668 
1 1 1    3   43   23 o  168.009   36.896   25.931   9.2284   30.776   13.342   21.487   12.778  172.916   48.464  144.459   48.732 28.45711 68.72811 
1 1 1    3   43   24 o  112.643   35.744   11.557   6.9210   8.3704   8.4110   18.240   12.179  101.703   38.830  134.258   47.470 -32.55420 61.32820 
1 1 1    3   43   25 o  275.496   19.300   61.277   8.0870   60.135   9.8881   63.585   14.054  268.900   24.287  265.250   35.507 3.650360 43.01807 
1 1 1    3   43   26 o   77.474   33.526   1.3745   7.3092   11.020   9.1036 -16.1220   12.261  110.284   40.757   70.790   34.552 39.49380 53.43243 
1 1 1    3   43   27 o   56.866   27.454  -9.0586   7.1985  -6.6000   8.7996 -14.0327   12.516   68.084   32.160   73.497   35.654 -5.413406 48.01568 
1 1 1    3   44    0 o  194.434   39.316   33.731   10.364   33.731   10.364   33.731   10.364  194.434   39.316  194.434   39.316 0.000000 0.000000 
1 1 1    3   44    1 o  290.865   19.431   67.097   8.6009   71.575   12.200   62.672   12.128  295.573   27.273  275.102   29.250 20.47110 39.99274 
1 1 1    3   44    2 o  256.084   21.241   52.435   8.2505   48.093   11.256   57.477   12.129  239.220   31.507  262.273   30.799 -23.05345 44.06025 
1 1 1    3   44    3 o  467.008   15.000  170.133   10.723  170.726   14.937  169.503   15.401  463.587   21.051  461.302   21.812 2.285217 30.31356 
1 1 1    3   44    4 f  159.102   32.533   21.736   7.6554   20.640   10.895   22.804   10.759  149.458   44.393  157.415   43.299 -7.957062 62.01220 
1 1 1    3   44    5 o  110.172   32.896   10.392   5.9711   17.353   7.4364  -2.2409   10.018  140.835   34.718   83.415   37.507 57.41991 51.10891 
1 1 1    3   44    6 o   70.402   32.088  -3.3863   7.6378  -0.5859   11.265  -5.7693   10.391   91.197   40.469   78.853   36.480 12.34415 54.48429 
1 1 1    3   44    7 o  225.049   23.861   41.089   8.0940   44.347   11.552   37.948   11.344  227.491   34.237  208.391   36.917 19.09978 50.34877 
1 1 1    3   44    8 o  330.841   17.267   86.213   8.7134   81.194   12.459   91.019   12.191  315.422   26.038  335.695   23.882 -20.27277 35.33166 
1 1 1    3   44    9 o  280.902   19.638   62.763   8.3903   65.749   11.861   59.773   11.870  282.324   27.809  267.948   29.427 14.37561 40.48824 
1 1 1    3   44   10 o  472.395   14.673  174.161   10.610  178.632   15.085  169.785   14.925  473.806   20.801  461.650   21.122 12.15588 29.64450 
1 1 1    3   44   11 o  203.943   25.904   34.257   7.9037   30.522   10.854   38.475   11.532  183.993   39.705  208.850   37.451 -24.85718 54.58054 
1 1 1    3   44   12 o  122.385   36.947   13.291   7.5019   9.6469   10.024   17.929   11.310  111.376   42.422  138.542   45.832 -27.16576 62.45159 
1 1 1    3   44   13 o   69.969   33.293  -9.6186   9.7655  -9.6186   9.7655   0.0000   0.0000   69.969   33.293  ?   ?  0.000000 33.29266 
1 1 1    3   44   14 o  258.778   31.128   56.846   12.082   56.846   12.082   0.0000   0.0000  258.778   31.128  ?   ?  0.000000 31.12773 
1 1 1    3   44   15 o   75.949   35.922  -8.9467   11.042  -8.9467   11.042   0.0000   0.0000   75.949   35.922  ?   ?  0.000000 35.92151 
1 1 1    3   44   16 o  235.924   25.373   45.999   9.0185   58.804   12.845   33.552   12.665  260.854   32.904  186.916   44.841 73.93867 55.61863 
1 1 1    3   44   17 o  278.578   22.791   63.236   9.6330   69.796   14.268   57.740   13.059  283.188   33.570  256.934   34.044 26.25455 47.81099 
1 1 1    3   44   18 o   71.883   32.912  -3.2782   8.1540 -12.6680   11.578   5.9632   11.486   72.899   35.099  102.666   43.139 -29.76669 55.61370 
1 1 1    3   44   19 o   51.867   25.795 -17.6514   8.0089 -18.3055   11.689 -17.0726   10.995   67.445   33.090   65.838   32.259 1.607727 46.21254 
1 1 1    3   44   20 o  142.163   37.609   18.877   8.3101   23.087   12.813   15.821   10.918  149.079   48.756  127.753   44.969 21.32511 66.32748 
1 1 1    3   44   21 o   81.664   35.551   1.3178   8.3173   3.9858   11.610  -1.4955   11.921   97.511   42.224   88.434   40.222 9.077446 58.31586 
1 1 1    3   44   22 f  121.792   40.359   14.153   8.7689   27.764   12.985   2.7416   11.889  162.085   48.537   95.383   41.986 66.70185 64.17702 
1 1 1    3   44   23 o  239.275   26.003   48.349   9.3700   42.794   13.333   53.768   13.170  208.987   43.113  241.992   36.710 -33.00478 56.62468 
1 1 1    3   45    0 o  201.268   28.148   33.830   8.1858   33.830   8.1858   33.830   8.1858  201.268   28.148  201.268   28.148 0.000000 0.000000 
1 1 1    3   45    1 o  236.610   16.155   44.115   5.8158   44.859   8.2991   43.398   8.1524  234.989   23.384  231.111   23.367 3.878708 33.05801 
1 1 1    3   45    2 o   96.305   31.593   7.6979   5.3784   7.6905   7.6336   7.7053   7.5791  100.306   37.272  100.241   37.160 0.6418610E-01 52.63152 
1 1 1    3   45    3 o  210.859   20.781   35.758   6.6197   32.291   8.1398   42.531   11.376  196.611   27.825  221.318   34.724 -24.70728 44.49700 
1 1 1    3   45    4 o  173.277   24.817   24.766   6.3941   21.643   7.8679   30.842   10.973  157.218   33.707  184.117   40.075 -26.89937 52.36584 
1 1 1    3   45    5 o  242.301   18.293   46.667   6.7342   39.752   8.2897   60.084   11.548  219.965   25.070  268.345   28.553 -48.38002 37.99698 
1 1 1    3   45    6 o  260.008   21.092   54.369   8.3219   35.726   11.479   75.020   12.082  199.012   39.079  301.699   26.430 -102.6873 47.17730 
1 1 1    3   45    7 o  118.070   43.715   11.887   10.482   11.887   10.482   0.0000   0.0000  118.070   43.715  ?   ?  0.000000 43.71458 
1 1 1    3   45    8 o  104.779   41.819   7.5735   10.112   7.5735   10.112   0.0000   0.0000  104.779   41.819  ?   ?  0.000000 41.81904 
1 1 1    3   45    9 o   95.075   40.639   3.3063   10.492   3.3063   10.492   0.0000   0.0000   95.075   40.639  ?   ?  0.000000 40.63928 
1 1 1    3   45   10 o  111.895   44.019   9.6939   11.055   9.6939   11.055   0.0000   0.0000  111.895   44.019  ?   ?  0.000000 44.01926 
1 1 1    3   45   11 o  291.053   20.883   68.284   9.2414   59.378   12.778   78.050   13.381  262.177   32.542  304.293   29.084 -42.11639 43.64485 
1 1 1    3   45   12 o  120.118   38.411   13.149   7.9804   18.983   11.091   6.8836   11.492  139.623   45.346  105.130   43.582 34.49361 62.89382 
1 1 1    3   45   13 o  147.268   37.062   19.920   8.3476   34.108   11.751   5.4681   11.860  190.335   41.505  102.512   43.495 87.82294 60.12095 
1 1 1    3   45   14 o  187.016   30.662   30.293   8.4728   13.722   11.724   48.413   12.259  122.440   46.053  233.002   35.495 -110.5615 58.14452 
1 1 1    3   45   15 o  170.104   33.105   25.699   8.3093   10.117   11.368   43.576   12.176  111.928   44.444  218.498   37.775 -106.5701 58.32860 
1 1 1    3   45   16 f  326.747   19.540   85.928   9.7276   85.900   13.775   85.956   13.739  318.010   28.605  318.220   28.509 -0.2103577 40.38616 
1 1 1    3   45   17 o  127.328   38.953   15.343   8.2991   18.776   12.616   12.724   11.019  135.611   48.274  117.929   44.582 17.68153 65.71135 
1 1 1    3   45   18 o  263.411   23.194   57.260   9.2559   54.004   12.777   60.855   13.427  244.974   35.077  260.823   34.477 -15.84909 49.18402 
1 1 1    3   45   19 o  313.432   19.814   79.488   9.4569   68.253   13.164   91.471   13.595  279.403   31.320  328.581   27.278 -49.17783 41.53296 
1 1 1    3   46    0 o   75.103   46.896   4.7472   11.021   4.7472   11.021   4.7472   11.021   75.103   46.896   75.103   46.896 0.000000 0.000000 
1 1 1    3   46    1 o   67.544   31.372  -4.7677   7.7972  -2.1044   10.834  -7.6290   11.230   84.916   38.515   77.901   36.654 7.015625 53.16930 
1 1 1    3   46    2 o   80.569   34.425   1.7843   7.5231  -0.2426   10.676   3.7835   10.603   87.706   39.129   95.720   40.883 -8.013161 56.59036 
1 1 1    3   46    3 o   86.371   38.755  -0.8622   10.635  -0.8622   10.635   0.0000   0.0000   86.371   38.755  ?   ?  0.000000 38.75510 
1 1 1    3   46    4 o  365.516   17.936  106.104   10.035  107.010   14.714  105.316   13.720  358.131   27.042  357.144   25.261 0.9875183 37.00565 
1 1 1    3   46    5 o  318.410   19.233   81.236   9.3296   68.262   13.582   92.826   12.837  280.805   32.181  335.171   25.208 -54.36633 40.87853 
1 1 1    3   46    6 o  399.758   16.802  126.425   10.281  116.327   14.973  135.433   14.141  374.005   26.323  407.740   22.749 -33.73560 34.79134 
1 1 1    3   46    7 o   63.332   29.753  -5.7962   7.3492 -18.1738   10.921   4.4489   9.9356   64.554   31.735   94.998   40.030 -30.44420 51.08362 
1 1 1    3   46    8 o   71.833   32.223  -1.3906   7.3466   7.2290   10.696  -9.0888   10.108  103.510   42.387   71.124   33.850 32.38573 54.24451 
1 1 1    3   46    9 o  148.561   35.439   20.135   7.9458   15.426   11.634   24.254   10.878  126.849   46.201  157.167   43.659 -30.31759 63.56625 
1 1 1    3   46   10 o  301.439   19.819   73.250   9.0932   63.189   12.732   83.725   12.992  269.907   31.405  315.551   27.164 -45.64328 41.52246 
1 1 1    3   46   11 o   62.943   29.632  -5.9172   7.3565 -22.2772   10.211   11.736   10.607   57.866   28.835  114.997   43.677 -57.13139 52.33690 
1 1 1    3   46   12 o   93.196   36.739   6.1695   7.7156   1.3694   10.278   12.367   11.679   88.532   39.001  117.457   45.518 -28.92532 59.94131 
1 1 1    3   46   13 o  194.075   28.721   32.415   8.2740   18.371   10.700   53.298   13.048  135.596   44.566  242.300   36.301 -106.7043 57.47905 
1 1 1    3   46   14 o   99.199   37.712   7.9549   7.9127   4.5091   11.047   11.586   11.339   96.920   41.571  114.554   44.723 -17.63400 61.06004 
1 1 1    3   47    0 o   64.126   39.185   3.7625   7.3070   3.7625   7.3070   3.7625   7.3070   64.126   39.185   64.126   39.185 0.000000 0.000000 
1 1 1    3   47    1 o  123.383   28.285   13.282   5.2275   11.996   7.4590   14.522   7.3284  114.347   37.191  125.207   36.194 -10.86000 51.89580 
1 1 1    3   47    2 o  138.338   26.154   16.345   5.3351   12.983   7.5263   19.739   7.5637  118.390   37.241  147.415   34.186 -29.02522 50.55256 
1 1 1    3   47    3 o  363.744   13.829  103.790   7.6996  109.260   9.6677   94.304   12.732  370.876   17.030  336.982   24.860 33.89423 30.13416 
1 1 1    3   47    4 o   74.871   31.349   2.1727   6.0315   2.5951   7.2831   1.2508   10.761   81.101   34.229   89.739   39.700 -8.637070 52.41890 
1 1 1    4    0    1 o  163.711   7.4035   20.640   1.8465   20.640   1.8465   20.640   1.8465  163.711   7.4035  163.711   7.4035 0.000000 0.000000 
1 1 1    4    0    2 o  1258.43   11.749  1212.68   22.626  1212.68   22.626  1212.68   22.626  1258.43   11.749  1258.43   11.749 0.000000 0.000000 
1 1 1    4    0    3 o  310.985   5.6817   74.094   2.7025   74.094   2.7025   74.094   2.7025  310.985   5.6817  310.985   5.6817 0.000000 0.000000 
1 1 1    4    0    5 o  1244.20   8.2654  1185.08   15.739  1185.08   15.739  1185.08   15.739  1244.20   8.2654  1244.20   8.2654 0.000000 0.000000 
1 1 1    4    0    6 o  190.431   4.3288   27.798   1.2603   27.798   1.2603   27.798   1.2603  190.431   4.3288  190.431   4.3288 0.000000 0.000000 
1 1 1    4    0    7 o  238.611   4.3352   43.619   1.5821   43.619   1.5821   43.619   1.5821  238.611   4.3352  238.611   4.3352 0.000000 0.000000 
1 1 1    4    0    8 o  1144.99   9.0030  1003.70   15.776  1003.70   15.776  1003.70   15.776  1144.99   9.0030  1144.99   9.0030 0.000000 0.000000 
1 1 1    4    0    9 o  934.837   6.7528  668.998   9.6614  668.998   9.6614  668.998   9.6614  934.837   6.7528  934.837   6.7528 0.000000 0.000000 
1 1 1    4    0   10 o  960.234   6.9132  705.845   10.160  705.845   10.160  705.845   10.160  960.234   6.9132  960.234   6.9132 0.000000 0.000000 
1 1 1    4    0   11 f  814.331   7.2338  507.690   9.0149  507.690   9.0149  507.690   9.0149  814.331   7.2338  814.331   7.2338 0.000000 0.000000 
1 1 1    4    0   12 o  357.883   4.8814   98.082   2.6728   98.082   2.6728   98.082   2.6728  357.883   4.8814  357.883   4.8814 0.000000 0.000000 
1 1 1    4    0   13 o  316.376   5.0804   76.668   2.4588   76.668   2.4588   76.668   2.4588  316.376   5.0804  316.376   5.0804 0.000000 0.000000 
1 1 1    4    0   14 o  756.021   7.0764  437.607   8.1871  437.607   8.1871  437.607   8.1871  756.021   7.0764  756.021   7.0764 0.000000 0.000000 
1 1 1    4    0   15 o  890.471   6.7793  607.041   9.2388  607.041   9.2388  607.041   9.2388  890.471   6.7793  890.471   6.7793 0.000000 0.000000 
1 1 1    4    0   16 o  572.508   5.5908  250.943   4.8982  250.943   4.8982  250.943   4.8982  572.508   5.5908  572.508   5.5908 0.000000 0.000000 
1 1 1    4    0   17 o  315.918   6.4665   76.490   3.1240   76.490   3.1240   76.490   3.1240  315.918   6.4665  315.918   6.4665 0.000000 0.000000 
1 1 1    4    0   18 o  105.816   11.148   8.8557   1.7597   8.8557   1.7597   8.8557   1.7597  105.816   11.148  105.816   11.148 0.000000 0.000000 
1 1 1    4    0   19 o  596.762   5.8943  272.672   5.3828  272.672   5.3828  272.672   5.3828  596.762   5.8943  596.762   5.8943 0.000000 0.000000 
1 1 1    4    0   20 o  665.744   6.1685  339.350   6.2845  339.350   6.2845  339.350   6.2845  665.744   6.1685  665.744   6.1685 0.000000 0.000000 
1 1 1    4    0   21 o  383.882   6.8928  112.916   4.0472  112.916   4.0472  112.916   4.0472  383.882   6.8928  383.882   6.8928 0.000000 0.000000 
1 1 1    4    0   22 o  744.705   6.5721  424.614   7.4900  424.614   7.4900  424.614   7.4900  744.705   6.5721  744.705   6.5721 0.000000 0.000000 
1 1 1    4    0   23 o  919.846   7.2920  647.810   10.265  647.810   10.265  647.810   10.265  919.846   7.2920  919.846   7.2920 0.000000 0.000000 
1 1 1    4    0   24 o  1004.76   8.9026  773.024   13.689  773.024   13.689  773.024   13.689  1004.76   8.9026  1004.76   8.9026 0.000000 0.000000 
1 1 1    4    0   25 o  165.794   10.693   21.306   2.6876   21.306   2.6876   21.306   2.6876  165.794   10.693  165.794   10.693 0.000000 0.000000 
1 1 1    4    0   26 o  1037.43   7.9925  823.984   12.690  823.984   12.690  823.984   12.690  1037.43   7.9925  1037.43   7.9925 0.000000 0.000000 
1 1 1    4    0   27 o  220.346   11.099   37.452   3.7216   37.452   3.7216   37.452   3.7216  220.346   11.099  220.346   11.099 0.000000 0.000000 
1 1 1    4    0   28 o  954.109   8.9134  697.013   13.014  697.013   13.014  697.013   13.014  954.109   8.9134  954.109   8.9134 0.000000 0.000000 
1 1 1    4    0   29 o  305.891   9.5275   71.835   4.4510   71.835   4.4510   71.835   4.4510  305.891   9.5275  305.891   9.5275 0.000000 0.000000 
1 1 1    4    0   30 o  690.167   8.3289  364.772   8.7957  364.772   8.7957  364.772   8.7957  690.167   8.3289  690.167   8.3289 0.000000 0.000000 
1 1 1    4    0   31 o  1650.98   11.196  2087.09   28.289  2087.09   28.289  2087.09   28.289  1650.98   11.196  1650.98   11.196 0.000000 0.000000 
1 1 1    4    0   32 o  503.827   7.7331  194.442   5.9604  194.442   5.9604  194.442   5.9604  503.827   7.7331  503.827   7.7331 0.000000 0.000000 
1 1 1    4    0   33 o  816.068   9.0999  510.009   11.364  510.009   11.364  510.009   11.364  816.068   9.0999  816.068   9.0999 0.000000 0.000000 
1 1 1    4    0   34 o  644.271   7.8873  317.886   7.7753  317.886   7.7753  317.886   7.7753  644.271   7.8873  644.271   7.8873 0.000000 0.000000 
1 1 1    4    0   35 o  1210.13   9.3366  1121.33   17.292  1121.33   17.292  1121.33   17.292  1210.13   9.3366  1210.13   9.3366 0.000000 0.000000 
1 1 1    4    0   36 o   82.769   38.523   7.7008   5.4220   7.7008   5.4220   7.7008   5.4220   82.769   38.523   82.769   38.523 0.000000 0.000000 
1 1 1    4    0   37 o  296.467   12.938   67.703   5.8454   67.703   5.8454   67.703   5.8454  296.467   12.938  296.467   12.938 0.000000 0.000000 
1 1 1    4    0   38 o  516.442   10.331  204.480   8.1590  204.480   8.1590  204.480   8.1590  516.442   10.331  516.442   10.331 0.000000 0.000000 
1 1 1    4    0   39 o  109.367   45.386   12.979   7.5641   12.979   7.5641   12.979   7.5641  109.367   45.386  109.367   45.386 0.000000 0.000000 
1 1 1    4    0   40 o  549.564   10.338  231.561   8.6892  231.561   8.6892  231.561   8.6892  549.564   10.338  549.564   10.338 0.000000 0.000000 
1 1 1    4    0   41 o   76.654   37.850   6.6898   5.3261   6.6898   5.3261   6.6898   5.3261   76.654   37.850   76.654   37.850 0.000000 0.000000 
1 1 1    4    0   42 o  351.323   13.301   95.027   7.1292   95.027   7.1292   95.027   7.1292  351.323   13.301  351.323   13.301 0.000000 0.000000 
1 1 1    4    0   43 o   47.946   30.686   0.3110   5.0606   0.3110   5.0606   0.3110   5.0606   47.946   30.686   47.946   30.686 0.000000 0.000000 
1 1 1    4    0   44 o  423.025   9.9865  137.356   6.4581  137.356   6.4581  137.356   6.4581  423.025   9.9865  423.025   9.9865 0.000000 0.000000 
1 1 1    4    0   45 o  211.111   18.866   35.089   5.9842   35.089   5.9842   35.089   5.9842  211.111   18.866  211.111   18.866 0.000000 0.000000 
1 1 1    4    0   46 o  342.157   11.209   90.067   5.8559   90.067   5.8559   90.067   5.8559  342.157   11.209  342.157   11.209 0.000000 0.000000 
1 1 1    4    0   47 o   48.782   30.811   0.8430   4.9075   0.8430   4.9075   0.8430   4.9075   48.782   30.811   48.782   30.811 0.000000 0.000000 
1 1 1    4    0   48 o  285.715   14.561   63.229   6.3303   63.229   6.3303   63.229   6.3303  285.715   14.561  285.715   14.561 0.000000 0.000000 
1 1 1    4    0   49 o  268.220   13.274   55.683   5.4192   55.683   5.4192   55.683   5.4192  268.220   13.274  268.220   13.274 0.000000 0.000000 
1 1 1    4    0   50 o  108.194   40.098   12.332   6.1643   12.332   6.1643   12.332   6.1643  108.194   40.098  108.194   40.098 0.000000 0.000000 
1 1 1    4    0   51 o   47.982   30.633   0.5497   5.0050   0.5497   5.0050   0.5497   5.0050   47.982   30.633   47.982   30.633 0.000000 0.000000 
1 1 1    4    0   52 o  452.384   10.175  157.379   7.0374  157.379   7.0374  157.379   7.0374  452.384   10.175  452.384   10.175 0.000000 0.000000 
1 1 1    4    0   53 o   46.308   30.943  -1.7479   6.0304  -1.7479   6.0304  -1.7479   6.0304   46.308   30.943   46.308   30.943 0.000000 0.000000 
1 1 1    4    0   54 o  126.475   33.057   14.860   5.5295   14.860   5.5295   14.860   5.5295  126.475   33.057  126.475   33.057 0.000000 0.000000 
1 1 1    4    0   55 o  202.743   18.781   32.690   5.7131   32.690   5.7131   32.690   5.7131  202.743   18.781  202.743   18.781 0.000000 0.000000 
1 1 1    4    0   56 o  214.938   20.284   36.898   6.5365   36.898   6.5365   36.898   6.5365  214.938   20.284  214.938   20.284 0.000000 0.000000 
1 1 1    4    0   57 o  175.382   22.408   25.177   5.7470   25.177   5.7470   25.177   5.7470  175.382   22.408  175.382   22.408 0.000000 0.000000 
1 1 1    4    0   58 o  310.365   14.586   74.996   6.8941   74.996   6.8941   74.996   6.8941  310.365   14.586  310.365   14.586 0.000000 0.000000 
1 1 1    4    0   59 o   51.941   34.042  -0.2542   6.7505  -0.2542   6.7505  -0.2542   6.7505   51.941   34.042   51.941   34.042 0.000000 0.000000 
1 1 1    4    0   60 o   92.886   40.319   10.151   5.9269   10.151   5.9269   10.151   5.9269   92.886   40.319   92.886   40.319 0.000000 0.000000 
1 1 1    4    0   61 o  108.666   40.947   13.124   6.3743   13.124   6.3743   13.124   6.3743  108.666   40.947  108.666   40.947 0.000000 0.000000 
1 1 1    4    0   62 o  285.316   13.385   63.563   5.8159   63.563   5.8159   63.563   5.8159  285.316   13.385  285.316   13.385 0.000000 0.000000 
1 1 1    4    0   63 o  251.461   14.942   49.816   5.7045   49.816   5.7045   49.816   5.7045  251.461   14.942  251.461   14.942 0.000000 0.000000 
1 1 1    4    0   64 f   57.667   34.975   3.3880   5.7241   3.3880   5.7241   3.3880   5.7241   57.667   34.975   57.667   34.975 0.000000 0.000000 
1 1 1    4    0   65 o   58.133   33.246   4.0946   4.6662   4.0946   4.6662   4.0946   4.6662   58.133   33.246   58.133   33.246 0.000000 0.000000 
1 1 1    4    0   66 o  158.740   25.097   21.974   5.6417   21.974   5.6417   21.974   5.6417  158.740   25.097  158.740   25.097 0.000000 0.000000 
1 1 1    4    1    1 o  901.808   12.713  622.859   17.548  622.859   17.548   0.0000   0.0000  901.808   12.713  ?   ?  0.000000 12.71288 
1 1 1    4    1    2 f  1135.24   10.786  986.833   18.742  1021.16   27.524  957.159   25.593  1154.47   15.576  1117.76   14.959 36.71399 21.59593 
1 1 1    4    1    3 o  173.910   3.5070   23.148   0.9335   23.141   1.4745   23.152   1.2060  173.877   5.5403  173.923   4.5302 -0.4574585E-01 7.156660 
1 1 1    4    1    4 o  579.319   4.9694  256.876   4.4064  260.686   6.2982  253.223   6.1672  583.565   7.0511  575.153   7.0054 8.412415 9.939492 
1 1 1    4    1    5 o  314.848   3.1138   75.869   1.5006   76.109   1.9825   75.546   2.2962  315.341   4.1074  314.169   4.7751 1.172058 6.298614 
1 1 1    4    1    6 o  484.195   3.2749  179.433   2.4271  176.753   3.4036  182.204   3.4619  480.555   4.6273  487.908   4.6357 -7.353699 6.549880 
1 1 1    4    1    7 o  917.547   4.6586  644.377   6.5427  652.263   9.3748  636.887   9.1354  923.098   6.6351  912.155   6.5432 10.94257 9.318666 
1 1 1    4    1    8 o  258.306   3.5994   51.066   1.4231   52.067   2.0183   50.077   2.0069  260.817   5.0556  255.784   5.1262 5.033203 7.199776 
1 1 1    4    1    9 o  1000.55   5.0094  766.239   7.6717  757.953   10.725  774.919   10.978  995.066   7.0419  1006.14   7.1284 -11.07233 10.02010 
1 1 1    4    1   10 o  564.058   3.6617  243.508   3.1614  250.279   4.5591  237.237   4.3876  571.828   5.2088  556.730   5.1488 15.09729 7.324107 
1 1 1    4    1   11 o  1303.43   7.1477  1300.53   14.260  1306.75   20.294  1294.46   20.042  1306.38   10.149  1300.23   10.071 6.152588 14.29754 
1 1 1    4    1   12 o  1523.21   7.5439  1776.18   17.588  1732.99   26.102  1812.09   23.804  1504.31   11.336  1538.36   10.109 -34.04907 15.18901 
1 1 1    4    1   13 o  907.925   4.7892  630.947   6.6555  624.625   9.3294  637.498   9.4976  903.310   6.7475  912.569   6.7995 -9.259155 9.579291 
1 1 1    4    1   14 o  1021.36   5.9977  798.524   9.3764  800.139   13.305  796.931   13.216  1022.28   8.5028  1020.24   8.4633 2.049255 11.99687 
1 1 1    4    1   15 o  949.037   4.9808  689.404   7.2353  687.892   10.230  690.918   10.234  947.920   7.0507  950.004   7.0384 -2.083374 9.962443 
1 1 1    4    1   16 o  744.093   4.3689  423.792   4.9759  426.762   7.0851  420.901   6.9899  746.645   6.1996  741.502   6.1587 5.143311 8.738676 
1 1 1    4    1   17 o  232.757   5.0746   41.470   1.8079   44.697   2.5470   38.193   2.5666  241.624   6.8867  223.343   7.5080 18.28085 10.18807 
1 1 1    4    1   18 f  763.419   4.5059  446.112   5.2652  446.140   7.4340  446.085   7.4582  763.373   6.3624  763.325   6.3835 0.4815674E-01 9.012661 
1 1 1    4    1   19 o  152.356   6.0670   17.771   1.4148   18.311   1.9518   17.173   2.0538  154.409   8.2889  149.468   9.0195 4.940445 12.24980 
1 1 1    4    1   20 o  563.898   4.1714  243.397   3.6004  236.349   4.9985  250.997   5.1903  555.627   5.8775  572.584   5.9222 -16.95752 8.343672 
1 1 1    4    1   21 o  570.867   4.8845  249.464   4.2680  249.463   6.0234  249.466   6.0485  570.800   6.8943  570.802   6.9229 -0.1953125E-02 9.770228 
1 1 1    4    1   22 o  518.260   4.2605  205.592   3.3797  202.434   4.7443  208.846   4.8157  514.221   6.0277  522.303   6.0237 -8.081543 8.521670 
1 1 1    4    1   23 o  616.926   4.4388  291.325   4.1915  288.954   5.8966  293.747   5.9592  614.360   6.2706  619.435   6.2853 -5.074158 8.878374 
1 1 1    4    1   24 o  269.341   5.8748   55.533   2.4220   56.343   3.4692   54.764   3.3827  271.261   8.3555  267.434   8.2638 3.826843 11.75183 
1 1 1    4    1   25 o  393.937   4.6463  118.783   2.8016  120.127   3.9615  117.438   3.9626  396.133   6.5336  391.672   6.6099 4.461060 9.293972 
1 1 1    4    1   26 o  247.492   7.5137   46.893   2.8463   49.239   3.7206   43.581   4.4197  253.582   9.5857  238.220   12.162 15.36270 15.48526 
1 1 1    4    1   27 o  252.704   7.8438   48.889   3.0340   46.909   3.9023   51.915   4.8242  247.504   10.301  260.347   12.106 -12.84242 15.89533 
1 1 1    4    1   28 o  912.456   5.3543  637.278   7.4780  643.771   10.644  630.951   10.508  917.023   7.5835  907.847   7.5620 9.175842 10.70950 
1 1 1    4    1   29 o  106.943   14.977   8.9338   2.3843   8.9959   3.5473   8.8827   3.2202  106.276   22.508  105.807   20.625 0.4693527 30.52810 
1 1 1    4    1   30 o  1638.60   9.0533  2055.81   22.707  2052.64   32.062  2059.01   32.162  1636.97   12.796  1639.51   12.816 -2.536377 18.11080 
1 1 1    4    1   31 o  483.857   5.7268  179.208   4.2413  181.160   6.4602  177.729   5.6228  486.423   8.6769  481.820   7.6242 4.603058 11.55064 
1 1 1    4    1   32 o  751.086   5.3632  431.816   6.1657  436.239   8.8090  427.567   8.6328  754.853   7.6242  747.315   7.5471 7.537964 10.72785 
1 1 1    4    1   33 f  972.644   6.7621  724.243   10.067  719.112   14.084  729.604   14.395  969.044   9.4953  976.079   9.6353 -7.035339 13.52769 
1 1 1    4    1   34 o  226.580   9.5818   39.317   3.3231   42.271   4.7211   36.416   4.6782  234.496   13.207  217.517   14.128 16.97844 19.33975 
1 1 1    4    1   35 o  286.966   8.3571   63.059   3.6707   66.544   5.1159   59.360   5.2700  294.720   11.341  278.329   12.370 16.39050 16.78202 
1 1 1    4    1   36 o  648.907   6.5847  322.382   6.5402  317.321   9.3171  327.297   9.1828  643.663   9.4569  653.718   9.1773 -10.05463 13.17789 
1 1 1    4    1   37 o  301.499   9.0991   69.624   4.1991   66.678   6.3077   71.969   5.6272  294.891   13.975  306.444   11.997 -11.55356 18.41788 
1 1 1    4    1   38 o  370.069   8.1788  104.886   4.6328  102.479   7.0262  106.737   6.1620  365.620   12.555  373.222   10.787 -7.602356 16.55246 
1 1 1    4    1   39 o  322.048   10.322   79.478   5.0880   82.623   7.4100   76.673   6.9988  328.136   14.754  316.115   14.465 12.02106 20.66134 
1 1 1    4    1   40 o  441.010   7.3518  148.960   4.9626  143.072   6.5850  156.700   7.5499  432.067   9.9572  452.114   10.910 -20.04660 14.77062 
1 1 1    4    1   41 o  505.484   7.5387  195.734   5.8328  202.991   8.4945  189.260   8.0232  514.515   10.786  496.828   10.551 17.68646 15.08833 
1 1 1    4    1   42 o  270.452   11.508   56.122   4.7640   54.447   6.6482   57.889   6.8300  265.533   16.438  273.838   16.370 -8.304688 23.19908 
1 1 1    4    1   43 o  466.005   6.8280  166.369   4.8703  168.427   6.9176  164.346   6.8580  468.636   9.6438  462.920   9.6788 5.715363 13.66317 
1 1 1    4    1   44 o  393.817   7.5165  118.866   4.5308  121.638   6.3894  116.062   6.4259  398.112   10.485  388.846   10.797 9.265137 15.05028 
1 1 1    4    1   45 o  601.049   7.1801  276.892   6.6055  279.418   9.3442  274.370   9.3391  603.338   10.118  597.847   10.206 5.490784 14.37143 
1 1 1    4    1   46 o  320.686   8.5667   78.893   4.2050   74.858   5.8716   83.142   6.0248  311.982   12.296  328.834   11.970 -16.85129 17.16021 
1 1 1    4    1   47 o  315.637   8.5684   76.451   4.1396   77.571   5.9082   75.371   5.8018  317.509   12.157  312.980   12.111 4.528992 17.16002 
1 1 1    4    1   48 o  103.933   24.989   8.8081   3.9263   5.7177   5.5640   11.874   5.5414   90.114   32.061  120.043   30.189 -29.92833 44.03708 
1 1 1    4    1   49 o  350.953   7.9886   94.540   4.2913   89.416   6.0043   99.891   6.1355  340.771   11.512  360.251   11.127 -19.47968 16.01009 
1 1 1    4    1   50 o  106.881   26.756   9.4096   4.3671   13.711   6.3688   5.5926   5.9997  127.996   32.460   90.520   33.147 37.47617 46.39367 
1 1 1    4    1   51 o  183.753   13.958   26.278   3.8965   21.490   5.4296   31.363   5.5952  163.878   22.219  199.653   18.520 -35.77458 28.92533 
1 1 1    4    1   52 o   83.882   25.743   5.6513   3.6215   6.4854   5.1596   4.8413   5.0844   91.524   30.966   83.670   30.533 7.853531 43.48721 
1 1 1    4    1   53 o  199.627   15.210   31.154   4.6127   30.475   6.4893   31.849   6.5578  195.173   22.112  199.690   21.810 -4.516464 31.05861 
1 1 1    4    1   54 o  256.568   10.543   50.797   4.1403   51.974   5.9460   49.690   5.7685  257.982   15.124  252.269   15.007 5.713058 21.30601 
1 1 1    4    1   55 o  171.811   14.996   23.165   3.9041   20.987   5.6122   25.207   5.4347  160.592   23.530  177.500   20.373 -16.90773 31.12367 
1 1 1    4    1   56 o  190.844   15.363   28.618   4.4498   27.625   6.3376   29.582   6.2494  184.605   22.922  191.656   21.685 -7.050461 31.55403 
1 1 1    4    1   57 o   99.115   25.368   8.2657   3.8646   3.9283   5.4566   12.631   5.4742   80.078   31.091  121.285   29.720 -41.20684 43.01067 
1 1 1    4    1   58 o  110.555   24.891   10.289   4.1105   7.1392   5.7451   13.593   5.8838   94.070   32.649  125.046   30.916 -30.97594 44.96402 
1 1 1    4    1   59 o   97.748   28.624   8.1888   4.5570   7.3567   6.5018   8.9923   6.3888   95.878   34.597  102.561   34.459 -6.682487 48.83009 
1 1 1    4    1   60 o  134.877   20.649   14.934   4.1272   15.792   5.7881   14.047   5.8867  134.768   28.925  126.038   30.780 8.729767 42.23821 
1 1 1    4    1   61 o  225.084   15.392   40.219   5.2710   31.644   8.5387   45.499   6.7001  190.011   30.383  237.563   18.574 -47.55190 35.61020 
1 1 1    4    1   62 o   73.682   25.932   4.2875   3.6306   2.3271   5.1107   6.2848   5.1585   70.618   29.152   86.892   30.875 -16.27432 42.46305 
1 1 1    4    1   63 o   98.000   24.644   8.4044   3.6930   7.5013   5.3243   9.2417   5.1266   91.987   31.455  100.591   30.583 -8.603592 43.87118 
1 1 1    4    1   64 o  106.988   25.785   10.252   4.1729   8.5967   5.8387   11.980   5.9661   95.833   32.934  111.470   32.783 -15.63762 46.46905 
1 1 1    4    1   65 o   71.350   25.019   4.2648   3.3776   3.0808   4.7550   5.4706   4.7985   69.857   28.394   79.935   29.581 -10.07870 41.00284 
1 1 1    4    1   66 o  162.846   17.153   21.970   4.2112   23.262   6.0286   20.738   5.8852  160.887   25.317  150.761   26.469 10.12642 36.62771 
1 1 1    4    2    1 o  1081.76   14.640  896.454   24.240  896.454   24.240   0.0000   0.0000  1081.76   14.640  ?   ?  0.000000 14.63953 
1 1 1    4    2    2 o  440.091   6.1449  148.252   4.1393  150.021   5.9014  146.538   5.8075  442.670   8.7097  437.503   8.6724 5.167175 12.29102 
1 1 1    4    2    3 o  604.233   7.0911  279.478   6.5582  279.478   6.5582   0.0000   0.0000  604.233   7.0911  ?   ?  0.000000 7.091082 
1 1 1    4    2    4 o  335.878   4.1747   86.345   2.1462   87.720   3.0607   85.015   3.0105  338.528   5.9068  333.267   5.9016 5.260651 8.349784 
1 1 1    4    2    5 o  925.464   6.5936  655.610   9.3401  653.013   13.164  658.242   13.254  923.538   9.3124  927.227   9.3390 -3.689148 13.18861 
1 1 1    4    2    6 o  621.625   4.2288  295.755   4.0236  282.403   5.4762  311.422   5.9317  607.407   5.8901  637.849   6.0756 -30.44165 8.462100 
1 1 1    4    2    7 o  1093.20   5.6671  914.755   9.4826  926.293   12.731  900.375   14.212  1100.01   7.5611  1084.47   8.5620 15.53894 11.42267 
1 1 1    4    2    8 o  670.597   4.1315  344.189   4.2407  346.983   6.5015  342.119   5.5946  673.278   6.3088  668.558   5.4672 4.719971 8.348130 
1 1 1    4    2    9 f  1351.32   6.3291  1397.77   13.091  1375.18   18.156  1422.22   18.892  1340.24   8.8505  1362.96   9.0560 -22.71973 12.66266 
1 1 1    4    2   10 o  944.865   5.1760  683.334   7.4857  682.933   9.8894  683.871   11.455  944.544   6.8404  945.158   7.9183 -0.6141357 10.46372 
1 1 1    4    2   11 o  1032.14   5.1786  815.398   8.1812  818.786   11.644  812.094   11.497  1034.21   7.3559  1029.98   7.2927 4.232788 10.35824 
1 1 1    4    2   12 o  1392.50   7.0013  1484.35   14.922  1480.33   22.746  1487.40   19.772  1390.38   10.688  1393.79   9.2679 -3.418213 14.14691 
1 1 1    4    2   13 o  578.574   4.1016  256.211   3.6323  254.903   5.5515  257.190   4.8032  577.060   6.2852  579.659   5.4136 -2.598450 8.295214 
1 1 1    4    2   14 o  759.796   5.0183  441.874   5.8361  444.976   8.3467  438.907   8.1632  762.400   7.1526  757.187   7.0435 5.213623 10.03844 
1 1 1    4    2   15 o  565.613   3.9009  244.862   3.3772  243.461   4.7716  246.268   4.7804  563.964   5.5277  567.207   5.5063 -3.242920 7.802177 
1 1 1    4    2   16 o  398.116   4.0195  121.313   2.4494  120.920   3.7200  121.615   3.2543  397.439   6.1151  398.592   5.3341 -1.152802 8.114682 
1 1 1    4    2   17 o  269.868   4.4396   55.746   1.8339   57.280   2.4384   53.747   2.7825  273.542   5.8239  264.957   6.8610 8.584503 8.999503 
1 1 1    4    2   18 o  483.036   4.2348  178.595   3.1310  176.014   4.0961  182.222   4.8560  479.505   5.5810  487.863   6.5029 -8.358337 8.569442 
1 1 1    4    2   19 o  686.291   4.3515  360.524   4.5711  357.150   6.4191  363.996   6.5109  683.011   6.1401  689.524   6.1691 -6.513184 8.703917 
1 1 1    4    2   20 o  602.846   4.2345  278.182   3.9073  280.227   5.5373  276.154   5.5142  605.005   5.9796  600.592   5.9984 4.413086 8.469733 
1 1 1    4    2   21 o  460.294   4.7608  162.183   3.3541  160.794   4.6975  163.627   4.7908  458.270   6.6969  462.289   6.7706 -4.018127 9.523123 
1 1 1    4    2   22 o  157.195   6.8015   18.919   1.6365   16.999   2.3086   20.858   2.3201  148.615   10.211  164.769   9.2368 -16.15363 13.76883 
1 1 1    4    2   23 o  945.228   5.5789  683.949   8.0716  685.787   10.722  681.545   12.263  946.405   7.4014  943.407   8.4922 2.998413 11.26493 
1 1 1    4    2   24 f  390.914   4.9103  116.971   2.9380  122.083   4.5258  113.247   3.8625  399.321   7.4047  384.616   6.5611 14.70557 9.893311 
1 1 1    4    2   25 o  130.086   9.7402   13.032   1.9253   13.783   2.5029   11.943   3.0131  133.561   12.384  123.752   16.304 9.808960 20.47429 
1 1 1    4    2   26 o  802.428   6.3128  492.893   7.7535  495.119   10.100  489.700   12.098  804.174   8.2057  799.691   9.8841 4.482666 12.84634 
1 1 1    4    2   27 o  826.089   5.0951  522.341   6.4424  531.633   9.2359  513.536   8.9910  833.345   7.2408  819.040   7.1719 14.30432 10.19141 
1 1 1    4    2   28 o  531.196   4.7859  215.974   3.8913  214.756   5.5144  217.182   5.4918  529.664   6.8019  532.648   6.7361 -2.984680 9.572895 
1 1 1    4    2   29 o  1255.29   6.8881  1206.24   13.235  1198.53   20.076  1212.18   17.601  1251.06   10.484  1258.25   9.1390 -7.190552 13.90807 
1 1 1    4    2   30 o  423.240   5.8170  137.118   3.7684  137.321   4.9710  136.844   5.7782  423.523   7.6682  422.763   8.9295 0.7601624 11.77018 
1 1 1    4    2   31 o  685.332   5.5167  359.517   5.7870  370.644   9.0202  351.734   7.5442  695.771   8.4699  677.828   7.2715 17.94366 11.16307 
1 1 1    4    2   32 o  158.408   12.320   19.339   2.9636   21.030   4.4890   18.032   3.9456  164.604   18.117  152.389   17.218 12.21526 24.99364 
1 1 1    4    2   33 o  263.575   9.5584   53.202   3.8562   58.165   5.5214   48.475   5.3880  275.521   13.093  251.108   14.075 24.41251 19.22311 
1 1 1    4    2   34 o  422.084   6.3773  136.386   4.1201  134.841   5.8644  137.892   5.7896  419.619   9.1306  424.346   8.9137 -4.727509 12.76018 
1 1 1    4    2   35 o  285.812   8.5743   62.555   3.7510   59.018   5.4386   65.764   5.1803  277.513   12.804  292.979   11.552 -15.46686 17.24461 
1 1 1    4    2   36 o  183.524   14.427   25.983   4.0201   27.461   5.9204   24.718   5.4761  187.910   20.940  178.234   20.443 9.676895 29.26415 
1 1 1    4    2   37 o  361.091   8.1402   99.851   4.4991   95.585   6.8043  103.166   5.9971  353.135   12.588  366.950   10.677 -13.81558 16.50683 
1 1 1    4    2   38 o  381.331   8.1140  111.366   4.7360  104.465   6.2308  120.809   7.2882  369.215   11.025  397.002   11.994 -27.78690 16.29141 
1 1 1    4    2   39 o  135.589   22.309   14.522   4.4689   12.585   6.5813   16.180   6.0876  125.228   33.626  142.149   28.962 -16.92107 44.37918 
1 1 1    4    2   40 o  609.354   6.1571  284.325   5.7427  281.232   8.0876  287.470   8.1555  605.864   8.7212  612.548   8.6984 -6.684021 12.31754 
1 1 1    4    2   41 o  117.919   22.292   11.077   3.8760   13.903   5.8235   8.8303   5.1935  131.270   29.680  105.447   30.466 25.82342 42.53312 
1 1 1    4    2   42 o  303.643   10.128   70.703   4.7069   70.936   5.8825   70.287   7.8476  303.975   12.643  301.720   17.063 2.254578 21.23641 
1 1 1    4    2   43 o  476.293   7.1350  173.814   5.2016  174.774   7.1051  172.706   7.6358  477.371   9.7240  474.453   10.515 2.918274 14.32175 
1 1 1    4    2   44 o  308.526   8.6819   72.991   4.0999   75.703   5.9198   70.490   5.6838  313.898   12.321  302.903   12.259 10.99561 17.38095 
1 1 1    4    2   45 o  197.626   13.741   30.199   4.1306   29.794   5.7287   30.637   5.9613  195.296   19.422  197.961   19.946 -2.664932 27.83976 
1 1 1    4    2   46 o  424.335   7.0406  138.027   4.5729  136.050   6.5162  139.945   6.4189  420.921   10.114  426.945   9.8224 -6.023865 14.09877 
1 1 1    4    2   47 o  367.586   7.6899  103.635   4.3266  103.127   6.2134  104.112   6.0284  366.256   11.083  368.057   10.701 -1.801331 15.40615 
1 1 1    4    2   48 o  469.681   7.6564  169.239   5.5043  175.815   8.1049  163.610   7.4987  478.086   11.076  461.289   10.621 16.79764 15.34496 
1 1 1    4    2   49 o  273.120   9.5221   57.329   3.9807   56.765   5.6430   57.887   5.6161  270.839   13.656  273.886   13.397 -3.047394 19.13017 
1 1 1    4    2   50 o   96.076   28.380   7.5001   4.4626   19.426   6.6879  -2.0716   5.9915  153.584   29.522   65.398   29.235 88.18570 41.54760 
1 1 1    4    2   51 o  200.148   12.681   31.066   3.8647   31.109   5.4211   31.023   5.5112  198.974   17.995  198.598   18.337 0.3754120 25.69161 
1 1 1    4    2   52 o  197.645   13.008   30.348   3.9133   35.380   5.5375   25.327   5.5309  212.345   17.185  178.401   20.636 33.94443 26.85423 
1 1 1    4    2   53 o  248.600   12.947   47.970   4.9095   49.130   6.7347   46.654   7.1721  250.091   17.708  243.035   19.443 7.056259 26.29818 
1 1 1    4    2   54 o  173.030   14.951   23.461   3.9207   21.566   5.4979   25.422   5.5929  163.411   22.585  178.270   20.893 -14.85825 30.76660 
1 1 1    4    2   55 o  257.430   10.899   51.205   4.2946   47.535   6.0733   54.874   6.0736  246.121   16.212  264.956   15.038 -18.83511 22.11309 
1 1 1    4    2   56 o   95.778   27.330   7.6895   4.2037   10.096   5.9394   5.2737   5.9505  108.720   32.887   87.398   32.822 21.32172 46.46329 
1 1 1    4    2   57 o  118.149   22.462   11.513   3.9136   15.185   5.5675   7.9275   5.5025  133.839   28.074   97.680   31.951 36.15907 42.53233 
1 1 1    4    2   58 o   57.489   24.679   0.1787   3.8993  -7.7117   5.4970   8.1702   5.5322   49.830   24.040   98.514   32.028 -48.68364 40.04669 
1 1 1    4    2   59 f  196.833   15.842   30.662   4.7324   34.245   6.6764   27.044   6.7088  205.306   21.568  180.460   24.956 24.84608 32.98467 
1 1 1    4    2   60 o  224.364   12.319   39.364   4.2145   37.465   5.7260   41.609   6.2256  216.582   17.420  228.001   17.985 -11.41916 25.03841 
1 1 1    4    2   61 o  105.206   27.423   9.6944   4.4609   10.236   6.2726   9.1402   6.3455  106.381   34.058  101.534   34.341 4.847771 48.36544 
1 1 1    4    2   62 o   89.121   25.667   6.8973   3.6914   0.8525   5.2621   12.754   5.1797   66.446   28.600  119.630   28.664 -53.18369 40.49149 
1 1 1    4    2   63 o  112.176   22.084   10.723   3.6569   11.380   5.2277   10.095   5.1173  111.500   29.981  104.991   30.215 6.509247 42.56553 
1 1 1    4    2   64 o   89.004   26.916   7.1330   3.9788   7.7108   5.3932   6.4429   5.8939   91.721   31.645   86.727   32.647 4.993423 45.46679 
1 1 1    4    2   65 o   63.586   24.760   2.7579   3.4686   2.8543   4.8385   2.6560   4.9750   69.285   28.456   69.076   28.658 0.2096405 40.38610 
1 1 1    4    2   66 o   70.316   26.737   3.9073   3.9776   2.1609   5.6066   5.6770   5.6438   69.111   29.629   81.262   31.600 -12.15096 43.31780 
1 1 1    4    3    0 o   68.050   9.6921   3.7543   0.9503   3.7543   0.9503   3.7543   0.9503   68.050   9.6921   68.050   9.6921 0.000000 0.000000 
1 1 1    4    3    2 f  876.592   8.8931  588.291   11.932  603.283   17.294  574.672   16.484  887.523   12.731  866.236   12.433 21.28650 17.79436 
1 1 1    4    3    3 f  743.168   8.0362  422.807   9.1413  422.807   9.1413   0.0000   0.0000  743.168   8.0362  ?   ?  0.000000 8.036206 
1 1 1    4    3    4 o  185.535   4.3721   26.347   1.2416   26.132   1.7566   26.562   1.7551  184.767   6.2114  186.282   6.1556 -1.514130 8.744849 
1 1 1    4    3    5 o  594.148   5.0957  270.197   4.6341  267.357   6.5002  273.132   6.6083  590.982   7.1859  597.330   7.2278 -6.347595 10.19208 
1 1 1    4    3    6 o  473.312   3.7643  171.460   2.7271  171.712   3.8569  171.208   3.8565  473.645   5.3200  472.948   5.3274 0.6970520 7.528852 
1 1 1    4    3    7 o  784.596   4.8620  471.171   5.8389  460.561   8.0891  482.713   8.4367  775.671   6.8132  794.102   6.9411 -18.43158 9.726157 
1 1 1    4    3    8 o  1225.16   6.7236  1148.98   12.608  1159.08   21.988  1144.03   15.390  1230.27   11.676  1222.45   8.2251 7.816650 14.28252 
1 1 1    4    3    9 o  892.042   4.9579  609.059   6.7695  608.295   8.9424  610.083   10.360  891.445   6.5538  892.724   7.5820 -1.279358 10.02191 
1 1 1    4    3   10 o  1167.10   5.6546  1042.61   10.101  1037.80   14.221  1047.51   14.350  1164.32   7.9799  1169.75   8.0150 -5.436035 11.31015 
1 1 1    4    3   11 o  314.343   3.6610   75.627   1.7615   75.309   2.7412   75.850   2.2989  313.667   5.7096  314.799   4.7711 -1.131866 7.440607 
1 1 1    4    3   12 o  798.459   4.7294  487.973   5.7800  488.603   8.8986  487.512   7.6021  798.911   7.2770  798.048   6.2235 0.8631592 9.575309 
1 1 1    4    3   13 o  843.592   4.9009  544.706   6.3282  550.526   9.7598  540.485   8.3124  848.009   7.5192  840.275   6.4630 7.734192 9.915032 
1 1 1    4    3   14 o  258.750   4.0113   51.244   1.5887   52.964   2.1564   49.202   2.3495  263.047   5.3557  253.525   6.0546 9.521973 8.083402 
1 1 1    4    3   15 o  1223.10   5.9616  1145.15   11.161  1138.74   15.700  1151.71   15.869  1219.52   8.4108  1226.44   8.4532 -6.921387 11.92468 
1 1 1    4    3   16 o  1172.43   6.1989  1052.29   11.124  1028.32   16.573  1071.95   15.007  1158.79   9.3441  1183.20   8.2865 -24.40894 12.48917 
1 1 1    4    3   17 o  594.925   4.3675  270.915   3.9771  267.608   5.2145  275.514   6.1493  591.248   5.7620  599.888   6.6971 -8.640259 8.834731 
1 1 1    4    3   18 o  1123.40   6.0682  966.172   10.434  960.905   13.714  973.412   16.079  1120.19   7.9985  1127.34   9.3181 -7.148560 12.28022 
1 1 1    4    3   19 o  412.243   4.0213  130.081   2.5374  129.421   3.6031  130.731   3.5739  411.162   5.7252  413.240   5.6503 -2.077667 8.043864 
1 1 1    4    3   20 o  287.788   4.7703   63.399   2.1013   63.626   2.7889   63.100   3.1959  288.280   6.3206  287.067   7.2734 1.213257 9.635971 
1 1 1    4    3   21 o  422.639   4.4418  136.729   2.8734  139.886   4.4195  134.417   3.7819  427.439   6.7550  419.020   5.8967 8.418304 8.966669 
1 1 1    4    3   22 o  1275.32   6.7596  1245.24   13.195  1249.03   17.471  1240.21   20.131  1277.07   8.9380  1272.40   10.336 4.669922 13.66495 
1 1 1    4    3   23 o  614.422   5.1523  288.978   4.8455  287.274   5.8995  292.513   8.4942  612.575   6.2919  618.035   8.9793 -5.459351 10.96429 
1 1 1    4    3   24 o  576.424   5.2240  254.336   4.6091  259.818   6.6198  249.177   6.4213  582.546   7.4241  570.495   7.3536 12.05115 10.44956 
1 1 1    4    3   25 o  677.473   4.6635  351.304   4.8359  363.547   7.0342  340.332   6.6591  689.128   6.6687  666.765   6.5249 22.36237 9.329873 
1 1 1    4    3   26 o  832.107   5.8156  530.008   7.4070  528.211   10.543  531.758   10.408  830.613   8.2926  833.402   8.1595 -2.788940 11.63379 
1 1 1    4    3   27 o  595.323   4.7106  271.267   4.2924  274.051   6.1757  268.665   5.9702  598.333   6.7434  592.428   6.5839 5.905701 9.424496 
1 1 1    4    3   28 f  504.237   4.7905  194.608   3.6973  192.620   5.2638  196.545   5.1945  501.623   6.8557  506.711   6.6976 -5.087433 9.584255 
1 1 1    4    3   29 o  211.112   8.0648   34.121   2.6060   35.184   3.9659   33.312   3.4571  213.986   12.159  208.282   10.882 5.703598 16.31707 
1 1 1    4    3   30 o  609.970   5.4372  284.793   5.0764  282.872   6.7251  287.336   7.7395  607.872   7.2280  612.621   8.2537 -4.749451 10.97123 
1 1 1    4    3   31 o  1575.53   7.6426  1900.39   18.431  1925.72   26.476  1876.56   25.672  1585.71   10.908  1565.35   10.715 20.35095 15.29041 
1 1 1    4    3   32 o  299.368   7.3076   68.612   3.3485   75.268   5.1444   63.719   4.4108  313.491   10.721  288.453   9.9901 25.03775 14.65421 
1 1 1    4    3   33 o  536.269   6.9513  220.167   5.7058  218.396   8.6574  221.526   7.5867  533.989   10.592  537.853   9.2155 -3.864014 14.03996 
1 1 1    4    3   34 o  909.784   6.6589  633.668   9.2728  638.066   16.170  631.514   11.319  912.627   11.576  908.161   8.1426 4.466248 14.15294 
1 1 1    4    3   35 o  1051.07   7.0775  845.827   11.386  841.790   16.198  849.770   16.008  1048.33   10.095  1053.31   9.9294 -4.971680 14.15979 
1 1 1    4    3   36 o  665.671   6.6227  339.258   6.7478  340.522   9.8713  338.149   9.2452  666.762   9.6724  664.467   9.0902 2.294739 13.27354 
1 1 1    4    3   37 o  381.591   7.8225  111.506   4.5689  106.952   7.0009  114.884   6.0301  373.556   12.244  387.249   10.173 -13.69244 15.91909 
1 1 1    4    3   38 o  604.225   7.1241  279.563   6.5887  280.933   9.6944  278.386   8.9820  605.509   10.460  602.807   9.7348 2.702087 14.28904 
1 1 1    4    3   39 o  765.032   6.0316  448.124   7.0629  445.250   10.025  450.956   9.9520  762.397   8.5910  767.275   8.4740 -4.878723 12.06707 
1 1 1    4    3   40 o  1033.02   6.3789  817.174   10.086  821.432   14.380  813.050   14.151  1035.39   9.0738  1030.11   8.9747 5.283203 12.76245 
1 1 1    4    3   41 o  167.444   15.369   21.723   3.8951   19.529   5.8677   23.452   5.2082  156.974   25.280  173.335   19.997 -16.36162 32.23288 
1 1 1    4    3   42 o   69.681   26.617   2.6089   3.9534   5.9685   5.1227  -2.3385   6.2165   90.778   30.854   67.088   29.900 23.68972 42.96494 
1 1 1    4    3   43 o  308.169   8.9247   72.813   4.2097   74.976   5.7903   70.388   6.1311  312.474   12.107  302.665   13.234 9.808960 17.93649 
1 1 1    4    3   44 o  366.741   8.0738  103.109   4.5322  104.094   6.1742  101.959   6.6738  368.224   10.955  364.318   11.968 3.906525 16.22467 
1 1 1    4    3   45 o   91.315   26.223   6.6656   3.8582   10.769   5.1882   1.5882   5.7710  114.990   29.372   75.467   31.045 39.52283 42.73774 
1 1 1    4    3   46 o   70.485   24.766   3.4438   3.3104   8.6239   4.8592  -1.0425   4.5221  103.310   29.351   59.070   25.950 44.23983 39.17756 
1 1 1    4    3   47 o  275.095   9.4394   58.110   3.9746   59.960   5.4294   55.973   5.8345  279.065   12.711  269.058   14.218 10.00745 19.07117 
1 1 1    4    3   48 o  310.451   8.8839   74.005   4.2215   75.716   6.4685   72.736   5.5715  313.346   13.487  307.384   11.842 5.962341 17.94796 
1 1 1    4    3   49 o  253.699   9.8552   49.482   3.8270   45.531   5.4054   53.453   5.4190  242.268   14.646  262.820   13.516 -20.55212 19.92956 
1 1 1    4    3   50 o  157.810   18.432   19.647   4.3682   26.333   6.5135   14.183   5.8889  181.320   24.064  130.634   30.074 50.68614 38.51627 
1 1 1    4    3   51 f  329.827   8.5414   83.613   4.3121   82.967   6.0084   84.300   6.1921  327.872   11.972  330.432   12.243 -2.559937 17.12395 
1 1 1    4    3   52 o  136.135   18.226   14.727   3.7024   10.284   5.1664   19.418   5.3085  110.835   29.806  155.132   23.058 -44.29689 37.68387 
1 1 1    4    3   53 o  153.366   19.169   18.722   4.4016   22.666   5.9305   13.884   6.5679  167.361   23.823  127.533   33.290 39.82903 40.93618 
1 1 1    4    3   54 o   48.856   22.280  -2.1289   3.6882  -1.2322   5.1596  -3.0659   5.2741   61.841   27.418   57.878   26.489 3.962948 38.12334 
1 1 1    4    3   55 o  222.692   12.195   38.523   4.1409   43.874   5.8735   33.235   5.8388  236.354   16.336  204.663   18.851 31.69148 24.94396 
1 1 1    4    3   56 o  118.154   24.933   11.639   4.3675   13.542   5.9265   9.3762   6.4612  125.497   31.028  105.698   34.625 19.79922 46.49342 
1 1 1    4    3   57 o   82.062   26.915   5.3959   3.9037   5.7034   5.4619   5.0749   5.5813   87.410   31.684   85.101   31.821 2.309540 44.90518 
1 1 1    4    3   58 o   84.362   27.422   5.7950   4.0554   8.3825   5.7136   3.1680   5.7570   99.673   32.556   78.135   31.424 21.53761 45.24771 
1 1 1    4    3   59 o  171.769   18.056   23.635   4.6762   25.838   6.5033   21.277   6.7287  176.393   24.770  157.591   28.963 18.80289 38.10983 
1 1 1    4    3   60 o   67.689   26.263   2.7823   3.8917   2.9044   5.3730   2.6476   5.6446   74.746   30.253   74.992   30.760 -0.2463608 43.14416 
1 1 1    4    3   61 o  104.800   27.459   9.6295   4.4576   9.4295   6.5194   9.8050   6.1086  102.788   34.808  104.375   33.630 -1.586586 48.40009 
1 1 1    4    3   62 f  197.954   13.178   30.926   3.9700   30.404   5.5350   31.478   5.6974  193.204   18.961  196.469   19.191 -3.265060 26.97808 
1 1 1    4    3   63 o   74.895   26.858   4.4732   3.9119   3.0619   5.8410   5.6212   5.2678   75.375   31.144   83.360   30.965 -7.985352 43.91784 
1 1 1    4    3   64 o  104.862   24.665   9.7621   3.8926   11.107   5.1833   8.0231   5.8951  108.772   30.109   93.181   33.017 15.59089 44.68422 
1 1 1    4    3   65 o   64.031   24.721   2.8822   3.4346   5.0049   4.7271   0.5083   4.9989   77.633   29.235   62.196   27.305 15.43673 40.00259 
1 1 1    4    4    1 o  1041.75   8.2294  830.802   13.122  816.954   15.767  862.007   23.668  1032.95   9.9724  1060.78   14.577 -27.82629 17.66172 
1 1 1    4    4    2 o  451.157   6.2810  155.802   4.3373  154.821   6.1141  156.797   6.1539  449.693   8.8828  452.554   8.8841 -2.861267 12.56307 
1 1 1    4    4    3 o  1316.06   10.028  1326.15   20.200  1315.93   24.518  1347.74   35.640  1310.83   12.220  1326.10   17.559 -15.26721 21.39224 
1 1 1    4    4    4 o  140.510   4.9235   15.111   1.0589   14.656   1.4887   15.578   1.5064  138.186   7.0619  142.656   6.8991 -4.470139 9.872596 
1 1 1    4    4    5 o  982.609   6.9339  739.089   10.429  737.924   14.714  740.265   14.783  981.726   9.7921  983.282   9.8223 -1.555237 13.86943 
1 1 1    4    4    6 o  564.731   5.0722  244.104   4.3844  246.059   6.2160  242.167   6.1850  566.955   7.1629  562.453   7.1843 4.501953 10.14505 
1 1 1    4    4    7 o  425.623   5.2921  138.658   3.4477  138.990   4.1190  137.880   6.3009  426.121   6.3152  424.362   9.7006 1.758881 11.57512 
1 1 1    4    4    8 o  787.577   5.4057  474.770   6.5165  472.263   8.3845  478.595   10.356  785.459   6.9740  790.663   8.5572 -5.203430 11.03915 
1 1 1    4    4    9 o  237.548   3.5734   43.188   1.2993   44.896   2.0248   41.993   1.6940  242.189   5.4621  234.233   4.7250 7.955719 7.222153 
1 1 1    4    4   10 o  865.525   4.8975  573.390   6.4882  573.069   9.9226  573.629   8.5754  865.216   7.4926  865.668   6.4719 -0.4526367 9.900743 
1 1 1    4    4   11 o  1421.60   7.1150  1547.05   15.482  1535.05   23.492  1556.26   20.584  1415.83   10.840  1425.68   9.4328 -9.852295 14.36959 
1 1 1    4    4   12 o  539.692   3.9712  222.930   3.2805  230.823   5.1607  217.579   4.2495  549.130   6.1400  533.159   5.2073 15.97101 8.050791 
1 1 1    4    4   13 o  491.749   4.2154  185.085   3.1729  186.214   4.5474  184.013   4.4292  493.220   6.0235  490.299   5.9020 2.921692 8.433019 
1 1 1    4    4   14 o  515.142   4.0239  203.113   3.1728  197.412   4.7328  207.767   4.2759  507.827   6.0889  520.989   5.3620 -13.16168 8.113280 
1 1 1    4    4   15 o  651.863   4.3826  325.245   4.3728  329.469   6.7304  322.159   5.7523  656.024   6.7028  648.731   5.7931 7.292480 8.859291 
1 1 1    4    4   16 o  579.295   3.9969  256.858   3.5440  256.990   5.0156  256.727   5.0083  579.408   5.6554  579.111   5.6502 0.2967529 7.994263 
1 1 1    4    4   17 o  216.604   4.8924   35.914   1.6220   36.220   2.1063   35.468   2.5426  217.510   6.3267  215.220   7.7183 2.290115 9.979932 
1 1 1    4    4   18 o  849.474   4.7650  552.372   6.1955  552.452   8.7735  552.293   8.7502  849.445   6.7479  849.324   6.7309 0.1215210 9.530968 
1 1 1    4    4   19 o  416.215   4.0090  132.600   2.5540  129.570   3.6046  135.655   3.6193  411.399   5.7243  420.949   5.6172 -9.550476 8.020055 
1 1 1    4    4   20 o  941.699   5.8988  678.904   8.5024  678.739   11.989  679.072   12.060  941.429   8.3198  941.656   8.3674 -0.2270508 11.79967 
1 1 1    4    4   21 o  780.859   5.4164  466.769   6.4738  468.214   9.1075  465.294   9.2038  781.963   7.6093  779.515   7.7139 2.448059 10.83536 
1 1 1    4    4   22 o  675.703   5.2179  349.504   5.3966  348.836   6.5737  350.885   9.4510  675.019   6.3624  676.876   9.1222 -1.856384 11.12183 
1 1 1    4    4   23 o  909.220   5.1474  632.799   7.1635  653.497   10.404  614.142   9.8778  923.872   7.3574  895.630   7.2055 28.24268 10.29804 
1 1 1    4    4   24 o  292.994   5.3450   65.711   2.3970   64.765   3.7863   66.345   3.0966  290.833   8.5055  294.383   6.8723 -3.550293 10.93494 
1 1 1    4    4   25 o  619.335   4.5719  293.594   4.3340  298.082   6.2586  289.458   6.0075  624.010   6.5527  614.921   6.3827 9.089172 9.147469 
1 1 1    4    4   26 o   99.692   14.200   7.7678   2.1056   6.6461   3.2623   8.5688   2.7567   91.311   23.273  104.253   17.921 -12.94209 29.37350 
1 1 1    4    4   27 f  370.770   5.0009  105.222   2.8381  103.620   4.0284  106.801   3.9991  367.911   7.1535  373.518   6.9949 -5.606842 10.00504 
1 1 1    4    4   28 o  1076.07   6.2272  886.355   10.257  881.733   15.560  889.906   13.639  1073.12   9.4728  1078.14   8.2651 -5.022095 12.57168 
1 1 1    4    4   29 o  803.644   5.2044  494.346   6.4019  491.179   9.0303  497.545   9.0770  801.008   7.3654  806.183   7.3560 -5.174438 10.40959 
1 1 1    4    4   30 o  333.609   6.4511   85.196   3.2941   88.669   4.3522   80.537   5.0404  340.315   8.3553  324.303   10.154 16.01196 13.14978 
1 1 1    4    4   31 o  1048.82   5.9274  842.047   9.5156  841.466   13.465  842.626   13.450  1048.35   8.3910  1049.07   8.3760 -0.7232666 11.85612 
1 1 1    4    4   32 f  1051.91   6.4301  847.055   10.353  845.445   15.910  848.238   13.635  1050.71   9.8928  1052.54   8.4632 -1.824341 13.01897 
1 1 1    4    4   33 o  1070.78   7.7482  877.854   12.699  876.562   20.085  878.714   16.391  1069.65   12.268  1071.15   9.9973 -1.504150 15.82527 
1 1 1    4    4   34 o  132.049   16.442   13.578   3.2513   11.993   4.8061   14.916   4.4148  122.526   26.405  137.710   21.660 -15.18372 34.15271 
1 1 1    4    4   35 o  355.842   7.9764   96.958   4.3445   99.612   6.3585   94.635   5.9498  360.576   11.521  351.466   11.060 9.109161 15.97042 
1 1 1    4    4   36 o  986.498   6.5662  745.080   9.9148  754.497   15.573  738.661   12.857  992.433   10.252  982.106   8.5531 10.32751 13.35117 
1 1 1    4    4   37 o  484.483   6.9962  179.725   5.1881  180.267   8.2351  179.369   6.6806  485.034   11.092  483.924   9.0192 1.109528 14.29649 
1 1 1    4    4   38 o  350.090   9.1405   93.887   4.8980   94.239   7.4018   93.613   6.5329  350.536   13.795  349.450   12.214 1.085602 18.42537 
1 1 1    4    4   39 o  677.545   5.9947  351.493   6.2169  338.349   8.6949  365.241   8.8925  664.598   8.5475  690.513   8.4136 -25.91565 11.99369 
1 1 1    4    4   40 o  319.082   8.4907   78.004   4.1469   78.168   5.9447   77.847   5.7876  319.238   12.166  318.599   11.868 0.6389160 16.99589 
1 1 1    4    4   41 o  598.502   6.6253  274.349   6.0693  282.339   9.2767  268.370   8.0253  606.858   9.9870  591.764   8.8602 15.09357 13.35076 
1 1 1    4    4   42 o  519.850   7.0965  207.032   5.6467  215.483   7.5848  196.525   8.4575  530.155   9.3470  506.134   10.917 24.02124 14.37183 
1 1 1    4    4   43 o  165.182   14.426   21.140   3.6107   22.251   5.1319   20.052   5.0810  168.525   20.304  159.655   21.325 8.870209 29.44513 
1 1 1    4    4   44 f  396.098   7.3934  120.248   4.4825  120.718   6.3700  119.787   6.3087  396.579   10.494  395.053   10.433 1.525787 14.79783 
1 1 1    4    4   45 o  278.061   11.129   59.394   4.7364   64.558   6.0747   51.386   7.5642  289.621   13.703  256.964   19.374 32.65643 23.73065 
1 1 1    4    4   46 o   76.017   25.487   4.2680   3.4949   7.8437   4.7529   0.0589   5.1567   98.977   29.303   66.745   28.509 32.23267 40.88327 
1 1 1    4    4   47 o  302.531   8.8924   70.255   4.1177   71.246   5.6656   69.146   5.9951  304.261   12.166  299.614   13.073 4.646790 17.85761 
1 1 1    4    4   48 o  102.891   23.556   8.6109   3.6298   3.1576   5.3999   13.106   4.9027   78.767   30.832  126.861   26.119 -48.09326 40.40801 
1 1 1    4    4   49 o  174.095   13.487   23.533   3.5658   25.868   5.0606   21.231   5.0251  181.488   18.475  163.731   20.501 17.75679 27.59723 
1 1 1    4    4   50 o   70.361   27.251   2.6675   4.1840   1.3229   6.2214   3.7777   5.6534   76.094   31.849   81.899   31.688 -5.805382 44.92759 
1 1 1    4    4   51 o   74.272   25.425   4.0824   3.4786   1.4745   4.8429   6.8620   4.9998   68.967   28.414   93.212   30.455 -24.24535 41.65165 
1 1 1    4    4   52 o  352.522   8.6743   95.574   4.6805  102.181   7.0020   90.237   6.2930  363.524   12.584  341.768   12.030 21.75558 17.40895 
1 1 1    4    4   53 o  139.587   19.948   15.607   4.1408   18.694   5.3521   11.003   6.5356  151.697   23.837  114.160   34.491 37.53671 41.92609 
1 1 1    4    4   54 o  239.765   11.231   44.417   4.1215   37.913   5.8996   50.617   5.7604  219.311   17.726  254.645   14.843 -35.33336 23.12030 
1 1 1    4    4   55 o  139.358   18.051   15.491   3.7599   11.352   5.3839   19.431   5.2532  115.447   30.143  154.610   22.890 -39.16308 37.84879 
1 1 1    4    4   56 o   80.987   28.034   5.0173   4.2342   9.5860   5.7758  -0.2907   6.2256  106.149   32.500   70.179   30.648 35.97027 44.67147 
1 1 1    4    4   57 o  391.973   8.2800  118.355   4.9677  116.571   7.0308  120.134   7.0201  387.687   11.848  393.654   11.651 -5.966858 16.61696 
1 1 1    4    4   58 o  181.837   15.867   26.141   4.3719   24.962   5.9233   27.552   6.4795  174.815   22.671  183.290   23.647 -8.474579 32.75908 
1 1 1    4    4   59 o   99.913   27.525   8.5731   4.3437   13.835   6.3276   3.8836   5.9735  124.766   32.727   81.077   32.210 43.68869 45.91921 
1 1 1    4    4   60 o  196.578   13.769   30.422   4.1167   33.256   5.7207   27.377   5.9288  203.311   18.589  182.760   21.613 20.55156 28.50686 
1 1 1    4    4   61 o   83.333   27.691   5.8106   4.1270   5.0632   6.3419   6.3597   5.4353   85.182   33.393   88.179   31.655 -2.997231 46.01231 
1 1 1    4    4   62 o  209.232   12.755   34.478   4.0653   30.730   5.7424   38.244   5.7561  193.788   19.631  217.815   17.411 -24.02736 26.23911 
1 1 1    4    4   63 o  106.668   24.806   9.9741   3.9734   4.0941   5.8378   15.049   5.4236   78.794   31.660  129.547   28.156 -50.75249 42.36863 
1 1 1    4    4   64 o   52.346   23.295  -0.5580   3.7588   1.4355   4.9558  -3.2579   5.7674   65.458   27.954   57.542   26.811 7.916195 38.73285 
1 1 1    4    4   65 o   89.874   24.519   7.2889   3.4665   2.1094   4.7214   13.346   5.1059   66.037   27.698  119.503   28.343 -53.46616 39.62991 
1 1 1    4    5    0 o  1352.58   12.514  1400.98   25.903  1400.98   25.903  1400.98   25.903  1352.58   12.514  1352.58   12.514 0.000000 0.000000 
1 1 1    4    5    1 o  402.855   4.9401  124.218   3.0462  127.250   3.7673  118.492   5.1774  407.730   6.0365  393.415   8.5978 14.31482 10.50528 
1 1 1    4    5    2 o  586.143   7.0590  262.994   6.3331  267.571   9.0652  258.630   8.8514  591.154   10.019  581.195   9.9499 9.958923 14.11998 
1 1 1    4    5    3 o  514.509   5.5433  202.622   4.3655  200.884   5.3191  206.208   7.6409  512.280   6.7837  518.969   9.6190 -6.688782 11.77048 
1 1 1    4    5    4 o  929.454   7.7051  661.323   10.962  676.320   13.716  634.812   18.236  939.867   9.5344  910.401   13.087 29.46558 16.19170 
1 1 1    4    5    5 o  740.638   6.6925  419.895   7.5869  417.399   9.2218  425.121   13.346  738.397   8.1593  745.076   11.703 -6.679321 14.26649 
1 1 1    4    5    6 o  1227.75   11.694  1154.33   21.975  1156.68   31.077  1151.98   31.077  1228.62   16.525  1226.11   16.559 2.505005 23.39439 
1 1 1    4    5    7 o  833.166   7.2456  531.382   9.2401  525.073   15.768  534.681   11.403  828.011   12.442  835.697   8.9147 -7.685974 15.30569 
1 1 1    4    5    8 o  1018.07   7.2198  793.417   11.250  789.484   15.817  797.443   16.006  1015.42   10.177  1020.53   10.247 -5.101990 14.44164 
1 1 1    4    5    9 o  814.575   5.5864  507.887   6.9652  517.845   9.1155  493.914   10.797  822.479   7.2408  803.202   8.7826 19.27716 11.38252 
1 1 1    4    5   10 o  845.741   6.4556  547.528   8.3569  563.174   12.137  533.423   11.524  857.646   9.2457  834.693   9.0198 22.95288 12.91659 
1 1 1    4    5   11 f  509.255   4.2127  198.496   3.2837  191.459   5.6636  202.059   4.0302  500.098   7.3990  513.794   5.1247 -13.69629 9.000419 
1 1 1    4    5   12 f  859.601   4.9444  565.579   6.5055  561.509   9.8819  568.693   8.6425  856.424   7.5384  861.918   6.5510 -5.494873 9.987154 
1 1 1    4    5   13 o   59.288   11.064   2.7796   0.9672   3.2577   1.5018   2.4408   1.2642   63.924   15.507   55.457   14.668 8.467091 21.34535 
1 1 1    4    5   14 o  651.214   4.3434  324.595   4.3294  319.249   6.5377  328.771   5.7778  645.775   6.6141  655.358   5.7599 -9.582581 8.770558 
1 1 1    4    5   15 o  1042.78   5.3189  832.370   8.4895  823.484   11.879  841.647   12.137  1037.09   7.4832  1048.46   7.5631 -11.37000 10.63949 
1 1 1    4    5   16 o  700.918   4.2882  376.045   4.6005  376.168   6.5165  375.924   6.4958  700.978   6.0735  700.752   6.0562 0.2263794 8.577019 
1 1 1    4    5   17 o  756.910   4.7995  438.549   5.5604  443.845   7.4119  431.732   8.4095  761.406   6.3598  750.900   7.3168 10.50568 9.694429 
1 1 1    4    5   18 o  1093.44   5.5707  915.283   9.3234  914.375   13.172  916.195   13.199  1092.73   7.8753  1093.82   7.8834 -1.086548 11.14309 
1 1 1    4    5   19 o  811.611   5.0374  504.246   6.2578  514.421   8.4073  491.606   9.3706  819.681   6.7011  801.246   7.6406 18.43518 10.16286 
1 1 1    4    5   20 o  601.601   5.3677  277.061   4.9427  276.197   6.2934  278.452   7.9849  600.611   6.8458  602.978   8.6517 -2.366699 11.03251 
1 1 1    4    5   21 o  302.862   4.8538   70.214   2.2501   70.830   2.9598   69.370   3.4634  304.166   6.3575  300.992   7.5175 3.173492 9.845379 
1 1 1    4    5   22 o  1267.45   6.7207  1229.88   13.038  1239.30   17.395  1217.81   19.696  1272.11   8.9338  1260.91   10.205 11.20129 13.56305 
1 1 1    4    5   23 o  568.205   4.4237  247.122   3.8473  245.395   5.4548  248.831   5.4272  566.175   6.2945  570.127   6.2192 -3.951599 8.848650 
1 1 1    4    5   24 o  762.776   5.1550  445.357   6.0186  445.933   9.3343  444.948   7.8740  763.176   7.9908  762.378   6.7477 0.7979736 10.45865 
1 1 1    4    5   25 o  866.367   5.1245  574.526   6.7956  560.642   9.4572  589.348   9.7712  855.769   7.2200  877.402   7.2758 -21.63293 10.25018 
1 1 1    4    5   26 o  901.982   6.0366  622.762   8.3341  631.666   12.056  614.613   11.533  908.312   8.6719  895.978   8.4100 12.33368 12.08008 
1 1 1    4    5   27 o  1222.09   6.2792  1143.23   11.746  1137.29   16.569  1149.23   16.653  1218.78   8.8816  1225.17   8.8803 -6.383545 12.55960 
1 1 1    4    5   28 o  1367.18   7.2626  1430.91   15.198  1447.50   23.512  1419.00   19.919  1374.83   11.173  1361.34   9.5592 13.48608 14.70433 
1 1 1    4    5   29 o  1082.68   5.9171  897.265   9.8056  915.508   14.177  880.532   13.577  1093.52   8.4700  1072.44   8.2711 21.08203 11.83861 
1 1 1    4    5   30 o  1240.09   7.4929  1177.29   14.222  1195.27   20.500  1160.60   19.748  1249.31   10.720  1231.08   10.480 18.23193 14.99212 
1 1 1    4    5   31 o  1314.17   7.2163  1322.16   14.516  1337.38   22.560  1311.40   18.962  1321.42   11.154  1308.66   9.4663 12.75732 14.62965 
1 1 1    4    5   32 o  939.906   7.2468  676.334   10.426  680.867   16.610  673.388   13.392  942.798   11.510  937.749   9.3303 5.049500 14.81673 
1 1 1    4    5   33 o  354.693   7.5996   96.322   4.1258   94.742   5.6884   98.075   5.9931  351.704   10.567  357.826   10.942 -6.122467 15.21157 
1 1 1    4    5   34 o  585.830   5.6770  262.719   5.0905  254.520   7.0914  271.436   7.3119  576.543   8.0358  595.394   8.0233 -18.85089 11.35551 
1 1 1    4    5   35 o  525.131   6.2598  211.116   5.0315  211.200   6.9074  211.021   7.3440  525.159   8.5931  524.914   9.1406 0.2446899 12.54564 
1 1 1    4    5   36 o  450.833   7.3664  155.628   5.0833  161.449   8.7716  152.685   6.2374  458.970   12.486  446.489   9.1269 12.48077 15.46614 
1 1 1    4    5   37 o  539.380   6.5041  222.750   5.3697  214.600   8.0583  229.260   7.2016  529.267   9.9471  547.116   8.5997 -17.84869 13.14911 
1 1 1    4    5   38 o  573.776   7.2687  252.109   6.3837  243.578   9.5543  258.989   8.5799  563.758   11.072  581.418   9.6410 -17.65961 14.68139 
1 1 1    4    5   39 o  123.422   19.442   11.998   3.5512   21.889   5.1996   3.3498   4.8619  167.384   20.739   77.976   29.581 89.40855 36.12670 
1 1 1    4    5   40 o  251.581   10.348   48.520   3.9847   49.868   6.0456   47.484   5.2984  254.311   15.607  248.321   13.997 5.990646 20.96392 
1 1 1    4    5   41 o  277.178   9.1566   58.886   3.8847   65.146   5.6754   53.368   5.3286  291.334   12.727  263.322   13.263 28.01132 18.38211 
1 1 1    4    5   42 o  103.478   24.275   8.6236   3.7784   7.2424   4.8931   10.664   5.9467   96.538   29.973  115.176   32.381 -18.63820 44.12369 
1 1 1    4    5   43 o  110.612   20.602   9.7557   3.3597   7.6048   4.7331   11.940   4.7698   98.055   29.290  121.624   26.381 -23.56864 39.41929 
1 1 1    4    5   44 f  470.974   6.9224  169.981   4.9903  173.513   7.4499  167.107   6.7209  475.473   10.237  466.717   9.4081 8.756531 13.90324 
1 1 1    4    5   45 o  368.849   8.0695  104.329   4.5558  105.213   5.9587  103.085   7.0681  370.150   10.517  366.116   12.613 4.033508 16.42250 
1 1 1    4    5   46 o  297.767   8.6443   68.031   3.9398   68.432   5.3963   67.573   5.7655  298.311   11.818  296.322   12.712 1.989166 17.35684 
1 1 1    4    5   47 o  405.454   7.3694  126.077   4.5735  125.342   6.2754  126.909   6.6792  403.892   10.151  406.311   10.740 -2.419891 14.77785 
1 1 1    4    5   48 o  300.493   9.2878   69.363   4.2719   66.547   6.5176   71.483   5.6562  293.548   14.506  304.652   12.130 -11.10373 18.90895 
1 1 1    4    5   49 o  421.769   7.5601  136.519   4.8806  129.075   6.4288  146.646   7.4984  409.634   10.253  436.406   11.226 -26.77267 15.20335 
1 1 1    4    5   50 o  114.091   24.011   10.632   4.0604   7.2761   6.8651   12.438   5.0356   99.704   35.598  122.738   27.488 -23.03422 44.97547 
1 1 1    4    5   51 o  270.697   9.6768   56.398   4.0094   56.167   5.6576   56.631   5.6828  269.020   13.786  270.132   13.790 -1.111603 19.49933 
1 1 1    4    5   52 o  257.201   10.722   51.011   4.2209   55.683   6.3275   47.265   5.6656  267.190   15.539  246.227   15.106 20.96230 21.67131 
1 1 1    4    5   53 o  361.831   8.9675  100.767   4.9665  100.871   6.4086  100.611   7.8583  361.332   11.587  359.995   14.261 1.337158 18.37546 
1 1 1    4    5   54 o  183.958   13.816   26.417   3.8617   27.014   5.5173   25.845   5.4070  184.139   19.891  180.048   19.955 4.091278 28.17609 
1 1 1    4    5   55 o   79.027   25.767   4.9365   3.5797   4.9746   5.1293   4.9003   4.9980   83.710   30.649   82.952   30.272 0.7585373 43.07840 
1 1 1    4    5   56 o  108.629   24.892   9.8747   4.0500   10.246   5.4546   9.4183   6.0462  109.367   31.106  105.446   33.404 3.920082 45.64393 
1 1 1    4    5   57 f   67.024   26.062   2.5527   3.8390  -3.0459   5.3906   8.3142   5.4685   58.218   26.694   99.411   31.797 -41.19286 41.51664 
1 1 1    4    5   58 o  318.077   10.405   78.303   5.0656   77.841   7.3446   78.723   6.9958  315.134   15.227  317.309   14.404 -2.174530 20.96013 
1 1 1    4    5   59 o  244.983   12.220   46.721   4.5822   43.569   6.7554   49.408   6.2362  233.071   19.104  249.755   16.404 -16.68419 25.18060 
1 1 1    4    5   60 o   96.509   26.495   8.0322   4.0330   11.604   5.3244   3.2250   6.1773  114.566   30.006   78.957   32.258 35.60945 44.05625 
1 1 1    4    5   61 o  271.523   12.044   57.610   5.0054   50.254   7.2028   64.480   6.9608  249.177   19.029  284.596   16.045 -35.41856 24.89064 
1 1 1    4    5   62 o  157.503   16.640   20.008   3.9509   20.519   5.4708   19.450   5.7118  155.646   23.713  150.204   25.772 5.441666 35.02165 
1 1 1    4    5   63 o  185.421   14.547   27.465   4.0956   32.371   6.1212   23.489   5.5109  197.439   20.556  166.910   22.116 30.52899 30.19370 
1 1 1    4    5   64 o   82.375   26.897   6.0199   3.8999   2.7685   5.0636   10.761   6.1145   70.353   29.027  104.959   33.628 -34.60571 44.42355 
1 1 1    4    5   65 o   36.439   17.917  -6.3942   3.4863  -3.2860   4.7592  -9.9936   5.1215   51.206   24.020   42.573   21.078 8.633339 31.95663 
1 1 1    4    6    0 o  420.295   6.2516  135.293   4.0198  135.293   4.0198  135.293   4.0198  420.295   6.2516  420.295   6.2516 0.000000 0.000000 
1 1 1    4    6    1 o  374.363   4.9737  107.269   2.8500  110.044   3.5237  102.022   4.8463  379.163   6.0716  365.049   8.6733 14.11346 10.58732 
1 1 1    4    6    2 o  501.009   6.6933  192.141   5.1328  197.643   7.3887  187.008   7.1356  508.080   9.5010  494.223   9.4327 13.85727 13.38822 
1 1 1    4    6    3 o  816.664   7.0670  510.535   8.8338  512.700   10.878  506.343   15.138  818.346   8.6846  813.123   12.163 5.222900 14.94498 
1 1 1    4    6    4 o  328.966   4.4728   82.829   2.2522   81.301   3.1522   84.422   3.2190  325.904   6.3191  332.099   6.3326 -6.194794 8.946117 
1 1 1    4    6    5 o  364.369   9.1238  101.645   5.0885  101.645   5.0885   0.0000   0.0000  364.369   9.1238  ?   ?  0.000000 9.123830 
1 1 1    4    6    6 o  775.612   6.9414  460.495   8.2406  459.285   14.239  461.103   10.105  774.422   12.012  776.081   8.5065 -1.658997 14.71927 
1 1 1    4    6    7 o  727.408   5.8383  405.010   6.5003  397.772   9.0475  412.733   9.3453  720.823   8.2003  734.250   8.3153 -13.42780 11.67861 
1 1 1    4    6    8 o  475.787   4.9789  173.268   3.6259  172.166   5.1117  174.383   5.1441  474.243   7.0420  477.288   7.0414 -3.044434 9.958467 
1 1 1    4    6    9 o  1224.82   8.3394  1148.52   15.634  1140.68   21.937  1156.62   22.288  1220.42   11.743  1228.92   11.849 -8.493042 16.68243 
1 1 1    4    6   10 o  383.050   4.9842  112.307   2.9223  113.168   4.1675  111.475   4.0988  384.490   7.0814  381.603   7.0174 2.886841 9.969440 
1 1 1    4    6   11 o  126.446   6.3208   12.239   1.2233   11.333   1.4991   14.045   2.1166  121.397   8.1145  135.033   10.319 -13.63688 13.12705 
1 1 1    4    6   12 o  298.812   4.5096   68.342   2.0625   67.011   2.6718   70.305   3.2447  295.875   5.8996  303.047   6.9952 -7.171753 9.150842 
1 1 1    4    6   13 o  972.209   5.8199  723.528   8.6605  727.007   15.029  721.797   10.597  974.328   10.078  970.992   7.1299 3.335999 12.34499 
1 1 1    4    6   14 o  887.356   5.1077  602.722   6.9373  599.770   10.554  604.969   9.2057  885.071   7.7903  888.946   6.7657 -3.874939 10.31809 
1 1 1    4    6   15 o  920.175   5.2577  648.151   7.4052  637.487   11.154  656.555   9.9021  912.442   7.9867  926.043   6.9860 -13.60107 10.61094 
1 1 1    4    6   16 o  449.144   4.1228  154.410   2.8343  157.340   3.7615  150.561   4.3111  453.360   5.4207  443.465   6.3512 9.895416 8.349941 
1 1 1    4    6   17 o  714.698   4.6974  390.997   5.1387  389.279   6.7357  393.390   7.9481  713.073   6.1714  716.780   7.2445 -3.707092 9.516764 
1 1 1    4    6   18 o   51.849   14.805   2.1101   1.2332   0.7260   1.5742   4.3087   1.9840   41.930   16.574   73.460   17.826 -31.52979 24.34027 
1 1 1    4    6   19 o  336.694   4.9298   86.778   2.5406   90.270   3.0862   79.437   4.4749  343.384   5.8719  322.049   9.0780 21.33542 10.81154 
1 1 1    4    6   20 o  295.745   4.5528   66.951   2.0609   64.774   3.0707   68.736   2.7801  290.861   6.8973  299.638   6.0618 -8.777679 9.182467 
1 1 1    4    6   21 o  904.539   5.4097  626.328   7.4898  628.141   9.9349  623.941   11.400  905.762   7.1660  902.664   8.2510 3.097717 10.92848 
1 1 1    4    6   22 o  738.196   4.6601  417.115   5.2654  415.888   7.4408  418.345   7.4521  737.048   6.5956  739.221   6.5862 -2.173584 9.320947 
1 1 1    4    6   23 o  540.274   4.3841  223.421   3.6254  225.624   5.2200  221.368   5.0391  542.893   6.2819  537.752   6.1221 5.140991 8.771650 
1 1 1    4    6   24 o  429.441   4.8405  141.159   3.1817  150.245   5.1856  135.674   4.0293  442.998   7.6476  420.993   6.2530 22.00464 9.878556 
1 1 1    4    6   25 o  1376.60   7.7917  1450.79   16.418  1468.95   23.656  1433.92   22.803  1384.94   11.160  1368.35   10.888 16.59436 15.59087 
1 1 1    4    6   26 o  496.359   4.5954  188.573   3.4913  190.603   4.9714  186.598   4.9041  498.995   6.5090  493.725   6.4895 5.270325 9.191330 
1 1 1    4    6   27 o  651.966   5.0920  325.348   5.0814  328.789   7.7550  322.759   6.7266  655.347   7.7311  649.334   6.7680 6.013672 10.27499 
1 1 1    4    6   28 o  1194.37   6.2430  1091.95   11.413  1090.23   16.132  1093.68   16.149  1193.30   8.8323  1195.19   8.8275 -1.883911 12.48736 
1 1 1    4    6   29 o  241.847   8.4110   44.781   3.1136   44.775   4.4778   44.786   4.3324  241.475   12.154  241.818   11.705 -0.3436432 16.87360 
1 1 1    4    6   30 o  719.753   6.0806  396.552   6.6988  399.916   9.5606  393.308   9.3890  722.719   8.6426  716.726   8.5584 5.992615 12.16312 
1 1 1    4    6   31 o  752.031   5.3319  432.902   6.1374  427.249   8.6786  438.558   8.6807  747.036   7.5899  756.861   7.4932 -9.825378 10.66562 
1 1 1    4    6   32 o  132.177   15.789   13.584   3.1312   12.821   4.1678   14.572   4.7443  127.393   22.180  135.775   23.691 -8.382591 32.45321 
1 1 1    4    6   33 o  452.651   5.9329  156.848   4.1105  160.176   5.9269  153.764   5.7057  457.366   8.4664  448.122   8.3185 9.244263 11.86914 
1 1 1    4    6   34 o  349.226   7.2535   93.376   3.8772   98.779   5.3596   87.444   5.6159  359.126   9.7502  337.863   10.859 21.26297 14.59429 
1 1 1    4    6   35 o  617.589   5.7316  291.987   5.4181  296.990   7.8057  287.335   7.5266  622.765   8.1888  612.566   8.0274 10.19879 11.46710 
1 1 1    4    6   36 o  417.557   7.2444  133.502   4.6301  129.229   7.3943  136.258   5.9384  410.653   11.764  421.781   9.1983 -11.12723 14.93311 
1 1 1    4    6   37 o  113.022   20.803   10.129   3.4662   15.648   5.2380   5.8289   4.6233  140.411   25.303   88.914   29.297 51.49709 38.71136 
1 1 1    4    6   38 o  630.636   7.4830  304.570   7.2231  295.183   11.611  310.496   9.2256  620.496   12.225  636.614   9.4678 -16.11792 15.46279 
1 1 1    4    6   39 o  383.973   8.1102  112.937   4.7665  113.391   7.7919  112.665   6.0254  384.454   13.241  383.406   10.267 1.048248 16.75562 
1 1 1    4    6   40 f  169.913   14.136   22.318   3.6429   20.495   5.3431   23.902   4.9798  161.531   22.197  175.225   18.864 -13.69403 29.13044 
1 1 1    4    6   41 o  554.420   6.3045  235.418   5.3501  231.466   7.5835  239.334   7.5490  549.533   9.0159  558.813   8.8258 -9.279358 12.61665 
1 1 1    4    6   42 o   91.171   25.224   6.6436   3.6388   13.125   4.6478  -3.6211   5.8489  128.043   24.609   61.628   28.086 66.41431 37.34179 
1 1 1    4    6   43 o  360.108   7.5920   99.386   4.1846   93.857   5.8698  105.099   5.9673  349.680   10.967  370.072   10.535 -20.39130 15.20699 
1 1 1    4    6   44 o  413.789   8.0739  131.277   5.1137  130.042   6.8638  132.818   7.6662  411.529   10.897  415.745   12.047 -4.215668 16.24408 
1 1 1    4    6   45 o  238.460   9.7444   43.648   3.5566   51.784   5.0669   35.746   4.9936  259.460   12.759  214.799   15.288 44.66040 19.91256 
1 1 1    4    6   46 o  430.466   7.0676  142.064   4.6567  134.677   6.2746  151.121   6.9479  418.787   9.7886  443.548   10.234 -24.76099 14.16159 
1 1 1    4    6   47 o  292.619   8.5827   65.722   3.8441   67.234   5.2990   64.042   5.5851  295.596   11.712  288.364   12.654 7.231781 17.24198 
1 1 1    4    6   48 o  372.295   8.2739  106.396   4.7149  103.274   6.8815  109.158   6.4729  366.129   12.279  376.618   11.229 -10.48877 16.63931 
1 1 1    4    6   49 o  170.133   14.143   22.522   3.6497   21.734   4.7092   23.706   5.7752  166.049   18.863  172.530   22.398 -6.481262 29.28280 
1 1 1    4    6   50 o  222.495   12.262   38.315   4.1598   43.533   6.7730   35.154   5.2712  235.450   18.954  212.152   16.359 23.29778 25.03759 
1 1 1    4    6   51 o  314.653   8.4992   76.109   4.0933   73.963   5.7406   78.329   5.8384  309.476   12.119  318.513   11.976 -9.036896 17.03756 
1 1 1    4    6   52 o  570.208   7.0547  249.656   6.1572  247.121   9.2233  251.695   8.2696  566.112   10.644  571.781   9.4490 -5.668762 14.23322 
1 1 1    4    6   53 o  360.554   8.9349  100.061   4.9309   99.503   6.2828  100.955   7.9567  358.895   11.437  360.515   14.419 -1.620483 18.40434 
1 1 1    4    6   54 o  197.517   12.840   30.360   3.8607   31.280   5.5042   29.470   5.4165  198.837   18.290  192.853   18.579 5.984116 26.07169 
1 1 1    4    6   55 o   88.459   26.025   6.4643   3.7594   6.4825   5.6208   6.4497   5.0569   91.730   32.268   90.325   30.656 1.404778 44.50859 
1 1 1    4    6   56 o  103.407   24.945   8.9646   3.9026   12.607   5.1243   3.9342   6.0221  121.894   28.048   82.419   32.468 39.47479 42.90504 
1 1 1    4    6   57 o  281.144   10.092   61.093   4.3430   57.451   6.1136   64.804   6.1705  270.725   14.810  288.253   13.985 -17.52802 20.36970 
1 1 1    4    6   58 o  235.988   12.051   43.383   4.3383   40.397   5.8616   47.000   6.4513  225.698   17.094  243.365   17.434 -17.66634 24.41674 
1 1 1    4    6   59 o  132.712   21.183   14.476   4.1582   16.134   6.1217   13.056   5.6658  135.941   30.205  121.949   30.447 13.99163 42.88801 
1 1 1    4    6   60 o  203.462   13.774   32.604   4.2643   37.280   5.5502   25.868   6.6622  216.113   16.914  175.132   25.610 40.98105 30.69100 
1 1 1    4    6   61 o  150.942   18.706   18.562   4.2291   10.326   6.5865   24.341   5.5165  106.320   34.966  171.566   21.478 -65.24680 41.03510 
1 1 1    4    6   62 o   53.337   23.385  -0.2538   3.6559   2.3709   5.1669  -2.8852   5.1735   70.819   29.279   55.898   25.819 14.92030 39.03686 
1 1 1    4    6   63 o  103.178   24.511   9.3570   3.8137   13.203   5.3785   5.4678   5.4083  119.959   29.498   82.591   31.231 37.36815 42.95953 
1 1 1    4    6   64 o  207.736   13.098   34.351   4.1433   38.874   5.3690   27.692   6.5150  218.895   16.139  178.123   24.548 40.77130 29.37783 
1 1 1    4    6   65 o   92.572   25.030   7.8000   3.6317   7.0414   5.0913   8.5858   5.1819   87.018   30.700   94.375   31.013 -7.357048 43.63822 
1 1 1    4    7    0 o  829.814   12.331  527.519   15.654  527.519   15.654  527.519   15.654  829.814   12.331  829.814   12.331 0.000000 0.000000 
1 1 1    4    7    1 o  402.009   6.3581  123.706   3.9123  127.809   5.6414  119.904   5.4304  408.584   9.0205  395.746   8.9649 12.83743 12.71770 
1 1 1    4    7    2 o  612.343   7.3761  287.037   6.9134  290.348   9.8747  283.853   9.6822  615.787   10.477  608.865   10.389 6.922913 14.75460 
1 1 1    4    7    3 o  916.362   9.3672  642.905   13.138  643.282   18.585  642.529   18.576  916.447   13.249  915.911   13.250 0.5365601 18.73806 
1 1 1    4    7    4 o  1116.06   10.883  953.789   18.591  972.217   26.932  937.018   25.694  1126.46   15.620  1105.92   15.179 20.54529 21.78046 
1 1 1    4    7    5 o  995.144   7.1061  758.080   10.824  763.856   15.472  752.543   15.148  998.806   10.120  991.389   9.9825 7.417358 14.21527 
1 1 1    4    7    6 o  1002.89   7.1442  769.931   10.967  776.313   15.653  763.779   15.369  1006.91   10.157  998.752   10.054 8.157043 14.29093 
1 1 1    4    7    7 o  1386.44   9.1948  1471.72   19.512  1463.69   27.407  1479.98   27.786  1382.36   12.953  1390.03   13.060 -7.662720 18.39400 
1 1 1    4    7    8 o  916.662   6.7658  643.222   9.4929  654.476   13.660  632.711   13.202  924.534   9.6530  909.038   9.4881 15.49567 13.53530 
1 1 1    4    7    9 o  814.454   6.3279  507.769   7.8885  507.491   11.148  508.047   11.164  814.143   8.9461  814.589   8.9538 -0.4454956 12.65711 
1 1 1    4    7   10 o  143.946   6.7363   15.862   1.4842   16.732   2.1518   15.072   2.0498  147.512   9.5823  139.967   9.6265 7.544998 13.58271 
1 1 1    4    7   11 o  757.079   8.6295  438.852   9.9999  432.368   14.031  445.545   14.256  751.296   12.201  762.657   12.212 -11.36127 17.26291 
1 1 1    4    7   12 o  851.134   7.5259  554.621   9.8045  550.891   11.917  562.437   17.249  848.190   9.1790  856.783   13.153 -8.593628 16.03932 
1 1 1    4    7   13 o  969.333   6.3864  719.303   9.4754  721.032   12.224  716.700   14.999  970.404   8.2295  967.364   10.130 3.039978 13.05132 
1 1 1    4    7   14 o  544.158   4.5059  226.652   3.7530  219.149   5.1541  235.120   5.4756  535.035   6.2936  554.183   6.4552 -19.14844 9.015495 
1 1 1    4    7   15 o  1751.63   9.2733  2349.92   24.863  2357.87   35.271  2342.08   35.052  1753.92   13.138  1748.05   13.100 5.874390 18.55364 
1 1 1    4    7   16 o  1158.29   6.6897  1027.19   11.860  1015.74   16.537  1039.31   17.019  1151.58   9.3821  1164.85   9.5454 -13.27271 13.38423 
1 1 1    4    7   17 o  653.881   4.9503  327.296   4.9545  315.830   6.7994  340.275   7.2342  642.253   6.9166  666.638   7.0897 -24.38452 9.904743 
1 1 1    4    7   18 o  652.036   4.9562  325.451   4.9464  337.791   7.1871  314.344   6.8182  664.202   7.0694  640.741   6.9521 23.46118 9.915025 
1 1 1    4    7   19 o  185.701   5.7629   26.400   1.6381   30.527   2.6858   23.956   2.0670  199.647   8.7890  176.875   7.6349 22.77176 11.64208 
1 1 1    4    7   20 o  1128.75   6.1656  975.399   10.652  973.830   14.079  977.499   16.292  1127.71   8.1563  1129.72   9.4219 -2.012573 12.46183 
1 1 1    4    7   21 o  1126.24   5.7861  971.002   9.9745  978.698   14.230  963.570   13.985  1130.54   8.2236  1121.77   8.1449 8.765625 11.57439 
1 1 1    4    7   22 o  914.465   5.1331  640.113   7.1848  644.318   10.253  636.055   10.071  917.375   7.3019  911.478   7.2186 5.897217 10.26778 
1 1 1    4    7   23 o  1500.85   7.6864  1724.57   17.658  1754.45   27.634  1703.96   22.955  1513.39   11.929  1491.66   10.054 21.73474 15.60115 
1 1 1    4    7   24 o  690.583   5.0153  365.035   5.3013  369.749   8.3620  361.868   6.8550  694.953   7.8612  687.545   6.5138 7.407043 10.20921 
1 1 1    4    7   25 o  771.098   5.6176  455.128   6.6302  457.169   9.6050  453.270   9.1637  772.753   8.1206  769.462   7.7806 3.290588 11.24639 
1 1 1    4    7   26 o  1093.45   6.2117  915.226   10.396  909.170   15.753  919.899   13.838  1089.69   9.4446  1096.16   8.2478 -6.470703 12.53896 
1 1 1    4    7   27 o  657.383   5.5747  330.786   5.6093  331.633   9.7251  330.363   6.8666  658.119   9.6543  656.937   6.8289 1.182434 11.82531 
1 1 1    4    7   28 o  805.542   5.5481  496.693   6.8407  497.489   10.626  496.129   8.9395  806.094   8.6123  805.038   7.2548 1.056274 11.26072 
1 1 1    4    7   29 o  446.398   5.7205  152.533   3.9087  152.047   5.1464  153.196   6.0086  445.655   7.5446  447.311   8.7759 -1.655548 11.57311 
1 1 1    4    7   30 o  935.595   5.5728  670.034   7.9804  667.379   11.275  672.700   11.297  933.651   7.8899  937.367   7.8737 -3.715149 11.14657 
1 1 1    4    7   31 o  611.153   5.2458  285.902   4.9072  288.539   7.0628  283.440   6.8231  613.907   7.5163  608.464   7.3262 5.443359 10.49607 
1 1 1    4    7   32 o  842.725   6.3672  543.670   8.2130  547.466   11.542  539.776   11.689  845.546   8.9184  839.577   9.0958 5.969116 12.73862 
1 1 1    4    7   33 o  551.063   5.5603  232.458   4.6899  230.409   6.6571  234.477   6.6083  548.563   7.9284  553.388   7.8018 -4.825562 11.12330 
1 1 1    4    7   34 o  737.882   5.9446  416.811   6.7140  410.838   8.9648  424.441   10.132  732.489   7.9959  744.471   8.8915 -11.98163 11.95802 
1 1 1    4    7   35 f  318.262   7.6177   77.559   3.7109   76.138   5.2872   78.939   5.2097  315.244   10.957  321.003   10.603 -5.758881 15.24757 
1 1 1    4    7   36 o  277.983   9.2595   59.189   3.9398   62.879   6.4141   56.953   4.9927  285.960   14.704  272.605   11.965 13.35538 18.95719 
1 1 1    4    7   37 o  570.837   7.0622  249.517   6.1705  244.964   9.2982  253.100   8.2487  565.402   10.744  574.802   9.3755 -9.399109 14.25966 
1 1 1    4    7   38 o  501.994   6.9588  192.974   5.3469  191.463   8.6856  193.896   6.7849  499.774   11.354  503.101   8.8109 -3.327057 14.37185 
1 1 1    4    7   39 o  297.783   8.6416   67.937   3.9388   73.842   5.9460   63.320   5.2578  310.270   12.520  287.345   11.955 22.92538 17.31093 
1 1 1    4    7   40 o  672.687   6.2891  346.542   6.4755  348.787   9.7546  344.772   8.6585  674.581   9.4472  670.789   8.4331 3.791748 12.66364 
1 1 1    4    7   41 o  847.832   6.0725  550.517   7.8803  562.609   11.323  539.158   10.975  856.778   8.6339  838.743   8.5484 18.03430 12.14991 
1 1 1    4    7   42 o  454.388   7.1960  158.196   5.0048  157.356   6.4975  159.421   7.8480  452.997   9.3709  455.764   11.250 -2.766357 14.64155 
1 1 1    4    7   43 f  458.494   6.5517  161.058   4.5979  160.815   6.5152  161.300   6.4896  457.893   9.2959  458.589   9.2454 -0.6957092 13.11073 
1 1 1    4    7   44 o  645.659   6.9416  319.486   6.8601  321.438   9.4282  317.291   10.000  647.231   9.5170  642.924   10.162 4.306458 13.92271 
1 1 1    4    7   45 o  423.165   6.8722  137.253   4.4512  138.538   6.3988  136.049   6.1959  424.800   9.8411  420.997   9.6151 3.803406 13.75855 
1 1 1    4    7   46 o  241.694   10.011   44.869   3.7034   42.544   5.0647   47.540   5.4292  234.504   14.177  247.902   14.370 -13.39749 20.18595 
1 1 1    4    7   47 o   58.596   23.314   1.4465   3.1338   0.1395   4.4650   2.7154   4.3994   62.372   26.582   72.036   27.931 -9.664146 38.55850 
1 1 1    4    7   48 o  497.420   7.0376  189.785   5.3581  196.007   8.5203  185.714   6.8914  504.684   11.030  491.674   9.1572 13.00977 14.33557 
1 1 1    4    7   49 o  293.305   10.359   66.198   4.6505   66.369   7.2381   66.078   6.0688  292.093   16.254  292.474   13.556 -0.3811951 21.16519 
1 1 1    4    7   50 o   87.174   24.468   6.1874   3.3983   8.6108   4.7385   3.6209   4.8763  102.203   28.966   77.758   29.595 24.44582 41.41073 
1 1 1    4    7   51 o   93.933   24.427   7.2617   3.5449   9.8970   5.0946   4.7884   4.9356  108.897   29.731   82.956   30.111 25.94067 42.31547 
1 1 1    4    7   52 o  219.200   11.216   37.179   3.7505   41.310   5.4213   33.386   5.1941  229.983   15.491  206.331   16.587 23.65193 22.69565 
1 1 1    4    7   53 o  134.962   19.983   14.626   4.0033   15.938   4.9204   12.058   6.8854  139.710   23.867  118.785   35.292 20.92421 42.60490 
1 1 1    4    7   54 o  130.931   18.345   13.705   3.5755   12.478   5.0390   14.949   5.0741  121.885   27.646  134.401   25.600 -12.51572 37.67827 
1 1 1    4    7   55 o  261.167   10.363   52.676   4.1425   54.043   6.1824   51.562   5.5804  262.667   15.445  256.989   14.242 5.677795 21.00963 
1 1 1    4    7   56 o  222.026   12.726   38.408   4.3069   35.257   5.6622   42.734   6.6344  210.941   17.701  231.850   18.858 -20.90933 25.86404 
1 1 1    4    7   57 o  114.081   23.152   10.816   3.9046   4.3597   5.2837   18.585   5.7957   80.993   30.811  148.997   26.378 -68.00404 40.56029 
1 1 1    4    7   58 o  144.824   17.773   16.818   3.8570   20.829   5.4449   12.779   5.4644  159.131   23.024  121.368   29.665 37.76212 37.55145 
1 1 1    4    7   59 o   83.221   27.599   5.6664   4.1005   4.4118   5.9685   6.7880   5.6431   82.737   32.406   91.497   32.317 -8.760536 45.76606 
1 1 1    4    7   60 o   53.924   24.441  -1.7660   4.3539  -4.6439   6.6333   0.4123   5.7710   61.248   28.610   68.322   29.677 -7.074913 41.22209 
1 1 1    4    7   61 o  252.095   10.789   49.482   4.1632   41.043   5.7224   58.971   6.0681  226.422   16.628  272.941   14.578 -46.51872 22.11315 
1 1 1    4    7   62 o   87.862   26.793   6.7473   3.9306   5.6198   5.8140   7.6964   5.3343   84.951   32.319   93.240   31.486 -8.289284 45.12107 
1 1 1    4    7   63 o   55.523   23.934   0.4162   3.6963  -3.8936   5.0841   5.2487   5.3836   52.645   24.736   81.449   31.073 -28.80441 39.71674 
1 1 1    4    7   64 o   99.871   25.988   9.0570   4.0109   10.278   5.1620   7.1964   6.3717  103.881   30.478   89.502   33.886 14.37887 45.57561 
1 1 1    4    7   65 o  109.259   22.749   10.546   3.6808   12.375   5.4229   8.9840   5.0122  112.817   30.621   96.436   30.399 16.38180 43.14782 
1 1 1    4    8    0 o  1742.81   22.302  2328.43   59.471  2328.43   59.471  2328.43   59.471  1742.81   22.302  1742.81   22.302 0.000000 0.000000 
1 1 1    4    8    1 o  1107.84   15.245  940.312   25.850   0.0000   0.0000  940.312   25.850  ?   ?   1107.84   15.245 0.000000 15.24470 
1 1 1    4    8    2 o  1073.74   14.900  883.278   24.488   0.0000   0.0000  883.278   24.488  ?   ?   1073.74   14.900 0.000000 14.90012 
1 1 1    4    8    3 o  467.105   9.5847  167.056   6.8527   0.0000   0.0000  167.056   6.8527  ?   ?   467.105   9.5847 0.000000 9.584724 
1 1 1    4    8    4 o  235.855   5.5878   42.579   2.0172   43.175   2.4930   41.449   3.4330  237.492   6.8582  232.668   9.6399 4.824081 11.83055 
1 1 1    4    8    5 o  476.945   4.9579  174.113   3.6194  175.100   5.1344  173.137   5.1030  478.266   7.0138  475.578   7.0102 2.687988 9.916458 
1 1 1    4    8    6 o  2058.88   13.008  3246.97   40.993  3272.41   58.552  3222.52   57.411  2066.00   18.516  2050.23   18.294 15.76538 26.02913 
1 1 1    4    8    7 f  454.042   4.9937  157.794   3.4704  156.470   4.8728  159.156   4.9439  452.103   7.0415  455.968   7.0838 -3.864410 9.988167 
1 1 1    4    8    8 o  1039.95   7.4015  827.933   11.782  812.089   16.329  845.136   17.015  1029.80   10.360  1050.53   10.582 -20.73047 14.80859 
1 1 1    4    8    9 o  808.587   7.2938  500.527   9.0272  515.473   16.077  493.646   10.909  820.304   12.804  802.949   8.8764 17.35522 15.58008 
1 1 1    4    8   10 f  1344.98   12.757  1385.84   26.262  1388.21   37.280  1383.50   37.000  1345.44   18.103  1343.18   17.997 2.266357 25.52659 
1 1 1    4    8   11 o  794.208   7.2806  482.905   8.8506  477.150   10.759  494.955   15.567  789.392   8.9042  803.769   12.653 -14.37726 15.47231 
1 1 1    4    8   12 o  178.423   6.6060   24.371   1.8041   26.008   2.5853   22.818   2.5188  184.290   9.1651  172.345   9.5860 11.94478 13.26237 
1 1 1    4    8   13 o  260.741   5.7985   52.045   2.3142   51.337   3.2327   52.788   3.3143  258.930   8.1566  262.562   8.2469 -3.632324 11.59920 
1 1 1    4    8   14 o  297.712   4.9575   67.846   2.2591   66.535   2.8145   70.221   3.7876  294.802   6.2373  302.822   8.1717 -8.020203 10.28012 
1 1 1    4    8   15 o   47.498   15.854   1.6273   1.3524   1.8580   1.6284   1.1146   2.4278   51.240   17.396   52.013   20.575 -0.7729836 26.94358 
1 1 1    4    8   16 o  617.329   5.3078  291.736   5.0153  304.276   6.5936  274.520   7.7257  630.402   6.8333  598.714   8.4304 31.68738 10.85198 
1 1 1    4    8   17 o  187.482   6.5892   26.912   1.8909   29.701   2.3525   21.820   3.1782  196.943   7.8040  168.272   12.427 28.67117 14.67467 
1 1 1    4    8   18 o  814.067   6.7035  507.391   8.3528  512.429   11.801  502.333   11.825  817.931   9.4259  809.825   9.5394 8.106262 13.41072 
1 1 1    4    8   19 o  693.483   5.5871  368.155   5.9305  365.648   9.3084  369.868   7.6942  690.976   8.8012  695.029   7.2326 -4.053162 11.39169 
1 1 1    4    8   20 o  301.587   5.2539   69.625   2.4253   69.614   3.4043   69.635   3.4561  301.531   7.3760  301.574   7.4873 -0.4345703E-01 10.51023 
1 1 1    4    8   21 o  650.530   4.7468  323.927   4.7264  329.778   7.3760  319.851   6.1565  656.303   7.3426  646.386   6.2226 9.916809 9.624649 
1 1 1    4    8   22 o  312.027   4.6074   74.522   2.2005   77.020   3.2027   72.289   3.0285  317.189   6.5967  307.295   6.4387 9.894440 9.218116 
1 1 1    4    8   23 o  822.851   5.2720  518.268   6.6399  527.052   10.395  512.215   8.6297  829.696   8.1857  817.983   6.8926 11.71356 10.70106 
1 1 1    4    8   24 o  840.270   5.7388  540.452   7.3809  538.853   10.556  541.981   10.324  838.946   8.2208  841.385   8.0163 -2.439148 11.48228 
1 1 1    4    8   25 o  679.633   5.4151  353.553   5.6331  332.739   7.8640  375.488   8.0730  659.270   7.7931  700.348   7.5310 -41.07831 10.83735 
1 1 1    4    8   26 o  569.969   5.7601  248.666   5.0252  249.593   8.1649  248.101   6.3758  570.951   9.3429  569.291   7.3170 1.659302 11.86711 
1 1 1    4    8   27 o  1367.74   7.2900  1432.09   15.262  1426.73   23.340  1436.09   20.172  1364.93   11.172  1369.51   9.6229 -4.582397 14.74484 
1 1 1    4    8   28 o  702.351   4.9987  377.578   5.3737  379.691   7.6458  375.516   7.5543  704.264   7.0928  700.383   7.0467 3.880981 9.998206 
1 1 1    4    8   29 o  414.277   5.8224  131.373   3.6920  131.690   4.8320  130.929   5.7228  414.748   7.6115  413.518   9.0416 1.229462 11.81890 
1 1 1    4    8   30 o  376.112   5.6855  108.284   3.2731  108.400   4.6674  108.171   4.5913  376.275   8.1039  375.880   7.9802 0.3954468 11.37357 
1 1 1    4    8   31 o  395.097   6.6520  119.502   4.0227  122.994   5.5157  115.535   5.8798  400.778   8.9914  388.412   9.8900 12.36591 13.36630 
1 1 1    4    8   32 o  281.219   7.3468   60.548   3.1624   57.774   4.4846   63.291   4.4600  274.643   10.668  287.469   10.136 -12.82623 14.71571 
1 1 1    4    8   33 o  311.631   7.4215   74.355   3.5400   68.519   4.8504   81.006   5.1782  299.085   10.595  325.203   10.403 -26.11792 14.84865 
1 1 1    4    8   34 o  460.941   6.0415  162.654   4.2624  158.429   6.0984  166.690   5.9600  454.837   8.7597  466.559   8.3458 -11.72198 12.09897 
1 1 1    4    8   35 o  302.359   7.7770   70.005   3.5992   69.732   5.2033   70.255   4.9838  301.677   11.269  302.822   10.752 -1.144867 15.57549 
1 1 1    4    8   36 o  348.662   7.9466   93.095   4.2409  102.830   6.9704   87.374   5.3437  366.267   12.433  337.704   10.338 28.56354 16.16989 
1 1 1    4    8   37 o  612.959   6.9008  287.699   6.4744  293.904   9.8534  282.985   8.5887  619.319   10.395  607.785   9.2322 11.53394 13.90249 
1 1 1    4    8   38 o  620.150   5.9683  294.467   5.6652  307.117   8.1406  282.587   7.8890  633.185   8.3996  607.367   8.4860 25.81873 11.94001 
1 1 1    4    8   39 o  321.004   8.1044   78.940   3.9820   76.181   5.8285   81.354   5.4530  315.152   12.083  325.743   10.937 -10.59027 16.29748 
1 1 1    4    8   40 o  351.623   7.8113   94.725   4.2041   89.976   6.1646   98.853   5.7481  342.462   11.760  359.050   10.459 -16.58752 15.73856 
1 1 1    4    8   41 o  676.164   6.8198  350.232   7.0582  340.926   9.4577  361.931   10.604  666.853   9.2659  686.978   10.085 -20.12506 13.69509 
1 1 1    4    8   42 f  312.857   7.9519   75.019   3.8079   70.633   5.4369   79.242   5.3349  303.313   11.711  321.338   10.847 -18.02484 15.96233 
1 1 1    4    8   43 o  255.341   8.9543   50.004   3.4996   52.830   5.0485   47.390   4.8555  262.185   12.580  247.972   12.837 14.21317 17.97344 
1 1 1    4    8   44 o  235.919   10.811   42.745   3.9039   41.212   5.1459   44.823   5.9922  230.861   14.638  240.500   16.376 -9.638916 21.96455 
1 1 1    4    8   45 o  457.166   6.7182  160.193   4.7011  162.685   6.4848  157.432   6.8249  460.404   9.2021  452.818   9.8469 7.586304 13.47741 
1 1 1    4    8   46 o  483.097   6.6324  178.905   4.9043  182.730   6.7509  174.632   7.1366  487.889   9.0400  476.832   9.7781 11.05679 13.31665 
1 1 1    4    8   47 o  228.815   9.8451   40.232   3.4481   41.976   4.9723   38.616   4.7857  232.829   14.018  223.273   14.076 9.556229 19.86506 
1 1 1    4    8   48 o  184.740   12.806   26.443   3.5989   24.553   5.7031   27.694   4.6393  175.966   21.630  188.393   16.247 -12.42761 27.05241 
1 1 1    4    8   49 f  194.539   13.914   29.401   4.1158   33.729   7.0142   27.128   5.0828  206.065   22.610  185.857   18.097 20.20851 28.96033 
1 1 1    4    8   50 o  207.772   11.569   33.398   3.6647   30.539   4.9323   36.921   5.4755  197.548   16.462  217.296   16.588 -19.74832 23.37011 
1 1 1    4    8   51 o  364.106   8.2741  101.905   4.6113   99.963   6.5995  103.758   6.4459  359.760   11.985  366.661   11.485 -6.901794 16.59961 
1 1 1    4    8   52 o  266.071   9.8319   54.538   4.0041   56.619   5.6357   52.417   5.6900  269.936   13.685  259.494   14.382 10.44186 19.85227 
1 1 1    4    8   53 o  196.531   13.720   30.112   4.1014   33.068   5.1757   25.122   6.7241  205.141   16.627  175.304   25.834 29.83759 30.72193 
1 1 1    4    8   54 o  195.714   12.149   29.770   3.6216   31.462   5.2226   28.203   5.0263  199.700   17.256  188.890   17.587 10.81004 24.63853 
1 1 1    4    8   55 o  315.937   9.9737   77.047   4.8231   76.852   6.5724   77.275   7.0998  314.366   13.659  314.823   14.734 -0.4561462 20.09106 
1 1 1    4    8   56 o   81.460   25.682   5.3873   3.5774   4.2853   5.1308   6.4299   4.9905   80.343   30.410   89.713   30.454 -9.369904 43.03728 
1 1 1    4    8   57 o   89.811   26.014   6.7628   3.7822   11.886   5.2262   1.1285   5.4805  117.530   29.185   70.038   29.633 47.49174 41.59187 
1 1 1    4    8   58 o  253.811   10.807   49.936   4.1983   54.213   5.9492   45.693   5.9255  262.587   14.863  240.397   16.198 22.19048 21.98362 
1 1 1    4    8   59 o  105.688   25.448   9.5544   4.0673   9.7396   5.9843   9.3954   5.5449  105.119   33.225  103.476   31.871 1.643349 46.03951 
1 1 1    4    8   60 o  219.152   15.408   38.121   5.1356   19.553   7.3705   55.643   7.1598  146.626   33.565  263.403   17.864 -116.7764 38.02330 
1 1 1    4    8   61 o   74.378   25.967   4.3982   3.6367   0.1057   5.0555   9.0017   5.2355   63.197   27.609  100.197   30.986 -36.99907 41.50156 
1 1 1    4    8   62 o   98.380   26.068   8.5472   3.9884   15.771   5.9077   2.4974   5.4064  131.886   29.948   72.018   29.877 59.86777 42.30281 
1 1 1    4    8   63 o  182.805   14.178   26.721   3.9361   29.837   5.5056   23.464   5.6295  189.951   19.200  165.804   22.784 24.14658 29.79525 
1 1 1    4    8   64 o   95.928   26.439   8.4207   4.0067   13.502   5.1910   0.9321   6.3020  120.420   28.590   69.245   30.520 51.17434 41.81983 
1 1 1    4    8   65 o   78.335   26.130   5.4928   3.6736   1.5623   5.3496   9.0005   5.0536   66.503   28.730   96.313   30.542 -29.81036 41.93122 
1 1 1    4    9    0 o  115.809   13.682   10.692   2.3363   10.692   2.3363   10.692   2.3363  115.809   13.682  115.809   13.682 0.000000 0.000000 
1 1 1    4    9    1 o  915.758   9.4643  642.096   13.266  652.129   19.049  632.647   18.485  922.667   13.488  908.793   13.289 13.87415 18.93504 
1 1 1    4    9    2 o  674.221   7.9012  348.003   8.1539  366.017   12.011  332.605   11.105  691.332   11.351  659.036   11.009 32.29547 15.81233 
1 1 1    4    9    3 o  834.289   8.9233  532.909   11.395  558.672   16.839  511.143   15.477  854.025   12.882  816.917   12.378 37.10797 17.86459 
1 1 1    4    9    4 o  785.100   7.0922  471.852   8.5227  478.652   10.609  459.474   14.312  790.682   8.7658  774.538   12.072 16.14398 14.91916 
1 1 1    4    9    5 o  1296.09   10.070  1286.32   19.978  1327.03   35.761  1267.84   24.087  1315.68   17.758  1286.58   12.232 29.09705 21.56285 
1 1 1    4    9    6 o  439.681   5.7093  147.977   3.8423  151.903   6.7139  146.066   4.6854  445.395   9.8483  436.812   7.0078 8.582794 12.08712 
1 1 1    4    9    7 o  755.346   6.9992  436.773   8.0922  448.650   14.306  431.185   9.8128  765.323   12.213  750.446   8.5428 14.87732 14.90409 
1 1 1    4    9    8 o  605.932   5.5382  281.040   5.1365  271.908   7.1141  290.985   7.4239  595.950   7.7991  616.500   7.8673 -20.54993 11.07790 
1 1 1    4    9    9 o  682.053   6.7096  356.125   7.0046  364.983   8.7596  340.417   11.665  690.430   8.2889  666.656   11.432 23.77405 14.12077 
1 1 1    4    9   10 o  965.506   8.1797  713.757   12.088  706.211   14.662  729.774   21.360  960.279   9.9752  975.814   14.301 -15.53479 17.43627 
1 1 1    4    9   11 o  818.769   6.4558  513.212   8.0906  519.776   11.564  506.919   11.323  823.858   9.1706  813.609   9.0925 10.24902 12.91403 
1 1 1    4    9   12 o  565.426   5.6041  244.738   4.8501  248.148   6.9148  241.437   6.8047  569.278   7.9357  561.528   7.9172 7.750061 11.20968 
1 1 1    4    9   13 o  320.697   5.5314   78.731   2.7152   77.525   3.8396   79.938   3.8401  318.186   7.8837  323.104   7.7649 -4.917267 11.06557 
1 1 1    4    9   14 o  606.421   5.8515  281.530   5.4314  283.967   7.7222  279.144   7.6408  608.944   8.2850  603.752   8.2682 5.192444 11.70486 
1 1 1    4    9   15 o  454.630   5.5535  158.228   3.8645  167.019   5.4337  149.230   5.4974  467.028   7.6012  441.439   8.1361 25.58871 11.13432 
1 1 1    4    9   16 o  693.818   5.5116  368.516   5.8532  374.471   7.5900  359.778   9.1940  699.335   7.0907  685.392   8.7638 13.94330 11.27309 
1 1 1    4    9   17 o  122.390   8.9249   11.533   1.6604   12.776   2.0413   9.1043   2.8543  128.715   10.452  107.467   17.988 21.24783 20.80416 
1 1 1    4    9   18 f  922.618   7.1641  651.750   10.117  642.843   13.988  661.521   14.651  916.096   9.9757  929.282   10.300 -13.18640 14.33887 
1 1 1    4    9   19 o  725.224   5.2672  402.610   5.8469  405.888   8.2726  399.337   8.2648  728.089   7.4231  722.187   7.4768 5.901550 10.53589 
1 1 1    4    9   20 o  687.128   5.2243  361.414   5.4946  365.645   7.8278  357.304   7.7145  691.068   7.4003  683.141   7.3778 7.926270 10.44971 
1 1 1    4    9   21 o  1333.44   7.5759  1361.31   15.463  1361.69   21.871  1360.94   21.864  1333.37   10.716  1333.00   10.716 0.3698730 15.15479 
1 1 1    4    9   22 o  577.295   5.0969  255.097   4.5038  266.587   8.3729  250.419   5.3425  590.045   9.2708  571.958   6.1025 18.08691 11.09908 
1 1 1    4    9   23 o  986.958   6.2754  745.646   9.4800  783.500   17.538  730.022   11.268  1011.45   11.329  976.514   7.5387 34.93140 13.60771 
1 1 1    4    9   24 o  331.085   6.0370   83.908   3.0594   80.495   5.5855   85.371   3.6567  324.204   11.256  333.946   7.1538 -9.741882 13.33670 
1 1 1    4    9   25 o  754.944   5.6461  436.254   6.5242  446.057   11.518  431.624   7.9166  763.250   9.8596  750.896   6.8879 12.35352 12.02726 
1 1 1    4    9   26 o  431.026   4.7766  142.200   3.1513  138.646   4.4604  145.741   4.4530  425.581   6.8473  436.336   6.6674 -10.75513 9.557219 
1 1 1    4    9   27 o  1017.79   5.6803  792.922   8.8491  802.440   12.720  783.996   12.319  1023.79   8.1172  1011.96   7.9531 11.82709 11.36399 
1 1 1    4    9   28 o  1170.13   6.6504  1048.13   11.911  1058.12   15.872  1035.24   18.022  1175.58   8.8208  1162.72   10.126 12.86230 13.42948 
1 1 1    4    9   29 o  1111.31   6.5035  945.418   11.062  951.898   14.659  936.846   16.860  1115.01   8.5893  1106.07   9.9588 8.935303 13.15119 
1 1 1    4    9   30 o  228.262   7.6638   39.891   2.6776   42.251   3.8218   37.615   3.7526  234.877   10.631  221.610   11.063 13.26738 15.34278 
1 1 1    4    9   31 o  967.287   6.6365  716.281   9.8257  704.826   13.560  728.946   14.258  959.383   9.2340  975.641   9.5476 -16.25751 13.28245 
1 1 1    4    9   32 o  1171.64   6.8088  1050.94   12.211  1044.75   16.143  1059.22   18.667  1168.03   9.0297  1175.98   10.371 -7.949463 13.75075 
1 1 1    4    9   33 o  491.735   5.7774  185.105   4.3484  187.380   6.1715  182.863   6.1279  494.680   8.1508  488.680   8.1925 6.000000 11.55652 
1 1 1    4    9   34 o  313.937   7.6168   75.465   3.6600   84.164   5.6112   69.023   4.8286  331.443   11.061  300.170   10.510 31.27338 15.25736 
1 1 1    4    9   35 o  621.550   6.2458  295.770   5.9420  304.713   9.6022  290.220   7.5643  630.695   9.9468  615.615   8.0277 15.07953 12.78211 
1 1 1    4    9   36 o  992.290   6.5060  753.899   9.8815  753.224   13.364  754.712   14.677  991.661   8.8046  992.556   9.6608 -0.8952026 13.07100 
1 1 1    4    9   37 o  540.975   6.9756  224.104   5.7760  231.449   8.9721  218.905   7.5483  549.553   10.666  534.545   9.2256 15.00769 14.10255 
1 1 1    4    9   38 o  427.382   6.7929  139.878   4.4437  152.327   6.7618  130.415   5.8955  445.832   9.9088  412.553   9.3362 33.27887 13.61430 
1 1 1    4    9   39 o  873.644   6.0224  584.473   8.0533  591.174   11.576  578.188   11.211  878.368   8.6102  868.689   8.4315 9.679199 12.05097 
1 1 1    4    9   40 f  354.213   7.1575   96.114   3.8806   94.968   5.5468   97.213   5.4310  351.915   10.298  356.072   9.9650 -4.157166 14.32967 
1 1 1    4    9   41 o  627.150   6.5653  301.290   6.3022  297.948   8.1517  306.254   9.9363  623.463   8.5422  631.872   10.274 -8.409058 13.36107 
1 1 1    4    9   42 o  392.005   7.1602  117.752   4.2962  119.907   6.3075  115.887   5.8678  395.299   10.425  388.669   9.8634 6.630005 14.35137 
1 1 1    4    9   43 o  248.208   10.656   47.297   4.0482   48.404   5.4502   45.935   6.0462  250.382   14.280  243.560   16.312 6.821503 21.68010 
1 1 1    4    9   44 o  189.495   12.696   27.741   3.6611   30.813   4.7392   23.194   5.7655  199.295   15.662  171.342   22.530 27.95308 27.43911 
1 1 1    4    9   45 o  381.948   7.2729  111.853   4.2519  111.597   5.8097  112.148   6.2394  381.205   9.9570  382.048   10.670 -0.8422852 14.59406 
1 1 1    4    9   46 o  198.879   10.602   30.488   3.2158   31.092   4.6467   29.933   4.4549  200.085   15.288  196.364   14.934 3.721619 21.37187 
1 1 1    4    9   47 o  346.474   7.3576   92.087   3.9019   89.941   5.6187   94.086   5.4228  341.962   10.735  349.848   10.127 -7.885925 14.75759 
1 1 1    4    9   48 o  273.118   9.7333   57.350   4.0689   57.781   6.1635   57.017   5.4172  272.932   14.809  271.834   13.020 1.098328 19.71852 
1 1 1    4    9   49 o  122.792   20.101   12.077   3.6471   18.610   6.5056   9.0820   4.4043  150.186   29.352  104.918   27.200 45.26833 40.01738 
1 1 1    4    9   50 o   46.712   20.898  -1.2137   3.0682  -2.6922   4.3617   0.2346   4.3168   52.724   24.115   61.291   26.130 -8.566322 35.55682 
1 1 1    4    9   51 o  153.746   14.355   18.486   3.3391   18.130   4.6850   18.853   4.7605  150.479   20.905  153.531   20.792 -3.052536 29.48469 
1 1 1    4    9   52 o  370.838   7.7254  105.687   4.3851  101.962   6.0822  109.718   6.3280  363.488   10.932  377.050   10.965 -13.56128 15.48330 
1 1 1    4    9   53 o  134.396   24.340   14.826   4.8226   14.826   4.8226   0.0000   0.0000  134.396   24.340  ?   ?  0.000000 24.33971 
1 1 1    4    9   54 o  369.727   8.2538  105.198   4.6709  100.228   6.3295  111.140   6.9215  359.959   11.488  378.886   11.935 -18.92728 16.56563 
1 1 1    4    9   55 o  304.025   9.9847   71.360   4.6464   67.141   6.2025   76.756   7.0141  293.740   13.795  313.757   14.605 -20.01727 20.09042 
1 1 1    4    9   56 o  285.097   9.5771   62.746   4.1792   62.550   5.8134   62.955   6.0123  283.485   13.398  284.250   13.819 -0.7646790 19.24726 
1 1 1    4    9   57 o  212.586   12.655   35.271   4.0991   32.760   5.6037   38.160   6.0119  202.738   18.254  218.991   18.098 -16.25270 25.70464 
1 1 1    4    9   58 o  168.897   15.364   22.580   3.9285   12.753   5.4553   33.166   5.6619  121.019   29.678  203.609   18.365 -82.59104 34.90041 
1 1 1    4    9   59 o  138.196   20.222   15.633   4.1510   21.486   5.9874   10.218   5.7600  159.754   25.331  107.269   32.373 52.48499 41.10575 
1 1 1    4    9   60 o   96.085   26.929   8.0426   4.1195   7.1232   6.6897   8.6041   5.2284   93.660   34.874   98.662   31.040 -5.001701 46.68707 
1 1 1    4    9   61 o   88.355   26.362   6.7798   3.8358   11.455   5.5027   2.3613   5.3497  112.199   31.009   71.763   29.741 40.43565 42.96602 
1 1 1    4    9   62 f  147.680   17.248   17.755   3.8254   9.4826   5.2488   27.126   5.5868  101.577   30.959  180.810   20.552 -79.23328 37.15965 
1 1 1    4    9   63 o  123.960   20.364   12.990   3.7295   13.782   5.1399   12.108   5.4199  122.958   27.944  113.367   30.546 9.591560 41.39996 
1 1 1    4    9   64 o   66.240   26.263   2.9083   3.9642  -0.6358   5.0101   8.8417   6.4826   59.103   26.555   95.420   34.528 -36.31630 43.55876 
1 1 1    4   10    0 o  127.061   13.288   12.762   2.5196   12.762   2.5196   12.762   2.5196  127.061   13.288  127.061   13.288 0.000000 0.000000 
1 1 1    4   10    1 o  1837.12   23.521  2591.01   66.139   0.0000   0.0000  2591.01   66.139  ?   ?   1837.12   23.521 0.000000 23.52071 
1 1 1    4   10    2 o  1183.48   11.478  1072.72   20.791  1091.74   29.954  1055.04   28.882  1193.46   16.398  1173.26   16.083 20.19995 22.96817 
1 1 1    4   10    3 o  1134.23   11.120  985.257   19.304  969.394   26.811  1002.33   27.817  1124.67   15.575  1143.59   15.892 -18.91589 22.25146 
1 1 1    4   10    4 o   75.374   12.632   4.4705   1.4058   3.6566   1.7448   5.9764   2.3734   67.741   16.887   86.641   18.461 -18.89999 25.01999 
1 1 1    4   10    5 o  719.872   6.8440  396.711   7.5411  392.561   9.1742  405.357   13.241  716.047   8.3706  727.466   11.892 -11.41919 14.54258 
1 1 1    4   10    6 o  1495.40   9.8476  1712.46   22.540  1726.05   32.170  1699.36   31.591  1500.85   14.004  1489.22   13.859 11.62805 19.70238 
1 1 1    4   10    7 o  1308.24   8.8547  1310.50   17.731  1365.10   26.204  1264.39   24.081  1334.83   12.825  1284.71   12.246 50.11816 17.73282 
1 1 1    4   10    8 o  296.620   5.9321   67.351   2.6933   68.169   3.3132   65.759   4.6241  298.397   7.2542  293.020   10.310 5.377136 12.60642 
1 1 1    4   10    9 o  838.302   6.5278  537.994   8.3760  544.584   11.930  531.586   11.763  843.289   9.2424  833.165   9.2239 10.12347 13.05767 
1 1 1    4   10   10 o  1058.21   7.5857  857.393   12.287  862.320   17.455  852.556   17.298  1061.00   10.748  1054.98   10.712 6.020630 15.17485 
1 1 1    4   10   11 o  1074.89   7.7020  884.686   12.672  880.223   17.805  889.266   18.038  1071.91   10.852  1077.39   10.938 -5.482910 15.40849 
1 1 1    4   10   12 o  566.484   5.6627  245.662   4.9100  245.561   6.9248  245.765   6.9629  566.287   7.9891  566.520   8.0298 -0.2330322 11.32711 
1 1 1    4   10   13 o  927.067   7.0625  658.054   10.022  667.432   14.356  649.141   13.996  933.429   10.048  920.559   9.9333 12.86914 14.12918 
1 1 1    4   10   14 o  530.105   5.6879  215.128   4.6152  215.428   6.5307  214.830   6.5230  530.391   8.0444  529.654   8.0461 0.7368774 11.37764 
1 1 1    4   10   15 f  273.184   6.2102   57.136   2.5967   56.196   3.6429   58.107   3.7025  270.879   8.7861  275.446   8.7820 -4.566833 12.42257 
1 1 1    4   10   16 o  513.871   6.8711  202.179   5.4044  202.591   6.5643  201.314   9.5214  514.340   8.3382  512.532   12.137 1.807617 14.72522 
1 1 1    4   10   17 o  146.109   10.135   16.431   2.2525   14.560   2.4859   25.016   5.3247  137.327   11.945  179.421   19.714 -42.09460 23.05059 
1 1 1    4   10   18 o  1014.32   6.8046  787.683   10.564  796.330   13.713  775.057   16.570  1019.74   8.7857  1005.87   10.762 13.87189 13.89300 
1 1 1    4   10   19 o  455.034   5.4090  158.498   3.7673  155.310   4.7362  163.991   6.2164  450.404   6.8700  462.769   8.7761 -12.36493 11.14526 
1 1 1    4   10   20 o  1126.15   6.7061  970.871   11.559  964.822   16.205  977.139   16.494  1122.46   9.4319  1129.60   9.5398 -7.134155 13.41521 
1 1 1    4   10   21 o  1173.20   7.6123  1053.75   13.670  1062.55   21.961  1048.18   17.465  1177.76   12.182  1169.96   9.7530 7.793701 15.60536 
1 1 1    4   10   22 o  1024.95   7.0497  804.206   11.060  792.344   17.402  812.243   14.325  1017.15   11.178  1029.96   9.0864 -12.81647 14.40507 
1 1 1    4   10   23 o  958.331   7.5769  703.077   11.114  693.405   15.812  712.523   15.626  951.563   10.856  964.607   10.583 -13.04370 15.16095 
1 1 1    4   10   24 o  742.728   6.1529  422.263   6.9948  407.589   10.727  433.120   9.2265  729.607   9.6051  752.165   8.0141 -22.55774 12.50931 
1 1 1    4   10   25 o  1231.54   6.7232  1161.00   12.673  1146.60   19.172  1172.18   16.890  1223.69   10.236  1237.34   8.9179 -13.64978 13.57597 
1 1 1    4   10   26 o  788.528   5.4082  475.927   6.5274  474.771   10.049  476.772   8.5849  787.487   8.3374  789.183   7.1070 -1.696838 10.95545 
1 1 1    4   10   27 f  169.066   8.9294   21.946   2.3025   16.283   3.6310   25.754   2.9779  144.800   16.688  183.077   10.673 -38.27702 19.80919 
1 1 1    4   10   28 o  997.652   6.6426  761.920   10.143  754.878   14.206  769.247   14.489  992.904   9.3473  1002.30   9.4440 -9.400146 13.28762 
1 1 1    4   10   29 o  872.915   5.8466  583.280   7.8117  591.073   12.247  577.934   10.143  878.593   9.1069  868.841   7.6269 9.752563 11.87877 
1 1 1    4   10   30 o   71.522   21.760   3.9391   2.5948   2.1856   3.3959   6.3994   4.0224   64.613   24.672   90.682   26.982 -26.06935 36.56149 
1 1 1    4   10   31 o  416.943   6.3647  133.083   4.0618  139.717   5.7850  126.631   5.7045  427.152   8.8481  406.648   9.1649 20.50421 12.73907 
1 1 1    4   10   32 o  407.481   6.2199  127.112   3.8794  123.182   5.2086  132.007   5.8136  401.081   8.4844  415.180   9.1482 -14.09961 12.47700 
1 1 1    4   10   33 o  203.240   9.5295   31.637   2.9645   37.230   4.2776   26.468   4.1121  220.040   12.756  185.229   14.623 34.81114 19.40449 
1 1 1    4   10   34 o  509.058   6.3456  198.397   4.9443  203.146   6.4431  191.595   7.7112  515.052   8.1729  500.115   10.074 14.93643 12.97198 
1 1 1    4   10   35 o  476.171   6.6380  173.603   4.8380  176.499   7.6871  171.704   6.2257  479.967   10.464  473.488   8.5903 6.479706 13.53812 
1 1 1    4   10   36 o  328.962   8.5529   82.888   4.3065   77.536   6.7909   86.488   5.5698  317.947   13.954  335.947   10.832 -18.00076 17.66474 
1 1 1    4   10   37 o  212.721   10.052   34.676   3.2728   31.416   4.6884   37.774   4.5706  201.728   15.298  221.491   13.547 -19.76282 20.43417 
1 1 1    4   10   38 o  228.426   9.6341   39.988   3.3684   39.010   4.9211   40.851   4.6204  224.970   14.366  230.366   13.158 -5.395416 19.48142 
1 1 1    4   10   39 o  251.876   8.7613   48.617   3.3777   51.344   4.8066   45.956   4.7477  258.687   12.139  244.376   12.737 14.31081 17.59497 
1 1 1    4   10   40 o  587.065   5.9138  263.945   5.3140  271.268   7.6645  257.167   7.3741  594.941   8.4167  579.281   8.3167 15.65955 11.83251 
1 1 1    4   10   41 o  533.223   6.6890  217.820   5.4593  212.789   7.0713  225.243   8.5897  526.837   8.7690  541.849   10.357 -15.01135 13.57063 
1 1 1    4   10   42 o  252.606   8.7102   48.930   3.3677   53.138   4.8630   45.052   4.6684  263.008   12.080  241.799   12.658 21.20876 17.49697 
1 1 1    4   10   43 o  274.051   9.8856   57.642   4.1467   58.299   5.6417   56.869   6.1156  275.285   13.389  271.338   14.781 3.946991 19.94370 
1 1 1    4   10   44 o   96.944   21.337   7.5765   3.0802   9.6196   4.3297   5.4829   4.3828  108.782   26.295   85.632   28.540 23.14930 38.80669 
1 1 1    4   10   45 o  339.523   7.3940   88.397   3.8426   89.087   5.6206   87.792   5.2652  340.467   10.785  338.061   10.175 2.405518 14.82780 
1 1 1    4   10   46 o  174.179   11.562   23.445   3.0648   22.155   4.4853   24.575   4.1976  168.191   17.688  177.661   15.594 -9.470444 23.58058 
1 1 1    4   10   47 o  592.812   6.6055  269.480   5.9937  272.661   9.6383  267.474   7.6535  595.389   10.576  590.229   8.4717 5.160156 13.55090 
1 1 1    4   10   48 f  151.320   16.159   17.947   3.6847   13.383   6.3251   20.292   4.5334  126.560   32.487  160.370   18.826 -33.81014 37.54771 
1 1 1    4   10   49 o  225.005   9.7483   38.953   3.3573   41.307   4.7775   36.656   4.7189  230.741   13.587  217.160   14.276 13.58138 19.70852 
1 1 1    4   10   50 o   78.392   23.448   4.9324   3.0318   2.6104   4.4172   7.0007   4.1689   71.081   27.868   92.625   27.448 -21.54426 39.11596 
1 1 1    4   10   51 o  243.275   9.6524   45.573   3.5942   47.823   5.0950   43.345   5.0711  248.136   13.465  236.027   14.101 12.10858 19.49763 
1 1 1    4   10   52 o  375.549   8.2376  108.465   4.7352  113.157   6.1407  101.582   7.4371  383.013   10.474  361.987   13.423 21.02628 17.02601 
1 1 1    4   10   53 o  126.610   19.805   12.911   3.7123   9.5274   4.5595   19.564   6.3938  106.507   27.706  153.187   28.312 -46.67989 39.61269 
1 1 1    4   10   54 o  190.230   12.777   28.191   3.6986   28.171   5.2867   28.210   5.1763  188.345   18.580  188.631   18.152 -0.2864075 25.97578 
1 1 1    4   10   55 o   48.332   22.168  -2.3434   3.7215  -1.9607   4.6805  -3.0012   6.1362   56.406   25.474   63.000   28.733 -6.593998 38.39897 
1 1 1    4   10   56 o  167.332   14.959   22.054   3.7909   23.670   5.2221   20.254   5.5120  171.436   20.295  157.022   23.669 14.41451 31.17869 
1 1 1    4   10   57 o  129.708   19.235   13.627   3.7030   10.866   5.2737   16.312   5.2008  111.935   30.119  139.632   25.264 -27.69704 39.31224 
1 1 1    4   10   58 o  127.032   20.022   13.188   3.7642   15.958   5.2648   10.292   5.3839  137.310   26.002  108.355   30.933 28.95437 40.41010 
1 1 1    4   10   59 o  331.640   10.382   85.346   5.2702   70.036   7.0216  105.099   7.9758  297.580   15.469  365.812   14.244 -68.23233 21.02839 
1 1 1    4   10   60 o  193.344   14.709   29.658   4.3202   24.537   7.1632   32.585   5.4161  167.577   28.976  201.116   17.777 -33.53990 33.99428 
1 1 1    4   10   61 o  125.944   20.159   13.176   3.7551   13.581   5.4394   12.807   5.1904  122.999   29.309  119.709   28.699 3.290352 41.02011 
1 1 1    4   10   62 o  100.132   24.105   8.7759   3.6501   2.4733   5.0641   15.590   5.2658   70.113   28.987  132.571   26.871 -62.45840 39.52555 
1 1 1    4   10   63 o  128.050   21.527   14.023   4.0696   16.956   5.2008   9.3913   6.5357  138.325   25.504   98.684   34.787 39.64095 43.13424 
1 1 1    4   10   64 o  126.679   19.211   13.551   3.6080   12.304   5.0586   14.843   5.1477  114.137   28.920  127.028   27.289 -12.89092 39.76291 
1 1 1    4   11    0 o  1115.38   15.579  953.394   26.585  953.394   26.585  953.394   26.585  1115.38   15.579  1115.38   15.579 0.000000 0.000000 
1 1 1    4   11    1 o  402.930   9.8097  124.327   6.0500   0.0000   0.0000  124.327   6.0500  ?   ?   402.930   9.8097 0.000000 9.809661 
1 1 1    4   11    2 o  1153.43   11.303  1019.01   19.956  1038.10   28.806  1001.39   27.671  1163.68   16.173  1142.96   15.817 20.71594 22.62159 
1 1 1    4   11    3 o  623.392   7.8469  297.535   7.4873  299.100   10.632  295.994   10.546  624.902   11.115  621.651   11.084 3.251465 15.69699 
1 1 1    4   11    4 o  983.877   8.2678  741.175   12.451  737.499   15.194  748.692   21.725  981.321   10.115  988.394   14.360 -7.072815 17.56521 
1 1 1    4   11    5 o  191.763   8.2399   28.156   2.4186   28.156   2.4186   0.0000   0.0000  191.763   8.2399  ?   ?  0.000000 8.239900 
1 1 1    4   11    6 o  897.041   7.8427  616.109   10.768  617.104   13.175  614.106   18.691  897.667   9.5886  895.180   13.641 2.486694 16.67384 
1 1 1    4   11    7 f  1061.60   8.7726  863.006   14.255  859.046   17.351  871.231   25.003  1059.01   10.704  1066.01   15.323 -6.999756 18.69184 
1 1 1    4   11    8 o  1186.31   8.2489  1077.63   14.978  1059.49   20.771  1097.28   21.619  1175.97   11.540  1196.73   11.802 -20.75928 16.50644 
1 1 1    4   11    9 o  250.335   5.5879   47.973   2.1411   47.611   3.0059   48.347   3.0506  249.355   7.8756  251.273   7.9317 -1.918137 11.17752 
1 1 1    4   11   10 o  1019.71   7.4369  796.175   11.608  787.264   16.200  805.575   16.640  1013.75   10.440  1025.46   10.601 -11.70642 14.87918 
1 1 1    4   11   11 o  381.152   5.3877  111.212   3.1432  111.438   4.4343  110.983   4.4561  381.490   7.5940  380.710   7.6470 0.7806396 10.77713 
1 1 1    4   11   12 o  511.389   5.5599  200.202   4.3520  201.011   6.1420  199.386   6.1674  512.348   7.8320  510.271   7.8965 2.077209 11.12184 
1 1 1    4   11   13 f  306.480   5.7880   71.909   2.7152   69.377   3.7421   74.723   3.9458  300.991   8.1225  312.369   8.2527 -11.37799 11.57935 
1 1 1    4   11   14 o  587.869   5.8542  264.569   5.2676  270.375   7.5340  259.016   7.3679  594.190   8.2838  581.574   8.2769 12.61603 11.71021 
1 1 1    4   11   15 o  690.683   7.2603  365.264   7.6755  352.886   9.1257  395.193   14.190  678.804   8.7831  718.050   12.911 -39.24567 15.61539 
1 1 1    4   11   16 o  396.758   6.7822  120.521   4.1188  127.998   7.2275  116.925   5.0123  408.727   11.553  390.753   8.3804 17.97339 14.27223 
1 1 1    4   11   17 o  238.322   7.2121   43.486   2.6309   46.202   3.8180   41.031   3.6303  245.600   10.156  231.447   10.248 14.15364 14.42788 
1 1 1    4   11   18 o   73.579   15.255   4.3047   1.6617   5.0073   2.0121   2.7976   2.9468   79.286   17.084   65.394   23.325 13.89265 28.91241 
1 1 1    4   11   19 o  293.417   6.5373   65.908   2.9360   72.353   4.0488   58.760   4.2637  307.398   8.6051  276.995   10.056 30.40314 13.23557 
1 1 1    4   11   20 o  983.045   6.8129  739.793   10.251  743.258   16.373  737.559   13.147  985.129   10.858  981.469   8.7513 3.659546 13.94603 
1 1 1    4   11   21 o  1004.91   6.9030  773.048   10.618  766.818   16.748  777.235   13.729  1000.65   10.935  1007.53   8.9027 -6.888611 14.10072 
1 1 1    4   11   22 o  370.234   6.4605  104.927   3.6611  106.983   5.6240  103.415   4.8230  373.790   9.8298  367.526   8.5735 6.264099 13.04342 
1 1 1    4   11   23 o  394.940   5.8548  119.393   3.5393  111.640   5.1728  126.217   4.8531  381.859   8.8502  406.042   7.8086 -24.18332 11.80259 
1 1 1    4   11   24 o  483.814   5.4076  179.168   4.0045  176.805   5.6092  181.624   5.7189  480.578   7.6255  487.082   7.6708 -6.504425 10.81619 
1 1 1    4   11   25 o  497.568   5.5962  189.502   4.2620  197.532   6.1460  182.064   5.9153  507.959   7.9048  487.665   7.9248 20.29425 11.19325 
1 1 1    4   11   26 o  1361.63   7.8791  1419.39   16.421  1420.11   23.188  1418.67   23.258  1361.75   11.125  1361.05   11.164 0.6927490 15.76096 
1 1 1    4   11   27 o  938.764   6.4055  674.612   9.2040  668.916   12.893  680.533   13.144  934.685   9.0117  942.761   9.1085 -8.076782 12.81315 
1 1 1    4   11   28 o  603.411   5.3739  278.704   4.9633  274.717   7.6681  281.579   6.5113  599.005   8.3635  606.478   7.0142 -7.473389 10.91545 
1 1 1    4   11   29 o  975.867   6.6436  729.033   9.9234  713.077   13.802  746.108   14.278  964.992   9.3443  987.083   9.4502 -22.09106 13.28990 
1 1 1    4   11   30 o  297.544   8.6290   67.791   3.9299   70.086   6.0869   66.150   5.1463  302.434   13.149  293.863   11.441 8.570770 17.42992 
1 1 1    4   11   31 o  586.473   6.1398  263.306   5.5115  267.847   8.2411  259.630   7.4134  591.409   9.1039  582.296   8.3177 9.112549 12.33148 
1 1 1    4   11   32 o  876.409   5.6730  587.987   7.6101  591.372   10.892  584.758   10.638  878.809   8.0971  873.888   7.9528 4.920166 11.34940 
1 1 1    4   11   33 o  347.718   6.5152   92.567   3.4676   91.630   4.9363   93.480   4.8721  345.886   9.3240  349.365   9.1110 -3.479156 13.03639 
1 1 1    4   11   34 o  295.096   7.5427   66.681   3.4069   72.922   4.9257   60.958   4.7172  308.519   10.431  282.063   10.926 26.45599 15.10575 
1 1 1    4   11   35 o  422.833   7.2298  136.905   4.6791  138.739   7.3246  135.640   6.0819  425.487   11.247  420.793   9.4429 4.694275 14.68526 
1 1 1    4   11   36 o  123.137   19.075   11.927   3.4789   13.730   5.9729   11.001   4.2797  130.638   30.436  117.297   24.622 13.34083 39.14788 
1 1 1    4   11   37 o   96.482   20.897   7.4425   2.9967   8.2726   4.4636   6.7613   4.0434  101.806   27.842   92.617   26.917 9.189201 38.72632 
1 1 1    4   11   38 o  578.166   5.8744  255.968   5.1986  253.339   7.2843  258.698   7.4216  575.031   8.2761  581.076   8.3444 -6.044373 11.75254 
1 1 1    4   11   39 o  550.505   5.9124  232.083   4.9819  238.832   7.1175  225.600   6.9755  558.274   8.3294  542.584   8.3992 15.69073 11.82896 
1 1 1    4   11   40 o  342.062   7.8369   89.663   4.1032   86.761   5.1180   94.886   6.8649  336.347   9.9412  351.506   12.760 -15.15851 16.17509 
1 1 1    4   11   41 o  125.631   15.641   12.334   2.9425   14.933   4.0608   9.4613   4.2698  137.663   19.845  108.182   26.089 29.48125 32.77883 
1 1 1    4   11   42 o  300.701   7.8455   69.316   3.6110   68.234   5.1740   70.344   5.0419  298.072   11.341  302.689   10.883 -4.616302 15.71749 
1 1 1    4   11   43 o  628.039   6.4361  302.245   6.1869  300.174   8.0058  305.315   9.7487  625.613   8.3604  630.640   10.099 -5.027161 13.11086 
1 1 1    4   11   44 o  488.998   6.4000  183.255   4.7903  183.152   6.5647  183.373   7.0057  488.562   8.7786  488.768   9.3644 -0.2059937 12.83571 
1 1 1    4   11   45 f  227.525   9.3306   39.749   3.2494   40.909   4.7469   38.726   4.4576  230.011   13.543  223.852   13.066 6.159286 18.81867 
1 1 1    4   11   46 o  513.267   6.4506  201.970   5.0677  197.715   7.4231  205.684   6.9354  507.301   9.5598  517.583   8.7543 -10.28210 12.96251 
1 1 1    4   11   47 o  292.292   9.0997   65.639   4.0711   59.781   6.0550   70.473   5.4999  277.797   14.289  302.449   11.880 -24.65195 18.58244 
1 1 1    4   11   48 o  347.840   8.7749   92.970   4.6719  107.748   8.4504   86.465   5.6067  373.089   14.798  335.079   10.932 38.00937 18.39774 
1 1 1    4   11   49 o  227.641   9.7664   39.880   3.4029   40.935   5.2193   39.099   4.4880  229.316   14.952  224.532   13.116 4.783585 19.88918 
1 1 1    4   11   50 o  363.523   7.3306  101.480   4.0789   97.795   5.8588  104.947   5.6821  356.167   10.747  369.127   10.057 -12.95972 14.71860 
1 1 1    4   11   51 o  162.425   13.228   20.560   3.2600   21.124   4.7472   20.057   4.4846  163.010   19.408  158.969   18.794 4.040680 27.01648 
1 1 1    4   11   52 o  139.448   17.946   15.464   3.7416   18.598   4.7615   10.405   6.0495  152.159   21.005  111.006   33.104 41.15368 39.20526 
1 1 1    4   11   53 o  126.014   16.684   12.620   3.1389   12.128   4.4304   13.116   4.4478  121.020   24.752  126.259   23.890 -5.239082 34.40056 
1 1 1    4   11   54 o  122.488   18.718   12.069   3.3979   16.622   4.9225   7.9250   4.6961  142.491   23.381   97.345   29.198 45.14625 37.40585 
1 1 1    4   11   55 o  308.703   9.7937   73.574   4.6276   66.955   5.8127   85.029   7.6471  293.538   12.937  329.870   15.146 -36.33218 19.91886 
1 1 1    4   11   56 o  190.867   13.246   28.492   3.8459   30.535   5.3710   26.342   5.5094  195.844   18.123  180.916   20.243 14.92776 27.16982 
1 1 1    4   11   57 o  102.673   23.447   8.8511   3.6040   6.8585   4.9555   11.088   5.2508   91.162   30.346  112.968   29.900 -21.80647 42.60134 
1 1 1    4   11   58 o  194.561   14.051   29.797   4.1564   25.904   6.3451   32.723   5.5009  176.663   24.093  202.208   17.960 -25.54497 30.05092 
1 1 1    4   11   59 o   67.304   27.007   2.3631   4.2419  -2.7436   7.0107   5.3123   5.3278   66.905   30.591   83.762   31.135 -16.85679 43.64856 
1 1 1    4   11   60 o  162.323   15.369   21.037   3.7732   20.133   5.2686   21.988   5.4062  155.009   22.895  162.423   22.337 -7.414322 31.98615 
1 1 1    4   11   61 o  169.026   15.671   22.915   4.0082   27.073   5.9344   19.427   5.4354  180.057   21.990  150.764   24.387 29.29338 32.83685 
1 1 1    4   11   62 o  130.071   18.796   14.037   3.6336   11.554   5.0013   16.813   5.2881  112.211   28.933  138.101   25.970 -25.89028 38.87905 
1 1 1    4   11   63 o   86.123   26.882   6.7058   3.9301   8.0458   4.9803   4.4940   6.3985   92.780   30.400   80.137   32.796 12.64248 44.71801 
1 1 1    4   11   64 o  170.658   14.918   23.617   3.8576   17.434   5.6931   28.866   5.2453  137.089   28.076  185.937   18.683 -48.84792 33.72432 
1 1 1    4   12    0 o  843.841   12.987  545.684   16.765  545.684   16.765  545.684   16.765  843.841   12.987  843.841   12.987 0.000000 0.000000 
1 1 1    4   12    1 f  1234.06   16.895  1167.98   31.913   0.0000   0.0000  1167.98   31.913  ?   ?   1234.06   16.895 0.000000 16.89499 
1 1 1    4   12    3 o  439.506   10.181  147.950   6.8488  147.950   6.8488   0.0000   0.0000  439.506   10.181  ?   ?  0.000000 10.18067 
1 1 1    4   12    4 o  879.090   9.5278  591.858   12.820  591.858   12.820   0.0000   0.0000  879.090   9.5278  ?   ?  0.000000 9.527830 
1 1 1    4   12    5 o  651.714   6.6755  325.171   6.6591  331.430   8.2894  313.782   11.181  657.894   8.2319  639.975   11.415 17.91846 14.07331 
1 1 1    4   12    6 o  570.954   6.4010  249.571   5.5939  245.455   6.7798  258.348   9.9006  566.177   7.8234  580.701   11.139 -14.52435 13.61169 
1 1 1    4   12    7 o  1095.39   7.8046  918.766   13.085  913.291   18.373  924.402   18.641  1091.83   10.994  1098.45   11.087 -6.611572 15.61394 
1 1 1    4   12    8 o  500.599   5.4339  191.837   4.1636  191.172   5.8814  192.506   5.8951  499.664   7.6902  501.404   7.6813 -1.740356 10.86926 
1 1 1    4   12    9 o  886.963   6.8384  602.331   9.2839  600.027   13.081  604.669   13.179  885.078   9.6556  888.492   9.6905 -3.414368 13.67980 
1 1 1    4   12   10 o  930.156   7.0529  662.451   10.041  665.599   14.268  659.362   14.134  932.144   10.000  927.771   9.9531 4.372742 14.10926 
1 1 1    4   12   11 o  539.952   5.6580  223.193   4.6761  222.497   6.5909  223.898   6.6353  539.029   7.9885  540.722   8.0171 -1.692932 11.31770 
1 1 1    4   12   12 o  177.508   7.4596   24.127   2.0268   24.512   2.7533   23.672   2.9944  178.595   10.113  175.412   11.211 3.182983 15.09888 
1 1 1    4   12   13 o  722.989   7.2316  400.231   8.0027  401.655   9.7870  397.357   13.902  724.190   8.8293  720.038   12.614 4.151367 15.39691 
1 1 1    4   12   14 o  436.999   6.7068  146.208   4.4861  153.126   7.6836  142.630   5.5256  447.060   11.229  431.572   8.3649 15.48837 14.00191 
1 1 1    4   12   15 o  1214.07   9.8847  1128.96   18.369  1102.10   31.025  1143.46   22.793  1198.61   16.911  1221.59   12.190 -22.97766 20.84644 
1 1 1    4   12   16 o  208.754   7.5677   33.366   2.4181   35.618   3.4315   31.145   3.4079  215.641   10.396  201.330   11.102 14.31064 15.20973 
1 1 1    4   12   17 o  992.544   7.5813  754.252   11.518  743.035   16.028  766.231   16.562  984.941   10.631  1000.18   10.819 -15.24133 15.16801 
1 1 1    4   12   18 o  387.439   6.3593  114.911   3.7712  109.255   5.2848  120.780   5.3832  377.730   9.1407  397.161   8.8553 -19.43069 12.72667 
1 1 1    4   12   19 o  449.152   6.2916  154.430   4.3254  155.775   6.1032  153.072   6.1309  451.052   8.8402  447.120   8.9584 3.932404 12.58580 
1 1 1    4   12   20 o  1093.52   8.1506  915.495   13.642  894.573   18.851  938.500   19.768  1080.77   11.396  1106.96   11.667 -26.19775 16.30871 
1 1 1    4   12   21 o  617.875   7.1960  292.254   6.8056  291.163   8.2460  294.583   12.052  616.682   8.7360  620.154   12.697 -3.472473 15.41205 
1 1 1    4   12   22 o  1138.11   8.3056  991.656   14.469  981.716   20.226  1002.07   20.705  1132.20   11.671  1143.87   11.826 -11.66833 16.61547 
1 1 1    4   12   23 o  698.578   6.0985  373.551   6.5209  365.056   8.1539  388.625   10.862  690.550   7.7143  712.423   9.9607 -21.87238 12.59871 
1 1 1    4   12   24 o  938.550   6.2452  674.282   8.9717  682.843   12.799  666.011   12.580  944.394   8.8541  932.684   8.8119 11.71014 12.49178 
1 1 1    4   12   25 o  719.028   5.7555  395.737   6.3343  390.321   8.8308  401.478   9.0911  714.028   8.0801  724.158   8.2018 -10.12964 11.51339 
1 1 1    4   12   26 o  868.005   6.1879  576.737   8.2213  575.258   11.570  578.246   11.684  866.799   8.7205  869.044   8.7839 -2.244995 12.37755 
1 1 1    4   12   27 o  700.156   5.9408  375.250   6.3666  368.290   8.8824  382.604   9.1303  693.560   8.3671  706.907   8.4382 -13.34747 11.88328 
1 1 1    4   12   28 f  846.012   6.2589  547.901   8.1049  561.205   11.688  535.578   11.249  856.111   8.9195  836.341   8.7872 19.76923 12.52085 
1 1 1    4   12   29 o  1164.69   8.9660  1038.72   15.984  1037.89   22.290  1039.61   22.932  1163.92   12.512  1164.85   12.862 -0.9299316 17.94373 
1 1 1    4   12   30 o  305.129   8.4758   71.292   3.9585   74.460   5.1823   66.853   6.1334  311.784   10.859  295.357   13.567 16.42661 17.37791 
1 1 1    4   12   31 o  603.318   6.3932  278.659   5.9038  281.686   8.3754  275.670   8.3233  606.489   9.0222  599.976   9.0634 6.512939 12.78853 
1 1 1    4   12   32 o  529.261   6.7414  214.462   5.4612  220.087   7.8633  209.219   7.5905  536.052   9.5836  522.654   9.4883 13.39825 13.48600 
1 1 1    4   12   33 o  637.247   6.0230  310.886   5.8747  313.376   9.3241  309.246   7.5652  639.632   9.5237  635.493   7.7775 4.139526 12.29598 
1 1 1    4   12   34 o  523.702   7.0771  210.005   5.6730  193.254   11.369  215.559   6.5462  501.948   14.798  530.541   8.0612 -28.59250 16.85090 
1 1 1    4   12   35 o  424.372   7.1681  137.908   4.6561  142.246   7.1507  134.715   6.1348  430.831   10.844  419.336   9.5581 11.49576 14.45469 
1 1 1    4   12   36 o  232.462   9.1389   41.402   3.2518   45.159   4.8479   38.329   4.3843  242.288   13.121  223.178   12.889 19.11017 18.39302 
1 1 1    4   12   37 o  517.974   5.8996  205.440   4.6774  202.110   6.6661  208.669   6.5646  513.616   8.4794  521.900   8.2177 -8.284058 11.80811 
1 1 1    4   12   38 o  201.831   9.9698   31.229   3.0799   32.416   4.3137   29.995   4.3990  205.005   13.828  197.063   14.689 7.941895 20.17408 
1 1 1    4   12   39 o  276.664   7.7071   58.649   3.2637   57.759   4.6409   59.519   4.5908  274.388   11.050  278.553   10.767 -4.164886 15.42852 
1 1 1    4   12   40 o  469.553   6.8110  168.914   4.8952  176.532   6.3113  157.411   7.7552  479.877   8.5925  452.881   11.188 26.99609 14.10660 
1 1 1    4   12   41 o  256.389   8.2898   50.397   3.2532   47.432   4.5796   53.417   4.6221  248.490   12.041  263.751   11.449 -15.26074 16.61516 
1 1 1    4   12   42 o  454.766   7.1256  158.508   4.9600  167.493   6.8008  148.297   7.2495  467.212   9.5099  439.462   10.778 27.75076 14.37339 
1 1 1    4   12   43 o  589.976   6.1992  266.711   5.5980  275.002   7.7126  257.480   8.1382  598.766   8.4154  579.253   9.1789 19.51288 12.45275 
1 1 1    4   12   44 o  105.125   17.403   8.7685   2.7023   10.035   3.9701   7.6751   3.6887  111.318   24.006   97.243   24.727 14.07503 34.46309 
1 1 1    4   12   45 o  462.240   6.1847  163.770   4.3758  157.300   6.1637  170.343   6.2132  452.651   8.8962  471.089   8.6167 -18.43784 12.38506 
1 1 1    4   12   46 o  345.537   7.2282   91.586   3.8229   90.286   5.5961   92.724   5.2348  342.611   10.671  347.335   9.8465 -4.724670 14.52003 
1 1 1    4   12   47 o   86.761   22.774   6.1213   3.0626   7.2557   5.0223   5.4497   3.8642   95.675   30.458   83.570   26.729 12.10464 40.52367 
1 1 1    4   12   48 o  231.393   11.920   41.403   4.2073   8.6436   10.774   47.298   4.5702  114.254   43.869  247.615   12.058 -133.3611 45.49643 
1 1 1    4   12   49 o  129.984   15.074   13.276   2.9435   16.296   4.2510   10.495   4.0796  142.926   19.978  113.087   24.293 29.84003 31.45273 
1 1 1    4   12   50 o  184.323   11.305   26.313   3.1740   25.876   4.4403   26.770   4.5389  181.669   16.136  184.785   16.211 -3.116470 22.87342 
1 1 1    4   12   51 o  347.896   7.6614   93.008   4.0797   85.545   5.7107  100.786   5.8303  332.872   11.208  361.493   10.537 -28.62128 15.38373 
1 1 1    4   12   52 o  197.608   12.769   30.372   3.8414   33.698   4.8411   24.716   6.3123  207.472   15.353  174.437   24.302 33.03456 28.74560 
1 1 1    4   12   53 o  211.744   11.144   34.751   3.5992   36.877   5.1971   32.791   4.9892  216.803   15.769  204.274   16.087 12.52968 22.52699 
1 1 1    4   12   54 o   38.908   18.785  -5.0760   3.3707  -2.2990   4.4873  -8.6723   5.1064   54.214   24.665   45.961   22.404 8.252331 33.32121 
1 1 1    4   12   55 o  125.342   18.591   12.653   3.4587   13.587   4.7709   11.618   5.0214  127.533   25.333  116.714   28.382 10.81883 38.04358 
1 1 1    4   12   56 o   80.375   24.705   5.3006   3.3338   1.1220   4.7025   9.5229   4.7271   65.801   27.624  105.414   28.579 -39.61327 39.74695 
1 1 1    4   12   57 o   87.137   25.004   6.3877   3.5090   6.2384   4.6934   6.5770   5.2838   87.514   29.534   90.224   31.311 -2.710297 43.04275 
1 1 1    4   12   58 o  115.010   23.815   11.167   4.0543   20.501   5.8631   2.6149   5.6124  155.987   25.433   74.791   30.674 81.19597 39.84634 
1 1 1    4   12   59 o   47.505   22.271  -3.5091   4.0812  -2.7492   6.5791  -3.9845   5.2034   64.550   29.558   54.098   25.293 10.45179 38.90240 
1 1 1    4   12   60 o   89.594   25.761   6.9654   3.7214  -1.4088   5.2683   15.305   5.2573   60.197   27.121  132.515   26.840 -72.31789 38.15650 
1 1 1    4   12   61 o  182.317   13.501   26.365   3.7409   27.024   5.3093   25.715   5.2717  181.282   19.438  176.538   19.854 4.744186 27.78489 
1 1 1    4   12   62 o  148.786   16.203   17.999   3.6304   18.498   5.1007   17.486   5.1682  146.357   23.569  141.397   24.783 4.960266 34.20121 
1 1 1    4   12   63 o   72.985   28.573   3.9273   4.6381   7.4202   6.5021   0.3090   6.6178   90.175   34.209   68.930   30.776 21.24495 46.01517 
1 1 1    4   13    1 o  786.035   12.577  473.497   15.132   0.0000   0.0000  473.497   15.132  ?   ?   786.035   12.577 0.000000 12.57748 
1 1 1    4   13    2 o  2011.50   25.691  3114.29   79.097   0.0000   0.0000  3114.29   79.097  ?   ?   2011.50   25.691 0.000000 25.69053 
1 1 1    4   13    3 o  485.284   7.4977  180.320   5.5692  185.785   8.0251  175.244   7.7350  492.459   10.647  478.288   10.566 14.17084 14.99949 
1 1 1    4   13    4 o  325.174   6.0831   80.949   3.0277   83.470   3.7777   76.422   5.0626  330.171   7.4752  315.849   10.472 14.32227 12.86625 
1 1 1    4   13    5 o  1530.59   11.677  1795.09   27.356  1791.96   33.485  1801.38   47.435  1528.78   14.310  1531.40   20.237 -2.613159 24.78487 
1 1 1    4   13    6 o  297.037   6.3382   67.549   2.8817   63.036   3.4755   77.476   5.1547  286.914   7.9141  318.011   10.590 -31.09711 13.22037 
1 1 1    4   13    7 o  721.031   6.1546  398.016   6.7924  401.269   9.6534  394.826   9.5590  723.844   8.7130  718.010   8.6978 5.833252 12.31129 
1 1 1    4   13    8 o  350.503   5.4881   94.047   2.9443   95.284   4.1869   92.837   4.1413  352.751   7.7545  348.192   7.7705 4.559326 10.97784 
1 1 1    4   13    9 o  368.054   5.5093  103.701   3.1037  103.092   4.3669  104.324   4.4121  366.919   7.7755  369.104   7.8095 -2.184967 11.02029 
1 1 1    4   13   10 o  483.616   6.4668  179.064   4.7870  179.424   5.8718  178.350   8.2661  484.056   7.9251  482.467   11.193 1.589478 13.71496 
1 1 1    4   13   11 o  108.022   12.450   9.0611   2.0208   8.3772   2.3901   10.776   3.7848  103.362   15.592  116.511   22.030 -13.14930 26.98939 
1 1 1    4   13   12 o  721.853   6.2993  398.922   6.9601  400.016   9.8271  397.821   9.8590  722.719   8.8835  720.730   8.9370 1.988464 12.60105 
1 1 1    4   13   13 o  452.352   6.6246  156.657   4.5868  158.303   7.9663  155.841   5.6100  454.557   11.450  451.131   8.1243 3.426086 14.03934 
1 1 1    4   13   14 o   96.838   15.916   7.3796   2.2772   5.3618   3.9813   8.3606   2.7761   84.562   27.140  102.855   18.304 -18.29263 32.73565 
1 1 1    4   13   15 o  763.270   6.5704  445.999   7.6761  448.044   10.860  443.957   10.852  764.898   9.2757  761.400   9.3113 3.497986 13.14300 
1 1 1    4   13   16 o  290.120   6.6545   64.435   2.9550   62.210   4.0841   66.881   4.2809  285.024   9.3615  295.528   9.4638 -10.50354 13.31173 
1 1 1    4   13   17 o  584.819   6.1855  261.811   5.5369  259.058   7.7495  264.681   7.9137  581.668   8.7042  587.945   8.7937 -6.276611 12.37306 
1 1 1    4   13   18 o  703.100   6.5662  378.428   7.0664  369.667   9.8040  387.900   10.194  694.830   9.2184  711.754   9.3574 -16.92407 13.13542 
1 1 1    4   13   19 o  550.724   6.3417  232.168   5.3458  236.372   7.6482  228.153   7.4749  555.626   8.9931  545.882   8.9461 9.744019 12.68496 
1 1 1    4   13   20 o  1167.29   11.961  1043.56   21.371  1029.63   30.025  1057.86   30.425  1159.04   16.924  1174.83   16.919 -15.78503 23.93095 
1 1 1    4   13   21 o  1213.67   8.7309  1127.74   16.219  1121.49   18.634  1147.27   32.946  1210.23   10.059  1223.42   17.593 -13.19458 20.26611 
1 1 1    4   13   22 o  601.354   5.9121  276.806   5.4418  278.129   6.8990  274.629   8.8530  602.758   7.4778  598.897   9.6576 3.860291 12.21418 
1 1 1    4   13   23 o  1766.92   9.5538  2390.43   25.838  2373.06   36.145  2408.59   36.950  1760.09   13.417  1773.19   13.614 -13.10535 19.11411 
1 1 1    4   13   24 o  280.859   6.6458   60.384   2.8570   56.202   3.9805   64.826   4.1030  270.927   9.5989  290.976   9.2125 -20.04941 13.30442 
1 1 1    4   13   25 o  599.039   5.6346  274.680   5.1664  279.514   7.3332  269.917   7.2799  604.235   7.9290  593.768   8.0101 10.46643 11.27081 
1 1 1    4   13   26 o  679.556   5.8318  353.491   6.0659  354.673   8.5490  352.293   8.6083  680.624   8.2062  678.334   8.2909 2.289978 11.66535 
1 1 1    4   13   27 o  568.072   5.8833  247.026   5.1156  241.210   7.1038  253.290   7.3728  561.286   8.2687  575.165   8.3747 -13.87909 11.76894 
1 1 1    4   13   28 o  760.293   7.5921  442.559   8.8351  438.850   12.012  446.933   13.041  756.972   10.367  763.868   11.154 -6.895569 15.22787 
1 1 1    4   13   29 o  651.486   6.7244  324.932   6.7055  330.795   8.7778  316.715   10.391  657.265   8.7252  643.043   10.557 14.22205 13.69596 
1 1 1    4   13   30 o  488.615   6.6134  182.777   4.9461  177.217   6.9485  188.488   7.0420  481.041   9.4371  496.108   9.2736 -15.06702 13.23098 
1 1 1    4   13   31 o  865.734   6.6608  573.812   8.8263  577.243   12.611  570.517   12.358  868.153   9.4900  863.089   9.3545 5.063721 13.32542 
1 1 1    4   13   32 o  359.258   7.9103   98.832   4.3498   98.300   6.2288   99.339   6.0772  358.182   11.361  360.082   11.026 -1.899414 15.83221 
1 1 1    4   13   33 o  980.410   7.8728  736.075   11.814  731.860   19.135  738.670   15.019  977.109   12.795  981.954   9.9924 -4.845154 16.23419 
1 1 1    4   13   34 o  275.575   12.301   58.216   5.1885   60.272   9.4143   57.319   6.2181  279.004   22.229  272.930   14.941 6.073730 26.78415 
1 1 1    4   13   35 o  654.070   7.3122  327.626   7.3205  340.537   11.296  318.277   9.6121  666.547   11.072  644.505   9.7437 22.04218 14.74891 
1 1 1    4   13   36 o  397.564   7.0360  121.049   4.2816  115.184   6.8539  124.802   5.4830  387.580   11.553  403.596   8.8757 -16.01575 14.56910 
1 1 1    4   13   37 o  442.440   6.7995  149.927   4.6047  152.076   7.4144  148.578   5.8750  445.335   10.877  440.337   8.7168 4.998077 13.93905 
1 1 1    4   13   38 f  282.575   8.6772   61.196   3.7530   55.825   5.9752   64.696   4.8231  269.155   14.558  290.427   10.850 -21.27133 18.15623 
1 1 1    4   13   39 o  578.080   7.2551  256.039   6.4195  260.747   8.9946  251.150   9.1649  583.067   10.078  572.187   10.465 10.88025 14.52869 
1 1 1    4   13   40 o  261.539   10.433   52.488   4.1767   45.223   5.8119   60.246   6.0063  241.851   15.787  279.552   14.082 -37.70146 21.15474 
1 1 1    4   13   41 o  207.955   9.6088   33.180   3.0585   36.047   4.5050   30.728   4.1656  216.046   13.694  199.400   13.732 16.64679 19.39327 
1 1 1    4   13   42 o  185.105   11.640   26.433   3.2813   29.343   4.0979   21.234   5.4776  194.761   13.836  163.876   22.426 30.88560 26.35099 
1 1 1    4   13   43 o  382.327   6.7820  112.043   3.9688  110.666   5.4666  113.577   5.7713  379.699   9.4060  384.610   9.8035 -4.911224 13.58612 
1 1 1    4   13   44 o  234.692   8.3644   42.265   3.0047   42.192   4.3362   42.332   4.1675  233.837   12.157  234.595   11.606 -0.7577362 16.80754 
1 1 1    4   13   45 o  291.799   7.7978   65.329   3.4828   64.046   5.1569   66.405   4.7225  288.466   11.680  293.891   10.498 -5.424866 15.70423 
1 1 1    4   13   46 o  318.191   8.1672   77.725   3.9777   77.149   6.2184   78.125   5.1749  316.288   12.845  318.669   10.609 -2.380463 16.65974 
1 1 1    4   13   47 f   59.054   23.107   1.7067   3.0321   6.6988   5.4610  -0.5181   3.6457   93.797   31.857   54.001   23.522 39.79659 39.59990 
1 1 1    4   13   48 o  130.265   14.324   13.292   2.8088   13.418   4.1217   13.182   3.8379  129.080   21.627  128.302   20.212 0.7784424 29.60118 
1 1 1    4   13   49 o   98.608   18.724   7.8411   2.7228   8.6487   3.9909   7.1380   3.7241  102.294   25.561   93.170   25.411 9.123962 36.04324 
1 1 1    4   13   50 o   65.749   22.379   3.1942   2.6950   3.3161   3.8375   3.0756   3.7857   71.418   26.448   69.972   26.199 1.445839 37.22766 
1 1 1    4   13   51 o  124.300   16.092   12.233   2.9898   10.019   4.2131   14.478   4.2435  109.813   25.547  133.845   21.437 -24.03188 33.34930 
1 1 1    4   13   52 o   61.784   24.197   1.9675   3.3272   3.0214   3.9555  -0.5821   6.1522   70.256   26.675   69.383   30.380 0.8733368 40.42854 
1 1 1    4   13   53 o   99.209   21.181   8.0866   3.1185   8.6742   4.4783   7.5335   4.3451  101.522   27.939   95.072   27.982 6.450424 39.54245 
1 1 1    4   13   54 o  115.154   21.116   10.846   3.5848   12.668   4.4635   7.5372   6.0166  123.490   24.479   96.910   33.425 26.57990 41.42990 
1 1 1    4   13   55 o  175.105   13.435   24.006   3.5734   23.791   4.9342   24.243   5.1820  172.406   19.014  173.720   19.845 -1.313431 27.48350 
1 1 1    4   13   56 o  176.444   13.276   24.396   3.5592   22.521   4.8888   26.510   5.1918  167.261   19.460  181.857   18.929 -14.59610 27.14742 
1 1 1    4   13   57 o  165.092   14.397   21.508   3.6017   17.805   4.9779   25.577   5.2177  146.710   22.917  178.033   19.464 -31.32343 30.06735 
1 1 1    4   13   58 o   98.543   25.649   8.3515   3.9062   12.448   5.4245   3.9391   5.6297  118.703   29.878   79.416   31.358 39.28635 43.31284 
1 1 1    4   13   59 o  323.403   10.237   81.250   5.0674   65.439   7.7486   93.066   6.6985  285.488   17.821  344.748   12.694 -59.26062 21.88018 
1 1 1    4   13   60 o   46.335   21.286  -2.0060   3.4503  -3.1539   4.7428  -0.7156   5.0286   52.641   24.456   60.540   26.943 -7.899487 36.38685 
1 1 1    4   13   61 o   85.984   24.763   6.4777   3.4362   1.3395   4.8027   11.866   4.9183   65.039   27.640  114.491   28.241 -49.45255 39.51624 
1 1 1    4   13   62 o  123.146   21.515   12.978   3.9077   12.456   6.4147   13.286   4.9276  112.334   34.222  120.959   27.267 -8.624588 43.75634 
1 1 1    4   13   63 o   98.180   26.346   8.8552   4.0417   6.1822   5.2239   12.841   6.3794   83.561   30.876  112.780   34.077 -29.21941 45.98409 
1 1 1    4   14    0 o  668.716   11.750  342.770   12.019  342.770   12.019  342.770   12.019  668.716   11.750  668.716   11.750 0.000000 0.000000 
1 1 1    4   14    1 o  496.168   10.711  188.608   8.1347   0.0000   0.0000  188.608   8.1347  ?   ?   496.168   10.711 0.000000 10.71136 
1 1 1    4   14    2 o  245.928   11.370   46.343   4.2799   0.0000   0.0000   46.343   4.2799  ?   ?   245.928   11.370 0.000000 11.36977 
1 1 1    4   14    3 f  973.277   10.221  725.661   15.227  737.398   21.969  714.810   21.124  980.616   14.636  965.525   14.294 15.09131 20.45814 
1 1 1    4   14    4 o  584.590   6.5871  261.648   5.8940  266.707   7.3470  252.513   9.8726  590.152   8.1335  574.075   11.235 16.07751 13.87048 
1 1 1    4   14    5 o  629.652   6.7643  303.545   6.5192  300.406   7.9637  309.924   11.350  626.320   8.3071  635.969   11.660 -9.648865 14.31675 
1 1 1    4   14    6 o  705.826   7.0704  381.446   7.6386  386.198   9.4892  372.699   12.875  710.124   8.7302  697.382   12.061 12.74188 14.88940 
1 1 1    4   14    7 o  934.890   8.2030  669.308   11.738  672.881   14.455  662.388   20.115  937.237   10.076  929.486   14.139 7.750977 17.36165 
1 1 1    4   14    8 o  1045.63   8.8168  837.333   14.111  830.408   17.151  851.843   24.827  1041.12   10.763  1053.90   15.390 -12.77808 18.78024 
1 1 1    4   14    9 o  1011.63   10.586  783.989   16.392  783.989   16.392   0.0000   0.0000  1011.63   10.586  ?   ?  0.000000 10.58606 
1 1 1    4   14   10 o  796.159   6.5795  485.288   8.0179  495.635   11.527  475.587   11.160  804.451   9.3612  788.020   9.2527 16.43066 13.16223 
1 1 1    4   14   11 o  1260.84   10.151  1217.66   19.590  1205.62   33.624  1223.84   24.102  1253.55   17.524  1263.77   12.460 -10.21643 21.50249 
1 1 1    4   14   12 o  381.501   6.7918  111.427   3.9660  104.280   6.7672  115.165   4.8946  368.924   11.984  387.815   8.2457 -18.89099 14.54670 
1 1 1    4   14   13 o  681.854   6.2706  355.916   6.5445  355.932   9.2422  355.899   9.2684  681.772   8.8565  681.739   8.8821 0.3265381E-01 12.54316 
1 1 1    4   14   14 o  753.691   6.5500  434.864   7.5562  425.778   10.482  444.694   10.902  745.670   9.1840  762.046   9.3470 -16.37659 13.10391 
1 1 1    4   14   15 o  448.543   5.9797  154.009   4.1054  152.094   5.7575  155.990   5.8556  445.695   8.4397  451.366   8.4756 -5.671753 11.96093 
1 1 1    4   14   16 o  1059.72   7.8902  859.779   12.798  867.984   18.225  851.797   17.976  1064.57   11.185  1054.60   11.136 9.969727 15.78351 
1 1 1    4   14   17 o  1239.66   8.8027  1176.61   16.703  1181.49   23.703  1171.81   23.540  1241.96   12.469  1236.86   12.434 5.095825 17.60919 
1 1 1    4   14   18 o  258.855   8.6083   51.300   3.4107   44.103   5.6097   55.522   4.2959  239.414   15.390  269.269   10.423 -29.85580 18.58715 
1 1 1    4   14   19 o  554.283   8.7437  235.218   7.4182  239.525   10.775  231.337   10.228  559.220   12.588  549.593   12.159 9.626770 17.50127 
1 1 1    4   14   20 f  824.448   8.1794  520.368   10.322  521.478   12.791  518.296   17.478  825.254   10.126  822.549   13.882 2.705261 17.18275 
1 1 1    4   14   21 o  328.298   7.7125   82.510   3.8756   83.605   5.5449   81.463   5.4190  330.420   10.964  326.163   10.855 4.257111 15.42807 
1 1 1    4   14   22 o  373.366   7.4284  106.716   4.2452  103.626   5.9651  109.888   6.0430  367.866   10.594  378.823   10.422 -10.95651 14.86085 
1 1 1    4   14   23 o  818.748   6.5167  513.142   8.1667  514.987   10.439  510.233   13.111  820.160   8.3158  816.278   10.494 3.882751 13.38915 
1 1 1    4   14   24 f  1281.71   7.5245  1257.64   14.762  1237.86   20.455  1279.12   21.325  1271.40   10.511  1292.40   10.780 -20.99341 15.05618 
1 1 1    4   14   25 o  465.914   6.4818  166.172   4.6224  171.541   7.6833  163.127   5.7868  473.282   10.606  461.590   8.1906 11.69125 13.40065 
1 1 1    4   14   26 o  1089.75   6.8722  909.116   11.463  933.563   16.559  886.623   15.884  1104.13   9.7982  1076.03   9.6440 28.10657 13.74817 
1 1 1    4   14   27 o  239.954   10.595   44.098   3.8913   46.278   4.8101   39.971   6.6196  245.434   12.849  227.449   19.194 17.98511 23.09729 
1 1 1    4   14   28 o  265.303   9.2979   53.900   3.7757   57.785   5.3450   50.032   5.3343  274.623   12.716  255.145   13.709 19.47794 18.69850 
1 1 1    4   14   29 o  836.260   6.4320  535.377   8.2330  541.016   11.751  529.941   11.538  840.517   9.1340  831.874   9.0618 8.643250 12.86648 
1 1 1    4   14   30 o  181.447   11.691   25.329   3.2298   24.855   4.4948   25.836   4.6440  179.250   16.570  182.758   16.789 -3.507645 23.58906 
1 1 1    4   14   31 o  887.053   7.4813  602.495   10.158  592.000   12.656  621.496   17.028  879.166   9.4049  900.546   12.354 -21.37988 15.52634 
1 1 1    4   14   32 o  1056.01   7.1781  853.864   11.602  851.390   16.306  856.400   16.512  1054.22   10.106  1057.31   10.203 -3.087280 14.36049 
1 1 1    4   14   33 o  273.021   12.185   57.137   5.0922   56.658   8.9712   57.365   6.1851  270.531   21.852  273.059   14.855 -2.527802 26.42274 
1 1 1    4   14   34 o  307.992   9.6148   72.678   4.5326   73.168   6.5270   72.221   6.2993  308.848   13.807  306.862   13.412 1.986603 19.24846 
1 1 1    4   14   35 o  485.621   7.2442  180.612   5.3847  177.350   7.6460  183.823   7.5846  481.032   10.385  489.750   10.118 -8.718079 14.49861 
1 1 1    4   14   36 o  297.925   9.3444   68.022   4.2612   66.403   6.1353   69.531   5.9228  294.130   13.628  301.026   12.854 -6.896637 18.73367 
1 1 1    4   14   37 o  598.944   6.9785  274.785   6.3977  277.580   9.1499  272.111   8.9487  601.713   9.9348  595.768   9.8133 5.944763 13.96426 
1 1 1    4   14   38 o  103.202   22.274   8.5456   3.4153   14.081   4.8698   3.1882   4.7910  132.716   24.887   76.691   29.300 56.02493 38.44272 
1 1 1    4   14   39 o  269.427   10.220   55.689   4.2147   55.445   5.9702   55.931   5.9508  268.108   14.603  269.300   14.490 -1.191681 20.57217 
1 1 1    4   14   40 o  480.821   6.7754  177.143   4.9864  176.809   7.9703  177.359   6.3918  479.918   10.850  480.928   8.6831 -1.009674 13.89683 
1 1 1    4   14   41 o  739.050   8.3997  418.867   9.5018  406.982   13.407  430.859   13.468  727.706   12.037  748.823   11.750 -21.11621 16.82154 
1 1 1    4   14   42 o  343.146   7.9949   90.301   4.1991   85.256   6.6489   93.648   5.4160  332.855   13.050  349.231   10.132 -16.37637 16.52175 
1 1 1    4   14   43 o  379.878   7.1900  110.644   4.1806  109.431   6.9912  111.320   5.2159  377.150   12.111  380.842   8.9478 -3.691986 15.05760 
1 1 1    4   14   44 o  294.271   8.2205   66.451   3.7027   64.507   6.1896   67.535   4.6206  289.201   13.983  296.448   10.183 -7.247498 17.29774 
1 1 1    4   14   45 o  245.810   8.2799   46.382   3.1153   42.892   4.4213   49.823   4.3901  235.638   12.301  254.437   11.273 -18.79961 16.68510 
1 1 1    4   14   46 o   78.350   23.223   4.8996   2.9840   13.971   5.0384  -0.0014   3.7034  130.821   26.077   56.364   24.120 74.45730 35.52166 
1 1 1    4   14   47 o  212.267   10.759   34.788   3.4841   37.558   6.3139   33.575   4.1778  218.596   19.061  208.064   13.187 10.53163 23.17805 
1 1 1    4   14   48 o  176.501   10.695   24.091   2.8756   21.179   4.1253   26.844   4.0107  164.198   16.644  185.636   14.223 -21.43846 21.89351 
1 1 1    4   14   49 o  120.298   15.616   11.427   2.8076   16.226   4.0672   7.0581   3.8806  142.778   19.089   92.687   26.193 50.09104 32.41065 
1 1 1    4   14   50 o  261.396   8.5060   52.553   3.4032   49.348   4.8915   55.561   4.7380  252.218   12.711  268.211   11.541 -15.99333 17.16906 
1 1 1    4   14   51 o  106.336   20.721   9.2089   3.2513   7.4310   3.9789   12.781   5.6402   94.657   26.444  122.854   30.206 -28.19756 40.14541 
1 1 1    4   14   52 o  140.631   14.482   15.542   3.0728   10.503   4.4367   20.187   4.2598  112.017   26.322  159.516   17.748 -47.49960 31.74660 
1 1 1    4   14   53 o  132.295   16.826   13.922   3.3301   9.3034   4.3144   20.729   5.2376  105.107   26.750  159.997   21.967 -54.89012 34.61377 
1 1 1    4   14   54 o  195.353   11.865   29.690   3.5311   25.763   4.9697   33.693   5.0182  179.878   18.305  206.832   15.975 -26.95404 24.29581 
1 1 1    4   14   55 o  260.508   9.7015   52.422   3.8684   54.632   5.6074   50.416   5.3436  264.310   13.909  253.922   13.801 10.38788 19.59404 
1 1 1    4   14   56 o  252.576   10.747   49.437   4.1546   55.422   5.4645   41.238   6.3958  266.173   13.456  227.236   18.550 38.93619 22.91710 
1 1 1    4   14   57 o  267.015   10.039   55.229   4.1028   50.881   5.6800   59.974   5.9328  254.172   14.662  276.314   14.074 -22.14268 20.32404 
1 1 1    4   14   58 o  171.398   17.389   23.611   4.4988   12.989   10.004   26.304   5.0369  117.672   42.845  180.443   18.498 -62.77110 46.66783 
1 1 1    4   14   59 o  153.193   15.597   18.778   3.6061   17.139   5.2584   20.233   4.9548  141.555   25.193  156.302   21.262 -14.74687 32.96593 
1 1 1    4   14   60 o  194.288   14.372   30.021   4.2435   38.304   7.2008   25.614   5.2525  214.217   22.288  176.430   19.791 37.78706 29.80678 
1 1 1    4   14   61 o   78.144   27.135   5.1515   3.9684  -3.6508   6.5094   10.358   5.0064   60.946   28.426  105.767   29.702 -44.82095 41.11279 
1 1 1    4   14   62 o   64.806   25.359   2.8067   3.6521   3.3858   4.5211   1.7192   6.1956   70.583   28.028   71.170   30.832 -0.5871735 41.66750 
1 1 1    4   14   63 o   91.631   24.054   7.5594   3.4165   6.1601   4.9039   8.8793   4.7626   82.897   30.026   96.511   29.506 -13.61353 42.09686 
1 1 1    4   15    0 o  561.907   11.243  242.066   9.6608  242.066   9.6608  242.066   9.6608  561.907   11.243  561.907   11.243 0.000000 0.000000 
1 1 1    4   15    1 f  644.133   11.710  317.923   11.545   0.0000   0.0000  317.923   11.545  ?   ?   644.133   11.710 0.000000 11.70968 
1 1 1    4   15    2 f  575.898   11.303  254.113   9.9633   0.0000   0.0000  254.113   9.9633  ?   ?   575.898   11.303 0.000000 11.30286 
1 1 1    4   15    3 o  947.017   14.270  687.611   20.684   0.0000   0.0000  687.611   20.684  ?   ?   947.017   14.270 0.000000 14.26971 
1 1 1    4   15    4 o  1198.80   9.7238  1100.76   17.842  1097.30   21.830  1107.74   30.967  1196.65   11.918  1201.58   16.838 -4.930908 20.62889 
1 1 1    4   15    5 o  387.163   6.4599  114.758   3.8282  111.246   4.6579  122.068   6.7199  381.156   7.9839  399.165   10.999 -18.00903 13.59094 
1 1 1    4   15    6 f  1097.45   9.1475  922.402   15.366  924.328   18.916  918.665   26.348  1098.40   11.251  1094.46   15.728 3.933228 19.33787 
1 1 1    4   15    7 o  525.493   6.6071  211.413   5.3143  214.548   6.6020  205.643   8.9567  529.325   8.1486  518.092   11.295 11.23236 13.92726 
1 1 1    4   15    8 o  1328.43   9.1279  1351.47   18.560  1355.22   26.323  1347.76   26.173  1329.82   12.932  1326.16   12.894 3.660400 18.26206 
1 1 1    4   15    9 o  732.012   7.3889  410.263   8.2788  427.004   14.918  402.813   9.9519  746.459   13.057  725.262   8.9648 21.19702 15.83817 
1 1 1    4   15   10 o  354.091   6.8508   95.989   3.7130   96.845   6.5062   95.575   4.5216  355.539   11.956  353.297   8.3616 2.242004 14.58943 
1 1 1    4   15   11 f  287.135   6.3201   63.116   2.7777   63.441   3.9230   62.788   3.9335  287.836   8.9043  286.349   8.9745 1.486969 12.64233 
1 1 1    4   15   12 o  906.732   7.1434  629.428   9.9142  624.990   13.905  634.017   14.140  903.380   10.056  909.874   10.153 -6.494263 14.28999 
1 1 1    4   15   13 o  655.439   6.2282  328.860   6.2484  337.621   8.9901  320.673   8.6905  664.030   8.8452  647.151   8.7734 16.87891 12.45836 
1 1 1    4   15   14 o  458.557   5.9802  160.960   4.1974  154.478   5.7724  168.233   6.1142  449.182   8.3959  468.751   8.5218 -19.56934 11.96292 
1 1 1    4   15   15 o  325.069   6.4057   80.889   3.1872   83.040   4.5292   78.779   4.4860  329.327   8.9851  320.763   9.1370 8.563751 12.81475 
1 1 1    4   15   16 o  753.878   7.6866  435.089   8.8696  431.898   15.202  436.736   10.921  750.878   13.227  755.243   9.4474 -4.364990 16.25446 
1 1 1    4   15   17 o  1181.70   9.8521  1069.22   17.820  1055.98   30.386  1076.16   22.000  1173.80   16.913  1185.38   12.126 -11.58020 20.81042 
1 1 1    4   15   18 o  945.774   8.6290  684.816   12.492  693.516   15.548  668.976   20.980  951.669   10.674  934.446   14.668 17.22321 18.14062 
1 1 1    4   15   19 o  530.081   6.5889  215.089   5.3459  220.959   7.6269  209.419   7.4954  537.211   9.2754  522.991   9.3634 14.21954 13.17974 
1 1 1    4   15   20 f  764.645   7.0294  447.575   8.2271  455.204   11.747  440.232   11.525  771.040   9.9539  758.254   9.9306 12.78577 14.06048 
1 1 1    4   15   21 o  1030.42   8.0991  812.847   12.774  799.851   17.752  826.804   18.395  1021.98   11.348  1039.04   11.566 -17.06317 16.20390 
1 1 1    4   15   22 o  370.772   7.5734  105.241   4.2980  102.219   6.0236  108.376   6.1346  365.353   10.771  376.197   10.654 -10.84399 15.15007 
1 1 1    4   15   23 o  775.140   7.3263  459.971   8.6923  452.747   12.148  467.548   12.442  768.916   10.322  781.380   10.403 -12.46417 14.65519 
1 1 1    4   15   24 o  606.170   6.2952  281.274   5.8408  288.392   7.5046  270.337   9.3022  613.748   7.9885  594.154   10.229 19.59442 12.97847 
1 1 1    4   15   25 o  793.057   6.6343  481.470   8.0532  483.340   10.236  478.433   13.046  794.529   8.4172  790.373   10.784 4.156128 13.67982 
1 1 1    4   15   26 o  583.759   8.4403  260.924   7.5416  265.947   8.8019  247.054   14.626  589.305   9.7582  567.630   16.834 21.67426 19.45763 
1 1 1    4   15   27 o  1110.75   8.5963  944.714   14.615  967.771   20.998  923.047   20.355  1123.92   12.206  1097.66   12.115 26.26904 17.19768 
1 1 1    4   15   28 f  581.048   6.6448  258.470   5.9097  270.633   7.7872  241.952   9.0750  594.497   8.5578  562.032   10.549 32.46466 13.58378 
1 1 1    4   15   29 o  266.099   8.3158   54.221   3.3870   58.605   4.8699   50.114   4.7139  276.576   11.504  255.742   12.042 20.83417 16.65368 
1 1 1    4   15   30 o  733.113   6.3935  411.468   7.1743  412.196   10.110  410.730   10.182  733.632   9.0035  732.321   9.0839 1.310608 12.78983 
1 1 1    4   15   31 o  607.322   6.5174  282.393   6.0584  296.637   8.7813  269.454   8.3693  622.325   9.2188  593.127   9.2188 29.19879 13.03733 
1 1 1    4   15   32 o  722.201   7.4933  399.402   8.2832  411.092   13.899  392.964   10.315  732.322   12.400  716.236   9.4092 16.08594 15.56552 
1 1 1    4   15   33 o  251.608   10.555   48.513   4.0649   51.147   5.8331   46.026   5.6677  257.759   14.848  244.434   15.224 13.32513 21.26565 
1 1 1    4   15   34 o  1073.82   7.3797  883.113   12.129  867.935   17.009  898.818   17.302  1064.17   10.442  1082.93   10.438 -18.76746 14.76467 
1 1 1    4   15   35 o  465.998   7.2298  166.323   5.1568  169.855   7.2331  162.672   7.3540  470.745   10.039  460.657   10.430 10.08841 14.47598 
1 1 1    4   15   36 o  814.302   6.9752  507.899   8.6938  502.724   12.145  513.337   12.450  809.811   9.7985  818.294   9.9401 -8.483521 13.95763 
1 1 1    4   15   37 o  313.229   8.7523   75.200   4.1962   75.127   5.9214   75.274   5.9473  312.842   12.366  313.144   12.408 -0.3017883 17.51799 
1 1 1    4   15   38 f   56.164   23.225   0.6807   3.2519   6.0591   4.7208  -4.1758   4.4859   89.952   29.603   50.639   23.611 39.31331 37.86604 
1 1 1    4   15   39 o  160.624   14.319   20.001   3.4836   23.581   4.8026   16.027   5.0606  173.868   18.322  141.780   24.187 32.08771 30.34328 
1 1 1    4   15   40 o  451.107   9.6492  156.145   6.6626  167.577   8.5590  138.565   10.614  467.001   11.974  423.924   16.357 43.07715 20.27153 
1 1 1    4   15   41 o  306.496   9.7694   72.106   4.5831   75.488   6.0277   67.471   7.0562  313.300   12.570  295.396   15.662 17.90326 20.08226 
1 1 1    4   15   42 o   76.482   25.281   4.3786   3.4414   7.6962   4.8056   0.8861   4.9307   98.237   29.552   68.091   28.413 30.14539 40.99579 
1 1 1    4   15   43 o  394.862   8.1895  119.629   4.9496  117.793   7.0106  121.455   6.9891  391.301   11.705  397.373   11.491 -6.072906 16.40275 
1 1 1    4   15   44 o  167.908   14.676   21.933   3.7338   24.040   5.4188   20.029   5.1521  174.516   20.689  158.811   21.768 15.70517 30.03113 
1 1 1    4   15   45 o  169.804   14.642   22.448   3.7684   14.368   9.9695   23.795   4.0704  132.102   42.997  174.710   15.378 -42.60872 45.66470 
1 1 1    4   15   46 o  370.158   8.8386  105.286   5.0077  107.338   7.1501  103.310   7.0158  372.990   12.524  365.925   12.526 7.065247 17.71315 
1 1 1    4   15   47 o  589.205   6.9242  266.419   6.2446  246.531   10.386  277.679   7.8150  565.234   12.005  601.111   8.4938 -35.87720 14.70578 
1 1 1    4   15   48 o  275.963   8.9047   58.569   3.7613   55.881   6.3669   60.011   4.6618  267.770   15.602  278.996   10.917 -11.22528 19.04184 
1 1 1    4   15   49 o   80.528   23.673   5.2476   3.1116   6.1388   5.4852   4.8248   3.7784   90.639   31.877   79.309   26.501 11.33025 41.45424 
1 1 1    4   15   50 o   41.450   19.390  -2.8828   3.0653  -4.7006   5.4047  -2.0208   3.7218   55.219   25.804   49.491   22.496 5.728081 34.23319 
1 1 1    4   15   51 o  159.482   14.258   19.918   3.4437   22.865   4.3772   15.129   5.5786  170.179   17.033  134.436   28.019 35.74309 32.79037 
1 1 1    4   15   52 o  160.325   13.483   20.100   3.2781   18.831   4.9786   21.071   4.3555  152.497   21.963  162.945   17.750 -10.44809 28.23892 
1 1 1    4   15   53 o  171.968   14.203   23.184   3.7050   27.129   4.7855   17.282   5.8538  185.179   17.076  143.476   27.658 41.70279 32.50499 
1 1 1    4   15   54 o  133.450   16.074   14.148   3.2172   13.263   4.6613   14.953   4.4460  126.041   25.044  135.106   22.276 -9.064804 33.51754 
1 1 1    4   15   55 o   73.466   23.897   4.2953   3.0796   5.6393   4.4654   3.0763   4.2529   84.298   28.806   71.221   27.505 13.07680 39.82851 
1 1 1    4   15   56 o  272.323   9.4526   57.332   3.9401   58.879   5.6189   55.835   5.5265  274.596   13.369  267.003   13.567 7.592896 19.04713 
1 1 1    4   15   57 o  112.521   22.404   10.608   3.7230   10.680   5.7172   10.554   4.9057  109.505   32.060  109.784   28.826 -0.2795868 43.11323 
1 1 1    4   15   58 o  242.255   12.263   45.974   4.5324   41.765   8.4116   47.696   5.3802  222.919   25.088  245.716   14.368 -22.79649 28.91133 
1 1 1    4   15   59 o  116.346   23.209   11.530   3.9883   10.320   7.0766   12.093   4.8281  105.827   36.263  117.104   27.419 -11.27627 45.46210 
1 1 1    4   15   60 o   77.956   24.659   5.1933   3.2959   4.7810   4.6600   5.6059   4.6621   78.209   29.109   82.063   29.332 -3.853798 41.32431 
1 1 1    4   15   61 o  149.575   15.342   18.091   3.4627   22.071   4.8725   14.029   4.9218  162.479   20.015  125.109   26.525 37.37006 33.22942 
1 1 1    4   15   62 o   60.776   24.934   1.8827   3.7100  -0.8072   4.4482   8.0301   6.7245   55.597   24.996   92.556   34.866 -36.95875 42.90016 
1 1 1    4   16    0 f  221.413   12.976   37.929   4.3629   37.929   4.3629   37.929   4.3629  221.413   12.976  221.413   12.976 0.000000 0.000000 
1 1 1    4   16    1 o  220.776   12.434   37.468   4.1847   0.0000   0.0000   37.468   4.1847  ?   ?   220.776   12.434 0.000000 12.43414 
1 1 1    4   16    2 o  590.665   11.509  267.289   10.405   0.0000   0.0000  267.289   10.405  ?   ?   590.665   11.509 0.000000 11.50930 
1 1 1    4   16    3 o  365.776   11.050  102.492   6.1864   0.0000   0.0000  102.492   6.1864  ?   ?   365.776   11.050 0.000000 11.04970 
1 1 1    4   16    4 o  176.633   8.7773   23.891   2.3730   26.228   2.9952   19.953   3.8892  184.735   10.638  160.508   16.045 24.22726 19.25125 
1 1 1    4   16    5 o  422.070   6.5487  136.380   4.2307  137.089   5.2416  135.056   7.1662  423.128   8.0933  419.885   11.150 3.243195 13.77796 
1 1 1    4   16    6 o  299.713   7.1330   68.773   3.2722   73.031   4.1148   61.448   5.3970  308.823   8.7051  283.193   12.451 25.62949 15.19225 
1 1 1    4   16    7 f  821.831   9.5219  517.236   11.978  534.578   17.607  502.296   16.342  835.197   13.773  809.633   13.187 25.56427 19.06798 
1 1 1    4   16    8 o  392.169   6.7601  117.740   4.0579  115.292   7.0806  118.938   4.9517  387.941   11.924  394.129   8.2082 -6.187958 14.47639 
1 1 1    4   16    9 o  368.191   5.9134  103.774   3.3326  105.757   4.7740  101.889   4.6543  371.648   8.3923  364.790   8.3356 6.858002 11.82847 
1 1 1    4   16   10 o  976.997   7.4494  730.768   11.140  741.907   15.992  720.269   15.527  984.236   10.616  969.787   10.460 14.44843 14.90313 
1 1 1    4   16   11 o  890.366   7.0976  606.888   9.6728  616.531   13.873  597.765   13.494  897.271   10.101  883.516   9.9781 13.75476 14.19847 
1 1 1    4   16   12 o  913.849   7.2174  639.320   10.095  652.753   14.528  626.777   14.039  923.257   10.280  904.709   10.138 18.54871 14.43843 
1 1 1    4   16   13 o  569.222   6.1262  248.023   5.3376  246.129   7.4641  250.005   7.6358  566.988   8.6007  571.431   8.7301 -4.442627 12.25512 
1 1 1    4   16   14 o  1258.35   10.230  1212.50   19.704  1212.21   34.012  1212.64   24.174  1257.52   17.670  1258.25   12.552 -0.7307129 21.67477 
1 1 1    4   16   15 o  524.375   7.0963  210.491   5.6956  211.949   9.7279  209.731   7.0258  526.061   12.081  523.392   8.7699 2.668518 14.92879 
1 1 1    4   16   16 o  533.435   8.8525  217.856   7.2280  217.856   7.2280   0.0000   0.0000  533.435   8.8525  ?   ?  0.000000 8.852496 
1 1 1    4   16   17 o  422.646   7.4269  136.744   4.8045  136.741   5.9706  136.750   8.0927  422.610   9.2302  422.551   12.512 0.5914307E-01 15.54858 
1 1 1    4   16   18 o  387.956   6.7655  115.213   4.0175  113.226   5.6188  117.292   5.7465  384.554   9.5458  391.396   9.5921 -6.842468 13.53262 
1 1 1    4   16   19 o  1139.26   8.5001  993.675   14.822  976.387   20.539  1012.46   21.412  1129.11   11.884  1149.77   12.167 -20.65027 17.00794 
1 1 1    4   16   20 o  902.393   7.5679  623.388   10.453  613.986   14.524  633.491   15.055  895.435   10.597  909.536   10.814 -14.10059 15.14110 
1 1 1    4   16   21 o  1164.09   8.6767  1037.50   15.460  1024.17   21.550  1051.65   22.192  1156.36   12.175  1171.75   12.374 -15.39380 17.35925 
1 1 1    4   16   22 o  347.175   7.9599   92.277   4.2299   87.893   5.9005   96.911   6.0669  338.766   11.379  355.724   11.142 -16.95831 15.92624 
1 1 1    4   16   23 o  267.723   9.6650   54.885   3.9606   59.722   5.7735   50.586   5.4433  279.197   13.510  256.570   13.913 22.62714 19.39295 
1 1 1    4   16   24 o  1110.11   8.5993  943.573   14.612  940.744   20.566  946.457   20.764  1108.19   12.124  1111.54   12.204 -3.352905 17.20300 
1 1 1    4   16   25 o  315.843   9.7589   76.394   4.7179   77.888   5.3274   70.963   10.157  318.891   10.914  303.220   22.036 15.67053 24.59067 
1 1 1    4   16   26 o  1330.43   9.6432  1355.53   19.637  1378.24   27.911  1333.27   27.634  1341.09   13.597  1319.02   13.687 22.07117 19.29311 
1 1 1    4   16   27 f  959.732   6.6078  705.153   9.7068  721.169   13.924  690.009   13.539  970.407   9.3742  949.215   9.3188 21.19226 13.21801 
1 1 1    4   16   28 o  1145.59   7.2586  1004.82   12.728  997.748   17.781  1012.25   18.227  1141.32   10.179  1149.57   10.359 -8.245117 14.52252 
1 1 1    4   16   29 o  985.610   6.8397  743.749   10.318  766.303   14.895  722.942   14.307  1000.23   9.7293  971.532   9.6211 28.70209 13.68303 
1 1 1    4   16   30 o  516.081   6.5877  203.917   5.2038  207.576   7.4082  200.353   7.3113  520.586   9.2972  511.447   9.3395 9.139008 13.17820 
1 1 1    4   16   31 o  279.908   10.485   60.029   4.4921   56.152   8.6802   61.447   5.2498  269.422   21.220  283.141   12.114 -13.71912 24.43457 
1 1 1    4   16   32 o  156.274   14.548   18.897   3.4398   20.695   4.8611   17.094   4.8680  162.872   19.914  147.406   22.270 15.46596 29.87508 
1 1 1    4   16   33 o  637.675   6.7140  311.382   6.5532  314.623   9.3513  308.255   9.1860  640.793   9.5342  634.281   9.4619 6.511902 13.43237 
1 1 1    4   16   34 o  574.799   6.7620  253.027   5.9492  259.443   8.4300  246.661   8.3969  581.852   9.4656  567.321   9.6699 14.53027 13.53160 
1 1 1    4   16   35 f  799.581   6.7937  489.670   8.3145  496.905   11.916  482.804   11.607  805.145   9.6688  793.653   9.5552 11.49231 13.59365 
1 1 1    4   16   36 o   98.704   21.462   7.8096   3.1501   11.334   4.4508   4.2718   4.4590  118.775   25.259   80.175   28.683 38.60028 38.21899 
1 1 1    4   16   37 o  444.708   7.3912  151.531   5.0311  146.738   6.9125  156.929   7.3364  437.375   10.326  452.279   10.598 -14.90427 14.79622 
1 1 1    4   16   38 o  406.147   7.6171  126.420   4.7353  122.930   6.5225  130.309   6.8855  400.234   10.647  412.042   10.918 -11.80814 15.24974 
1 1 1    4   16   39 o  151.111   15.808   17.782   3.6023   19.338   5.2877   16.434   4.9208  156.299   22.771  143.767   23.148 12.53242 32.47079 
1 1 1    4   16   40 o  144.066   21.075   16.420   4.5098   14.830   4.7388   31.689   14.685  136.219   23.582  192.962   49.482 -56.74309 54.81431 
1 1 1    4   16   41 o   82.513   24.000   5.4182   3.2133   9.1467   4.7075   2.1654   4.3969  106.078   28.420   69.868   27.673 36.20946 39.66726 
1 1 1    4   16   42 o  342.543   8.5604   90.040   4.4882   83.130   6.2516   97.390   6.4477  328.649   12.428  355.815   11.839 -27.16592 17.16397 
1 1 1    4   16   43 o   93.599   23.390   7.1170   3.3416   16.851   4.8005  -2.0328   4.6542  145.357   22.288   56.975   25.597 88.38171 33.93999 
1 1 1    4   16   44 o   86.708   24.521   6.0698   3.3997   5.0166   4.7772   7.1505   4.8391   84.117   29.731   94.984   29.859 -10.86621 42.13676 
1 1 1    4   16   45 o  297.467   23.761   70.020   10.728   70.020   10.728   0.0000   0.0000  297.467   23.761  ?   ?  0.000000 23.76081 
1 1 1    4   16   46 o  253.066   11.191   49.351   4.3350   59.142   6.3075   40.586   5.9678  275.892   14.993  227.808   17.243 48.08455 22.84949 
1 1 1    4   16   47 o  242.570   11.160   45.367   4.1434   44.259   5.9569   46.406   5.7671  238.018   16.452  244.016   15.522 -5.998230 22.61814 
1 1 1    4   16   48 o   78.714   26.009   4.7756   3.6428   0.0080   5.0123   10.113   5.3033   64.874   27.918  109.960   30.462 -45.08594 41.31989 
1 1 1    4   16   49 o   81.832   26.052   5.3150   3.6743   8.4839   5.2791   2.3374   5.1172  101.371   31.076   73.356   29.583 28.01591 42.90538 
1 1 1    4   16   50 o   42.129   20.151  -4.8267   3.6773  -4.6277   5.2191  -5.0229   5.1820   54.082   25.300   53.019   24.932 1.062611 35.52015 
1 1 1    4   16   51 o  309.981   9.0220   74.010   4.2806   76.207   7.9153   73.103   5.0890  311.745   16.648  307.647   10.807 4.098724 19.84858 
1 1 1    4   16   52 o  139.519   20.465   15.716   4.2404   19.235   6.7155   13.382   5.4684  150.596   30.185  125.550   29.035 25.04591 41.88259 
1 1 1    4   16   53 o  233.738   11.858   42.452   4.2284   47.232   7.6785   40.372   5.0656  242.865   20.858  227.020   14.656 15.84592 25.49249 
1 1 1    4   16   54 o  101.697   24.126   8.6747   3.6989   6.1354   6.7161   9.7803   4.4315   92.384   34.834  107.264   27.009 -14.87984 44.07825 
1 1 1    4   16   55 o  183.894   14.247   26.593   3.9790   31.902   7.5244   24.533   4.6880  196.013   25.699  175.302   17.715 20.71150 31.21273 
1 1 1    4   16   56 o  145.506   18.515   17.099   4.0303   18.848   6.8695   16.182   4.9768  146.251   31.609  138.976   24.279 7.274734 39.85771 
1 1 1    4   16   57 o  190.905   15.836   29.003   4.5855   5.0068   10.316   34.912   5.1190   96.292   40.694  209.433   16.092 -113.1411 43.75991 
1 1 1    4   16   58 f  100.295   25.805   8.7478   3.9844  -5.5142   7.3792   14.617   4.7337   63.201   29.730  130.923   24.523 -67.72255 38.53922 
1 1 1    4   16   59 o   99.620   22.166   8.4725   3.2927   10.561   4.6458   6.3642   4.6676  108.841   27.790   86.265   29.451 22.57645 40.49277 
1 1 1    4   16   60 o  154.858   14.226   19.189   3.3343   22.743   4.7697   15.793   4.6630  165.919   19.132  135.542   23.317 30.37758 30.16156 
1 1 1    4   16   61 o   85.167   23.467   6.4063   3.1572   7.0755   4.5928   5.8068   4.3472   88.126   29.208   81.483   28.394 6.643356 40.73499 
1 1 1    4   16   62 f  125.440   21.162   13.534   3.9186   7.3180   5.1120   22.391   6.1019   88.586   30.795  157.854   26.171 -69.26737 40.41369 
1 1 1    4   17    0 o  1100.17   15.902  927.700   26.766  927.700   26.766  927.700   26.766  1100.17   15.902  1100.17   15.902 0.000000 0.000000 
1 1 1    4   17    1 o  482.024   11.276  177.973   8.3197   0.0000   0.0000  177.973   8.3197  ?   ?   482.024   11.276 0.000000 11.27640 
1 1 1    4   17    2 o  1793.40   23.341  2470.54   64.072   0.0000   0.0000  2470.54   64.072  ?   ?   1793.40   23.341 0.000000 23.34119 
1 1 1    4   17    3 o  191.133   14.202   28.150   4.1251   0.0000   0.0000   28.150   4.1251  ?   ?   191.133   14.202 0.000000 14.20168 
1 1 1    4   17    4 o  501.247   8.2555  192.370   6.3338  190.208   9.1627  194.349   8.7651  498.298   12.013  503.718   11.368 -5.420044 16.53976 
1 1 1    4   17    5 o  720.851   9.0323  397.886   9.9658  391.240   14.157  404.416   14.032  714.608   12.943  726.561   12.617 -11.95306 18.07516 
1 1 1    4   17    6 o  597.691   7.0125  273.481   6.4154  280.378   8.0474  261.454   10.626  605.131   8.6883  584.232   11.883 20.89905 14.72060 
1 1 1    4   17    7 o  1482.03   11.538  1682.30   26.172  1717.97   32.887  1620.68   43.223  1497.33   14.349  1453.55   19.428 43.77417 24.15233 
1 1 1    4   17    8 o  426.041   6.8793  138.952   4.4861  140.286   5.5270  136.374   7.6800  428.053   8.4357  421.954   11.891 6.098358 14.57947 
1 1 1    4   17    9 o  588.535   6.1546  265.142   5.5443  266.346   7.8820  263.962   7.8002  589.807   8.7308  587.162   8.6792 2.644775 12.31082 
1 1 1    4   17   10 o  2196.55   13.997  3696.46   47.060  3662.43   65.845  3731.99   67.282  2185.28   19.686  2205.88   19.927 -20.59790 28.01113 
1 1 1    4   17   11 o  1202.37   9.8956  1106.97   18.212  1100.21   31.333  1110.42   22.380  1198.08   17.086  1204.08   12.143 -6.002686 20.96177 
1 1 1    4   17   12 o  1533.92   11.892  1802.02   27.921  1822.08   49.005  1792.38   33.976  1541.30   20.772  1529.54   14.512 11.75720 25.33960 
1 1 1    4   17   13 o  1573.91   10.591  1896.87   25.515  1884.21   35.950  1909.72   36.218  1568.21   14.977  1578.79   14.988 -10.57898 21.18829 
1 1 1    4   17   14 o  1106.23   8.2064  936.859   13.895  957.899   20.085  917.545   19.244  1118.39   11.733  1094.60   11.486 23.79602 16.41925 
1 1 1    4   17   15 o  224.109   9.3457   38.454   3.2058   38.030   3.8974   39.340   5.6373  222.551   11.480  225.985   16.409 -3.433777 20.02675 
1 1 1    4   17   16 o  1029.28   7.9738  811.037   12.562  807.431   17.556  814.820   17.983  1026.84   11.170  1031.52   11.390 -4.675903 15.95315 
1 1 1    4   17   17 o  291.361   7.7490   64.988   3.4558   66.644   4.7255   63.084   5.0668  295.015   10.465  287.010   11.534 8.005432 15.57374 
1 1 1    4   17   18 o  736.491   6.9850  415.223   7.8741  413.784   11.025  416.722   11.250  735.126   9.7983  737.726   9.9626 -2.599487 13.97355 
1 1 1    4   17   19 o  276.733   8.4192   58.630   3.5661   58.772   4.9953   58.483   5.0927  277.017   11.781  276.332   12.041 0.6846008 16.84542 
1 1 1    4   17   20 o  438.509   7.2090  147.204   4.8386  144.607   6.7185  150.003   6.9744  434.564   10.101  442.592   10.295 -8.027679 14.42261 
1 1 1    4   17   21 o  756.804   7.1919  438.466   8.3309  435.701   11.644  441.365   11.925  754.306   10.085  759.185   10.262 -4.879150 14.38803 
1 1 1    4   17   22 o  443.444   7.4053  150.543   5.0264  153.162   7.1311  147.958   7.0858  447.211   10.418  439.545   10.532 7.666534 14.81402 
1 1 1    4   17   23 o  256.431   12.487   50.375   4.9010   47.367   5.7411   58.455   9.4103  248.135   15.189  275.009   22.554 -26.87337 27.19190 
1 1 1    4   17   24 o  738.093   10.881  417.263   12.293  405.357   16.703  431.333   18.157  727.224   15.005  750.100   15.815 -22.87585 21.80060 
1 1 1    4   17   25 f  1202.95   10.592  1108.36   19.504  1123.74   34.166  1100.93   23.754  1210.28   18.444  1198.67   12.947 11.60950 22.53419 
1 1 1    4   17   26 o  822.183   6.9571  517.532   8.7553  524.528   11.211  506.593   14.018  827.627   8.8496  813.205   11.262 14.42242 14.32328 
1 1 1    4   17   27 o  327.666   8.3643   82.215   4.1950   83.767   5.0849   78.905   7.4230  330.704   10.045  320.797   15.117 9.907349 18.15066 
1 1 1    4   17   28 o  260.838   8.4974   52.102   3.3926   52.412   4.7579   51.781   4.8388  261.534   11.885  259.949   12.161 1.585022 17.00467 
1 1 1    4   17   29 o  1040.24   7.0078  828.528   11.158  826.152   15.651  830.982   15.911  1038.51   9.8462  1041.53   9.9807 -3.018677 14.02011 
1 1 1    4   17   30 o  445.632   8.0547  152.084   5.4941  144.745   9.6222  155.633   6.6922  434.426   14.471  450.735   9.7001 -16.30954 17.42106 
1 1 1    4   17   31 o  252.607   9.7458   48.888   3.7682   51.854   5.4976   46.260   5.1751  259.644   13.883  245.198   13.845 14.44612 19.60736 
1 1 1    4   17   32 o  411.560   7.0957  129.714   4.4699  128.950   6.3349  130.472   6.3080  410.209   10.089  412.628   9.9877 -2.418915 14.19680 
1 1 1    4   17   33 o  371.319   7.4993  105.607   4.2623  103.311   5.9123  108.091   6.1502  367.114   10.522  375.501   10.701 -8.386658 15.00697 
1 1 1    4   17   34 o  171.079   12.577   22.579   3.2703   22.636   4.4807   22.514   4.7840  170.679   17.394  170.015   18.693 0.6642303 25.53380 
1 1 1    4   17   35 o  322.248   8.4124   79.579   4.1494   76.036   5.8544   83.155   5.8819  314.766   12.151  329.208   11.673 -14.44174 16.84962 
1 1 1    4   17   36 o  385.328   7.6205  113.771   4.4945  115.178   6.2688  112.283   6.4474  387.484   10.570  382.545   11.011 4.939819 15.26307 
1 1 1    4   17   37 o  752.192   6.7516  433.475   7.7733  429.361   10.892  437.745   11.097  748.218   9.5110  755.472   9.5964 -7.254944 13.51106 
1 1 1    4   17   38 o  306.112   8.8217   71.861   4.1333   74.988   6.1450   69.277   5.5858  312.343   12.853  300.282   12.153 12.06104 17.68920 
1 1 1    4   17   39 o   70.446   26.535   2.8815   3.8951   1.7588   4.0671   15.313   13.534   66.292   26.500  142.454   50.073 -76.16231 56.65289 
1 1 1    4   17   40 o  418.709   7.9388  134.445   5.0879  132.088   7.4140  136.542   6.9949  414.535   11.685  421.595   10.840 -7.060303 15.93846 
1 1 1    4   17   41 o  301.197   9.0640   69.632   4.1787   74.089   6.1096   65.714   5.7279  310.229   12.867  292.177   12.808 18.05261 18.15469 
1 1 1    4   17   42 o  242.275   10.289   45.108   3.8154   48.725   5.4284   41.577   5.3638  250.942   14.191  231.546   15.219 19.39563 20.80875 
1 1 1    4   17   43 o  395.585   9.7194  120.253   5.8850  124.999   6.9773  108.553   10.955  403.025   11.311  373.159   19.245 29.86591 22.32281 
1 1 1    4   17   44 o  279.412   24.986   61.977   10.573   61.977   10.573   0.0000   0.0000  279.412   24.986  ?   ?  0.000000 24.98634 
1 1 1    4   17   45 o  299.490   9.6104   68.981   4.4055   70.951   6.3416   67.142   6.1246  302.983   13.675  294.759   13.575 8.223846 19.26848 
1 1 1    4   17   46 o   61.838   24.257   1.8829   3.3482   2.2414   4.6906   1.5103   4.7809   71.098   28.445   68.793   28.273 2.305397 40.10643 
1 1 1    4   17   47 f  196.732   12.784   30.043   3.8288   33.791   5.5209   26.570   5.3144  207.453   17.552  183.304   19.228 24.14966 26.03390 
1 1 1    4   17   48 o  274.060   10.237   57.883   4.2945   63.122   6.1507   52.899   5.9987  285.314   14.084  260.520   15.108 24.79422 20.65490 
1 1 1    4   17   49 o  243.413   11.821   45.795   4.4043   43.208   6.6987   47.766   5.8453  233.965   18.866  247.254   15.524 -13.28918 24.43190 
1 1 1    4   17   50 o  306.884   10.128   72.640   4.7572   68.889   6.7096   76.432   6.7460  297.567   14.731  313.665   14.051 -16.09897 20.35807 
1 1 1    4   17   51 o  212.252   14.506   35.228   4.6846   31.176   6.7259   39.046   6.5284  196.544   22.780  221.692   19.435 -25.14867 29.94424 
1 1 1    4   17   52 o  127.968   30.353   14.025   5.8554   13.132   6.2519   20.404   16.707  123.106   32.646  147.437   55.070 -24.33155 64.01949 
1 1 1    4   17   53 o   69.588   27.467   2.5782   4.3176   5.2140   6.4024   0.3796   5.8474   88.266   33.835   69.866   30.110 18.39938 45.29293 
1 1 1    4   17   54 o   91.232   29.665   6.8893   4.7460   9.1871   7.2949   5.2029   6.2493  104.915   36.769   87.329   33.440 17.58628 49.70105 
1 1 1    4   17   55 o  237.678   33.972   49.449   12.007   0.0000   0.0000   49.449   12.007  ?   ?   237.678   33.972 0.000000 33.97178 
1 1 1    4   17   56 o  118.803   32.085   12.630   5.9716   18.064   10.448   9.9935   7.2773  135.599   44.012  106.496   36.758 29.10291 57.34307 
1 1 1    4   17   57 o  119.299   26.690   12.354   4.7517   13.785   7.3779   11.340   6.2115  121.241   36.649  111.544   33.607 9.696678 49.72561 
1 1 1    4   17   58 o   40.312   19.428  -4.9395   3.5677  -6.4931   6.4138  -4.2434   4.2931   56.354   26.860   47.249   22.363 9.105831 34.95095 
1 1 1    4   17   59 o   75.105   26.147   4.6089   3.6860   0.1599   6.4582   6.7583   4.4889   69.539   30.760   87.717   28.867 -18.17754 42.18396 
1 1 1    4   17   60 o  188.251   13.380   28.210   3.8303   30.546   6.4734   26.952   4.7512  189.321   22.797  181.669   17.295 7.652084 28.61562 
1 1 1    4   17   61 o  199.144   18.973   32.976   5.7134   41.218   7.4262   21.021   8.9438  219.476   22.421  139.618   39.873 79.85776 45.74426 
1 1 1    4   18    0 o  504.285   11.639  195.008   8.9728  195.008   8.9728  195.008   8.9728  504.285   11.639  504.285   11.639 0.000000 0.000000 
1 1 1    4   18    1 o  658.585   12.267  332.229   12.365   0.0000   0.0000  332.229   12.365  ?   ?   658.585   12.267 0.000000 12.26670 
1 1 1    4   18    2 o  697.354   12.601  372.511   13.450   0.0000   0.0000  372.511   13.450  ?   ?   697.354   12.601 0.000000 12.60055 
1 1 1    4   18    3 o  484.342   11.522  179.667   8.5417   0.0000   0.0000  179.667   8.5417  ?   ?   484.342   11.522 0.000000 11.52188 
1 1 1    4   18    4 o  1417.04   13.697  1538.34   29.709  1535.03   42.135  1541.62   41.895  1414.76   19.458  1417.82   19.305 -3.055908 27.40974 
1 1 1    4   18    5 o  1609.05   12.383  1983.09   30.497  1963.59   36.998  2024.43   53.864  1600.80   15.100  1624.34   21.665 -23.54480 26.40760 
1 1 1    4   18    6 o  622.062   8.7021  296.267   8.2857  289.124   11.598  303.712   11.841  614.393   12.333  629.704   12.285 -15.31097 17.40783 
1 1 1    4   18    7 o  1120.61   11.558  961.726   19.825  969.393   28.297  954.335   27.783  1124.67   16.438  1115.91   16.266 8.752930 23.12557 
1 1 1    4   18    8 o  1758.29   16.316  2369.25   43.912  2401.84   63.166  2338.78   61.086  1769.08   23.328  1745.80   22.860 23.28113 32.66132 
1 1 1    4   18    9 o  1033.27   9.0244  817.419   14.273  862.854   25.963  797.743   17.086  1061.14   15.985  1020.66   10.937 40.47565 19.36847 
1 1 1    4   18   10 o  2137.03   19.351  3501.51   63.297   0.0000   0.0000  3501.51   63.297  ?   ?   2137.03   19.351 0.000000 19.35084 
1 1 1    4   18   11 o  627.467   6.3791  301.375   6.1266  296.757   8.6814  305.956   8.6472  622.579   9.1102  632.158   8.9368 -9.579834 12.76171 
1 1 1    4   18   12 o  217.989   8.2391   36.379   2.7491   33.623   3.8464   39.257   3.9304  209.184   12.064  226.126   11.392 -16.94289 16.59332 
1 1 1    4   18   13 o  365.136   7.5872  102.063   4.2404  106.587   5.3235   94.210   7.0138  373.114   9.3215  350.713   13.066 22.40094 16.04997 
1 1 1    4   18   14 o  391.381   7.6265  117.263   4.5687  120.870   5.6989  110.774   7.6434  397.327   9.3707  380.295   13.131 17.03232 16.13171 
1 1 1    4   18   15 o  879.659   7.3694  592.356   9.9224  590.142   13.915  594.647   14.153  877.899   10.355  881.238   10.492 -3.338440 14.74203 
1 1 1    4   18   16 o  1371.67   9.6106  1440.59   20.178  1435.25   28.348  1446.07   28.726  1368.82   13.530  1373.96   13.660 -5.139648 19.22643 
1 1 1    4   18   17 o  831.995   7.2872  529.907   9.2801  524.242   12.919  535.946   13.339  827.427   10.201  836.602   10.417 -9.175476 14.57963 
1 1 1    4   18   18 o   44.030   19.736  -1.2945   2.7505   0.4977   3.7905  -3.2875   3.9973   59.705   24.913   49.140   22.696 10.56496 33.70144 
1 1 1    4   18   19 o  829.646   7.3515  526.935   9.3356  506.279   12.752  550.788   13.704  813.106   10.246  848.080   10.557 -34.97357 14.71186 
1 1 1    4   18   20 o  347.926   7.8550   92.677   4.1831   96.360   5.8966   88.945   5.9353  354.713   10.861  340.782   11.379 13.93176 15.72992 
1 1 1    4   18   21 o  803.937   7.4648  494.805   9.1856  504.945   13.055  484.862   12.927  811.996   10.504  795.678   10.614 16.31793 14.93297 
1 1 1    4   18   22 f  757.216   8.6392  439.026   10.013  437.940   12.087  441.403   17.878  756.194   10.442  758.862   15.392 -2.668335 18.59967 
1 1 1    4   18   23 o   89.379   27.808   6.1012   4.2095   1.6640   7.4131   8.2129   5.1139   85.279   35.146  102.577   30.401 -17.29790 46.47060 
1 1 1    4   18   24 o  1037.14   8.4845  823.650   13.469  813.020   18.790  834.884   19.317  1030.17   11.916  1043.91   12.090 -13.74414 16.97523 
1 1 1    4   18   25 o  573.269   7.8746  251.631   6.9097  253.292   9.7151  249.931   9.8294  575.026   11.038  571.187   11.243 3.838684 15.75562 
1 1 1    4   18   26 o  824.517   8.1001  520.563   10.223  511.389   14.180  530.491   14.751  817.009   11.339  832.109   11.582 -15.09973 16.20815 
1 1 1    4   18   27 o  1029.64   8.7672  811.904   13.817  816.442   19.582  807.405   19.499  1032.17   12.395  1026.44   12.411 5.730469 17.54026 
1 1 1    4   18   28 o  674.090   7.0761  347.922   7.3010  337.952   8.9712  367.475   12.564  664.274   8.8233  692.476   11.853 -28.20209 14.77685 
1 1 1    4   18   29 o  818.624   9.3274  513.334   11.687   0.0000   0.0000  513.334   11.687  ?   ?   818.624   9.3274 0.000000 9.327428 
1 1 1    4   18   30 o  227.229   10.345   39.564   3.5981   37.695   5.0313   41.521   5.1477  221.146   14.952  232.187   14.558 -11.04153 20.86847 
1 1 1    4   18   31 o  607.853   6.4181  282.923   5.9713  288.550   8.4825  277.395   8.4075  613.708   9.0301  601.721   9.1285 11.98700 12.84030 
1 1 1    4   18   32 o  249.283   9.2022   47.617   3.5112   45.017   4.9905   50.166   4.9410  241.831   13.537  255.728   12.623 -13.89729 18.50903 
1 1 1    4   18   33 o  232.250   9.6905   41.345   3.4449   40.155   4.7506   42.665   5.0027  228.305   13.657  235.322   13.951 -7.017548 19.52333 
1 1 1    4   18   34 o  425.522   7.1392  138.706   4.6499  133.355   6.3811  144.765   6.7898  417.044   9.9964  434.501   10.209 -17.45731 14.28840 
1 1 1    4   18   35 o  396.499   7.3460  120.451   4.4582  116.855   6.1478  124.440   6.4746  390.324   10.290  402.774   10.502 -12.44971 14.70326 
1 1 1    4   18   36 o  555.520   6.7933  236.431   5.7763  228.340   7.9392  245.532   8.4197  545.651   9.5059  565.793   9.7224 -20.14185 13.59726 
1 1 1    4   18   37 o  117.951   17.596   10.963   3.0795   12.346   4.5263   9.7708   4.2019  123.923   24.730  109.927   25.472 13.99664 35.50164 
1 1 1    4   18   38 o  302.203   12.322   70.197   5.6998   72.829   6.1361   53.637   15.391  307.738   13.027  256.075   40.625 51.66351 42.66219 
1 1 1    4   18   39 o  293.944   8.6708   66.282   3.9012   58.658   5.3221   75.135   5.7352  276.163   12.591  312.624   11.986 -36.46100 17.38326 
1 1 1    4   18   40 o   55.495   22.307   1.1414   2.8995   1.1826   3.9109   1.0910   4.3205   62.754   25.656   65.032   26.820 -2.278854 37.11557 
1 1 1    4   18   41 o  130.540   17.009   13.400   3.3177   13.496   4.4904   13.285   4.9234  129.543   23.512  127.922   26.030 1.621170 35.07723 
1 1 1    4   18   42 o  202.519   11.720   31.674   3.6174   36.818   5.3078   27.212   4.9432  217.586   16.051  186.573   17.515 31.01357 23.75685 
1 1 1    4   18   43 o  212.600   14.829   35.110   4.7953   46.469   10.189   31.878   5.4347  240.544   28.210  201.867   17.770 38.67630 33.34084 
1 1 1    4   18   44 o  300.452   9.5732   69.411   4.4025   70.063   6.6023   68.888   5.9077  300.987   14.331  298.745   12.920 2.242676 19.29489 
1 1 1    4   18   45 o  362.033   8.5185  100.719   4.7204  104.787   6.6716   96.640   6.6797  368.577   11.826  353.838   12.333 14.73898 17.08699 
1 1 1    4   18   46 o  362.180   8.4748  100.826   4.6981   96.982   6.6298  104.703   6.6585  354.382   12.222  368.328   11.811 -13.94543 16.99649 
1 1 1    4   18   47 o  279.618   10.052   60.227   4.3023   63.322   6.0956   57.154   6.0731  285.864   13.931  271.016   14.695 14.84808 20.24907 
1 1 1    4   18   48 o   90.936   25.363   6.8106   3.6635   7.4975   5.0901   6.0724   5.2768   96.164   30.669   89.655   31.281 6.509377 43.80714 
1 1 1    4   18   49 o  280.897   10.264   60.857   4.4129   63.062   6.2106   58.610   6.2715  284.920   14.241  274.067   15.007 10.85333 20.68874 
1 1 1    4   18   50 o  189.773   15.450   28.258   4.4489   26.721   6.6008   29.538   6.0224  181.226   24.418  192.180   20.806 -10.95406 32.07954 
1 1 1    4   18   51 o  276.656   15.041   59.872   6.3453   60.253   6.7838   57.204   17.941  277.121   16.062  246.688   49.240 30.43346 51.79310 
1 1 1    4   18   52 o  138.363   20.618   15.508   4.2331   12.671   6.1149   18.119   5.8659  120.835   32.398  147.131   27.044 -26.29578 42.20207 
1 1 1    4   18   53 o   83.411   28.207   5.5169   4.2810   4.7304   6.1988   6.2340   5.9194   85.611   33.166   90.692   32.968 -5.080635 46.76356 
1 1 1    4   18   54 o   84.578   28.878   5.7148   4.4878   6.3149   6.5439   5.1819   6.1664   92.098   34.452   86.757   33.218 5.341202 47.85797 
1 1 1    4   18   55 o   51.830   24.248  -3.9589   4.7952   0.9302   7.1447  -7.9664   6.4685   76.600   33.147   55.037   26.431 21.56229 42.39479 
1 1 1    4   18   56 o   97.680   32.472   8.2924   5.6750  -2.6832   15.800   9.9181   6.0807   97.097   44.943  105.328   33.513 -8.231728 56.06256 
1 1 1    4   18   57 o  236.869   14.238   44.347   5.1381   39.589   6.9734   49.998   7.5995  219.711   20.991  247.671   20.223 -27.95959 29.14814 
1 1 1    4   18   58 o   61.742   26.103   1.0957   4.2472   2.8495   6.3278  -0.3423   5.7297   76.917   32.150   65.180   28.896 11.73627 43.22717 
1 1 1    4   18   59 o   47.232   22.269  -3.6879   4.1828 -15.2846   6.1044   6.5759   5.7429   43.149   21.621   87.675   32.378 -44.52593 38.93277 
1 1 1    4   18   60 o   64.053   26.192   2.1839   4.0770   1.8501   5.6765   2.5395   5.8594   69.739   29.853   72.539   30.663 -2.799950 42.79535 
1 1 1    4   18   61 o  166.613   17.946   23.003   4.5044   21.106   6.8273   24.465   5.9942  149.035   30.941  167.005   24.151 -17.97011 39.25082 
1 1 1    4   19    0 o  611.944   12.390  287.053   11.595  287.053   11.595  287.053   11.595  611.944   12.390  611.944   12.390 0.000000 0.000000 
1 1 1    4   19    1 o  344.836   12.489   91.076   6.5919   0.0000   0.0000   91.076   6.5919  ?   ?   344.836   12.489 0.000000 12.48907 
1 1 1    4   19    2 o  1565.01   20.985  1878.55   50.267   0.0000   0.0000  1878.55   50.267  ?   ?   1565.01   20.985 0.000000 20.98450 
1 1 1    4   19    3 o  1382.95   19.069  1466.32   40.365   0.0000   0.0000  1466.32   40.365  ?   ?   1382.95   19.069 0.000000 19.06888 
1 1 1    4   19    4 o  619.987   12.378  294.395   11.747   0.0000   0.0000  294.395   11.747  ?   ?   619.987   12.378 0.000000 12.37839 
1 1 1    4   19    5 o  1232.29   12.436  1163.03   23.456  1148.21   32.909  1178.33   33.440  1223.96   17.566  1239.90   17.620 -15.94226 24.88056 
1 1 1    4   19    6 o  1272.21   12.744  1239.63   24.816  1264.92   36.076  1216.92   34.190  1284.58   18.348  1260.04   17.728 24.54114 25.51298 
1 1 1    4   19    7 o  768.556   7.8522  452.187   9.2371  446.707   11.281  463.332   16.090  763.828   9.6494  777.746   13.516 -13.91833 16.60674 
1 1 1    4   19    8 o  838.348   8.1543  538.054   10.464  536.753   12.860  540.602   17.999  837.266   10.035  840.074   13.998 -2.807251 17.22304 
1 1 1    4   19    9 o  485.555   7.2821  180.479   5.4121  181.486   6.7286  178.632   9.1087  486.876   9.0289  482.952   12.322 3.923950 15.27595 
1 1 1    4   19   10 o  754.394   9.6590  435.739   11.153  435.739   11.153   0.0000   0.0000  754.394   9.6590  ?   ?  0.000000 9.658954 
1 1 1    4   19   11 o  1201.82   10.065  1105.93   18.515  1113.81   22.835  1090.80   31.634  1205.94   12.371  1193.01   17.324 12.93225 21.28731 
1 1 1    4   19   12 o  496.393   7.4623  188.628   5.6698  189.663   6.9857  186.632   9.7060  497.718   9.1697  493.629   12.846 4.089050 15.78301 
1 1 1    4   19   13 o  282.335   7.5350   61.022   3.2562   60.269   4.5148   61.839   4.7008  280.550   10.514  284.176   10.807 -3.625458 15.07779 
1 1 1    4   19   14 o  411.919   6.7701  129.886   4.2685  132.833   6.0080  126.882   6.0656  416.521   9.4237  407.078   9.7348 9.443451 13.54886 
1 1 1    4   19   15 o  495.973   6.6983  188.303   5.0850  184.469   7.0632  192.427   7.3266  490.844   9.4014  501.315   9.5482 -10.47125 13.39977 
1 1 1    4   19   16 o  1017.81   7.9978  793.089   12.460  781.055   17.305  806.043   17.954  1009.89   11.195  1025.91   11.434 -16.01276 16.00189 
1 1 1    4   19   17 o  837.764   7.3750  537.298   9.4570  542.112   13.337  532.428   13.412  841.386   10.356  833.830   10.509 7.556519 14.75377 
1 1 1    4   19   18 o  465.144   7.0603  165.631   5.0267  166.667   6.9780  164.513   7.2472  466.535   9.7718  463.499   10.215 3.036530 14.13655 
1 1 1    4   19   19 o  1478.80   14.468  1675.76   32.748  1675.76   32.748   0.0000   0.0000  1478.80   14.468  ?   ?  0.000000 14.46784 
1 1 1    4   19   20 o  1219.08   10.443  1138.17   19.486  1148.51   23.983  1118.10   33.427  1224.39   12.797  1207.45   18.086 16.94482 22.15587 
1 1 1    4   19   21 o  263.505   10.163   53.176   4.0989   58.927   5.7457   47.217   5.8491  277.313   13.536  247.705   15.505 29.60805 20.58279 
1 1 1    4   19   22 o  272.584   12.211   56.924   5.0948   45.449   8.7213   62.869   6.2772  242.049   23.850  286.408   14.319 -44.35864 27.81836 
1 1 1    4   19   23 o  551.318   7.6325  232.719   6.4408  235.311   9.1387  230.161   9.0789  554.260   10.772  548.160   10.821 6.100464 15.26847 
1 1 1    4   19   24 o  1202.25   9.1776  1106.91   16.889  1114.99   23.937  1098.90   23.832  1206.23   12.965  1197.49   13.002 8.740356 18.36140 
1 1 1    4   19   25 o  863.281   8.1290  570.668   10.741  563.266   14.990  578.481   15.400  857.434   11.421  868.924   11.579 -11.48999 16.26396 
1 1 1    4   19   26 o  574.590   8.2631  252.825   7.2672  248.919   10.100  257.018   10.464  569.967   11.577  579.151   11.805 -9.184692 16.53430 
1 1 1    4   19   27 o  539.088   8.5424  222.568   7.0487  214.997   9.7440  230.879   10.209  529.657   12.019  548.863   12.152 -19.20575 17.09174 
1 1 1    4   19   28 o  464.230   10.319  165.118   7.3320  160.185   12.055  168.013   9.2367  456.785   17.243  468.135   12.891 -11.35089 21.52847 
1 1 1    4   19   29 o  586.600   8.6037  263.572   7.7250  272.890   9.3460  243.478   13.725  596.772   10.232  563.205   15.921 33.56659 18.92514 
1 1 1    4   19   30 o  587.012   7.3489  263.902   6.6030  258.936   7.9944  274.561   11.713  581.362   8.9840  598.320   12.790 -16.95837 15.62974 
1 1 1    4   19   31 o  232.352   9.3187   41.370   3.3141   40.712   4.5186   42.137   4.8755  230.003   12.887  233.924   13.676 -3.920380 18.79147 
1 1 1    4   19   32 o  479.773   6.7703  176.295   4.9718  167.887   6.7932  185.994   7.2960  468.021   9.4829  492.598   9.6766 -24.57657 13.54849 
1 1 1    4   19   33 o  464.695   6.8910  165.409   4.9014  167.570   6.8806  163.182   6.9839  467.526   9.6150  461.341   9.8901 6.184479 13.79360 
1 1 1    4   19   34 o  380.376   7.2220  110.850   4.2048  115.629   6.0039  106.249   5.8906  388.289   10.102  372.187   10.340 16.10193 14.45576 
1 1 1    4   19   35 o  700.666   6.5936  376.095   7.0714  374.460   9.8951  377.801   10.109  698.802   9.2511  701.888   9.4098 -3.086243 13.19576 
1 1 1    4   19   36 o  385.582   7.4118  113.942   4.3743  110.122   6.0318  118.179   6.3531  378.806   10.403  392.400   10.578 -13.59448 14.83610 
1 1 1    4   19   37 o  379.583   10.839  110.634   6.2972  110.659   6.8348  110.492   16.199  379.514   11.766  374.710   28.456 4.804382 30.79218 
1 1 1    4   19   38 o  298.133   8.4656   68.175   3.8631   66.761   5.3834   69.676   5.5468  294.703   11.934  301.058   12.037 -6.354462 16.95056 
1 1 1    4   19   39 o  508.082   8.4304  198.042   6.5562  169.650   11.358  212.228   8.0287  468.828   15.828  525.711   9.9777 -56.88293 18.71044 
1 1 1    4   19   40 o  484.666   7.2308  180.125   5.3642  180.906   7.5973  179.349   7.5749  485.241   10.229  483.145   10.243 2.096100 14.47590 
1 1 1    4   19   41 o  316.161   8.3533   76.719   4.0424   73.135   5.6456   80.489   5.7907  308.224   11.967  323.391   11.699 -15.16611 16.73499 
1 1 1    4   19   42 o   73.123   23.584   4.0985   3.0035   2.6225   4.0281   5.9465   4.5073   69.524   26.791   87.969   28.925 -18.44521 39.42564 
1 1 1    4   19   43 o  192.304   16.340   28.877   4.7641   28.103   11.954   29.023   5.1944  179.922   43.816  192.431   17.838 -12.50908 47.30763 
1 1 1    4   19   44 f  325.760   8.6154   81.546   4.2958   75.080   6.0042   88.327   6.1487  311.863   12.578  338.417   11.870 -26.55386 17.29501 
1 1 1    4   19   45 o   90.219   22.799   6.6636   3.1497   4.7548   4.5335   8.4448   4.3793   81.530   28.947  101.107   27.548 -19.57726 39.96043 
1 1 1    4   19   46 o  214.553   11.544   35.624   3.7772   36.660   5.3981   34.631   5.2872  216.454   16.415  210.301   16.559 6.152313 23.31688 
1 1 1    4   19   47 o  246.359   10.744   46.811   4.0513   42.381   5.5290   51.947   5.9534  232.921   15.599  258.121   15.135 -25.19977 21.73428 
1 1 1    4   19   48 o  327.898   9.2567   82.793   4.6458   80.953   6.4813   84.737   6.6628  323.241   13.100  330.691   13.163 -7.450165 18.57100 
1 1 1    4   19   49 o  236.534   12.438   43.443   4.4873   42.787   6.4348   44.065   6.2609  232.842   18.200  236.611   17.410 -3.768936 25.18601 
1 1 1    4   19   50 o  126.458   27.126   13.413   5.0932   15.814   5.3379 -10.9833   17.017  137.907   26.247   95.854   45.108 42.05364 52.18811 
1 1 1    4   19   51 f  178.977   16.200   25.273   4.3897   23.139   6.0796   27.598   6.3449  168.074   24.341  184.425   22.975 -16.35007 33.47128 
1 1 1    4   19   52 o  188.834   15.203   28.056   4.3570   33.133   6.4237   23.729   5.9294  202.928   20.984  170.405   23.347 32.52306 31.39154 
1 1 1    4   19   53 o  316.272   13.679   78.039   6.6219   81.144   7.7723   69.818   12.648  321.483   15.795  288.618   29.023 32.86554 33.04271 
1 1 1    4   19   54 o  149.881   20.923   18.343   4.6690   14.839   6.5247   22.020   6.6842  129.095   32.918  160.697   28.204 -31.60136 43.34853 
1 1 1    4   19   55 o   80.648   30.685   4.5700   5.2410   15.813   10.903   1.1915   5.9767  127.630   44.937   71.780   30.677 55.85021 54.40990 
1 1 1    4   19   56 o  208.403   15.438   34.512   4.8896   36.049   7.6209   33.436   6.3746  207.472   24.469  202.065   20.913 5.406982 32.18840 
1 1 1    4   19   57 o  172.636   18.268   24.199   4.7538   28.024   7.5598   21.698   6.1138  179.077   28.538  158.862   26.046 20.21495 38.63729 
1 1 1    4   19   58 o  117.110   25.088   11.996   4.3617   11.186   6.4838   12.666   5.8949  108.360   34.620  116.305   32.075 -7.945297 47.19437 
1 1 1    4   19   59 o   75.511   27.298   4.6554   4.0506   6.7434   5.8307   2.7078   5.6312   87.974   32.597   72.601   30.336 15.37327 44.52926 
1 1 1    4   19   60 o   44.629   21.357  -4.6154   4.1411  -4.5666   6.2420  -4.6538   5.5343   57.246   27.055   53.300   25.274 3.945217 37.02348 
1 1 1    4   20    0 o  656.500   12.799  330.347   12.850  330.347   12.850  330.347   12.850  656.500   12.799  656.500   12.799 0.000000 0.000000 
1 1 1    4   20    1 o  1204.81   17.288  1112.45   31.880   0.0000   0.0000  1112.45   31.880  ?   ?   1204.81   17.288 0.000000 17.28764 
1 1 1    4   20    2 o  1958.98   25.411  2945.83   76.195   0.0000   0.0000  2945.83   76.195  ?   ?   1958.98   25.411 0.000000 25.41127 
1 1 1    4   20    3 f  849.310   14.113  552.554   18.346   0.0000   0.0000  552.554   18.346  ?   ?   849.310   14.113 0.000000 14.11261 
1 1 1    4   20    4 o  1252.44   12.661  1201.37   24.271  1193.39   34.276  1209.39   34.374  1247.80   17.946  1256.15   17.878 -8.343872 25.33182 
1 1 1    4   20    5 o  1519.32   14.619  1768.35   33.997  1755.26   47.923  1781.61   48.236  1512.93   20.695  1524.25   20.675 -11.31763 29.25283 
1 1 1    4   20    6 o  534.656   7.4171  218.826   6.0699  221.137   7.5741  214.678   10.148  537.434   9.2074  529.439   12.523 7.994934 15.54315 
1 1 1    4   20    7 o  637.096   9.4728  310.765   9.2374  336.747   13.803  289.689   12.432  663.045   13.601  614.990   13.207 48.05524 18.95770 
1 1 1    4   20    8 f  590.839   13.153  267.383   11.895  267.383   11.895   0.0000   0.0000  590.839   13.153  ?   ?  0.000000 13.15325 
1 1 1    4   20    9 o  412.010   9.3068  129.968   5.8692  129.968   5.8692   0.0000   0.0000  412.010   9.3068  ?   ?  0.000000 9.306773 
1 1 1    4   20   10 o  1196.50   10.062  1096.17   18.428  1111.42   22.911  1068.21   31.014  1204.64   12.426  1180.59   17.163 24.04932 21.18853 
1 1 1    4   20   11 o  1315.78   9.3138  1325.54   18.758  1323.96   26.473  1327.12   26.582  1314.72   13.156  1316.28   13.194 -1.562622 18.63172 
1 1 1    4   20   12 o  453.418   6.6990  157.375   4.6492  161.294   6.5604  153.421   6.5897  458.980   9.3382  447.631   9.6178 11.34897 13.40539 
1 1 1    4   20   13 o  766.351   7.0551  449.581   8.2756  449.538   11.653  449.625   11.755  766.216   9.9357  766.287   10.022 -0.7049561E-01 14.11257 
1 1 1    4   20   14 o  1192.42   8.7749  1088.62   16.015  1089.90   22.667  1087.34   22.631  1192.87   12.415  1191.47   12.410 1.401123 17.55335 
1 1 1    4   20   15 o  903.796   7.5745  625.346   10.478  629.254   14.855  621.475   14.783  906.472   10.707  900.850   10.721 5.621277 15.15144 
1 1 1    4   20   16 o  1048.17   8.1674  841.148   13.103  841.456   18.495  840.838   18.567  1048.16   11.528  1047.77   11.577 0.3884277 16.33812 
1 1 1    4   20   17 o  364.337   8.9266  101.638   4.9781  102.010   5.9801  100.798   8.9837  364.966   10.705  362.629   16.185 2.336761 19.40520 
1 1 1    4   20   18 f  603.943   8.2081  279.264   7.5876  286.932   9.3904  264.842   12.879  612.114   10.023  587.886   14.312 24.22766 17.47267 
1 1 1    4   20   19 o  1031.00   8.2700  813.861   13.051  825.187   18.592  802.859   18.324  1037.91   11.703  1023.77   11.694 14.13739 16.54375 
1 1 1    4   20   20 o  511.057   8.7596  199.990   6.8521  198.490   11.730  200.767   8.4421  508.874   15.060  511.980   10.773 -3.105438 18.51653 
1 1 1    4   20   21 o  864.209   9.0520  571.920   11.974  572.601   20.868  571.586   14.620  864.201   15.776  863.831   11.057 0.3706665 19.26500 
1 1 1    4   20   22 o  527.203   7.8588  212.814   6.3417  209.031   8.8867  216.739   9.0526  522.373   11.115  531.917   11.119 -9.544006 15.72134 
1 1 1    4   20   23 o  1021.95   8.5125  799.743   13.315  788.360   18.598  811.714   19.073  1014.36   11.979  1029.26   12.106 -14.90186 17.03095 
1 1 1    4   20   24 o  278.728   15.690   59.770   6.6667   59.770   6.6667   0.0000   0.0000  278.728   15.690  ?   ?  0.000000 15.69020 
1 1 1    4   20   25 o  285.727   11.282   62.553   4.9342   63.483   7.0042   61.637   6.9519  287.230   15.995  283.000   16.116 4.230713 22.70600 
1 1 1    4   20   26 o   72.205   28.276   2.3727   4.5433   1.7738   6.3847   2.9870   6.4665   80.162   32.778   84.644   33.549 -4.481590 46.90332 
1 1 1    4   20   27 f  652.773   9.5611  326.433   9.5530  324.417   15.502  327.668   12.130  650.221   15.576  653.809   12.121 -3.587769 19.73623 
1 1 1    4   20   28 o  1122.83   10.467  966.132   17.989  960.621   22.111  976.923   30.938  1119.23   12.907  1127.65   17.925 -8.409790 22.08803 
1 1 1    4   20   29 o  294.038   12.212   66.300   5.4960   58.773   7.7662   73.852   7.7787  275.875   18.499  309.645   16.472 -33.76953 24.76959 
1 1 1    4   20   30 o  273.068   9.9263   57.151   4.1489   61.502   4.9320   46.621   7.6731  283.205   11.378  245.175   20.639 38.02968 23.56711 
1 1 1    4   20   31 o  439.067   7.8848  147.691   5.2989  147.400   6.3533  148.358   9.6047  438.532   9.4652  439.533   14.276 -1.001495 17.12914 
1 1 1    4   20   32 o  246.169   8.8224   46.445   3.3242   43.123   4.5129   50.386   4.9152  236.701   12.501  256.210   12.533 -19.50867 17.70178 
1 1 1    4   20   33 o  557.719   8.5745  238.416   7.3197  207.752   10.615  266.211   10.107  520.055   13.336  589.013   11.210 -68.95758 17.42153 
1 1 1    4   20   34 o  198.200   10.404   30.222   3.1453   27.764   4.3335   32.958   4.5725  189.380   15.075  206.509   14.559 -17.12897 20.95738 
1 1 1    4   20   35 o  752.065   7.9836  433.569   9.1902  443.657   13.086  423.751   12.910  760.156   11.247  742.884   11.353 17.27136 15.98090 
1 1 1    4   20   36 o  340.004   11.072   88.776   5.7620   91.083   6.2961   76.883   14.296  344.297   11.947  311.598   30.359 32.69925 32.62544 
1 1 1    4   20   37 o  329.796   9.7424   83.482   4.9179   57.374   9.1913   93.955   5.8213  270.849   22.371  349.747   10.874 -78.89780 24.87377 
1 1 1    4   20   38 o  408.878   7.3944  128.182   4.6277  129.128   6.5126  127.217   6.5769  410.019   10.377  406.948   10.559 3.070801 14.80456 
1 1 1    4   20   39 o  119.039   16.104   11.142   2.8588   9.0629   3.8948   13.570   4.2096  105.603   24.560  130.334   21.877 -24.73106 32.89012 
1 1 1    4   20   40 o  225.608   10.064   39.114   3.4752   39.236   4.9714   38.996   4.8600  225.010   14.512  224.373   14.225 0.6366882 20.32099 
1 1 1    4   20   41 o  258.579   9.5975   51.382   3.7986   50.562   5.3115   52.240   5.4346  255.622   13.624  259.823   13.714 -4.200256 19.33125 
1 1 1    4   20   42 o  148.856   18.941   17.517   4.2179   28.197   11.539   15.870   4.5315  180.935   42.405  140.859   21.716 40.07619 47.64178 
1 1 1    4   20   43 o  164.232   13.116   20.962   3.2696   17.767   4.4773   24.613   4.7861  149.509   20.072  176.954   17.917 -27.44540 26.90553 
1 1 1    4   20   44 o  178.965   12.477   24.850   3.3964   23.405   4.6306   26.532   4.9967  172.435   17.801  183.645   18.008 -11.21075 25.32075 
1 1 1    4   20   45 o  464.028   7.7460  165.396   5.5016  164.403   7.7412  166.410   7.8204  461.785   10.952  464.581   10.998 -2.795715 15.52081 
1 1 1    4   20   46 o  386.137   10.283  114.907   6.0774  120.855   7.1763   99.824   11.428  395.553   11.853  355.395   21.103 40.15833 24.20400 
1 1 1    4   20   47 o  104.398   21.629   8.9089   3.3426   9.4132   4.7499   8.4141   4.7047  106.051   28.605  100.586   28.978 5.465538 40.71811 
1 1 1    4   20   48 o  184.028   13.708   26.423   3.8334   30.435   5.3914   22.321   5.4516  196.229   18.156  166.528   21.921 29.70126 28.46330 
1 1 1    4   20   49 o  111.953   24.070   10.385   4.0019   10.656   5.6348   10.110   5.6846  111.831   31.549  109.108   31.975 2.723587 44.91927 
1 1 1    4   20   50 o   77.353   28.948   3.9848   4.6209   2.6616   5.1117   9.9003   10.808   73.995   29.663  114.522   43.948 -40.52686 53.02134 
1 1 1    4   20   51 o  256.879   11.980   51.167   4.7105   52.472   6.7003   49.891   6.6238  257.896   17.070  251.333   17.324 6.563019 24.32117 
1 1 1    4   20   52 o  165.932   17.358   21.920   4.3433   21.979   6.2330   21.865   6.0555  162.464   25.938  162.406   25.175 0.5755615E-01 36.14617 
1 1 1    4   20   53 o  106.882   31.559   9.9592   5.5192   14.318   6.2878  -4.6708   11.520  127.358   32.229   83.592   38.581 43.76592 50.27094 
1 1 1    4   20   54 o  185.910   16.872   27.568   4.7489   25.864   6.3539   29.725   7.1479  176.381   24.171  188.502   25.422 -12.12141 35.07894 
1 1 1    4   20   55 o  131.400   30.129   15.291   5.9303 -10.9551   16.108   19.407   6.3783   88.389   42.250  149.180   28.978 -60.79001 51.23288 
1 1 1    4   20   56 o  141.084   20.948   16.488   4.3864   23.643   6.1613   9.1354   6.2461  167.045   24.855  101.099   34.071 65.94601 42.17365 
1 1 1    4   20   57 o  183.661   17.917   27.407   4.9726   17.194   6.6090   40.733   7.5491  136.405   32.176  220.578   22.683 -84.17296 39.36724 
1 1 1    4   20   58 o   82.229   28.771   5.7897   4.4656   5.6935   6.8031   5.8626   5.9193   86.252   34.340   85.040   32.549 1.212639 47.31468 
1 1 1    4   20   59 o   52.256   23.999  -1.9939   4.3813   4.2807   6.6326  -6.8512   5.8357   80.310   33.186   51.450   24.809 28.86008 41.43381 
1 1 1    4   21    0 o  1886.31   24.635  2728.42   71.099  2728.42   71.099  2728.42   71.099  1886.31   24.635  1886.31   24.635 0.000000 0.000000 
1 1 1    4   21    1 o  1059.38   15.933  859.937   25.836   0.0000   0.0000  859.937   25.836  ?   ?   1059.38   15.933 0.000000 15.93329 
1 1 1    4   21    2 o  245.890   15.606   46.512   5.8432   0.0000   0.0000   46.512   5.8432  ?   ?   245.890   15.606 0.000000 15.60618 
1 1 1    4   21    4 o  953.416   15.362  696.458   22.418  696.458   22.418   0.0000   0.0000  953.416   15.362  ?   ?  0.000000 15.36212 
1 1 1    4   21    5 o  1755.65   23.354  2365.13   62.759  2365.13   62.759   0.0000   0.0000  1755.65   23.354  ?   ?  0.000000 23.35421 
1 1 1    4   21    6 o  1581.73   21.487  1919.02   52.021  1919.02   52.021   0.0000   0.0000  1581.73   21.487  ?   ?  0.000000 21.48723 
1 1 1    4   21    7 o  1918.49   14.470  2819.75   42.492  2777.41   51.090  2914.77   76.532  1903.57   17.535  1948.39   25.663 -44.81555 31.08102 
1 1 1    4   21    8 o  1426.72   11.477  1558.86   25.062  1525.06   30.017  1636.68   45.540  1410.95   13.899  1460.86   20.366 -49.90955 24.65693 
1 1 1    4   21    9 o  496.831   9.4053  188.997   7.1524  179.008   9.8799  199.996   10.368  483.413   13.353  510.970   13.256 -27.55701 18.81534 
1 1 1    4   21   10 o  806.355   10.231  497.886   12.628  510.108   18.177  486.485   17.556  815.963   14.554  796.855   14.394 19.10791 20.46976 
1 1 1    4   21   11 o  102.215   17.818   8.2422   2.6863   14.650   3.6634   0.7891   3.9508  137.087   17.885   62.018   25.619 75.06895 31.24425 
1 1 1    4   21   12 o  963.996   7.7761  711.434   11.474  714.664   16.244  708.219   16.209  966.020   10.986  961.653   11.012 4.367065 15.55494 
1 1 1    4   21   13 o  706.765   7.0014  382.394   7.5740  382.112   10.709  382.675   10.714  706.406   9.9044  706.926   9.9013 -0.5202026 14.00470 
1 1 1    4   21   14 o  420.033   9.9538  135.102   6.3994  135.102   6.3994   0.0000   0.0000  420.033   9.9538  ?   ?  0.000000 9.953770 
1 1 1    4   21   15 o  333.798   9.2279   85.316   4.7147   82.299   5.6596   92.158   8.5224  327.800   11.280  346.742   16.058 -18.94174 19.62379 
1 1 1    4   21   16 o  584.809   8.1290  261.848   7.2764  261.811   8.8671  261.924   12.732  584.708   9.9077  584.642   14.228 0.6604004E-01 17.33801 
1 1 1    4   21   17 o  584.331   7.1493  261.399   6.3943  265.833   9.2068  257.267   8.8874  589.164   10.209  579.601   10.018 9.563110 14.30352 
1 1 1    4   21   18 o  294.991   10.826   66.651   4.8880   55.764   8.1632   72.736   6.1030  268.829   19.982  308.110   12.941 -39.28079 23.80630 
1 1 1    4   21   19 o  1051.44   9.6996  846.639   15.610  872.925   27.907  834.670   18.832  1066.88   17.090  1043.81   11.787 23.06726 20.76026 
1 1 1    4   21   20 o  739.953   7.6078  419.216   8.6166  411.229   12.009  427.691   12.371  732.714   10.708  747.230   10.816 -14.51587 15.21972 
1 1 1    4   21   21 o  638.275   7.6778  311.930   7.5009  310.212   10.407  313.787   10.821  636.376   10.684  640.013   11.046 -3.636292 15.36759 
1 1 1    4   21   22 o  1229.83   9.3071  1158.35   17.520  1147.10   24.464  1170.20   25.102  1223.41   13.064  1235.64   13.272 -12.22583 18.62330 
1 1 1    4   21   23 o  410.697   8.8995  129.178   5.5944  127.202   7.9018  131.163   7.9217  407.397   12.672  413.701   12.510 -6.303314 17.80671 
1 1 1    4   21   24 o  601.742   8.0101  277.284   7.3776  279.339   10.364  275.172   10.504  603.791   11.214  599.256   11.452 4.534912 16.02857 
1 1 1    4   21   25 o  1562.80   12.647  1872.24   30.251  1902.08   53.041  1857.86   36.829  1572.58   22.036  1556.15   15.462 16.42383 26.91936 
1 1 1    4   21   26 o  310.461   12.315   73.892   5.8520   76.249   7.5409   70.323   9.2789  315.209   15.630  301.768   20.205 13.44098 25.54506 
1 1 1    4   21   27 o  827.880   9.4630  525.123   11.991  512.566   14.636  550.766   20.915  817.680   11.694  846.949   16.134 -29.26892 19.92589 
1 1 1    4   21   28 o  688.773   8.4017  363.429   8.8575  347.627   12.117  381.565   12.981  673.316   11.757  705.387   12.023 -32.07043 16.81582 
1 1 1    4   21   29 o  1041.42   9.0154  831.066   14.371  816.092   19.852  847.553   20.830  1031.38   12.575  1050.99   12.949 -19.61450 18.04988 
1 1 1    4   21   30 o  214.008   16.398   35.417   5.3306   29.945   7.3673   41.430   7.7224  195.169   25.254  230.660   22.145 -35.49161 33.58864 
1 1 1    4   21   31 o  744.173   7.3039  424.258   8.3195  427.278   10.499  419.161   13.639  746.596   9.1872  739.040   12.057 7.555847 15.15858 
1 1 1    4   21   32 o  631.979   7.2219  306.001   6.9860  302.941   8.6008  311.936   11.976  628.627   8.9388  637.416   12.275 -8.789124 15.18490 
1 1 1    4   21   33 o  318.498   7.4985   77.736   3.6556   77.673   5.0311   77.806   5.3205  318.181   10.330  318.408   10.917 -0.2266846 15.02983 
1 1 1    4   21   34 o  360.237   7.8457   99.473   4.3260   89.651   5.4855  115.630   7.0356  341.779   10.486  388.001   11.847 -46.22211 15.82084 
1 1 1    4   21   35 o  668.268   9.5438  342.647   9.7620  344.421   11.175  336.935   20.055  669.735   10.902  659.884   19.856 9.851135 22.65174 
1 1 1    4   21   36 o  464.144   8.1467  165.206   5.7877  178.074   7.1071  139.873   9.9722  481.685   9.6396  425.988   15.294 55.69781 18.07853 
1 1 1    4   21   37 o  106.273   17.055   8.9403   2.6804   10.596   3.7933   7.2894   3.7881  114.812   22.389   94.942   25.519 19.87013 33.94829 
1 1 1    4   21   38 o  294.986   8.2160   66.760   3.7097   65.533   5.0681   68.177   5.4446  291.935   11.342  297.690   11.949 -5.754547 16.47485 
1 1 1    4   21   39 o  194.081   10.772   29.050   3.1875   28.863   4.3782   29.260   4.6497  192.771   14.955  193.939   15.801 -1.167969 21.75609 
1 1 1    4   21   40 o  112.958   17.275   10.112   2.8919   10.341   3.9449   9.8447   4.2517  112.867   23.595  109.706   25.760 3.160271 34.93248 
1 1 1    4   21   41 o  408.500   10.242  128.356   6.4037  121.127   13.834  130.327   7.2242  392.163   23.150  411.360   11.474 -19.19708 25.83753 
1 1 1    4   21   42 o  236.383   9.8379   42.983   3.5595   48.019   5.1416   38.347   4.9327  248.923   13.546  222.132   14.589 26.79138 19.90776 
1 1 1    4   21   43 o  476.287   7.3321  174.144   5.3452  176.522   7.5925  171.807   7.5265  478.800   10.360  472.348   10.410 6.451965 14.68683 
1 1 1    4   21   44 o  369.571   8.1067  104.943   4.5858  110.289   6.5730   99.874   6.4010  378.148   11.356  359.784   11.623 18.36368 16.25014 
1 1 1    4   21   45 o  535.217   7.4250  220.014   6.0827  211.459   8.4129  229.385   8.8050  523.779   10.494  545.510   10.545 -21.73132 14.87678 
1 1 1    4   21   46 o  424.926   8.0473  138.803   5.2340  139.976   7.4144  137.638   7.3896  425.775   11.377  422.186   11.435 3.589111 16.13074 
1 1 1    4   21   47 o  442.568   8.0799  150.620   5.4734  139.510   7.6185  162.470   7.8686  424.816   11.716  458.636   11.209 -33.82013 16.21456 
1 1 1    4   21   49 o   68.479   28.025   1.7755   4.6722   1.8542   5.2225   1.4601   10.458   71.651   29.511   92.713   40.111 -21.06213 49.79746 
1 1 1    4   21   50 o   46.336   21.524  -2.9387   3.6722  -7.4751   5.1250   1.8475   5.2643   47.922   23.143   71.657   29.584 -23.73507 37.56073 
1 1 1    4   21   51 o  138.979   19.598   15.597   4.0532   22.417   5.6911   8.5769   5.7740  165.574   23.084  100.892   32.716 64.68192 40.03990 
1 1 1    4   21   52 o   58.233   25.128   0.0660   4.0825   3.5587   5.8977  -3.1475   5.6570   79.929   31.925   59.414   27.280 20.51484 41.99327 
1 1 1    4   21   53 o  120.918   24.141   12.302   4.3116   10.474   5.7193   14.708   6.5625  108.977   32.111  128.236   33.180 -19.25920 46.17443 
1 1 1    4   21   54 o  108.718   32.260   10.564   5.7557   8.3735   17.163   10.841   6.1095  116.122   50.796  109.817   33.385 6.304565 60.78480 
1 1 1    4   21   55 o   57.759   24.853   0.3216   3.9712   3.9636   5.5904  -3.3882   5.6421   78.918   31.221   58.006   26.852 20.91243 41.17961 
1 1 1    4   21   56 o   71.283   26.974   3.5883   4.0363   3.5189   5.7396   3.6562   5.6773   77.174   31.257   77.445   31.185 -0.2710876 44.15292 
1 1 1    4   21   57 o  189.467   16.403   28.990   4.7101   18.183   6.0764   45.258   7.4552  142.019   28.935  233.236   21.112 -91.21704 35.81830 
1 1 1    4   21   58 o  151.649   18.435   19.017   4.1912   11.362   5.8501   27.089   6.0074  108.658   32.588  178.287   22.516 -69.62902 39.60974 
1 1 1    4   21   59 o  136.248   24.061   16.305   4.8343   17.741   7.9315   15.456   6.0979  130.210   37.658  126.802   31.547 3.408112 49.12588 
1 1 1    4   22    1 o  353.970   14.910   95.998   8.0780   0.0000   0.0000   95.998   8.0780  ?   ?   353.970   14.910 0.000000 14.90963 
1 1 1    4   22    2 o  1392.59   19.385  1487.03   41.319   0.0000   0.0000  1487.03   41.319  ?   ?   1392.59   19.385 0.000000 19.38471 
1 1 1    4   22    3 o  945.430   15.233  684.881   22.043   0.0000   0.0000  684.881   22.043  ?   ?   945.430   15.233 0.000000 15.23277 
1 1 1    4   22    4 o  1168.63   12.206  1045.99   21.834  1035.28   30.723  1056.92   31.034  1162.18   17.271  1174.27   17.267 -12.08765 24.42185 
1 1 1    4   22    5 o  807.604   10.152  499.426   12.550  499.473   17.807  499.379   17.689  807.421   14.409  807.351   14.314 0.7037354E-01 20.31024 
1 1 1    4   22    6 o  1434.73   14.097  1577.03   30.958  1521.85   42.052  1642.32   45.744  1408.73   19.503  1463.29   20.424 -54.55273 28.23961 
1 1 1    4   22    7 o  1906.80   14.427  2785.71   42.106  2746.47   50.662  2873.36   75.716  1892.82   17.486  1934.24   25.575 -41.41956 30.98122 
1 1 1    4   22    8 o  581.239   7.7473  258.638   6.8925  256.460   8.3124  263.430   12.331  578.742   9.3836  586.392   13.738 -7.649780 16.63691 
1 1 1    4   22    9 o  593.510   7.8377  269.678   7.1201  262.770   8.5859  284.889   12.741  585.809   9.5755  609.805   13.650 -23.99603 16.67367 
1 1 1    4   22   10 o  113.945   19.485   10.237   3.2762   7.7056   4.1494   14.428   5.3384   98.551   26.800  134.671   26.840 -36.11970 37.92964 
1 1 1    4   22   11 o  836.951   10.418  536.435   13.347  546.437   19.283  527.237   18.492  844.433   14.919  829.491   14.565 14.94208 20.84966 
1 1 1    4   22   12 o  917.428   10.864  644.605   15.256  644.129   21.698  645.070   21.455  916.753   15.463  917.438   15.279 -0.6852417 21.73831 
1 1 1    4   22   13 o  310.203   9.4597   73.684   4.4915   75.434   5.5526   70.370   7.6394  313.822   11.560  302.523   16.561 11.29947 20.19617 
1 1 1    4   22   14 f  578.032   7.0850  255.790   6.2684  254.131   8.8272  257.479   8.9031  576.061   10.011  579.843   10.031 -3.781372 14.17223 
1 1 1    4   22   15 o  838.599   7.5623  538.411   9.7069  543.347   13.868  533.670   13.591  842.271   10.757  834.744   10.637 7.526917 15.12846 
1 1 1    4   22   16 o  1574.80   12.500  1900.02   30.131  1955.73   54.192  1875.09   36.251  1595.87   22.185  1564.04   15.142 31.82898 26.86044 
1 1 1    4   22   17 o  638.070   8.5544  311.749   8.3546  315.476   14.740  309.984   10.141  641.522   15.011  636.181   10.414 5.341492 18.27005 
1 1 1    4   22   18 o  710.585   7.4672  386.592   8.1216  386.576   11.555  386.608   11.418  710.418   10.626  710.454   10.500 -0.3637695E-01 14.93860 
1 1 1    4   22   19 o  731.072   7.5904  409.220   8.4937  425.601   12.320  394.379   11.726  745.388   10.798  717.535   10.677 27.85370 15.18520 
1 1 1    4   22   20 o  300.816   9.9329   69.310   4.5735   81.759   6.5781   57.661   6.3630  326.616   13.158  273.802   15.243 52.81384 20.13697 
1 1 1    4   22   21 o  695.328   7.7428  370.208   8.2406  374.933   11.737  365.615   11.573  699.568   10.961  690.822   10.945 8.746094 15.48970 
1 1 1    4   22   22 o  227.231   13.010   39.707   4.5063   33.733   6.2432   46.205   6.5109  208.642   19.786  244.743   17.496 -36.10136 26.41192 
1 1 1    4   22   23 o  745.693   9.0922  425.910   10.378  431.239   17.715  423.126   12.805  749.763   15.437  743.089   11.258 6.673767 19.10581 
1 1 1    4   22   24 o  243.288   14.574   45.565   5.4020   45.618   8.9928   45.534   6.7569  242.127   24.607  242.797   18.316 -0.6704254 30.67583 
1 1 1    4   22   25 o  1227.08   10.857  1153.98   20.391  1143.14   24.829  1176.45   35.739  1220.88   13.287  1237.22   18.872 -16.34058 23.08016 
1 1 1    4   22   26 o  468.175   9.0164  167.927   6.4611  160.548   8.8965  176.163   9.3991  457.533   12.704  479.258   12.813 -21.72580 18.04302 
1 1 1    4   22   27 o  479.721   9.0243  176.333   6.6263  182.745   9.2637  169.616   9.4822  488.107   12.399  470.179   13.176 17.92828 18.09262 
1 1 1    4   22   28 o  401.985   9.9595  123.866   6.1280  112.676   8.5831  135.501   8.7519  383.042   14.640  420.149   13.609 -37.10709 19.98812 
1 1 1    4   22   29 o  469.596   9.2285  169.023   6.6332  161.105   9.1294  177.877   9.6542  458.122   13.019  481.369   13.103 -23.24722 18.47133 
1 1 1    4   22   30 f  105.000   28.993   8.8395   4.8130   5.0015   6.5554   13.328   7.0891   91.846   34.458  128.349   35.083 -36.50273 49.17471 
1 1 1    4   22   31 o   91.073   29.674   6.2590   4.7478   2.2352   6.8354   10.010   6.5997   83.405   33.988  112.808   34.774 -29.40365 48.62524 
1 1 1    4   22   32 o  164.132   13.387   20.841   3.3339   22.394   3.8261   15.941   6.7947  169.977   14.855  139.898   32.373 30.07932 35.61897 
1 1 1    4   22   33 o  316.350   10.967   76.830   5.3105   79.541   5.7820   62.211   13.427  321.810   11.738  279.760   31.929 42.04929 34.01814 
1 1 1    4   22   34 o  372.936   9.1310  106.691   5.2122  109.207   6.4800  102.081   8.7726  377.080   11.227  363.947   15.748 13.13272 19.34010 
1 1 1    4   22   35 o  526.984   6.5787  212.820   5.3065  216.278   7.4728  209.304   7.5366  530.910   9.1959  522.246   9.4282 8.663940 13.17027 
1 1 1    4   22   36 o  538.083   6.7041  221.919   5.5215  223.846   7.7337  219.915   7.8857  540.029   9.3562  535.219   9.6258 4.809387 13.42367 
1 1 1    4   22   37 o  305.475   9.8002   71.667   4.5823   77.588   5.4524   57.430   8.4550  317.671   11.214  271.108   20.527 46.56284 23.39045 
1 1 1    4   22   38 f  282.856   10.266   61.489   4.4445   67.742   5.2110   44.802   8.5130  296.734   11.473  238.204   23.662 58.52962 26.29676 
1 1 1    4   22   39 o  104.646   17.947   8.7289   2.7712   11.182   3.8223   6.0098   4.0237  117.837   22.001   87.290   27.193 30.54648 34.97856 
1 1 1    4   22   40 o  555.835   9.4781  237.463   8.0638  224.372   15.794  242.078   9.3782  536.729   19.225  560.816   10.925 -24.08667 22.11248 
1 1 1    4   22   41 o  117.829   16.348   10.970   2.8690   11.614   3.8435   10.160   4.3114  119.990   21.727  111.178   25.829 8.812019 33.75217 
1 1 1    4   22   42 o  466.750   7.3405  167.234   5.2442  168.235   7.4445  166.249   7.3886  467.431   10.405  464.669   10.388 2.762054 14.70329 
1 1 1    4   22   43 o   57.641   22.482   1.6720   2.8633   4.9735   3.9163  -2.1195   4.1969   80.708   26.980   53.050   24.025 27.65791 36.12650 
1 1 1    4   22   44 o  329.504   8.6198   83.486   4.3474   89.444   6.3426   78.207   5.9704  340.260   12.178  318.148   12.260 22.11264 17.28099 
1 1 1    4   22   45 o  119.740   17.920   11.440   3.1834   12.417   4.3953   10.363   4.6168  123.026   24.203  111.477   27.280 11.54964 36.46885 
1 1 1    4   22   46 o  305.293   9.1714   71.764   4.2857   74.577   6.0893   69.003   6.0329  310.326   12.820  298.397   13.209 11.92914 18.40694 
1 1 1    4   22   47 o  290.143   10.769   65.004   4.7826   58.804   6.5176   72.237   7.0398  274.211   15.593  304.556   15.102 -30.34540 21.70716 
1 1 1    4   22   48 o  164.401   31.799   22.994   7.7125   7.6412   10.880   38.500   10.934  108.882   43.403  211.928   34.925 -103.0462 55.70954 
1 1 1    4   22   49 o  100.684   23.982   8.4527   3.6430   2.4001   5.1018   14.750   5.2038   72.910   29.490  132.768   26.535 -59.85839 39.67078 
1 1 1    4   22   50 o  197.371   19.158   31.106   5.7147   37.965   6.5422   9.0227   11.739  217.904   19.832  112.960   45.066 104.9441 49.23655 
1 1 1    4   22   51 o  314.225   13.225   76.929   6.3608   88.436   7.5099   47.720   11.965  336.260   14.591  234.246   34.396 102.0141 37.36269 
1 1 1    4   22   52 o   83.763   27.340   5.7557   4.0298   3.2329   5.4884   8.7065   5.9357   76.834   30.759  100.781   33.196 -23.94661 45.25568 
1 1 1    4   22   53 o  130.045   29.479   14.820   5.7324   39.557   15.905   11.127   6.1455  192.025   52.574  111.351   33.401 80.67395 62.28693 
1 1 1    4   22   54 o  167.618   21.004   23.083   5.2705   7.5527   10.054   28.967   6.1891  101.743   41.313  187.425   21.992 -85.68200 46.80151 
1 1 1    4   22   55 o   58.971   25.233   0.5732   4.0521  -5.2526   5.7047   6.5061   5.7569   54.464   25.778   89.032   32.489 -34.56832 41.47334 
1 1 1    4   22   56 o   48.620   22.625  -2.8727   4.0860   6.3594   5.6572 -12.9415   5.9080   87.267   32.152   44.545   22.154 42.72227 39.04506 
1 1 1    4   22   57 o  168.147   16.979   23.034   4.3100   29.633   6.1334   16.596   6.0578  187.447   21.784  133.920   30.265 53.52722 37.28963 
1 1 1    4   22   58 o  104.455   30.224   10.325   5.1078   15.465   6.5781   2.5216   8.1060  125.478   33.586   79.625   34.867 45.85300 48.41240 
1 1 1    4   23    0 o  901.128   15.180  622.388   20.924  622.388   20.924  622.388   20.924  901.128   15.180  901.128   15.180 0.000000 0.000000 
1 1 1    4   23    3 o  678.538   13.903  352.746   14.439   0.0000   0.0000  352.746   14.439  ?   ?   678.538   13.903 0.000000 13.90298 
1 1 1    4   23    4 o  916.119   10.780  642.734   15.116  641.023   21.481  644.411   21.276  914.589   15.345  917.018   15.158 -2.428772 21.56899 
1 1 1    4   23    5 o  836.936   10.423  536.409   13.352  509.261   18.271  567.519   19.559  815.233   14.642  860.586   14.849 -45.35254 20.85385 
1 1 1    4   23    6 o  671.610   9.7403  345.395   10.013  346.723   14.218  344.088   14.103  672.713   13.809  670.154   13.749 2.558105 19.48616 
1 1 1    4   23    7 o  1620.14   15.507  2011.71   38.456  2015.02   54.558  2008.43   54.213  1620.31   21.998  1617.68   21.895 2.629028 31.03720 
1 1 1    4   23    8 o  133.223   16.942   13.825   3.3765   12.978   4.0887   15.642   5.9874  128.304   21.586  140.066   28.887 -11.76193 36.06152 
1 1 1    4   23    9 o  582.268   7.9851  259.571   7.1166  254.834   8.6694  269.360   12.461  576.872   9.8184  592.917   13.731 -16.04510 16.88031 
1 1 1    4   23   10 o  551.051   8.0286  232.488   6.7717  231.655   8.2867  234.160   11.749  550.008   9.8433  552.806   13.885 -2.798706 17.02027 
1 1 1    4   23   11 o  333.936   9.2993   85.390   4.7532   87.928   5.9142   80.761   7.9879  338.815   11.404  324.578   16.078 14.23706 19.71211 
1 1 1    4   23   12 o  266.164   9.4899   54.250   3.8662   54.147   5.6810   54.338   5.2765  265.449   14.032  266.313   12.944 -0.8639526 19.09080 
1 1 1    4   23   13 o  1018.55   9.4904  794.467   14.796  812.691   26.411  786.132   17.862  1029.50   16.760  1013.05   11.519 16.44922 20.33726 
1 1 1    4   23   14 o  211.336   13.294   34.359   4.2785   23.153   7.3081   40.203   5.2774  171.110   28.935  228.509   15.175 -57.39897 32.67305 
1 1 1    4   23   15 o  811.606   8.7834  504.400   10.911  509.543   19.211  501.951   13.257  815.257   15.396  809.522   10.699 5.734314 18.74816 
1 1 1    4   23   16 o  405.805   8.2403  126.095   5.1183  119.026   7.1160  133.672   7.3674  394.159   11.795  417.716   11.523 -23.55649 16.48933 
1 1 1    4   23   17 o  429.900   8.1493  141.515   5.3624  130.128   7.3872  154.198   7.7965  412.126   11.711  448.641   11.354 -36.51480 16.31077 
1 1 1    4   23   18 o  570.632   7.7091  249.325   6.7333  253.193   9.5851  245.557   9.4609  574.901   10.893  566.164   10.917 8.737000 15.42202 
1 1 1    4   23   19 o  812.233   7.8304  505.164   9.7350  520.816   14.094  490.885   13.462  824.492   11.168  800.464   10.988 24.02814 15.66714 
1 1 1    4   23   20 o  928.120   11.503  660.052   16.341   0.0000   0.0000  660.052   16.341  ?   ?   928.120   11.503 0.000000 11.50262 
1 1 1    4   23   21 o  235.890   14.188   42.823   5.0989   46.531   8.8982   41.011   6.2217  244.719   24.067  230.450   17.776 14.26912 29.91965 
1 1 1    4   23   22 o  995.856   9.7898  759.760   14.923  782.573   26.454  749.112   18.072  1009.64   17.118  988.607   11.943 21.03101 20.87254 
1 1 1    4   23   23 o  308.623   11.680   73.010   5.5176   72.504   6.9255   73.890   9.1293  307.408   14.719  309.452   19.372 -2.044067 24.32913 
1 1 1    4   23   24 o  887.992   9.5443  604.171   12.972  596.530   15.821  619.847   22.661  882.100   11.718  898.410   16.479 -16.31000 20.22058 
1 1 1    4   23   25 o  158.517   19.078   19.603   4.5359   15.263   6.0749   25.070   6.8187  137.794   29.680  178.387   25.716 -40.59259 39.27060 
1 1 1    4   23   26 o  796.703   8.3049  486.287   10.127  483.500   14.052  489.300   14.609  794.022   11.562  798.714   11.950 -4.692322 16.62769 
1 1 1    4   23   27 o   54.480   24.747  -2.6803   4.4938  -0.3087   6.1361  -5.4235   6.5995   72.114   30.958   62.763   29.050 9.350227 42.45344 
1 1 1    4   23   28 o  828.929   8.5115  526.572   10.799  536.968   15.430  516.593   15.119  836.508   12.051  820.486   12.039 16.02136 17.03436 
1 1 1    4   23   29 o  379.490   9.9172  110.435   5.7605  106.681   8.0431  114.389   8.2540  372.604   14.103  385.844   13.976 -13.23978 19.85503 
1 1 1    4   23   30 o  485.287   9.0949  180.566   6.7556  171.328   9.3993  190.436   9.7163  472.258   13.003  497.933   12.748 -25.67526 18.21003 
1 1 1    4   23   31 o  389.296   12.491  116.424   7.4433  110.265   8.6134  134.586   14.791  378.561   14.865  415.981   23.324 -37.42050 27.65824 
1 1 1    4   23   32 o  256.153   22.868   51.295   8.8717   45.524   12.016   58.211   13.154  238.140   33.925  270.292   32.442 -32.15228 46.94042 
1 1 1    4   23   33 o  453.100   8.3483  157.433   5.7898  149.834   7.1929  171.415   9.7575  441.757   10.638  472.035   13.505 -30.27808 17.19148 
1 1 1    4   23   34 f  268.243   9.7191   55.230   3.9905   57.615   4.6630   48.704   7.7131  273.849   11.125  249.867   20.344 23.98291 23.18706 
1 1 1    4   23   35 o  200.911   9.7024   30.991   2.9837   31.901   4.1289   29.995   4.3164  203.122   13.355  196.762   14.433 6.359665 19.66364 
1 1 1    4   23   36 o  380.534   7.1147  111.029   4.1440  112.962   5.7504  108.941   5.9772  383.512   9.7960  376.546   10.371 6.966248 14.26578 
1 1 1    4   23   37 o   89.887   19.075   6.5050   2.5432   8.1331   3.5396   4.7677   3.6565  100.036   23.514   79.308   26.051 20.72726 35.09348 
1 1 1    4   23   38 o  369.012   7.6866  104.483   4.3416  105.620   6.4879  103.560   5.8425  370.434   11.443  366.985   10.401 3.448639 15.46336 
1 1 1    4   23   39 o  429.784   9.7008  142.001   6.3816  136.939   13.461  143.469   7.2479  418.071   21.104  431.730   10.968 -13.65860 23.78369 
1 1 1    4   23   40 o  202.103   10.056   31.424   3.1107   28.965   4.3107   34.097   4.4934  192.915   14.709  209.536   14.092 -16.62108 20.37042 
1 1 1    4   23   41 o  236.264   9.6005   42.940   3.4718   42.672   4.7853   43.238   5.0448  234.590   13.382  235.994   14.029 -1.404526 19.38832 
1 1 1    4   23   42 o  459.202   7.4065  161.901   5.2058  165.094   7.3338  158.659   7.3908  462.997   10.349  453.803   10.640 9.194397 14.84284 
1 1 1    4   23   43 o  255.644   9.4323   50.297   3.6908   48.027   5.1562   52.682   5.2854  248.705   13.596  260.589   13.295 -11.88451 19.01650 
1 1 1    4   23   44 o  199.638   11.361   30.862   3.4572   34.355   5.0589   27.800   4.7357  209.542   15.891  188.174   16.612 21.36855 22.98927 
1 1 1    4   23   45 o   54.920   22.388   1.0253   2.9673   4.3580   4.3204  -1.9505   4.0825   78.445   28.215   52.486   23.739 25.95876 36.87353 
1 1 1    4   23   46 o  166.934   15.006   21.857   3.7932   21.539   5.1997   22.219   5.5458  163.752   21.246  165.931   22.409 -2.178467 30.87972 
1 1 1    4   23   47 o  208.382   15.023   34.004   4.7595   35.240   5.3141   28.995   10.701  211.652   16.535  180.667   39.773 30.98509 43.07318 
1 1 1    4   23   48 o  296.930   12.793   68.428   5.8142   58.812   11.387   71.819   6.7622  266.969   28.297  303.578   14.553 -36.60983 31.82007 
1 1 1    4   23   49 o  210.357   13.527   34.574   4.3323   38.888   6.1140   30.224   6.1398  221.361   18.206  193.795   21.036 27.56628 27.82078 
1 1 1    4   23   50 o  185.317   14.859   27.026   4.1793   21.601   5.8442   32.706   5.9791  161.772   24.358  202.027   19.581 -40.25516 31.25245 
1 1 1    4   23   51 o  165.762   17.328   21.938   4.3314   29.265   6.3594   15.598   5.9157  189.271   22.385  134.215   29.592 55.05629 37.10489 
1 1 1    4   23   52 o  179.882   32.358   28.482   8.5817   41.082   16.022   23.414   10.162  197.068   52.264  156.004   41.740 41.06421 66.88564 
1 1 1    4   23   53 o  107.521   28.711   10.164   4.8140   7.6772   9.5049   11.022   5.5830  101.334   40.510  110.987   31.436 -9.653175 51.27652 
1 1 1    4   23   54 o   85.245   27.188   6.1953   4.0002   5.3910   5.5339   7.0755   5.7892   84.132   31.641   91.742   32.697 -7.610649 45.49974 
1 1 1    4   23   55 o  102.372   26.706   9.2890   4.2284   14.211   6.1825   4.9628   5.7961  123.654   32.309   82.290   32.017 41.36410 45.48542 
1 1 1    4   23   56 o  139.417   29.089   17.639   6.0067   13.837   8.5558   21.334   8.4350  116.133   39.870  146.227   37.505 -30.09448 54.73794 
1 1 1    4   23   57 o   69.442   27.945   3.0081   4.5560   4.2772   5.4749   0.1503   8.2156   77.311   30.798   75.104   33.849 2.207031 45.76330 
1 1 1    4   24    0 o  166.681   26.919   22.898   6.3305   22.898   6.3305   22.898   6.3305  166.681   26.919  166.681   26.919 0.000000 0.000000 
1 1 1    4   24    1 o  310.987   15.494   74.126   7.3752   0.0000   0.0000   74.126   7.3752  ?   ?   310.987   15.494 0.000000 15.49397 
1 1 1    4   24    2 o  596.925   14.049  273.030   12.836   0.0000   0.0000  273.030   12.836  ?   ?   596.925   14.049 0.000000 14.04924 
1 1 1    4   24    4 o  357.871   15.478   98.163   8.4784   98.163   8.4784   0.0000   0.0000  357.871   15.478  ?   ?  0.000000 15.47803 
1 1 1    4   24    5 o  642.967   9.9764  316.586   9.8182  321.029   13.992  312.276   13.780  647.259   14.123  638.375   14.103 8.883484 19.95910 
1 1 1    4   24    6 o  412.083   10.346  130.049   6.5259  128.845   9.3410  131.197   9.1210  410.020   14.884  413.765   14.402 -3.745605 20.71100 
1 1 1    4   24    7 o  145.367   21.057   16.554   4.5489   15.859   6.6737   17.157   6.2168  140.730   31.739  146.838   28.689 -6.107727 42.78326 
1 1 1    4   24    8 o  567.920   9.9646  247.002   8.6620  242.725   12.311  251.195   12.189  562.785   14.292  572.541   13.909 -9.756165 19.94313 
1 1 1    4   24    9 o  1080.62   9.7474  894.258   16.122  884.924   19.603  913.771   28.343  1074.79   11.916  1091.63   16.963 -16.83887 20.72980 
1 1 1    4   24   10 f  1006.22   9.4336  775.346   14.529  774.543   17.845  776.927   25.025  1005.54   11.594  1006.64   16.242 -1.094116 19.95551 
1 1 1    4   24   11 o  1140.05   12.366  995.775   21.579  991.981   30.634  999.511   30.402  1137.24   17.599  1141.58   17.399 -4.336182 24.74727 
1 1 1    4   24   12 o  649.684   10.506  323.292   10.447  305.406   14.420  343.052   15.157  631.197   14.926  668.979   14.803 -37.78143 21.02126 
1 1 1    4   24   13 o  780.619   8.8206  466.630   10.539  460.603   18.387  469.579   12.862  775.087   15.499  782.971   10.732 -7.884583 18.85156 
1 1 1    4   24   14 o  494.922   7.8679  187.553   5.9603  181.994   8.5808  192.735   8.2852  487.399   11.502  501.606   10.791 -14.20688 15.77171 
1 1 1    4   24   15 o  859.229   16.120  566.201   21.200  566.201   21.200   0.0000   0.0000  859.229   16.120  ?   ?  0.000000 16.11966 
1 1 1    4   24   16 o  1285.85   11.023  1266.67   21.695  1244.21   37.118  1278.32   26.738  1273.10   19.048  1291.41   13.527 -18.30908 23.36214 
1 1 1    4   24   17 o  1056.33   8.5856  854.523   13.882  853.946   19.691  855.093   19.572  1055.62   12.187  1056.34   12.105 -0.7182617 17.17723 
1 1 1    4   24   18 o   70.657   27.529   2.3459   4.2896   4.6418   7.4405   1.2030   5.2498   94.738   36.438   71.864   29.592 22.87324 46.94064 
1 1 1    4   24   19 o  536.387   15.288  220.702   12.552  220.702   12.552   0.0000   0.0000  536.387   15.288  ?   ?  0.000000 15.28838 
1 1 1    4   24   20 o  512.029   8.0767  200.785   6.3300  202.632   9.1304  199.076   8.7835  514.188   11.601  509.678   11.259 4.510162 16.16636 
1 1 1    4   24   21 o  346.724   10.932   92.132   5.8016   86.327   7.1176  103.622   10.014  335.484   13.861  367.291   17.813 -31.80627 22.57078 
1 1 1    4   24   22 o  1098.96   10.287  925.501   17.303  931.463   21.399  914.242   29.408  1102.11   12.685  1090.85   17.613 11.25574 21.70584 
1 1 1    4   24   23 o  264.924   11.743   53.815   4.7618   45.915   6.5775   62.516   6.9028  243.773   17.750  284.876   15.894 -41.10329 23.82600 
1 1 1    4   24   24 o  232.770   13.105   41.704   4.6502   41.606   6.5531   41.802   6.5999  231.825   18.625  232.363   18.715 -0.5375824 26.40386 
1 1 1    4   24   25 o  241.353   13.099   44.836   4.8209   46.437   6.7246   43.144   6.9148  245.019   18.058  235.939   19.317 9.080643 26.44301 
1 1 1    4   24   26 o  498.865   8.6894  190.717   6.6350  198.652   9.3614  182.708   9.4054  508.824   12.020  487.916   12.594 20.90808 17.40946 
1 1 1    4   24   27 o  425.312   9.3980  138.676   6.1180  134.776   8.4692  142.932   8.8476  418.939   13.207  431.408   13.399 -12.46912 18.81405 
1 1 1    4   24   28 o  205.865   15.456   32.779   4.8347   28.169   6.6710   37.880   7.0168  189.344   23.525  220.467   21.049 -31.12364 31.56744 
1 1 1    4   24   29 o  162.582   19.055   20.671   4.6519   15.768   6.3804   26.234   6.7970  139.411   30.728  182.206   25.033 -42.79530 39.63437 
1 1 1    4   24   30 o  195.837   19.726   29.928   5.8323   26.316   6.7535   40.526   11.568  182.434   24.830  224.333   34.819 -41.89934 42.76548 
1 1 1    4   24   31 o  298.876   14.250   68.739   6.5191   71.688   11.954   67.490   7.7774  302.226   26.097  295.278   17.283 6.947754 31.30140 
1 1 1    4   24   32 o  299.805   12.309   69.094   5.6486   68.477   7.9022   69.738   8.0775  297.307   17.441  299.991   17.669 -2.684021 24.82744 
1 1 1    4   24   33 o  404.659   10.493  125.757   6.4992  123.737   9.0357  127.923   9.3553  400.719   14.732  407.388   15.003 -6.668701 21.02646 
1 1 1    4   24   34 o  184.358   12.377   26.264   3.4724   26.223   3.9073   26.419   7.5729  183.968   13.981  181.370   28.195 2.597702 31.47057 
1 1 1    4   24   35 o  289.677   9.5018   64.436   4.2130   65.931   4.8869   60.108   8.3141  292.864   10.902  277.581   19.696 15.28259 22.51194 
1 1 1    4   24   36 o  256.002   8.5868   50.307   3.3647   49.539   4.5424   51.239   5.0085  253.719   11.697  257.909   12.687 -4.190674 17.25629 
1 1 1    4   24   37 o  192.520   10.503   28.587   3.0834   25.196   4.2015   32.546   4.5392  179.866   15.410  204.757   14.579 -24.89059 21.21317 
1 1 1    4   24   38 o  326.415   10.022   81.935   5.0074   71.690   9.3556   86.049   5.9280  302.430   20.329  334.238   11.587 -31.80820 23.39919 
1 1 1    4   24   39 o  145.960   12.472   16.553   2.7595   11.345   3.7422   22.762   4.0855  118.650   21.393  170.645   15.822 -51.99525 26.60765 
1 1 1    4   24   40 o  359.010   7.5387   98.951   4.1426  101.466   5.8800   96.473   5.8374  362.990   10.583  353.904   10.776 9.085785 15.10382 
1 1 1    4   24   41 o  262.601   8.8673   53.018   3.5642   53.885   4.9908   52.116   5.0917  264.172   12.343  259.711   12.809 4.460999 17.78784 
1 1 1    4   24   42 o  156.165   12.790   18.977   3.0305   17.525   4.1401   20.653   4.4480  148.644   18.604  161.621   18.303 -12.97720 26.09815 
1 1 1    4   24   43 o  201.094   10.915   31.282   3.3469   31.198   4.7233   31.367   4.7432  199.729   15.573  200.267   15.597 -0.5377808 22.04056 
1 1 1    4   24   44 o  350.080   8.2298   94.242   4.4099   94.492   6.2115   93.987   6.2618  349.725   11.604  348.754   11.730 0.9704285 16.49997 
1 1 1    4   24   45 o  252.792   10.738   49.330   4.1548   46.448   5.7269   52.533   6.0370  243.723   15.431  259.305   15.278 -15.58229 21.71481 
1 1 1    4   24   46 o  171.427   17.978   23.301   4.6470   28.051   5.2957   7.3990   9.6898  188.012   18.648  105.539   41.304 82.47272 45.31863 
1 1 1    4   24   47 o  194.243   12.948   29.411   3.8276   30.661   5.4302   28.176   5.3962  196.622   18.251  188.147   18.998 8.475861 26.34446 
1 1 1    4   24   48 o  123.864   19.474   12.407   3.5703   16.468   5.0360   8.3029   5.0624  141.308   24.151   99.300   30.431 42.00863 38.84945 
1 1 1    4   24   49 o  229.108   12.146   40.866   4.2442   34.452   5.7766   48.391   6.2565  208.019   18.330  247.594   16.605 -39.57504 24.73298 
1 1 1    4   24   50 o  122.356   21.260   12.312   3.8370   16.418   5.2669   7.6688   5.6012  139.824   25.551   95.922   32.265 43.90267 41.15679 
1 1 1    4   24   51 o   72.842   27.245   3.6636   4.0921   0.2954   5.5938   7.5413   6.0020   67.495   29.268   95.350   33.356 -27.85456 44.37584 
1 1 1    4   24   52 o   44.851   21.637  -6.2096   4.4512  -6.1652   9.5196  -6.2220   5.0355   72.452   33.981   48.865   23.428 23.58691 41.27438 
1 1 1    4   24   53 o  151.124   18.199   18.523   4.1250   20.828   6.1461   16.634   5.5644  155.660   26.761  138.498   27.219 17.16124 38.17103 
1 1 1    4   24   54 o  132.779   21.691   14.799   4.2562   20.067   6.1032   9.8126   5.9386  151.482   27.328  103.361   33.144 48.12118 42.95718 
1 1 1    4   24   55 o   63.556   27.503   0.6991   4.9190   3.4951   6.0076  -4.9890   8.5686   77.131   31.696   68.232   32.078 8.898750 45.09576 
1 1 1    4   24   56 o  126.414   22.970   13.809   4.2808   16.893   6.1763   10.958   5.9386  134.503   30.680  106.648   33.005 27.85538 45.06173 
1 1 1    4   25    0 o  456.433   14.031  159.997   9.7816  159.997   9.7816  159.997   9.7816  456.433   14.031  456.433   14.031 0.000000 0.000000 
1 1 1    4   25    1 f  437.962   14.585  147.009   9.7770   0.0000   0.0000  147.009   9.7770  ?   ?   437.962   14.585 0.000000 14.58483 
1 1 1    4   25    2 o  501.397   13.919  192.655   10.682   0.0000   0.0000  192.655   10.682  ?   ?   501.397   13.919 0.000000 13.91935 
1 1 1    4   25    3 o  304.101   16.923   71.133   7.8457   0.0000   0.0000   71.133   7.8457  ?   ?   304.101   16.923 0.000000 16.92269 
1 1 1    4   25    4 o  460.368   10.483  162.324   7.3865  163.291   10.596  161.409   10.303  461.553   14.998  458.901   14.668 2.652283 20.97834 
1 1 1    4   25    5 o  392.664   15.884  118.210   9.5464  118.210   9.5464   0.0000   0.0000  392.664   15.884  ?   ?  0.000000 15.88353 
1 1 1    4   25    6 o  914.456   15.798  641.117   22.113  641.117   22.113   0.0000   0.0000  914.456   15.798  ?   ?  0.000000 15.79844 
1 1 1    4   25    7 o  322.032   12.174   79.452   6.0005   90.116   8.9219   70.643   8.1084  342.789   17.004  302.976   17.560 39.81296 24.44385 
1 1 1    4   25    8 o  816.551   10.798  510.716   13.495  499.379   18.891  522.531   19.285  807.089   15.292  825.589   15.261 -18.50031 21.60485 
1 1 1    4   25    9 o  506.333   10.619  196.373   8.2301  190.867   11.639  201.879   11.639  498.961   15.240  513.177   14.818 -14.21576 21.25607 
1 1 1    4   25   10 o  905.511   11.228  628.129   15.562  615.047   21.779  641.776   22.244  895.597   15.887  914.850   15.885 -19.25385 22.46659 
1 1 1    4   25   11 o  1187.85   10.436  1080.77   18.975  1071.46   23.076  1100.21   33.343  1182.47   12.750  1197.43   18.192 -14.96460 22.21511 
1 1 1    4   25   12 o  796.738   8.9038  486.129   10.858  488.835   13.310  480.744   18.776  798.825   10.885  791.795   15.492 7.030029 18.93415 
1 1 1    4   25   13 o  717.731   8.7969  394.500   9.6640  391.069   11.772  401.592   16.925  714.487   10.764  723.678   15.280 -9.190979 18.69062 
1 1 1    4   25   14 o  1655.53   11.379  2099.95   28.833  2101.92   40.848  2097.99   40.706  1655.36   16.122  1653.82   16.080 1.537109 22.77018 
1 1 1    4   25   15 o  1499.19   12.204  1722.45   28.005  1709.14   48.040  1729.29   34.468  1491.38   21.045  1501.64   14.996 -10.26306 25.84127 
1 1 1    4   25   16 o  894.620   9.4297  613.042   12.912  599.612   22.817  619.370   15.662  883.932   16.864  899.049   11.381 -15.11682 20.34543 
1 1 1    4   25   17 o  848.287   11.211  551.423   14.556   0.0000   0.0000  551.423   14.556  ?   ?   848.287   11.211 0.000000 11.21099 
1 1 1    4   25   18 o  823.556   9.2174  519.554   11.619  486.391   19.435  538.001   14.495  796.101   15.949  837.853   11.303 -41.75195 19.54793 
1 1 1    4   25   19 o   73.230   27.894   2.8807   4.3342   4.0737   5.4902   0.9073   7.0611   84.052   31.534   81.002   33.919 3.049858 46.31296 
1 1 1    4   25   20 o  650.485   9.0101  324.162   8.9709  328.696   11.199  316.041   14.987  654.838   11.173  641.669   15.260 13.16858 18.91270 
1 1 1    4   25   21 o  171.480   16.305   22.789   4.2280   20.715   5.9214   24.946   6.0390  162.048   24.650  178.524   22.607 -16.47609 33.44704 
1 1 1    4   25   22 o  291.659   10.905   65.217   4.8684   69.601   6.8919   60.850   6.8781  301.069   14.956  280.981   16.059 20.08725 21.94473 
1 1 1    4   25   23 o  332.865   10.115   84.936   5.1535   82.047   7.2139   87.948   7.3647  326.877   14.418  338.442   14.217 -11.56552 20.24860 
1 1 1    4   25   24 o  634.680   8.1127  308.638   7.8812  297.254   10.881  321.203   11.431  622.513   11.419  647.090   11.541 -24.57635 16.23571 
1 1 1    4   25   25 o  148.301   19.864   17.253   4.3958   12.230   6.1521   22.492   6.2831  122.978   32.276  168.654   25.105 -45.67596 40.88978 
1 1 1    4   25   26 o  826.404   8.3149  523.410   10.518  534.119   15.032  513.140   14.721  834.221   11.773  817.676   11.762 16.54492 16.64173 
1 1 1    4   25   27 o  184.747   16.288   26.476   4.5587   25.282   6.3854   27.717   6.5104  179.102   23.888  187.825   23.135 -8.723038 33.25444 
1 1 1    4   25   28 o  123.208   28.927   12.314   5.3619   10.633   6.1417   17.703   10.995  114.997   33.103  147.660   44.764 -32.66241 55.67450 
1 1 1    4   25   29 o  195.218   19.852   29.758   5.8493   38.917   10.643   25.794   7.0014  220.334   32.537  180.229   26.143 40.10419 41.73897 
1 1 1    4   25   30 o  167.067   23.040   22.065   5.7350   29.110   11.124   19.515   6.6930  187.651   39.954  155.471   29.198 32.17953 49.48609 
1 1 1    4   25   31 o  568.793   8.9103  248.191   7.7574  255.812   10.921  240.430   11.020  576.822   12.370  559.104   12.878 17.71771 17.85633 
1 1 1    4   25   32 o  144.389   22.693   16.594   4.8499   17.999   6.7007   15.048   7.0286  148.589   30.484  135.134   34.007 13.45535 45.67055 
1 1 1    4   25   33 o   60.015   26.566  -1.4235   4.8250  -8.8182   6.4971   7.6697   7.2047   55.688   26.676  103.351   36.514 -47.66315 45.22040 
1 1 1    4   25   34 o   75.280   32.693  -0.6442   7.0010  -0.6442   7.0010   0.0000   0.0000   75.280   32.693  ?   ?  0.000000 32.69343 
1 1 1    4   25   35 o  141.939   25.378   16.268   5.3111   14.073   7.4245   18.569   7.6007  130.072   36.046  149.489   33.987 -19.41731 49.54200 
1 1 1    4   25   36 o  149.107   29.374   18.223   6.4654   20.122   9.1970   16.367   9.0909  154.128   38.964  139.371   40.319 14.75722 56.06995 
1 1 1    4   25   37 o  240.989   11.523   44.733   4.2503   37.797   8.1086   47.360   4.9909  217.735   24.771  247.370   13.229 -29.63457 28.08273 
1 1 1    4   25   38 o  279.778   8.1374   60.113   3.4847   60.171   4.7509   60.046   5.1269  279.495   11.105  279.055   12.003 0.4399414 16.35241 
1 1 1    4   25   39 o  287.319   10.433   63.559   4.5882   43.825   9.0758   70.335   5.3178  233.768   25.794  302.049   11.502 -68.28152 28.24272 
1 1 1    4   25   40 o  303.125   8.1187   70.591   3.7668   71.698   5.2531   69.419   5.4044  304.955   11.254  299.966   11.771 4.989471 16.28502 
1 1 1    4   25   41 f  118.229   15.567   11.037   2.7486   8.4282   3.8512   13.745   3.9239  101.056   25.029  130.944   20.230 -29.88740 32.18215 
1 1 1    4   25   42 o  118.676   16.076   11.150   2.8451   14.611   4.1491   8.0790   3.9087  134.839   20.770   98.806   25.628 36.03361 32.98761 
1 1 1    4   25   43 o   67.867   22.858   3.4576   2.8113   5.8282   3.7620   0.4593   4.2308   85.017   26.262   61.315   25.995 23.70216 36.95156 
1 1 1    4   25   44 o  156.692   14.907   19.264   3.5322   17.074   4.7602   21.947   5.2689  145.281   22.103  165.349   21.315 -20.06772 30.70638 
1 1 1    4   25   45 o  122.900   22.695   12.366   4.1120   12.027   4.5190   13.995   9.9140  120.320   25.338  127.108   42.924 -6.788422 49.84510 
1 1 1    4   25   46 o  105.040   20.985   9.0367   3.2559   7.3511   4.4803   10.923   4.7397   94.119   28.584  113.781   27.517 -19.66238 39.67646 
1 1 1    4   25   47 o  263.350   13.530   54.086   5.4356   30.880   11.161   61.302   6.2235  184.983   40.537  279.999   14.572 -95.01663 43.07665 
1 1 1    4   25   48 o  221.079   11.940   38.030   4.0252   40.534   5.7629   35.645   5.6247  226.499   16.742  212.023   17.488 14.47523 24.20968 
1 1 1    4   25   49 o   37.767   18.344  -5.4584   3.3413 -11.0843   4.7101   0.2404   4.7406   39.812   19.797   62.916   27.113 -23.10383 33.57119 
1 1 1    4   25   50 o   60.405   24.818   1.3579   3.6821   5.3691   5.1415  -2.8654   5.2757   84.157   30.705   57.458   26.369 26.69881 40.47318 
1 1 1    4   25   51 o  114.516   28.056   11.433   4.8789   7.9607   9.9876   12.522   5.5915  103.503   41.473  118.821   30.569 -15.31789 51.52145 
1 1 1    4   25   52 o  158.325   16.757   20.126   3.9992   26.360   5.7517   14.291   5.5644  178.941   21.426  127.214   29.195 51.72741 36.21374 
1 1 1    4   25   53 o  102.477   29.853   9.4482   4.9682   13.557   5.8499  -1.1853   9.4104  121.869   31.221   79.047   35.869 42.82217 47.55361 
1 1 1    4   25   54 o  117.873   28.950   12.611   5.1852   15.871   6.3587   6.1403   8.9579  130.416   32.076   92.809   38.476 37.60760 50.09293 
1 1 1    4   25   55 o  100.214   26.113   9.0121   4.0459   7.3214   5.9618   10.456   5.5085   90.675   33.066  105.171   31.640 -14.49566 45.76556 
1 1 1    4   26    0 o  1316.88   19.098  1329.86   38.477  1329.86   38.477  1329.86   38.477  1316.88   19.098  1316.88   19.098 0.000000 0.000000 
1 1 1    4   26    1 o  837.103   15.062  537.213   19.299   0.0000   0.0000  537.213   19.299  ?   ?   837.103   15.062 0.000000 15.06219 
1 1 1    4   26    2 o  815.787   15.035  510.202   18.774   0.0000   0.0000  510.202   18.774  ?   ?   815.787   15.035 0.000000 15.03513 
1 1 1    4   26    3 o  145.198   31.668   16.884   6.8399   0.0000   0.0000   16.884   6.8399  ?   ?   145.198   31.668 0.000000 31.66841 
1 1 1    4   26    4 o  547.116   10.514  229.282   8.8052  221.925   12.426  236.701   12.479  538.022   15.089  555.672   14.672 -17.64935 21.04627 
1 1 1    4   26    5 o  592.244   10.394  268.663   9.4224  266.348   13.495  270.866   13.161  589.419   14.959  594.430   14.465 -5.011414 20.80893 
1 1 1    4   26    6 o  505.424   10.956  195.689   8.4756  197.738   11.795  193.502   12.187  507.840   15.174  502.331   15.851 5.509888 21.94310 
1 1 1    4   26    7 o  412.121   16.099  130.256   10.155  130.256   10.155   0.0000   0.0000  412.121   16.099  ?   ?  0.000000 16.09852 
1 1 1    4   26    8 o  741.872   15.218  422.016   17.280  422.016   17.280   0.0000   0.0000  741.872   15.218  ?   ?  0.000000 15.21751 
1 1 1    4   26    9 o  1615.61   15.780  2001.84   39.022  2066.78   57.222  1945.38   53.353  1639.73   22.799  1591.11   21.907 48.62268 31.61858 
1 1 1    4   26   10 o  460.839   9.1249  162.650   6.4365  158.831   7.8111  170.726   11.361  455.314   11.208  471.805   15.731 -16.49127 19.31573 
1 1 1    4   26   11 o  342.630   12.446   89.970   6.5271  102.304   9.2719   77.853   9.1901  365.165   16.589  317.869   18.975 47.29587 25.20402 
1 1 1    4   26   12 o  816.154   11.019  510.361   13.765  503.896   19.286  517.073   19.653  810.513   15.546  821.031   15.639 -10.51758 22.05106 
1 1 1    4   26   13 o  576.036   10.755  254.232   9.4830  254.960   13.197  253.454   13.636  576.557   14.954  574.805   15.499 1.751648 21.53673 
1 1 1    4   26   14 o  1065.36   12.283  869.966   20.030   0.0000   0.0000  869.966   20.030  ?   ?   1065.36   12.283 0.000000 12.28303 
1 1 1    4   26   15 o  1056.67   8.6570  855.211   14.002  838.275   19.439  873.472   20.185  1045.75   12.144  1067.45   12.354 -21.69897 17.32364 
1 1 1    4   26   16 o  236.859   12.132   43.121   4.3837   49.339   6.3214   37.360   6.0843  252.988   16.413  219.776   18.252 33.21208 24.54659 
1 1 1    4   26   17 o  144.499   21.209   16.404   4.5512   11.230   5.6529   25.938   7.6733  118.286   30.888  181.043   28.644 -62.75717 42.12514 
1 1 1    4   26   18 o  395.878   10.683  120.120   6.4735  116.004   8.0382  127.715   10.920  388.863   13.505  407.689   17.500 -18.82587 22.10482 
1 1 1    4   26   19 o  982.911   9.9167  740.407   14.919  743.327   26.079  738.986   18.190  983.450   17.325  981.634   12.106 1.815613 21.13581 
1 1 1    4   26   20 o  284.825   12.922   62.243   5.6334   54.079   9.9030   66.149   6.8497  263.459   24.851  293.080   15.323 -29.62051 29.19507 
1 1 1    4   26   21 o  450.689   8.6365  155.640   5.9578  157.058   8.4899  154.263   8.3626  452.460   12.259  448.423   12.184 4.037292 17.28374 
1 1 1    4   26   22 o  449.314   8.5571  154.702   5.8850  148.972   8.1673  160.889   8.4872  440.632   12.110  457.917   12.109 -17.28534 17.12523 
1 1 1    4   26   23 o  226.166   13.109   39.404   4.5187   45.421   6.3097   33.069   6.4742  242.356   17.119  206.006   20.818 36.34982 26.95283 
1 1 1    4   26   24 o  227.204   13.148   39.777   4.5528   38.841   6.3479   40.768   6.5333  223.723   18.709  229.230   18.786 -5.507462 26.51294 
1 1 1    4   26   25 o  284.380   11.473   62.070   4.9942   61.130   7.0197   63.035   7.1068  281.331   16.372  285.704   16.319 -4.373322 23.11631 
1 1 1    4   26   26 o  342.632   12.050   90.152   6.3195   87.133   7.5490   97.222   11.553  336.572   14.653  353.887   21.429 -17.31488 25.96031 
1 1 1    4   26   27 o  569.647   9.9557  248.963   8.6805  254.742   10.611  237.266   15.094  575.890   12.037  554.595   17.782 21.29529 21.47291 
1 1 1    4   26   28 o  735.737   9.8409  415.352   11.082  405.075   19.346  420.372   13.520  724.559   17.444  739.714   11.941 -15.15509 21.14006 
1 1 1    4   26   29 o  647.251   8.6610  321.314   8.5805  310.340   11.954  332.976   12.324  635.404   12.291  658.183   12.233 -22.77887 17.34104 
1 1 1    4   26   30 o  469.495   9.4241  169.162   6.7724  160.669   9.3667  178.465   9.8034  456.916   13.393  481.574   13.300 -24.65738 18.87485 
1 1 1    4   26   31 o  293.252   12.090   66.137   5.4268   58.134   7.4422   75.225   7.9303  273.584   17.870  311.631   16.686 -38.04761 24.44951 
1 1 1    4   26   32 o   91.650   29.698   6.4730   4.7586   2.9864   6.6926   10.038   6.7673   84.457   33.911  112.231   35.315 -27.77425 48.96035 
1 1 1    4   26   33 o  178.282   27.079   25.533   7.1569   25.533   7.1569   0.0000   0.0000  178.282   27.079  ?   ?  0.000000 27.07861 
1 1 1    4   26   34 o  305.755   14.214   72.156   6.6519   73.363   10.397   71.319   8.6551  305.636   22.380  302.468   18.788 3.167480 29.22078 
1 1 1    4   26   35 o  139.622   28.054   15.955   5.7874   5.4269   7.4395   32.094   9.2106   95.186   36.477  198.281   31.394 -103.0949 48.12605 
1 1 1    4   26   36 o  121.841   28.981   12.278   5.3261   19.751   7.5265   4.7820   7.5380  153.957   32.935   93.141   36.436 60.81573 49.11567 
1 1 1    4   26   37 o  238.385   10.620   43.749   3.8748   42.761   4.3557   47.499   8.4836  235.157   12.143  244.785   22.909 -9.627975 25.92809 
1 1 1    4   26   38 o  640.481   6.8248  314.754   6.6906  317.420   9.4308  312.053   9.4933  642.381   9.5915  636.877   9.7385 5.504028 13.66876 
1 1 1    4   26   39 o  264.511   8.4462   53.770   3.4196   56.531   4.7921   50.905   4.8812  270.724   11.565  256.749   12.421 13.97577 16.97096 
1 1 1    4   26   40 o  355.449   13.451   97.779   7.3179  102.609   10.721   93.566   10.013  361.453   19.450  345.308   19.018 16.14529 27.20303 
1 1 1    4   26   41 o  379.427   7.5590  110.592   4.3900  107.389   6.1971  113.819   6.2198  373.152   10.850  384.235   10.576 -11.08289 15.15152 
1 1 1    4   26   42 o  261.289   9.1356   52.553   3.6537   53.881   5.2641   51.319   5.0751  263.781   13.038  257.145   12.936 6.636749 18.36634 
1 1 1    4   26   43 o  257.839   10.444   51.290   4.1216   54.625   5.8577   48.021   5.8005  264.724   14.512  247.882   15.364 16.84177 21.13373 
1 1 1    4   26   44 o  232.054   13.164   41.900   4.6564   44.475   5.3746   34.151   9.3236  238.593   14.790  201.875   31.179 36.71819 34.50856 
1 1 1    4   26   45 o  176.147   13.350   24.230   3.5727   23.908   4.9985   24.565   5.1084  173.157   19.182  175.489   19.339 -2.331833 27.23842 
1 1 1    4   26   46 o   99.693   23.141   8.2633   3.4631   6.2404   4.6469   10.790   5.1937   88.240   29.387  112.348   29.737 -24.10798 41.80758 
1 1 1    4   26   47 o  184.078   13.428   26.515   3.7574   25.741   5.2784   27.311   5.3499  179.178   19.564  184.767   19.197 -5.588943 27.40992 
1 1 1    4   26   48 o  289.496   10.790   64.928   4.7809   76.733   6.9345   54.233   6.6004  313.203   14.465  261.965   16.546 51.23734 21.97751 
1 1 1    4   26   49 o  189.626   14.897   28.388   4.2890   25.725   6.1231   30.954   6.0095  176.674   23.204  195.544   20.378 -18.87000 30.88162 
1 1 1    4   26   50 o  128.778   24.028   13.962   4.5620   6.4677   9.9122   15.976   5.1386   99.552   40.789  137.295   25.388 -37.74313 48.04468 
1 1 1    4   26   51 o   93.800   29.212   7.6364   4.6438   9.0645   5.3905   3.5263   9.1447  101.162   31.468   89.371   38.064 11.79120 49.38719 
1 1 1    4   26   52 o   91.942   30.221   7.3862   4.9206   10.895   5.8259  -1.3467   9.1910  108.990   32.482   78.121   35.449 30.86936 48.08034 
1 1 1    4   26   53 o  133.335   21.056   14.916   4.1545   23.141   5.9541   7.1121   5.7996  164.397   24.403   90.641   32.681 73.75576 40.78605 
1 1 1    4   26   54 o   96.966   26.742   8.4592   4.0976   11.848   6.0031   5.5030   5.6069  111.285   32.929   82.936   31.694 28.34953 45.70356 
1 1 1    4   26   55 o   68.965   27.352   3.1249   4.3006  -2.2421   6.3873   7.5757   5.8166   62.762   28.881   91.105   32.742 -28.34264 43.65890 
1 1 1    4   27    0 o  814.360   15.371  508.602   19.145  508.602   19.145  508.602   19.145  814.360   15.371  814.360   15.371 0.000000 0.000000 
1 1 1    4   27    1 o  1687.34   16.181  2183.87   41.791  2175.96   58.779  2191.96   59.429  1682.40   22.826  1688.51   22.995 -6.117554 32.40001 
1 1 1    4   27    2 o  365.477   17.312  102.492   9.6845   0.0000   0.0000  102.492   9.6845  ?   ?   365.477   17.312 0.000000 17.31196 
1 1 1    4   27    3 o  196.039   18.184   29.748   5.3942   21.590   7.5931   38.060   7.6645  164.588   31.284  221.322   22.959 -56.73416 38.80479 
1 1 1    4   27    4 o  522.797   15.096  209.596   12.080   0.0000   0.0000  209.596   12.080  ?   ?   522.797   15.096 0.000000 15.09597 
1 1 1    4   27    5 f  538.529   14.922  222.396   12.300   0.0000   0.0000  222.396   12.300  ?   ?   538.529   14.922 0.000000 14.92159 
1 1 1    4   27    6 o  935.355   16.025  671.140   22.943   0.0000   0.0000  671.140   22.943  ?   ?   935.355   16.025 0.000000 16.02534 
1 1 1    4   27    7 f  845.349   15.473  548.131   20.020   0.0000   0.0000  548.131   20.020  ?   ?   845.349   15.473 0.000000 15.47257 
1 1 1    4   27    8 o  701.484   15.789  377.499   16.952   0.0000   0.0000  377.499   16.952  ?   ?   701.484   15.789 0.000000 15.78858 
1 1 1    4   27   10 o  460.420   11.297  162.449   7.9613  162.449   7.9613   0.0000   0.0000  460.420   11.297  ?   ?  0.000000 11.29685 
1 1 1    4   27   11 o  540.727   9.0420  223.962   7.4837  229.706   9.1458  212.325   13.018  547.507   10.913  525.987   16.170 21.52020 19.50846 
1 1 1    4   27   12 o  510.512   9.0678  199.642   7.0856  198.828   8.7231  201.220   12.148  509.348   11.189  512.074   15.499 -2.725708 19.11589 
1 1 1    4   27   13 o  629.203   8.8614  303.264   8.5342  296.771   10.348  317.076   15.092  622.286   10.864  642.781   15.340 -20.49469 18.79690 
1 1 1    4   27   14 o  167.159   18.710   21.742   4.7050   20.014   5.6879   25.487   8.3729  159.398   24.062  178.802   31.757 -19.40468 39.84372 
1 1 1    4   27   15 o  339.099   11.053   88.143   5.7369   86.178   7.0289   92.064   9.9288  335.154   13.702  345.527   18.845 -10.37323 23.29936 
1 1 1    4   27   16 o  349.795   10.792   93.793   5.7779   93.834   7.0813   93.711   9.9940  349.730   13.229  348.570   18.801 1.159576 22.98869 
1 1 1    4   27   17 o  439.347   8.5629  147.885   5.7583  149.277   8.1448  146.494   8.1422  441.175   12.061  437.035   12.172 4.140045 17.13570 
1 1 1    4   27   18 o  298.925   10.492   68.504   4.8005   68.805   6.7925   68.203   6.7853  299.324   14.826  298.008   14.875 1.316132 21.00200 
1 1 1    4   27   19 o  426.302   8.6640  139.258   5.6533  148.719   8.0962  130.255   7.8975  440.292   12.014  412.011   12.523 28.28098 17.35374 
1 1 1    4   27   20 o  651.646   8.1218  325.367   8.1009  308.699   11.327  342.817   11.590  634.338   11.667  668.520   11.326 -34.18213 16.26021 
1 1 1    4   27   21 o  262.798   13.521   53.178   5.4202   61.175   9.7109   49.558   6.5325  280.440   22.821  253.221   16.952 27.21909 28.42831 
1 1 1    4   27   22 o  555.955   9.6029  236.992   8.1717  256.466   14.790  228.434   9.8041  577.244   16.739  545.572   11.741 31.67206 20.44579 
1 1 1    4   27   23 o  184.755   15.951   26.461   4.4667   21.778   6.1617   31.646   6.4843  165.776   25.066  201.248   21.378 -35.47244 32.94410 
1 1 1    4   27   24 f  266.064   14.116   54.579   5.7283   54.013   6.8518   55.895   10.440  264.231   17.032  266.985   25.872 -2.753784 30.97539 
1 1 1    4   27   25 o  420.216   9.5509  135.447   6.1431  142.269   8.5182  128.053   8.8675  430.264   12.934  408.029   14.198 22.23495 19.20662 
1 1 1    4   27   26 o  321.124   12.794   79.261   6.2885   90.445   11.410   74.382   7.5363  340.921   21.983  310.317   15.920 30.60388 27.14255 
1 1 1    4   27   27 o  320.349   12.831   78.904   6.2912   96.563   11.730   71.773   7.4542  352.186   21.867  304.720   16.038 47.46677 27.11832 
1 1 1    4   27   28 o  170.682   17.821   22.747   4.5870   22.026   6.3677   23.525   6.6132  166.120   25.887  171.776   25.962 -5.655869 36.66296 
1 1 1    4   27   29 o  231.837   13.848   41.535   4.8915   43.351   6.8706   39.669   6.9657  235.841   19.200  225.265   20.424 10.57594 28.03187 
1 1 1    4   27   30 o  222.590   14.734   38.368   4.9916   35.706   7.0288   41.076   7.0898  213.178   21.850  229.149   20.428 -15.97093 29.91199 
1 1 1    4   27   31 o  270.002   12.987   56.144   5.3673   56.335   7.4961   55.943   7.6886  269.032   18.313  267.953   18.867 1.078979 26.29310 
1 1 1    4   27   32 o  185.759   20.022   27.129   5.6029   29.797   8.8832   25.367   7.2201  191.341   31.422  177.493   27.463 13.84723 41.73234 
1 1 1    4   27   33 o   80.341   30.659   3.7384   5.2419  -1.5087   7.9613   7.7540   6.9646   77.960   34.335  102.534   35.928 -24.57487 49.69623 
1 1 1    4   27   34 o  281.253   14.536   61.295   6.2363   61.112   7.9929   61.580   9.9702  279.685   18.780  279.148   23.555 0.5365906 30.12470 
1 1 1    4   27   35 o  453.543   10.448  158.289   7.2534  149.516   10.005  168.006   10.530  439.569   14.871  465.994   14.764 -26.42468 20.95487 
1 1 1    4   27   36 o  290.918   13.910   65.436   6.1937   56.227   8.5554   75.579   8.9785  267.142   21.095  310.755   18.967 -43.61301 28.36789 
1 1 1    4   27   37 o   60.081   27.133  -2.4383   5.3091  -0.8087   7.4991  -4.0758   7.5173   76.711   33.566   69.584   31.761 7.126999 46.21085 
1 1 1    4   27   38 f  134.356   16.495   14.236   3.3210   15.950   3.6667   6.4098   7.8349  142.150   17.202   98.963   37.550 43.18657 41.30257 
1 1 1    4   27   39 o  138.876   13.082   15.045   2.7480   12.505   3.7690   17.927   4.0152  124.717   20.453  150.600   17.760 -25.88307 27.08802 
1 1 1    4   27   40 o  286.777   8.2957   63.225   3.6414   62.795   5.0574   63.689   5.2472  285.188   11.586  287.132   11.939 -1.944183 16.63655 
1 1 1    4   27   41 o   62.675   22.299   2.7288   2.6917   2.7115   3.5566   2.7521   4.1180   66.936   25.323   69.989   27.055 -3.053154 37.05679 
1 1 1    4   27   42 o  220.169   10.958   37.428   3.6928   41.568   5.2717   33.438   5.1746  230.677   15.012  206.334   16.523 24.34349 22.32456 
1 1 1    4   27   43 o  143.203   18.730   16.373   4.0071   17.061   4.5110   13.798   8.7256  145.536   20.845  125.926   40.153 19.61065 45.24199 
1 1 1    4   27   44 o  183.602   12.514   26.249   3.4957   26.186   4.9380   26.312   4.9492  181.743   17.987  182.186   17.983 -0.4436188 25.43464 
1 1 1    4   27   45 o  178.574   13.738   24.953   3.7261   26.541   5.2535   23.345   5.2857  182.393   19.101  170.334   20.699 12.05894 28.16561 
1 1 1    4   27   46 o   56.224   23.154   1.0079   3.2141   3.9059   4.5536  -1.8692   4.5371   76.421   28.710   55.559   25.087 20.86221 38.12628 
1 1 1    4   27   47 o  298.562   13.181   69.464   6.0234   28.668   11.173   86.177   7.1516  175.015   42.200  332.133   14.068 -157.1179 44.48320 
1 1 1    4   27   48 o  245.087   17.476   47.804   6.5129   0.0000   0.0000   47.804   6.5129  ?   ?   245.087   17.476 0.000000 17.47590 
1 1 1    4   27   49 o   72.900   27.760   3.5376   4.2916  -8.3862   9.6030   6.5133   4.7973   69.844   33.169   88.577   29.860 -18.73233 44.62958 
1 1 1    4   27   50 o  173.435   18.701   24.343   4.8860   25.177   5.6232   21.773   9.8709  174.964   21.446  149.026   41.656 25.93816 46.85276 
1 1 1    4   27   51 o   78.248   29.006   4.6434   4.6176   8.4728   5.3317  -6.8494   9.2367   97.541   31.418   69.334   32.812 28.20627 45.42781 
1 1 1    4   27   52 o  128.241   22.291   13.942   4.2167   18.768   5.9005   8.9052   6.0281  145.908   27.427   98.734   33.470 47.17454 43.27280 
1 1 1    4   27   53 o  119.123   22.871   12.217   4.0185   15.824   5.6157   8.4316   5.7529  132.185   28.588   95.714   32.696 36.47090 43.43159 
1 1 1    4   27   54 o  121.679   24.961   13.082   4.4929   7.9776   6.3639   18.154   6.3440   93.298   34.142  139.586   30.542 -46.28784 45.80893 
1 1 1    4   28    0 o  231.795   23.325   42.465   8.0833   42.465   8.0833   42.465   8.0833  231.795   23.325  231.795   23.325 0.000000 0.000000 
1 1 1    4   28    1 o  643.585   10.562  317.358   10.404  318.394   14.718  316.323   14.709  644.266   14.925  642.164   14.965 2.102173 21.13528 
1 1 1    4   28    2 o  799.388   15.374  490.250   18.811   0.0000   0.0000  490.250   18.811  ?   ?   799.388   15.374 0.000000 15.37354 
1 1 1    4   28    3 o  497.192   10.927  189.422   8.3159  180.420   11.709  198.585   11.813  484.906   15.775  508.781   15.169 -23.87427 21.88515 
1 1 1    4   28    4 o  598.696   10.753  274.653   9.8535  265.219   13.917  284.136   13.953  587.939   15.465  608.593   14.978 -20.65460 21.52943 
1 1 1    4   28    5 f  264.090   15.270   53.688   6.1461   52.808   8.6879   54.568   8.6958  261.097   21.943  265.493   21.586 -4.395813 30.78022 
1 1 1    4   28    6 o  890.441   11.371  607.672   15.498  593.118   21.721  622.765   22.120  879.079   16.143  900.797   16.043 -21.71796 22.75924 
1 1 1    4   28    7 o  294.437   14.023   66.495   6.3199   61.778   9.0616   70.963   8.8189  282.630   21.099  303.289   19.095 -20.65869 28.45629 
1 1 1    4   28    8 o  692.206   10.924  367.209   11.574  351.523   15.972  384.557   16.796  676.795   15.418  707.871   15.502 -31.07654 21.86389 
1 1 1    4   28    9 o  704.183   10.906  380.042   11.755  383.899   16.724  376.275   16.526  707.239   15.449  700.185   15.420 7.053528 21.82795 
1 1 1    4   28   10 o  106.893   32.041   8.9487   5.6566   10.522   7.5961   6.9900   8.4750  117.360   37.469  106.405   39.325 10.95598 54.31742 
1 1 1    4   28   11 f  708.273   10.995  384.524   11.920  384.524   11.920   0.0000   0.0000  708.273   10.995  ?   ?  0.000000 10.99496 
1 1 1    4   28   12 o  501.945   11.214  193.150   8.6155  193.150   8.6155   0.0000   0.0000  501.945   11.214  ?   ?  0.000000 11.21381 
1 1 1    4   28   13 o  493.184   11.470  186.496   8.6588  186.496   8.6588   0.0000   0.0000  493.184   11.470  ?   ?  0.000000 11.47038 
1 1 1    4   28   14 o  438.570   9.7624  147.413   6.5534  143.485   7.8170  156.703   12.022  432.545   11.807  451.481   17.397 -18.93604 21.02485 
1 1 1    4   28   15 o  1122.58   10.419  966.088   17.902  948.724   21.597  1004.22   32.003  1111.99   12.689  1142.49   18.301 -30.50342 22.26944 
1 1 1    4   28   16 o  802.465   8.0849  493.358   9.9304  481.250   13.785  506.419   14.318  792.138   11.369  812.567   11.512 -20.42883 16.17974 
1 1 1    4   28   17 o  459.539   8.3929  161.815   5.9035  167.101   8.3978  156.651   8.3006  466.708   11.756  451.856   12.002 14.85178 16.79984 
1 1 1    4   28   18 o  231.559   12.532   41.275   4.4252   52.308   6.2917   30.473   6.2253  260.352   15.864  197.672   20.892 62.67986 26.23240 
1 1 1    4   28   19 o  169.448   16.220   22.287   4.1554   14.591   5.8999   29.862   5.8535  134.398   29.490  195.804   19.803 -61.40575 35.52255 
1 1 1    4   28   20 o  367.887   9.3901  103.768   5.2875  101.531   7.5410  105.932   7.4160  363.539   13.552  371.386   13.046 -7.846924 18.81111 
1 1 1    4   28   21 o  558.541   9.6449  239.244   8.2456  239.287   9.9349  239.148   14.782  558.331   11.625  557.155   17.333 1.176270 20.87056 
1 1 1    4   28   22 o  382.312   10.984  112.177   6.4279  116.009   7.8974  104.657   11.064  388.533   13.280  367.604   19.736 20.92920 23.78745 
1 1 1    4   28   23 o  419.674   10.691  135.174   6.8678  149.362   12.419  128.924   8.2431  439.921   18.443  409.559   13.149 30.36139 22.65057 
1 1 1    4   28   24 o  227.792   16.006   40.172   5.5453   38.860   9.8817   40.775   6.6997  220.864   30.007  228.913   19.301 -8.048828 35.67888 
1 1 1    4   28   25 o  262.355   14.539   53.148   5.8157   44.874   10.255   57.070   7.0608  237.804   28.759  271.446   17.081 -33.64212 33.44933 
1 1 1    4   28   26 o  277.996   11.937   59.396   5.0794   57.823   7.0376   61.107   7.3386  273.198   16.913  280.829   17.155 -7.630829 24.09028 
1 1 1    4   28   27 o  445.287   9.3208  152.166   6.3528  151.801   9.0254  152.525   8.9435  444.123   13.277  445.209   13.124 -1.086212 18.66873 
1 1 1    4   28   28 f  565.817   8.6798  245.641   7.5172  244.292   10.602  247.004   10.660  563.539   12.292  566.660   12.290 -3.120667 17.38176 
1 1 1    4   28   29 o  216.097   14.939   36.195   4.9108   29.262   6.7927   43.787   7.1079  192.260   23.577  236.726   19.798 -44.46635 30.78701 
1 1 1    4   28   30 o  415.515   11.306  132.792   7.1903  144.750   11.999  126.091   8.9817  432.139   18.140  404.247   14.516 27.89191 23.23318 
1 1 1    4   28   31 o  275.808   14.392   58.876   6.0546   74.022   9.9506   49.972   7.6294  307.418   21.278  252.712   19.885 54.70567 29.12299 
1 1 1    4   28   32 o  147.839   25.401   17.652   5.5407   25.733   7.2365   6.2032   8.6139  178.556   27.349  101.744   39.186 76.81242 47.78573 
1 1 1    4   28   33 f   71.195   29.494   1.3456   5.2581   8.3263   6.8881  -8.4027   8.1398  104.366   35.776   65.600   30.970 38.76646 47.31888 
1 1 1    4   28   34 o  204.487   17.285   32.710   5.3594   44.105   7.6495   21.724   7.5109  236.425   21.369  162.025   31.420 74.40041 37.99828 
1 1 1    4   28   35 o  142.766   25.006   16.543   5.2653   7.3346   7.3021   26.516   7.5993  101.121   36.638  180.360   28.472 -79.23931 46.40025 
1 1 1    4   28   36 o  280.856   14.700   61.262   6.2975   62.418   8.8864   60.096   8.9257  281.481   20.772  275.967   21.296 5.514038 29.74887 
1 1 1    4   28   37 o  203.903   19.092   32.773   5.8892   26.654   8.2244   39.214   8.4369  179.382   31.080  220.867   25.420 -41.48526 40.15178 
1 1 1    4   28   38 o  191.340   13.139   28.450   3.8247   31.344   4.3234   18.034   8.2027  200.637   14.169  144.775   36.906 55.86172 39.53239 
1 1 1    4   28   39 o  201.159   12.583   31.411   3.8548   30.942   4.3055   33.303   8.6534  199.262   14.210  201.419   28.896 -2.156876 32.20086 
1 1 1    4   28   40 o  208.293   11.000   33.576   3.4946   36.303   4.7810   30.447   5.1206  215.733   14.564  196.735   17.177 18.99799 22.52015 
1 1 1    4   28   41 o  143.960   19.170   16.552   4.1191   15.717   4.7111   19.264   8.4875  139.001   22.943  148.429   37.380 -9.427856 43.85957 
1 1 1    4   28   42 o   47.039   21.364  -1.7873   3.3474  -2.8091   3.6461   3.6947   8.4454   46.600   21.577   91.356   37.566 -44.75661 43.32177 
1 1 1    4   28   43 f  106.582   18.758   9.1863   2.9483   12.243   4.1436   6.0516   4.1960  122.063   23.022   86.640   27.868 35.42384 36.14768 
1 1 1    4   28   44 o  124.601   17.469   12.420   3.2400   18.577   4.6953   6.8226   4.4767  151.677   20.770   91.048   28.732 60.62931 35.45316 
1 1 1    4   28   45 o   70.308   24.303   3.7152   3.1818  -2.1649   4.5210   9.4857   4.4787   54.650   24.823  105.624   27.451 -50.97380 37.00972 
1 1 1    4   28   46 o  262.579   16.321   54.429   6.5271   0.0000   0.0000   54.429   6.5271  ?   ?   262.579   16.321 0.000000 16.32097 
1 1 1    4   28   47 f  271.681   11.158   57.299   4.6398   55.516   6.4055   59.267   6.7299  265.083   15.860  273.773   16.131 -8.690033 22.62198 
1 1 1    4   28   48 o  102.751   35.487   9.1265   6.7832   7.2827   10.201   10.588   9.0816  102.482   41.614  110.395   40.726 -7.912323 58.22668 
1 1 1    4   28   49 o  229.456   15.447   41.754   5.3936   45.997   6.4845   32.227   9.7159  239.525   17.814  188.546   34.953 50.97972 39.23129 
1 1 1    4   28   50 o  197.839   16.732   31.412   5.0192   43.756   6.0543   4.2825   8.9756  233.492   17.058   89.812   37.957 143.6805 41.61393 
1 1 1    4   28   51 o   66.528   25.876   2.8429   3.7851   1.0019   5.4035   4.6166   5.3037   67.209   28.955   79.502   30.712 -12.29339 42.20901 
1 1 1    4   28   52 o   66.619   25.892   2.9371   3.7876   0.2622   5.4513   5.4335   5.2663   64.827   28.485   82.152   30.872 -17.32503 42.00621 
1 1 1    4   29    0 o  358.312   17.085   99.104   9.3215   99.104   9.3215   99.104   9.3215  358.312   17.085  358.312   17.085 0.000000 0.000000 
1 1 1    4   29    1 o  361.589   12.192  100.250   6.7478   95.810   9.2841  105.221   9.8246  353.166   17.175  370.092   17.344 -16.92624 24.40837 
1 1 1    4   29    2 o  822.281   15.530  519.049   19.546   0.0000   0.0000  519.049   19.546  ?   ?   822.281   15.530 0.000000 15.52995 
1 1 1    4   29    3 o  589.908   10.931  266.731   9.8702  268.230   14.157  265.313   13.769  591.089   15.647  587.906   15.301 3.183167 21.88496 
1 1 1    4   29    4 o  480.219   11.409  176.788   8.3857  167.244   11.585  187.291   12.153  466.673   16.219  493.865   16.077 -27.19223 22.83736 
1 1 1    4   29    5 o   97.460   30.946   7.2368   5.1868   5.6215   7.2675   8.9137   7.4050   97.265   36.323  110.326   37.098 -13.06155 51.91920 
1 1 1    4   29    6 o  174.207   21.762   23.731   5.6761   25.110   7.7412   22.127   8.3474  177.817   29.474  165.817   34.030 12.00072 45.01968 
1 1 1    4   29    7 o  768.870   15.958  454.015   18.780  454.015   18.780   0.0000   0.0000  768.870   15.958  ?   ?  0.000000 15.95792 
1 1 1    4   29    8 o  584.099   15.716  262.019   14.051  262.019   14.051   0.0000   0.0000  584.099   15.716  ?   ?  0.000000 15.71634 
1 1 1    4   29    9 o  451.439   16.753  156.609   11.576  156.609   11.576   0.0000   0.0000  451.439   16.753  ?   ?  0.000000 16.75267 
1 1 1    4   29   10 o  667.088   15.630  341.829   15.959  341.829   15.959   0.0000   0.0000  667.088   15.630  ?   ?  0.000000 15.62978 
1 1 1    4   29   11 o  985.089   12.125  744.374   18.282  732.410   25.668  756.692   26.045  976.009   17.182  992.064   17.152 -16.05499 24.27754 
1 1 1    4   29   12 o  1087.80   10.311  907.174   17.168  925.836   21.151  871.137   29.392  1098.47   12.580  1064.08   18.046 34.39124 21.99790 
1 1 1    4   29   13 o  853.847   11.405  559.191   14.906  559.191   14.906   0.0000   0.0000  853.847   11.405  ?   ?  0.000000 11.40546 
1 1 1    4   29   14 o  623.967   10.982  298.601   10.488  298.601   10.488   0.0000   0.0000  623.967   10.982  ?   ?  0.000000 10.98156 
1 1 1    4   29   15 o  814.674   9.3221  508.754   11.624  521.175   14.444  485.920   19.584  824.221   11.449  794.912   16.096 29.30859 19.75249 
1 1 1    4   29   16 o  1081.40   8.9017  896.367   14.734  890.776   20.763  902.039   20.913  1077.19   12.593  1083.98   12.604 -6.785522 17.81717 
1 1 1    4   29   17 o  482.154   8.2846  178.165   6.1140  175.045   8.5944  181.363   8.6997  477.573   11.757  486.123   11.692 -8.549896 16.58121 
1 1 1    4   29   18 f  234.192   14.184   42.310   5.0605   43.346   6.2063   40.253   8.7410  236.610   17.256  226.343   25.685 10.26755 30.94331 
1 1 1    4   29   19 o  359.342   10.947   99.092   6.0212  104.154   7.3883   89.081   10.390  368.189   13.110  339.033   20.112 29.15585 24.00744 
1 1 1    4   29   20 o  470.644   9.8949  169.919   7.1281  174.786   8.8355  160.844   12.064  477.062   12.100  456.816   17.253 20.24570 21.07321 
1 1 1    4   29   21 o  263.015   11.778   53.127   4.7415   50.653   6.5424   55.864   6.8815  255.820   16.802  268.706   16.816 -12.88606 23.77141 
1 1 1    4   29   22 o  402.247   11.147  124.239   6.8630  113.033   11.987  129.703   8.3708  381.629   20.597  410.710   13.316 -29.08063 24.52661 
1 1 1    4   29   23 o  171.687   20.027   23.111   5.1640   24.301   9.3242   22.585   6.2020  171.976   36.549  168.641   24.765 3.334183 44.14863 
1 1 1    4   29   24 o  333.305   10.499   85.299   5.3563   78.363   7.6574   91.945   7.4951  318.822   15.691  345.581   14.170 -26.75943 21.14235 
1 1 1    4   29   25 o  154.322   22.235   18.871   5.1006   26.945   9.1872   15.274   6.1325  181.592   34.311  136.793   30.105 44.79848 45.64584 
1 1 1    4   29   26 o  353.254   12.017   95.965   6.4975  100.045   11.847   94.209   7.7704  358.111   21.715  349.620   14.520 8.490845 26.12288 
1 1 1    4   29   27 o  359.786   10.882   99.486   5.9929   97.431   8.7358  101.313   8.2366  355.168   16.069  362.418   14.848 -7.250183 21.87900 
1 1 1    4   29   28 o  416.468   10.966  133.350   6.9904  135.245   11.560  132.258   8.7769  417.780   18.078  414.198   13.844 3.582306 22.76966 
1 1 1    4   29   29 o   76.597   29.642   3.1402   4.9475   4.1025   7.8428   2.5041   6.3763   92.669   36.878   81.164   32.920 11.50546 49.43398 
1 1 1    4   29   30 o   71.877   28.177   2.5572   4.5152   3.4897   6.2831   1.5614   6.4928   83.989   33.139   78.612   32.688 5.377724 46.54771 
1 1 1    4   29   31 o  203.921   17.950   32.540   5.5456   27.157   7.0352   41.373   9.0124  183.962   25.686  227.483   26.373 -43.52118 36.81419 
1 1 1    4   29   32 o  100.705   29.748   8.2568   4.9030   5.5006   6.9221   11.032   6.9458   93.409   35.330  115.903   35.665 -22.49429 50.20190 
1 1 1    4   29   33 o   57.613   26.091  -2.4867   4.9491  -6.7904   6.9881   1.8442   7.0102   61.616   28.968   81.602   33.951 -19.98570 44.62925 
1 1 1    4   29   34 o   65.728   28.174   0.0872   5.0679   2.1001   7.2197  -1.8680   7.1157   83.211   34.523   72.241   32.105 10.97081 47.14458 
1 1 1    4   29   35 o  348.285   12.694   93.691   6.7673   92.969   9.3368   94.490   9.8224  345.011   17.741  347.509   18.533 -2.498077 25.65563 
1 1 1    4   29   36 o  402.989   11.845  125.333   7.3064  130.437   10.301  120.166   10.365  409.534   16.433  392.765   17.241 16.76840 23.81818 
1 1 1    4   29   37 o  452.618   11.416  158.079   7.9088  158.494   10.923  157.622   11.467  451.521   15.804  449.891   16.652 1.629700 22.95787 
1 1 1    4   29   38 o  246.378   21.092   48.148   7.8775   51.102   8.8491   36.865   17.292  253.007   23.106  196.553   55.203 56.45378 59.84328 
1 1 1    4   29   39 o  139.587   53.886   15.633   16.319   0.0000   0.0000   15.633   16.319  ?   ?   139.587   53.886 0.000000 53.88646 
1 1 1    4   29   40 o   59.002   24.458   0.9295   3.6191   3.0352   4.0509  -7.3992   8.0564   70.853   26.972   65.851   31.003 5.002327 41.09389 
1 1 1    4   29   41 o  135.671   15.511   14.527   3.1632   18.127   4.3370   10.436   4.6238  150.617   19.253  111.456   27.316 39.16164 33.41916 
1 1 1    4   29   42 f  198.990   11.291   30.721   3.4249   30.116   4.7621   31.369   4.9293  195.672   16.041  199.651   16.272 -3.978607 22.84938 
1 1 1    4   29   43 o  216.719   11.070   36.430   3.6599   40.068   5.1174   32.620   5.2365  226.129   14.868  203.193   16.993 22.93623 22.57914 
1 1 1    4   29   44 o   67.750   23.718   3.3819   3.0351   2.0116   4.3400   4.6934   4.2460   67.286   27.205   79.115   28.023 -11.82896 39.05624 
1 1 1    4   29   45 f   91.771   24.333   7.0884   3.4736   12.020   4.9617   2.3477   4.8646  118.459   27.836   71.031   28.773 47.42809 40.03474 
1 1 1    4   29   46 o  206.226   13.071   33.312   4.1046   35.047   5.5292   31.183   6.1260  209.739   17.380  196.145   20.718 13.59482 27.04263 
1 1 1    4   29   47 o  158.036   28.460   21.474   6.6310   27.577   9.7152   16.151   9.0731  172.896   37.768  130.340   40.871 42.55620 55.64965 
1 1 1    4   29   48 o   77.365   25.445   4.8984   3.4880   9.2088   4.9367   0.6019   4.9288  102.207   29.753   64.473   27.714 37.73492 40.66115 
1 1 1    4   29   49 o  213.207   13.462   35.869   4.3705   31.826   5.7546   41.380   6.7184  197.690   19.263  225.331   19.677 -27.64148 27.53569 
1 1 1    4   29   50 o  128.777   20.912   13.888   3.9805   13.858   5.7251   13.916   5.5383  123.120   30.530  123.956   29.598 -0.8361816 42.52236 
1 1 1    4   29   51 o   97.493   25.365   8.4194   3.8213   4.7437   5.5490   11.735   5.2701   80.116   31.284  112.753   30.008 -32.63737 43.34908 
1 1 1    4   29   52 o  188.563   23.833   30.550   6.7250   30.550   6.7250   0.0000   0.0000  188.563   23.833  ?   ?  0.000000 23.83261 
1 1 1    4   30    1 o  424.448   16.400  138.445   10.654  138.445   10.654   0.0000   0.0000  424.448   16.400  ?   ?  0.000000 16.39977 
1 1 1    4   30    3 o  962.607   16.825  712.269   24.790  712.269   24.790   0.0000   0.0000  962.607   16.825  ?   ?  0.000000 16.82504 
1 1 1    4   30    4 o  418.551   16.983  134.680   10.880  134.680   10.880   0.0000   0.0000  418.551   16.983  ?   ?  0.000000 16.98327 
1 1 1    4   30    5 o  523.467   15.721  210.537   12.596  210.537   12.596   0.0000   0.0000  523.467   15.721  ?   ?  0.000000 15.72121 
1 1 1    4   30    6 o  751.205   11.143  432.746   12.812  454.486   18.589  413.075   17.683  769.060   15.792  733.193   15.757 35.86707 22.30816 
1 1 1    4   30    7 o  811.340   11.340  504.863   14.083  511.426   20.254  498.720   19.595  815.686   16.222  805.560   15.892 10.12518 22.70932 
1 1 1    4   30    8 o  452.542   11.593  157.091   8.0298  146.350   11.219  168.373   11.498  436.249   16.801  468.020   16.051 -31.77197 23.23595 
1 1 1    4   30    9 o  731.216   11.169  410.090   12.501  403.381   17.475  417.122   17.890  724.429   15.759  736.642   15.867 -12.21362 22.36310 
1 1 1    4   30   10 o  1138.68   12.895  995.280   22.474  994.805   31.938  995.746   31.630  1136.67   18.357  1137.27   18.171 -0.6071777 25.82949 
1 1 1    4   30   11 o  733.789   11.248  413.053   12.633  409.969   17.803  416.180   17.930  730.181   15.929  735.693   15.922 -5.512451 22.52260 
1 1 1    4   30   12 o  634.410   11.162  308.763   10.839  320.465   15.720  298.159   14.964  645.521   15.910  622.690   15.700 22.83063 22.35266 
1 1 1    4   30   13 o  115.659   26.153   10.782   4.5214   9.1527   5.4563   14.353   8.0774  107.254   31.296  133.261   37.835 -26.00700 49.10173 
1 1 1    4   30   14 o  220.417   14.483   37.504   4.8590   38.414   5.8602   35.501   8.6922  222.681   17.330  212.038   27.425 10.64307 32.44143 
1 1 1    4   30   15 o  658.626   11.330  332.913   11.422  332.913   11.422   0.0000   0.0000  658.626   11.330  ?   ?  0.000000 11.32987 
1 1 1    4   30   16 o  181.387   21.304   25.777   5.8020   25.777   5.8020   0.0000   0.0000  181.387   21.304  ?   ?  0.000000 21.30362 
1 1 1    4   30   17 o  261.399   11.590   52.460   4.6374   54.848   6.4001   49.820   6.7288  266.466   15.762  253.644   17.438 12.82179 23.50570 
1 1 1    4   30   18 o  443.723   8.6662  150.963   5.8859  148.622   8.3034  153.327   8.3445  439.851   12.333  446.777   12.202 -6.926575 17.34948 
1 1 1    4   30   19 o  323.672   10.052   80.387   4.9801   76.694   6.9008   84.401   7.1942  315.730   14.279  331.226   14.190 -15.49606 20.13122 
1 1 1    4   30   20 o  154.063   21.865   18.752   5.0113   19.115   9.3723   18.607   5.9302  152.018   39.808  152.429   26.372 -0.4108582 47.75133 
1 1 1    4   30   21 o  355.336   11.624   97.005   6.3221   85.608   10.788  102.967   7.8024  331.633   21.366  365.784   13.936 -34.15170 25.50912 
1 1 1    4   30   22 o  228.635   13.235   40.350   4.6120   38.120   6.3092   42.910   6.7586  221.227   18.811  234.774   18.970 -13.54674 26.71507 
1 1 1    4   30   23 o   85.476   27.663   5.5806   4.1298  -1.0180   5.7905   12.411   5.8915   67.537   29.525  123.115   31.219 -55.57780 42.96909 
1 1 1    4   30   24 o  155.259   18.763   18.927   4.3686   19.515   6.2055   18.351   6.1510  155.703   27.018  150.709   27.685 4.993546 38.68358 
1 1 1    4   30   25 o  287.623   11.877   63.630   5.2286   67.619   7.4518   59.762   7.3383  295.357   16.550  277.428   17.369 17.92902 23.99120 
1 1 1    4   30   26 o  459.451   10.428  162.220   7.3332  161.315   12.322  162.717   9.1250  456.427   17.638  459.638   12.970 -3.211121 21.89356 
1 1 1    4   30   27 o  258.364   18.520   52.044   7.2754   0.0000   0.0000   52.044   7.2754  ?   ?   258.364   18.520 0.000000 18.52032 
1 1 1    4   30   28 o  268.520   15.427   55.921   6.3138   58.182   11.772   55.008   7.4806  269.536   28.991  265.538   18.521 3.998138 34.40191 
1 1 1    4   30   29 o  216.227   21.911   36.913   7.1518   42.747   11.779   33.505   9.0009  227.926   34.871  203.271   29.816 24.65575 45.87983 
1 1 1    4   30   30 o  192.931   17.454   29.131   5.0984   32.994   7.1452   25.125   7.2771  203.746   23.332  175.976   27.951 27.77032 36.40987 
1 1 1    4   30   31 o  166.670   20.161   21.991   5.0386   13.855   7.0365   30.552   7.2183  128.445   34.887  195.414   24.683 -66.96837 42.73629 
1 1 1    4   30   32 o  278.729   13.833   60.056   5.9015   57.001   8.4878   62.916   8.2111  269.125   20.766  283.427   19.038 -14.30188 28.17183 
1 1 1    4   30   33 o  163.358   22.805   21.377   5.5466   19.050   7.6351   23.976   8.0713  150.361   33.975  169.783   32.237 -19.42213 46.83556 
1 1 1    4   30   34 o  443.002   10.968  151.244   7.4369  149.167   10.325  153.482   10.721  438.480   15.384  444.631   15.753 -6.150269 22.01861 
1 1 1    4   30   35 o  396.354   12.116  121.304   7.3506  114.130   10.143  129.240   10.667  382.689   17.316  407.321   17.110 -24.63211 24.34357 
1 1 1    4   30   36 o  195.707   20.663   30.419   6.0961   26.067   8.5580   34.901   8.6859  176.188   32.945  206.749   28.182 -30.56143 43.35440 
1 1 1    4   30   37 o  171.648   28.867   24.349   7.3151   28.637   8.3440   10.108   15.206  185.760   30.398  126.040   50.936 59.72082 59.31738 
1 1 1    4   30   38 o  295.920   18.499   68.897   8.3368   41.129   15.750   79.707   9.8264  210.713   49.648  317.489   20.327 -106.7767 53.64769 
1 1 1    4   30   39 o  310.589   14.815   75.040   7.0428   67.482   9.7550   83.268   10.179  290.940   22.070  324.138   20.623 -33.19791 30.20575 
1 1 1    4   30   40 o  143.806   17.666   16.439   3.8068   16.735   4.2033   15.089   8.9788  144.543   19.496  130.858   40.597 13.68521 45.03588 
1 1 1    4   30   41 o  248.837   17.847   48.887   6.7523   45.643   9.3654   52.399   9.7444  236.200   26.354  253.784   25.427 -17.58383 36.62075 
1 1 1    4   30   42 o   98.995   21.305   8.0797   3.1326   11.358   4.1987   3.9632   4.7047  116.841   24.270   77.445   29.165 39.39602 37.94267 
1 1 1    4   30   43 o  155.646   14.025   19.040   3.3053   19.986   4.5636   17.996   4.7936  157.709   19.308  148.618   21.714 9.090652 29.05672 
1 1 1    4   30   44 o  132.625   17.779   14.134   3.5184   9.7303   4.8776   18.910   5.0800  106.213   29.129  151.756   22.556 -45.54278 36.84100 
1 1 1    4   30   45 o   88.489   34.198   5.4179   6.5783   7.7406   9.5252   3.2999   9.0959  103.087   40.762   90.098   38.151 12.98914 55.83092 
1 1 1    4   30   46 o  172.869   26.377   25.236   6.7584   12.826   9.9016   36.061   9.2474  118.383   42.699  204.198   30.524 -85.81435 52.48686 
1 1 1    4   30   47 o  228.974   12.091   41.025   4.2226   43.983   5.9865   38.096   5.9569  234.776   16.769  217.723   18.038 17.05356 24.62862 
1 1 1    4   30   48 o  208.874   15.771   34.822   5.0049   35.093   5.8874   34.115   9.5038  207.987   18.693  194.064   33.188 13.92332 38.09008 
1 1 1    4   30   49 o  199.552   13.535   31.541   4.1098   27.385   5.8666   35.547   5.7591  181.255   21.570  209.148   18.171 -27.89264 28.20319 
1 1 1    4   30   50 o  133.844   19.327   14.876   3.8447   10.936   5.5477   18.517   5.3330  108.115   31.561  146.241   24.705 -38.12658 40.08015 
1 1 1    4   31    0 o  297.269   20.670   68.865   9.3005   68.865   9.3005   68.865   9.3005  297.269   20.670  297.269   20.670 0.000000 0.000000 
1 1 1    4   31    1 o  471.924   11.493  170.858   8.3020  166.679   11.663  175.150   11.820  465.539   16.368  477.248   16.181 -11.70892 23.01585 
1 1 1    4   31    2 o  441.910   16.552  150.209   11.196   0.0000   0.0000  150.209   11.196  ?   ?   441.910   16.552 0.000000 16.55210 
1 1 1    4   31    3 o  308.113   13.737   72.909   6.4782   77.448   9.1085   68.262   9.2156  316.515   18.887  296.823   20.408 19.69211 27.80681 
1 1 1    4   31    4 o  326.094   13.224   81.649   6.6003   73.796   9.0487   90.577   9.6487  308.869   19.235  342.439   18.477 -33.57001 26.67198 
1 1 1    4   31    5 o  118.660   29.233   11.379   5.2749   9.5151   7.3703   13.336   7.5527  112.272   36.991  128.692   36.602 -16.42042 52.03882 
1 1 1    4   31    6 o  244.036   15.801   45.986   5.8703   48.244   8.7652   44.150   7.9050  248.715   23.296  238.096   21.938 10.61847 31.99938 
1 1 1    4   31    7 o  406.965   12.097  127.118   7.5354  126.774   10.896  127.433   10.433  405.770   17.543  406.931   16.750 -1.161530 24.25522 
1 1 1    4   31    8 o  102.193   31.050   8.2007   5.2858   13.732   7.7618   3.4173   7.2183  130.432   37.109   89.068   35.400 41.36425 51.28581 
1 1 1    4   31    9 o   57.142   25.926  -2.8198   4.9136  -3.9745   7.0814  -1.7477   6.8236   68.569   31.115   72.169   31.786 -3.600761 44.48051 
1 1 1    4   31   10 o   83.002   30.969   4.1341   5.2807   0.4822   7.7246   7.3382   7.2355   82.784   35.112  103.074   36.573 -20.28967 50.69957 
1 1 1    4   31   11 o  150.451   24.914   18.006   5.5366   16.706   8.2165   19.087   7.4931  142.962   37.194  153.317   32.914 -10.35527 49.66621 
1 1 1    4   31   12 o  736.056   11.403  415.849   12.847  432.180   18.784  401.498   17.608  749.203   16.380  722.238   15.928 26.96515 22.84779 
1 1 1    4   31   13 o  726.674   9.2983  404.942   10.342  400.034   12.624  414.957   18.035  721.888   11.425  734.147   16.049 -12.25897 19.70058 
1 1 1    4   31   14 o  524.263   9.4620  210.801   7.5928  208.800   9.2752  214.867   13.220  521.483   11.620  528.166   16.352 -6.683044 20.06069 
1 1 1    4   31   15 o  290.169   12.321   64.682   5.4722   62.522   6.6895   69.053   9.5138  284.568   15.416  298.031   20.990 -13.46262 26.04236 
1 1 1    4   31   16 o  525.627   9.7776  211.969   7.8665  223.433   9.7422  190.490   13.335  539.349   11.801  496.925   17.532 42.42383 21.13380 
1 1 1    4   31   17 o  154.091   26.026   18.985   5.9198   18.985   5.9198   0.0000   0.0000  154.091   26.026  ?   ?  0.000000 26.02595 
1 1 1    4   31   18 o  414.115   12.959  131.868   8.2140  128.845   11.732  134.774   11.504  408.283   18.774  417.740   17.991 -9.456940 26.00279 
1 1 1    4   31   19 o  465.223   10.185  166.147   7.2526  161.221   12.567  168.607   8.8810  456.798   17.973  468.311   12.390 -11.51260 21.82966 
1 1 1    4   31   20 o  220.249   13.267   37.461   4.4518   39.839   6.2800   35.059   6.3118  226.271   18.289  211.884   19.687 14.38673 26.87118 
1 1 1    4   31   21 o  228.326   12.729   40.231   4.4308   41.214   6.3057   39.271   6.2272  230.164   18.043  224.592   18.273 5.571350 25.68003 
1 1 1    4   31   22 o  338.729   10.279   88.127   5.3292   85.997   7.5259   90.270   7.5474  333.978   14.722  342.228   14.408 -8.250854 20.59950 
1 1 1    4   31   23 o  233.884   13.618   42.284   4.8539   41.888   6.9377   42.663   6.7935  231.517   19.767  233.813   19.150 -2.295868 27.52226 
1 1 1    4   31   24 o  231.114   15.484   41.432   5.4457   26.042   9.1179   49.966   6.7897  177.691   34.769  253.429   17.613 -75.73878 38.97580 
1 1 1    4   31   25 o  374.176   11.378  107.708   6.5165  107.104   10.681  108.066   8.2244  370.988   18.872  374.224   14.358 -3.235718 23.71337 
1 1 1    4   31   26 o  189.752   16.328   28.067   4.6961   23.733   6.5710   32.593   6.7140  171.950   25.760  203.184   21.937 -31.23416 33.83442 
1 1 1    4   31   27 o  100.355   29.948   8.1474   4.9498   7.5104   6.3252   9.1537   7.9501   99.831   34.280  110.119   38.397 -10.28759 51.47282 
1 1 1    4   31   28 o  250.941   15.286   48.904   5.8432   49.440   7.4472   48.046   9.4248  251.176   19.524  245.604   25.440 5.571701 32.06804 
1 1 1    4   31   29 o   65.442   29.099  -1.7449   5.8526  -7.9142   11.879   0.2325   6.7255   84.191   38.970   75.676   32.447 8.514687 50.70941 
1 1 1    4   31   30 o  108.748   33.434   9.6572   6.1055   18.362   11.979   6.6020   7.0965  146.461   47.083   97.909   36.020 48.55170 59.28103 
1 1 1    4   31   31 o  255.330   17.877   50.990   6.9425   48.488   13.831   51.832   8.0269  239.688   39.044  256.542   20.616 -16.85490 44.15280 
1 1 1    4   31   32 o   75.886   30.026   2.8257   5.1713  -3.3753   7.2826   9.1324   7.3444   69.698   31.599  107.968   36.943 -38.27015 48.61338 
1 1 1    4   31   33 o  370.631   12.120  106.044   6.8759  105.829   9.5322  106.276   9.9279  368.762   16.888  369.290   17.564 -0.5276184 24.36584 
1 1 1    4   31   34 o  166.808   23.169   22.378   5.7559   29.264   8.1720   15.597   8.1085  188.739   29.233  134.699   37.791 54.04054 47.77793 
1 1 1    4   31   35 o  108.001   35.245   9.5209   6.6970   10.848   7.6611   5.2206   13.790  114.706   37.710  112.742   47.315 1.963448 60.50400 
1 1 1    4   31   36 o   67.303   30.675  -3.5257   6.9800  -4.0470   13.277  -3.3266   8.2054   94.020   42.641   74.131   33.581 19.88920 54.27660 
1 1 1    4   31   37 o  181.030   28.214   27.026   7.5629  -2.4527   14.358   38.346   8.8973   99.845   44.898  216.610   27.452 -116.7644 52.62503 
1 1 1    4   31   38 o  180.315   24.042   26.361   6.4702   22.315   9.0600   30.572   9.2433  159.602   37.689  190.103   32.961 -30.50099 50.06922 
1 1 1    4   31   39 o  110.521   33.861   10.368   6.2688   14.960   8.6782   5.3582   9.0652  130.273   39.829   97.957   39.419 32.31610 56.03781 
1 1 1    4   31   40 o  365.341   13.929  103.845   7.7890  106.619   11.172  101.221   10.865  366.547   19.988  357.143   19.956 9.404053 28.24434 
1 1 1    4   31   41 o  236.176   13.028   43.479   4.6913   45.097   5.3897   38.420   9.5297  239.938   14.747  213.890   29.928 26.04802 33.36398 
1 1 1    4   31   42 o  170.736   17.241   23.178   4.4439   22.952   5.0868   23.906   9.1324  168.789   20.084  163.184   37.367 5.604889 42.42263 
1 1 1    4   31   43 o  254.745   20.977   52.329   8.1067   43.736   10.279   66.465   13.184  226.578   30.407  278.957   31.426 -52.37825 43.72870 
1 1 1    4   31   44 o   63.673   29.133  -2.9720   6.3740   5.2589   9.2514 -10.4096   8.7944   95.520   39.303   63.804   30.687 31.71676 49.86380 
1 1 1    4   31   45 o  219.059   15.564   38.003   5.1845   12.952   10.018   47.167   6.0591  118.732   42.929  243.751   16.335 -125.0193 45.93169 
1 1 1    4   31   46 o   96.150   23.396   7.8825   3.4105   9.1488   4.8007   6.5923   4.8459  101.853   29.252   88.548   30.010 13.30487 41.90767 
1 1 1    4   31   47 o  159.330   16.315   20.404   3.9227   14.970   5.5108   25.984   5.5849  130.025   28.478  177.393   20.975 -47.36836 35.36884 
1 1 1    4   31   48 o   59.336   24.424   1.4727   3.5743   3.6471   5.4232  -0.1973   4.7527   76.167   30.546   60.225   26.527 15.94215 40.45649 
1 1 1    4   31   49 o  300.234   13.684   71.340   6.2886  100.225   8.3323   33.110   9.5858  354.343   15.363  187.042   34.762 167.3019 38.00571 
1 1 1    4   32    0 o  344.825   18.151   92.074   9.5193   92.074   9.5193   92.074   9.5193  344.825   18.151  344.825   18.151 0.000000 0.000000 
1 1 1    4   32    1 o  620.330   11.019  295.275   10.462  321.312   15.327  272.560   14.316  646.274   15.495  595.185   15.715 51.08899 22.06902 
1 1 1    4   32    2 o  734.645   9.2906  413.819   10.447  412.653   12.855  416.086   17.928  733.252   11.454  735.320   15.929 -2.067261 19.61953 
1 1 1    4   32    3 o  195.967   19.333   29.911   5.7234   32.075   8.1278   27.783   8.0607  201.401   27.050  186.702   29.160 14.69890 39.77431 
1 1 1    4   32    4 o  883.209   11.726  598.803   15.853  588.036   22.410  609.589   22.428  873.854   16.754  889.818   16.467 -15.96320 23.49205 
1 1 1    4   32    5 o  536.331   11.427  220.786   9.3808  204.608   12.929  238.772   13.632  515.516   16.385  556.974   15.990 -41.45709 22.89440 
1 1 1    4   32    6 o  560.456   11.312  241.090   9.7042  265.030   14.534  221.831   13.035  586.738   16.183  536.856   15.864 49.88196 22.66178 
1 1 1    4   32    7 o  290.475   15.617   65.121   6.9178   67.773   10.342   62.973   9.3064  294.909   23.095  284.553   21.526 10.35654 31.57188 
1 1 1    4   32    8 o  664.558   11.284  338.999   11.478  324.323   16.078  354.252   16.391  648.993   16.186  678.378   15.786 -29.38507 22.60892 
1 1 1    4   32    9 o  283.725   15.164   62.120   6.5617   66.098   9.4014   58.342   9.1626  291.569   21.211  273.658   22.062 17.91171 30.60480 
1 1 1    4   32   10 o  826.639   11.731  524.727   14.843  514.531   20.788  535.331   21.201  817.187   16.619  833.541   16.617 -16.35419 23.50167 
1 1 1    4   32   11 o  273.679   15.564   57.855   6.4930   51.688   9.1697   64.055   9.1954  257.059   23.568  286.958   21.083 -29.89905 31.62164 
1 1 1    4   32   12 f  357.905   13.189   98.475   7.2254  106.069   10.616   91.923   9.8619  370.128   18.801  344.504   18.773 25.62448 26.56902 
1 1 1    4   32   13 o   72.605   29.782   1.5001   5.2918   3.2037   7.6293  -0.0793   7.3461   89.844   36.160   79.084   33.910 10.75946 49.57253 
1 1 1    4   32   14 o  399.755   10.538  122.675   6.4478  115.581   7.8240  137.691   11.383  387.689   13.185  422.359   17.608 -34.66995 21.99739 
1 1 1    4   32   15 o  219.822   19.110   37.641   6.3660   36.752   9.2040   38.456   8.8145  214.857   28.705  220.422   26.669 -5.564835 39.18114 
1 1 1    4   32   16 o  230.759   18.548   41.426   6.4959   38.983   9.3687   43.689   9.0146  221.410   28.292  235.386   25.424 -13.97604 38.03703 
1 1 1    4   32   17 o  269.785   12.765   55.983   5.2711   55.105   6.4056   57.825   9.2767  266.857   15.752  271.869   22.495 -5.012421 27.46182 
1 1 1    4   32   18 o  133.675   24.001   14.330   4.7304   15.494   5.6972   11.746   8.4876  138.229   27.889  122.087   39.670 16.14217 48.49260 
1 1 1    4   32   19 o  106.788   28.349   9.2793   4.7112   8.9571   5.6395   10.023   8.5711  105.828   32.054  115.630   39.893 -9.801842 51.17539 
1 1 1    4   32   20 o  215.206   16.246   35.972   5.3121   3.6316   5.9169  170.350   12.061   83.248   32.360  469.468   16.785 -386.2201 36.45422 
1 1 1    4   32   21 o  368.453   11.613  104.416   6.5496   95.528   10.882  109.465   8.2014  350.045   20.399  376.788   14.221 -26.74319 24.86656 
1 1 1    4   32   22 o  228.804   15.701   40.633   5.4655   42.220   9.3868   39.819   6.7225  230.150   27.170  225.595   19.665 4.554977 33.54018 
1 1 1    4   32   23 o  111.836   26.184   10.218   4.4031   15.175   6.4212   5.8182   6.0493  135.528   31.545   92.147   33.353 43.38069 45.90769 
1 1 1    4   32   24 o   59.452   25.906  -0.6391   4.4256   4.9945   6.4496  -5.6519   6.0838   90.187   34.105   58.362   27.306 31.82454 43.68965 
1 1 1    4   32   25 o  249.479   15.299   48.313   5.8140   51.231   7.4954   43.905   9.2123  255.895   19.278  234.617   26.095 21.27774 32.44378 
1 1 1    4   32   26 o  236.631   16.119   43.574   5.8035   41.577   7.4516   46.653   9.2526  229.656   21.447  242.040   25.351 -12.38452 33.20612 
1 1 1    4   32   27 o  282.666   12.751   61.638   5.5168   59.924   7.7528   63.398   7.8520  276.942   18.394  284.981   18.095 -8.039032 25.80235 
1 1 1    4   32   28 o  116.505   27.491   11.196   4.8232   11.740   6.8227   10.653   6.8194  118.868   35.086  114.018   35.381 4.849472 49.82811 
1 1 1    4   32   29 o  201.788   17.410   31.888   5.3247   24.216   7.4388   39.950   7.6252  171.903   29.324  224.436   22.500 -52.53314 36.96096 
1 1 1    4   32   30 o  313.332   12.908   75.834   6.1908   85.556   8.7200   65.953   8.7907  331.187   17.262  289.727   19.944 41.45978 26.37683 
1 1 1    4   32   31 o  219.421   20.801   38.080   6.9025   38.860   12.744   37.757   8.2113  212.686   40.627  216.862   25.208 -4.176666 47.81240 
1 1 1    4   32   32 o  257.196   18.823   51.972   7.3587   68.723   13.979   45.551   8.6548  289.303   32.111  238.746   24.009 50.55754 40.09452 
1 1 1    4   32   33 o   70.166   33.073  -8.6851   9.2160  -3.8917   13.015 -13.5056   13.052   93.799   42.409   80.794   38.456 13.00500 57.24880 
1 1 1    4   32   34 o  262.753   19.619   54.469   7.8334   51.546   9.1095   62.766   15.346  253.820   23.723  271.789   37.923 -17.96878 44.73142 
1 1 1    4   32   35 o  148.936   32.343   18.810   7.1618   41.082   14.465   11.577   8.2431  213.737   45.604  117.810   39.135 95.92725 60.09361 
1 1 1    4   32   36 o  147.894   27.807   18.170   6.0636   16.181   8.5556   20.177   8.5949  135.860   39.060  152.081   37.224 -16.22128 53.95657 
1 1 1    4   32   37 o  262.359   16.865   54.034   6.7365   57.142   9.2872   50.582   9.7861  267.045   22.944  249.561   26.001 17.48418 34.67665 
1 1 1    4   32   38 o  224.412   19.390   39.993   6.5949   34.908   9.3559   45.014   9.2976  203.981   30.937  234.743   26.331 -30.76175 40.62481 
1 1 1    4   32   39 o  122.175   33.689   12.974   6.5036   11.603   9.2544   14.311   9.1417  117.402   41.393  127.063   41.162 -9.660751 58.37535 
1 1 1    4   32   40 o  356.927   15.858   99.806   8.6636  110.210   14.143   93.557   10.961  367.874   25.271  342.022   21.039 25.85196 32.88271 
1 1 1    4   32   41 o  105.482   36.554   9.3392   7.2003   16.979   11.593   4.5418   9.1870  134.626   46.399   94.483   39.051 40.14252 60.64523 
1 1 1    4   32   42 o  128.440   22.642   13.661   4.2885   15.485   4.6808   4.1260   10.702  136.691   23.202   97.260   41.294 39.43134 47.36608 
1 1 1    4   32   43 o  222.630   20.416   40.062   6.8796   49.127   10.115   32.260   9.3842  241.452   27.882  191.546   33.212 49.90639 43.36401 
1 1 1    4   32   44 o  115.504   19.744   10.967   3.3652   10.715   4.7129   11.228   4.8068  110.981   27.802  113.608   27.856 -2.626724 39.35670 
1 1 1    4   32   45 o  164.966   14.721   21.616   3.6781   18.162   5.1071   25.337   5.3015  147.045   23.481  176.111   20.023 -29.06641 30.85892 
1 1 1    4   32   46 o  168.058   15.463   22.586   3.9331   26.491   5.5183   18.553   5.6073  179.362   20.467  146.660   25.927 32.70195 33.03192 
1 1 1    4   32   47 o  268.816   11.180   56.476   4.6002   55.484   6.3343   57.584   6.6917  263.330   15.788  267.822   16.403 -4.491882 22.76677 
1 1 1    4   32   48 o   88.614   26.012   6.9451   3.7592   2.1638   5.2807   11.858   5.3528   69.947   29.313  113.241   30.291 -43.29436 42.15234 
1 1 1    4   33    0 o  134.366   43.115   17.741   7.8225   17.741   7.8225   17.741   7.8225  134.366   43.115  134.366   43.115 0.000000 0.000000 
1 1 1    4   33    1 o  202.199   19.037   31.844   5.8223   35.463   8.2560   28.263   8.2122  211.980   25.990  188.026   29.506 23.95337 39.31974 
1 1 1    4   33    2 o  665.345   9.2611  339.521   9.4315  340.737   11.659  337.217   16.042  666.162   11.435  661.720   15.838 4.441467 19.53482 
1 1 1    4   33    3 o  409.310   12.611  128.731   7.9010  127.998   11.399  129.409   10.961  407.246   18.287  409.634   17.482 -2.387299 25.29909 
1 1 1    4   33    4 o  449.733   12.233  155.381   8.4207  152.938   12.143  157.644   11.687  445.237   17.818  452.220   16.885 -6.982819 24.54764 
1 1 1    4   33    5 o  529.515   11.775  215.350   9.5439  216.655   13.681  214.114   13.320  530.127   16.861  527.088   16.510 3.039246 23.59829 
1 1 1    4   33    6 o  560.212   11.532  241.018   9.8880  238.678   14.242  243.195   13.739  556.425   16.722  561.844   15.976 -5.418884 23.12731 
1 1 1    4   33    7 o  534.522   11.641  219.447   9.5243  209.596   13.649  228.796   13.297  521.307   17.106  544.936   15.941 -23.62946 23.38227 
1 1 1    4   33    8 o  741.353   11.540  422.132   13.095  407.145   18.591  436.886   18.447  726.646   16.716  752.953   16.006 -26.30615 23.14293 
1 1 1    4   33    9 o  345.213   13.432   91.658   7.0973   79.688   10.320  102.398   9.7760  320.033   21.188  364.245   17.535 -44.21161 27.50275 
1 1 1    4   33   10 o  678.574   11.485  353.713   11.929  348.323   17.146  358.770   16.607  672.005   16.669  682.246   15.903 -10.24146 23.03856 
1 1 1    4   33   11 o  422.270   12.477  137.080   8.0641  135.150   11.709  138.821   11.122  418.210   18.292  424.101   17.134 -5.890686 25.06333 
1 1 1    4   33   12 o  470.725   12.095  170.318   8.7144  175.244   12.767  166.020   11.924  476.354   17.510  463.817   16.796 12.53769 24.26343 
1 1 1    4   33   13 o  461.938   12.304  164.066   8.6996  158.209   12.229  170.067   12.378  452.511   17.656  469.269   17.234 -16.75778 24.67261 
1 1 1    4   33   14 o  295.424   15.267   67.461   6.8800   68.865   9.8014   66.098   9.6598  297.008   21.711  290.910   21.854 6.097229 30.80472 
1 1 1    4   33   15 o  299.516   12.420   69.002   5.6937   74.351   7.1231   59.538   9.4756  310.552   14.985  275.731   22.652 34.82016 27.16005 
1 1 1    4   33   16 f  487.199   9.9881  182.273   7.4483  180.191   9.0864  186.538   13.004  483.994   12.265  491.212   17.296 -7.218079 21.20357 
1 1 1    4   33   17 o  429.362   17.877  142.680   11.748   0.0000   0.0000  142.680   11.748  ?   ?   429.362   17.877 0.000000 17.87653 
1 1 1    4   33   18 o  196.272   20.835   30.272   6.1635   26.569   8.2589   34.926   9.2596  180.885   30.942  208.326   29.896 -27.43999 43.02501 
1 1 1    4   33   19 o  311.830   12.114   74.836   5.7820   79.660   9.9825   72.401   7.0930  319.430   20.526  306.235   15.132 13.19547 25.50085 
1 1 1    4   33   20 o  369.486   10.184  104.914   5.7593  102.465   8.1172  107.397   8.1729  364.363   14.555  373.082   14.312 -8.718933 20.41256 
1 1 1    4   33   21 o  417.974   11.049  134.387   7.0685  138.965   8.8843  126.492   11.668  424.459   13.675  403.537   18.890 20.92224 23.32047 
1 1 1    4   33   22 o  318.233   12.581   78.044   6.1283   81.278   7.7129   72.507   10.093  324.170   15.545  303.896   21.843 20.27386 26.80964 
1 1 1    4   33   23 o  336.138   12.342   87.076   6.3498   87.045   7.9065   87.132   10.657  335.430   15.400  333.445   20.987 1.985016 26.03099 
1 1 1    4   33   24 o  251.741   15.362   49.220   5.8910   44.188   7.4268   57.759   9.6741  237.047   20.676  270.211   23.628 -33.16376 31.39719 
1 1 1    4   33   25 o  291.084   12.331   65.329   5.4940   65.173   7.8016   65.482   7.7382  289.083   17.717  289.829   17.526 -0.7459717 24.92071 
1 1 1    4   33   26 o  521.523   9.4628  209.100   7.5537  214.741   10.926  203.935   10.455  527.265   13.539  513.913   13.291 13.35175 18.97193 
1 1 1    4   33   27 f   62.389   27.138  -0.5231   4.8390   0.3940   6.6748  -1.5390   7.0253   75.728   32.393   72.582   32.096 3.145790 45.60093 
1 1 1    4   33   28 o  141.867   24.095   16.291   5.0449   14.496   6.9877   18.246   7.2909  131.030   34.402  147.390   33.125 -16.35962 47.75753 
1 1 1    4   33   29 o  199.193   17.886   31.156   5.3952   27.439   7.5426   35.050   7.7206  183.586   27.704  209.132   24.589 -25.54616 37.04167 
1 1 1    4   33   30 o  384.384   11.677  113.998   6.8699  113.731   9.6610  114.271   9.7709  382.393   16.506  383.243   16.657 -0.8495178 23.44978 
1 1 1    4   33   31 o   96.030   35.201   6.5242   6.7688   13.655   7.8519 -14.1080   13.356  126.608   37.704   81.389   38.784 45.21837 54.09092 
1 1 1    4   33   32 o  167.073   27.062   22.865   6.6838   21.152   7.7824   27.679   13.048  158.120   33.212  174.489   47.554 -16.36897 58.00377 
1 1 1    4   33   33 o   72.663   31.755  -0.5620   6.6936   1.6950   13.235  -1.3379   7.7592  103.806   45.016   76.197   33.710 27.60935 56.23940 
1 1 1    4   33   34 o  225.494   22.633   40.689   7.7064   60.394   14.986   33.605   8.9854  265.801   37.909  201.388   30.071 64.41348 48.38795 
1 1 1    4   33   35 o  284.861   18.481   63.928   8.0145   78.022   15.645   58.913   9.3320  304.953   34.101  271.465   22.666 33.48828 40.94642 
1 1 1    4   33   36 o  168.234   24.648   23.100   6.1587   32.776   9.0405   14.722   8.4129  197.823   30.865  129.480   39.135 68.34235 49.84130 
1 1 1    4   33   37 o  226.351   19.433   40.719   6.6675   36.697   9.5567   44.533   9.3069  209.138   30.774  233.196   26.548 -24.05780 40.64271 
1 1 1    4   33   38 o  135.441   31.651   15.826   6.4436   12.480   9.0393   19.283   9.1878  120.038   40.985  145.916   39.962 -25.87807 57.24295 
1 1 1    4   33   39 o  155.801   30.768   20.812   7.0769   18.042   11.983   22.295   8.7698  138.677   47.189  157.962   36.932 -19.28537 59.92336 
1 1 1    4   33   40 o   96.494   36.440   6.9324   7.3567   2.8422   9.3497   13.581   11.920   90.516   38.519  124.192   46.491 -33.67620 60.37462 
1 1 1    4   33   41 o  199.046   23.261   32.498   6.9531   41.275   10.429   25.475   9.3287  218.464   32.151  167.419   37.352 51.04440 49.28381 
1 1 1    4   33   42 o  315.858   15.616   78.567   7.5496   79.965   10.850   77.255   10.512  313.031   22.801  307.944   22.456 5.087097 32.00260 
1 1 1    4   33   43 o  230.638   19.872   43.068   6.9467   49.962   10.361   37.437   9.3630  241.858   28.538  207.667   30.352 34.19081 41.66116 
1 1 1    4   33   44 o  141.541   21.241   16.614   4.4598   13.735   5.1192   25.677   9.0836  125.348   27.443  165.443   36.819 -40.09516 45.92115 
1 1 1    4   33   45 o  242.251   13.911   46.426   5.1364   59.569   6.1968   17.576   9.1811  273.898   14.837  131.978   41.070 141.9204 43.66749 
1 1 1    4   33   47 o  162.890   16.109   21.441   3.9637   21.822   5.4436   21.012   5.7829  160.273   22.836  155.669   25.126 4.604706 33.95257 
1 1 1    4   34    0 o  723.570   16.281  402.816   18.011  402.816   18.011  402.816   18.011  723.570   16.281  723.570   16.281 0.000000 0.000000 
1 1 1    4   34    1 o  192.750   20.383   29.082   5.9224   27.952   8.6719   30.070   8.1075  186.098   31.573  194.157   28.098 -8.058517 42.26505 
1 1 1    4   34    2 o  749.811   9.4693  431.388   10.868  436.963   13.489  421.074   18.347  754.130   11.686  738.946   16.221 15.18396 19.99210 
1 1 1    4   34    3 o  351.055   13.170   94.793   7.0769   86.389   10.235  102.492   9.7963  333.426   20.149  364.321   17.567 -30.89566 26.73183 
1 1 1    4   34    4 o  826.821   11.756  525.315   14.878  527.425   21.245  523.284   20.841  826.746   16.789  823.596   16.532 3.149719 23.56224 
1 1 1    4   34    5 o  295.861   15.188   67.623   6.8548   80.234   9.9968   56.432   9.4173  321.175   20.442  268.473   23.143 52.70212 30.87810 
1 1 1    4   34    6 o  196.351   20.215   30.171   5.9887   32.922   8.6692   27.661   8.2826  203.060   28.692  185.386   30.231 17.67346 41.67864 
1 1 1    4   34    7 f  525.099   11.753  211.907   9.4463  211.667   13.511  212.137   13.212  523.642   16.857  524.328   16.462 -0.6860352 23.56227 
1 1 1    4   34    8 o  347.896   14.082   93.197   7.4985   92.177   11.014   94.078   10.238  344.085   21.013  348.090   19.290 -4.005341 28.52474 
1 1 1    4   34    9 o  285.148   15.510   62.882   6.7439   63.735   9.8702   62.135   9.2360  285.383   22.786  282.083   21.554 3.298981 31.36544 
1 1 1    4   34   10 o  232.660   17.528   42.068   6.1962   49.910   9.1777   35.501   8.3995  251.930   24.094  211.440   26.538 40.48962 35.84405 
1 1 1    4   34   11 o   98.656   33.573   7.2372   6.0651   2.5938   8.5488   11.943   8.6063   91.647   37.753  122.931   39.947 -31.28368 54.96420 
1 1 1    4   34   12 o  638.901   11.848  313.894   11.587  305.877   16.404  321.876   16.368  629.090   17.036  645.505   16.566 -16.41553 23.76251 
1 1 1    4   34   13 o  453.640   17.777  159.244   12.344   0.0000   0.0000  159.244   12.344  ?   ?   453.640   17.777 0.000000 17.77716 
1 1 1    4   34   14 f  369.350   20.241  106.257   11.399   0.0000   0.0000  106.257   11.399  ?   ?   369.350   20.241 0.000000 20.24087 
1 1 1    4   34   15 o  421.060   18.429  137.409   11.877   0.0000   0.0000  137.409   11.877  ?   ?   421.060   18.429 0.000000 18.42890 
1 1 1    4   34   16 o  425.678   13.110  139.599   8.5417  141.927   12.137  137.315   12.023  427.802   18.536  420.754   18.669 7.047455 26.30763 
1 1 1    4   34   17 f  141.819   24.362   16.172   5.0978   17.712   6.2089   12.988   8.9301  147.425   28.547  126.664   40.646 20.76112 49.66892 
1 1 1    4   34   18 o  313.826   12.974   75.905   6.2321   74.645   7.5299   78.643   11.104  310.271   15.909  316.259   23.099 -5.987915 28.04710 
1 1 1    4   34   19 o  454.676   10.855  159.024   7.5541  147.853   9.0933  183.902   13.570  437.788   13.570  486.702   18.216 -48.91446 22.71497 
1 1 1    4   34   20 o  564.301   10.270  244.864   8.8703  248.564   11.037  238.113   14.907  567.838   12.698  553.939   17.582 13.89825 21.68809 
1 1 1    4   34   21 f  301.637   13.454   70.218   6.2114   76.519   7.8296   59.519   10.203  313.846   16.355  274.041   24.585 39.80441 29.52849 
1 1 1    4   34   22 o  357.220   10.880   98.212   5.9486  105.838   8.5249   90.975   8.3047  369.876   15.058  342.730   15.831 27.14575 21.84845 
1 1 1    4   34   23 o  180.621   19.808   25.735   5.3863   26.797   6.7971   23.943   8.8308  182.815   24.942  169.028   35.273 13.78685 43.20026 
1 1 1    4   34   24 o  327.583   13.102   82.847   6.5694   78.403   7.9912   92.111   11.538  317.458   16.503  341.996   22.161 -24.53860 27.63049 
1 1 1    4   34   25 o  164.100   23.575   21.607   5.7514   24.506   7.3068   16.884   9.3249  173.247   28.549  140.472   40.892 32.77550 49.87176 
1 1 1    4   34   26 o  306.255   12.454   72.391   5.8380   85.706   8.3629   59.735   8.1533  332.191   16.448  275.897   19.431 56.29456 25.45776 
1 1 1    4   34   27 o  103.781   29.798   8.8861   4.9822   10.275   7.1308   7.5613   6.9641  112.310   36.350  100.905   35.872 11.40499 51.07030 
1 1 1    4   34   28 o   71.779   29.169   1.9752   5.0169   5.6999   7.0515  -1.8427   7.1392   94.004   35.634   72.224   32.125 21.77943 47.97700 
1 1 1    4   34   29 o   60.841   28.111  -4.3645   6.1402  -5.8899   7.1515  -0.0865   11.977   63.884   29.796   96.850   42.397 -32.96577 51.82000 
1 1 1    4   34   30 o  144.476   26.630   17.162   5.6720   34.094   7.9538  -0.3586   8.0907  205.277   25.890   80.236   34.993 125.0409 43.52909 
1 1 1    4   34   31 o   54.788   26.341  -8.8350   6.4652   8.6587   12.186 -15.6887   7.6272  116.270   46.063   52.892   26.101 63.37804 52.94426 
1 1 1    4   34   32 o  149.054   31.638   18.771   6.9948   12.602   13.607   20.987   8.1548  128.611   49.320  156.412   34.943 -27.80106 60.44418 
1 1 1    4   34   33 o   73.650   30.743   1.5010   5.7749   0.5207   8.3224   2.4113   8.0199   82.941   35.833   86.510   36.180 -3.569405 50.92139 
1 1 1    4   34   34 o  331.781   13.751   85.470   6.9830   80.849   9.8439   90.150   9.9072  319.453   20.237  337.938   19.233 -18.48456 27.91825 
1 1 1    4   34   35 o  147.249   29.461   18.282   6.4082   15.707   9.1333   20.779   8.9936  132.928   40.896  153.029   38.445 -20.10072 56.12998 
1 1 1    4   34   36 o  166.616   32.791   23.835   8.0648   33.185   17.013   21.125   9.1593  181.032   55.836  153.558   38.919 27.47391 68.06108 
1 1 1    4   34   37 o  253.615   24.854   52.457   9.5239   0.0000   0.0000   52.457   9.5239  ?   ?   253.615   24.854 0.000000 24.85351 
1 1 1    4   34   38 o   90.608   34.670   5.6819   6.7143   9.3414   9.7472   2.3774   9.2623  109.546   41.806   89.417   38.201 20.12990 56.63133 
1 1 1    4   34   39 o  341.644   16.234   91.850   8.4891   81.361   10.713  109.551   13.917  317.125   22.211  365.598   25.020 -48.47266 33.45626 
1 1 1    4   34   40 o  121.051   33.256   13.057   6.3512   3.6153   9.2807   21.374   8.7103   91.573   38.643  152.699   37.533 -61.12584 53.87034 
1 1 1    4   34   41 o  103.484   34.681   9.3398   6.4713   20.440   9.7632   0.6417   8.6424  145.726   41.674   81.816   35.910 63.90998 55.01163 
1 1 1    4   34   42 o  246.607   18.710   48.987   7.0099   61.983   10.258   37.602   9.6011  272.548   24.864  206.957   31.285 65.59135 39.96249 
1 1 1    4   34   43 o  162.866   27.285   22.950   6.5613   31.709   9.6825   15.513   8.9221  185.233   35.442  125.499   40.665 59.73423 53.94249 
1 1 1    4   34   44 o  118.040   25.871   12.173   4.5452   15.817   5.3402   2.5950   8.6584  134.360   26.905   84.160   36.454 50.20036 45.30742 
1 1 1    4   34   45 o  128.201   19.347   13.627   3.6783   15.597   5.1518   11.579   5.2534  133.399   26.166  112.460   29.975 20.93968 39.78888 
1 1 1    4   35    0 o  126.942   45.040   16.583   7.9675   16.583   7.9675   16.583   7.9675  126.942   45.040  126.942   45.040 0.000000 0.000000 
1 1 1    4   35    1 o  860.935   11.977  569.959   15.783  577.872   22.536  562.342   22.112  864.802   17.025  853.147   16.933 11.65485 24.01225 
1 1 1    4   35    2 o  123.858   25.303   12.406   4.6348   11.439   5.6743   14.343   8.0338  118.232   30.981  132.027   37.818 -13.79504 48.88828 
1 1 1    4   35    3 o  695.138   11.785  371.534   12.539  379.946   18.392  364.228   17.141  701.155   17.137  686.817   16.305 14.33832 23.65443 
1 1 1    4   35    4 o  259.550   16.573   52.240   6.5495   55.990   9.6172   48.997   8.9442  266.942   23.787  249.610   23.695 17.33192 33.57459 
1 1 1    4   35    5 o  339.098   14.170   88.605   7.3549  100.610   11.131   79.302   9.7988  359.502   20.311  319.081   20.167 40.42136 28.62263 
1 1 1    4   35    6 o  217.666   19.394   37.010   6.3938   30.446   9.1253   43.340   8.9614  193.804   31.870  234.086   25.420 -40.28171 40.76601 
1 1 1    4   35    7 o  476.483   17.480  175.620   12.749   0.0000   0.0000  175.620   12.749  ?   ?   476.483   17.480 0.000000 17.48004 
1 1 1    4   35    8 o  246.948   23.636   48.009   8.8248   0.0000   0.0000   48.009   8.8248  ?   ?   246.948   23.636 0.000000 23.63574 
1 1 1    4   35    9 o  243.186   25.706   46.823   9.4235   0.0000   0.0000   46.823   9.4235  ?   ?   243.186   25.706 0.000000 25.70604 
1 1 1    4   35   10 o  319.880   21.108   79.933   10.277   0.0000   0.0000   79.933   10.277  ?   ?   319.880   21.108 0.000000 21.10789 
1 1 1    4   35   11 o  149.121   38.309   18.626   8.7906   0.0000   0.0000   18.626   8.7906  ?   ?   149.121   38.309 0.000000 38.30948 
1 1 1    4   35   12 o  228.620   19.280   40.856   6.6837   51.500   9.8308   31.708   9.1142  255.006   25.530  197.710   31.148 57.29593 40.27380 
1 1 1    4   35   13 o   80.416   32.357   2.6568   6.1073   7.4210   8.8359  -1.7016   8.4511  106.716   40.011   80.131   35.330 26.58461 53.37692 
1 1 1    4   35   14 o  253.748   17.988   50.177   6.9410   47.114   10.144   52.874   9.5184  242.837   27.791  258.636   24.330 -15.79945 36.93594 
1 1 1    4   35   15 o  483.159   13.088  179.962   9.6790  182.491   14.230  177.785   13.204  484.527   19.187  478.676   18.021 5.851837 26.32354 
1 1 1    4   35   16 o  219.769   16.072   37.575   5.3690   33.935   6.4289   45.966   9.7608  207.716   20.488  239.876   27.057 -32.16031 33.93871 
1 1 1    4   35   17 o  296.118   16.720   68.160   7.5473   68.160   7.5473   0.0000   0.0000  296.118   16.720  ?   ?  0.000000 16.71996 
1 1 1    4   35   18 o  351.449   14.928   95.502   8.0304   95.502   8.0304   0.0000   0.0000  351.449   14.928  ?   ?  0.000000 14.92810 
1 1 1    4   35   19 o  382.771   14.421  113.232   8.4488  113.232   8.4488   0.0000   0.0000  382.771   14.421  ?   ?  0.000000 14.42062 
1 1 1    4   35   20 o  262.328   15.008   53.409   6.0010   48.435   7.0990   65.862   11.233  248.780   18.781  287.716   25.780 -38.93576 31.89584 
1 1 1    4   35   21 f  377.446   10.466  109.630   6.0467  100.552   8.3474  119.653   8.7711  360.410   15.132  393.316   14.569 -32.90613 21.00552 
1 1 1    4   35   22 o  361.468   11.007  100.624   6.0900  106.578   8.6592   94.797   8.5668  370.944   15.251  349.629   16.008 21.31528 22.10999 
1 1 1    4   35   23 o   96.562   29.369   7.5439   4.7272   12.629   6.6553   2.3658   6.7157  122.728   34.169   81.747   33.543 40.98119 47.88188 
1 1 1    4   35   24 o  238.859   15.125   44.385   5.5014   48.936   7.6965   39.630   7.8665  249.264   20.350  223.112   23.382 26.15208 30.99793 
1 1 1    4   35   25 o  234.017   17.557   42.877   6.2430   48.122   7.7624   33.270   10.505  246.932   20.729  198.890   35.826 48.04221 41.39081 
1 1 1    4   35   26 o   68.053   30.628  -2.6042   6.6988  -2.6042   6.6988   0.0000   0.0000   68.053   30.628  ?   ?  0.000000 30.62839 
1 1 1    4   35   27 o   96.672   36.475   6.2097   7.3665   6.2097   7.3665   0.0000   0.0000   96.672   36.475  ?   ?  0.000000 36.47459 
1 1 1    4   35   28 o  253.860   15.799   50.292   6.1086   50.559   8.6547   50.027   8.6232  251.994   22.681  250.635   22.725 1.358292 32.10721 
1 1 1    4   35   29 o   99.759   32.385   8.0365   5.6571   6.9710   8.0337   9.0844   7.9673  100.920   38.087  108.262   38.382 -7.342445 54.07230 
1 1 1    4   35   30 o  301.234   17.150   71.072   7.8747   71.773   14.535   70.780   9.3689  294.060   32.854  299.118   20.589 -5.057953 38.77198 
1 1 1    4   35   31 o  272.213   15.763   57.904   6.5396   59.799   9.1493   55.924   9.3508  274.016   22.000  264.282   23.356 9.733398 32.08606 
1 1 1    4   35   32 f  186.957   21.184   27.971   5.9552   29.757   8.5350   26.277   8.3131  188.711   30.596  176.448   31.957 12.26324 44.24247 
1 1 1    4   35   33 o  239.311   17.940   45.187   6.5236   37.297   9.0466   53.736   9.4162  212.435   28.544  258.083   24.116 -45.64867 37.36798 
1 1 1    4   35   34 f  181.763   23.312   26.813   6.3363   35.395   9.0506   18.563   8.8737  205.945   29.559  144.006   39.205 61.93913 49.09924 
1 1 1    4   35   35 o   50.670   24.751 -10.8490   6.3264 -18.4373   10.081  -5.9195   8.1254   61.718   30.370   68.074   31.753 -6.356243 43.93862 
1 1 1    4   35   36 o  193.144   24.515   30.603   7.0843   30.945   11.317   30.383   9.0842  183.769   41.247  187.725   32.810 -3.956024 52.70438 
1 1 1    4   35   37 o   93.766   35.311   6.4667   6.8965   4.6426   8.9713   9.1019   10.783   93.948   38.685  110.386   43.458 -16.43804 58.18232 
1 1 1    4   35   38 o   76.393   33.426   0.1692   7.4363   0.1119   15.202   0.1873   8.5259  102.074   46.021   81.027   35.613 21.04660 58.19165 
1 1 1    4   35   39 o  100.470   36.814   8.2283   7.4023  -3.8136   14.389   12.562   8.6322   93.485   43.137  117.601   40.052 -24.11668 58.86367 
1 1 1    4   35   40 f  206.468   26.011   35.852   8.0377   33.562   15.317   36.723   9.4422  175.432   52.756  205.295   31.016 -29.86349 61.19743 
1 1 1    4   35   41 o  211.316   21.142   36.617   6.7464   33.127   9.6449   39.959   9.4402  191.223   34.208  214.411   29.550 -23.18851 45.20404 
1 1 1    4   35   42 o  100.980   33.296   9.2036   5.9711   0.3699   8.5077   17.779   8.3824   79.101   35.132  134.977   38.620 -55.87592 52.20880 
1 1 1    4   35   43 o  112.797   32.938   11.873   6.0418   3.1226   8.4557   21.000   8.6360   84.604   36.332  146.279   38.168 -61.67496 52.69520 
1 1 1    4   35   44 o   67.055   30.595  -1.9249   6.9671   6.2582   8.3960 -20.0184   12.485   92.127   37.620   66.735   33.018 25.39156 50.05396 
1 1 1    4   36    0 o  604.581   17.138  281.971   15.831  281.971   15.831  281.971   15.831  604.581   17.138  604.581   17.138 0.000000 0.000000 
1 1 1    4   36    1 o  362.994   14.203  101.618   7.8912  111.433   11.200   91.942   11.120  378.396   19.402  343.026   21.285 35.36990 28.80100 
1 1 1    4   36    2 o  579.253   12.018  258.210   10.655  260.513   15.060  255.901   15.078  580.250   16.957  575.027   17.131 5.223450 24.10387 
1 1 1    4   36    3 o  719.927   12.018  398.865   13.243  410.910   19.120  387.757   18.361  728.634   17.144  707.900   16.945 20.73358 24.10516 
1 1 1    4   36    4 o  368.726   14.690  104.923   8.2909   89.862   11.856  119.339   11.599  338.463   23.022  392.052   19.329 -53.58890 30.05974 
1 1 1    4   36    5 o  473.032   12.591  172.311   9.1164  171.573   13.193  172.985   12.612  470.396   18.324  472.618   17.434 -2.222595 25.29218 
1 1 1    4   36    6 o  137.746   29.546   15.556   6.0426   8.6850   8.8148   21.647   8.2995  110.924   40.244  161.586   34.600 -50.66167 53.07322 
1 1 1    4   36    7 o  307.893   15.956   73.485   7.4938   69.345   10.775   77.363   10.429  296.712   23.929  314.227   21.818 -17.51511 32.38305 
1 1 1    4   36    8 o  333.092   14.848   85.679   7.5701   91.518   10.953   80.337   10.475  342.116   21.018  320.301   21.490 21.81577 30.05954 
1 1 1    4   36    9 o  277.556   16.788   59.859   7.0987   77.316   10.668   45.985   9.5101  313.854   22.352  240.393   26.274 73.46054 34.49521 
1 1 1    4   36   10 o  109.541   33.390   9.7144   6.1055   8.5005   8.7059   10.889   8.5647  109.789   39.970  118.044   39.896 -8.255066 56.47420 
1 1 1    4   36   11 o  467.127   12.921  168.204   9.2387  174.491   13.602  162.820   12.588  473.900   18.753  458.065   17.953 15.83557 25.96109 
1 1 1    4   36   12 o   98.076   33.563   7.2380   6.0620   8.7170   8.5196   5.7213   8.6273  109.930   39.613  100.347   39.056 9.583549 55.62901 
1 1 1    4   36   13 f  349.628   14.978   94.492   8.0153   98.351   11.549   90.907   11.133  354.261   21.400  340.518   21.470 13.74353 30.31341 
1 1 1    4   36   14 o  415.485   19.859  134.492   12.629  134.492   12.629   0.0000   0.0000  415.485   19.859  ?   ?  0.000000 19.85916 
1 1 1    4   36   15 o  452.196   19.453  159.244   13.465  159.244   13.465   0.0000   0.0000  452.196   19.453  ?   ?  0.000000 19.45334 
1 1 1    4   36   16 o  227.229   22.253   40.799   7.6404   47.924   10.541   32.912   11.091  244.014   28.776  197.963   37.983 46.05101 47.65237 
1 1 1    4   36   17 o  688.114   10.204  364.214   10.748  357.951   13.067  377.311   18.897  681.300   12.531  696.846   17.716 -15.54626 21.70004 
1 1 1    4   36   18 o  160.626   23.806   20.704   5.6758   22.911   6.8909   16.047   10.009  167.835   27.797  137.799   42.882 30.03532 51.10276 
1 1 1    4   36   19 o  276.232   15.296   59.273   6.4421   54.788   7.7887   68.987   11.462  264.350   19.384  294.272   25.706 -29.92227 32.19528 
1 1 1    4   36   20 o  316.499   14.126   77.469   6.8434   87.705   8.4017   57.288   11.796  336.175   16.328  266.192   29.446 69.98306 33.66968 
1 1 1    4   36   21 o  186.704   21.858   27.709   6.1283   27.740   7.2436   27.632   11.495  185.322   26.272  178.217   42.699 7.104523 50.13370 
1 1 1    4   36   22 o  320.964   11.972   79.474   5.8814   77.167   8.1019   82.045   8.5514  314.603   16.887  324.277   17.291 -9.674255 24.16907 
1 1 1    4   36   23 o  334.098   13.870   86.374   7.0929   84.151   8.3179   92.299   13.578  328.596   16.592  339.655   26.324 -11.05942 31.11627 
1 1 1    4   36   24 o  281.171   15.784   61.588   6.7655   51.982   7.9418   87.001   12.918  256.707   20.380  329.786   25.796 -73.07837 32.87535 
1 1 1    4   36   25 f  431.202   10.817  143.330   7.1391  139.687   9.9343  147.221   10.266  424.162   15.302  435.408   15.404 -11.24600 21.71250 
1 1 1    4   36   26 o  211.562   17.713   35.171   5.6831   33.139   8.1694   37.077   7.9110  201.842   27.130  214.786   24.502 -12.94397 36.55651 
1 1 1    4   36   27 o  212.675   25.868   36.602   8.2472   40.573   12.683   33.693   10.855  216.737   39.695  198.505   37.091 18.23251 54.32765 
1 1 1    4   36   28 o  173.211   31.276   25.105   7.9867   34.889   12.692   18.691   10.276  198.299   43.052  145.165   43.112 53.13367 60.92721 
1 1 1    4   36   29 o  432.754   12.925  145.036   8.5616  146.796   10.715  141.927   14.239  433.948   16.131  422.821   22.079 11.12646 27.34399 
1 1 1    4   36   30 o  257.153   16.800   51.887   6.5763   46.415   9.5064   56.910   9.1071  238.842   26.448  266.818   22.510 -27.97575 34.72986 
1 1 1    4   36   31 o  196.854   20.715   30.963   6.1480   32.436   8.8265   29.575   8.5684  197.101   30.221  187.704   30.899 9.396927 43.22089 
1 1 1    4   36   32 o  167.230   24.285   22.847   6.0344   25.319   8.4899   20.325   8.5786  171.705   33.507  151.676   37.228 20.02870 50.08598 
1 1 1    4   36   33 o  195.862   23.599   31.184   6.9323   23.952   10.822   36.217   9.0279  161.079   43.062  208.271   29.116 -47.19228 51.98136 
1 1 1    4   36   34 o  131.514   33.393   15.161   6.7343   18.748   10.708   12.815   8.6614  141.704   44.397  120.552   40.119 21.15198 59.83786 
1 1 1    4   36   35 o  151.222   31.417   19.796   7.0343   22.177   8.9192   15.877   11.441  156.663   37.661  131.195   46.044 25.46869 59.48401 
1 1 1    4   36   36 o   58.123   27.573  -6.6943   6.6012  -3.8520   8.3549 -11.4163   10.769   72.202   33.153   71.636   34.323 0.5661316 47.71962 
1 1 1    4   36   37 o  286.052   16.107   64.652   7.0234   60.266   9.8803   69.132   9.9858  270.985   24.071  291.525   22.554 -20.53967 32.98671 
1 1 1    4   36   38 f  140.066   30.162   17.184   6.2752   11.628   8.7489   23.071   9.0055  113.722   40.231  157.697   37.801 -43.97525 55.20353 
1 1 1    4   36   39 o  227.486   19.250   41.838   6.6400   40.687   9.4653   42.953   9.3173  217.109   29.226  224.372   27.719 -7.263458 40.28034 
1 1 1    4   36   40 o  136.269   33.872   17.150   7.0345   19.218   12.824   16.260   8.4131  134.228   48.565  129.341   39.145 4.886765 62.37731 
1 1 1    4   36   41 o  124.853   35.387   14.810   7.0721  -1.3694   12.604   22.243   8.5436   88.562   40.685  152.335   37.007 -63.77344 54.99837 
1 1 1    4   36   42 o  141.834   39.243   20.112   8.8076   23.331   12.700   17.129   12.226  143.241   48.581  125.733   47.080 17.50854 67.65060 
1 1 1    4   37    0 o  271.523   23.643   58.352   9.6546   58.352   9.6546   58.352   9.6546  271.523   23.643  271.523   23.643 0.000000 0.000000 
1 1 1    4   37    1 o  136.714   24.975   15.112   5.0336   16.040   6.2397   13.383   8.5179  139.592   30.090  127.519   39.538 12.07227 49.68570 
1 1 1    4   37    2 o  177.036   19.210   24.640   5.1219   25.757   6.4420   22.720   8.4449  179.762   24.013  165.357   34.482 14.40475 42.01956 
1 1 1    4   37    3 o  722.848   9.8739  401.575   10.925  395.929   13.395  412.792   18.881  716.952   12.206  729.915   16.899 -12.96344 20.84650 
1 1 1    4   37    4 o  268.727   16.949   56.171   6.9359   69.090   10.215   45.119   9.4479  296.344   22.692  237.899   26.391 58.44507 34.80504 
1 1 1    4   37    5 o  135.075   31.016   15.091   6.2772   20.433   9.1180   10.277   8.6548  155.500   38.510  115.823   40.080 39.67678 55.58325 
1 1 1    4   37    6 o  506.402   12.800  197.681   9.9218  186.161   14.143  208.843   13.922  489.362   18.882  518.873   17.530 -29.51144 25.76496 
1 1 1    4   37    7 o  395.449   13.971  120.722   8.4567  125.833   12.367  116.233   11.590  401.374   20.195  385.916   19.686 15.45807 28.20241 
1 1 1    4   37    8 o  348.463   14.836   93.850   7.9132   93.165   11.867   94.398   10.619  344.261   22.647  347.530   20.047 -3.268677 30.24553 
1 1 1    4   37    9 o  142.211   31.643   16.761   6.7103   12.875   9.6337   20.423   9.3521  126.568   42.315  155.095   39.336 -28.52731 57.77481 
1 1 1    4   37   10 o  362.997   22.366  103.527   12.367  103.527   12.367   0.0000   0.0000  362.997   22.366  ?   ?  0.000000 22.36647 
1 1 1    4   37   11 o  301.750   23.958   71.961   10.974   71.961   10.974   0.0000   0.0000  301.750   23.958  ?   ?  0.000000 23.95764 
1 1 1    4   37   12 f  124.845   41.271   12.621   9.1717   12.621   9.1717   0.0000   0.0000  124.845   41.271  ?   ?  0.000000 41.27082 
1 1 1    4   37   13 o  400.869   14.620  124.260   8.9703  108.422   12.659  140.233   12.713  371.271   22.381  424.125   19.583 -52.85437 29.73899 
1 1 1    4   37   14 o  145.884   31.182   17.654   6.7518   17.957   10.020   17.402   9.1375  144.892   42.450  142.896   40.127 1.996323 58.41371 
1 1 1    4   37   15 o  335.127   16.150   87.086   8.2843   94.963   12.256   80.460   11.241  346.844   23.220  319.167   23.168 27.67697 32.80146 
1 1 1    4   37   16 o   84.809   33.843   3.4129   6.6216   3.2865   9.4479   3.5350   9.2830   95.805   39.600   95.843   39.395 -0.3833771E-01 55.85788 
1 1 1    4   37   17 o  126.963   34.567   13.555   6.8982   29.383   10.326   0.7992   9.2699  186.373   37.498   88.864   38.098 97.50822 53.45556 
1 1 1    4   37   18 f  132.511   28.545   14.519   5.6188   17.322   6.7855   8.4055   10.022  144.047   31.641  111.746   42.452 32.30063 52.94632 
1 1 1    4   37   19 o   85.060   31.616   4.7442   5.4935   3.6554   6.7361   6.9062   9.4924   85.914   34.181  105.705   41.016 -19.79153 53.39181 
1 1 1    4   37   20 f   68.081   29.227   0.0973   5.4691   2.1311   6.5730  -4.4790   9.8595   80.173   33.075   80.402   36.573 -0.2295685 49.31049 
1 1 1    4   37   21 f   78.846   31.200   3.1132   5.5842   2.9558   6.6078   3.5068   10.445   82.890   33.550   99.365   41.400 -16.47531 53.28720 
1 1 1    4   37   22 o  657.705   10.841  333.421   10.914  329.917   13.284  340.699   19.143  653.076   13.290  660.053   18.948 -6.976379 23.14416 
1 1 1    4   37   23 o  359.930   11.691   99.995   6.4406  106.001   9.2589   94.364   8.9648  369.072   16.390  348.070   16.827 21.00220 23.48999 
1 1 1    4   37   24 o  238.129   16.062   44.309   5.8201   44.860   8.3040   43.777   8.1597  237.020   23.186  234.169   23.065 2.851196 32.70445 
1 1 1    4   37   25 o  414.415   13.342  132.995   8.4630  127.527   15.272  135.419   10.167  399.201   25.122  417.136   15.924 -17.93500 29.74311 
1 1 1    4   37   26 o   95.816   34.586   6.7546   6.4984  -6.7349   12.542   11.705   7.5978   87.229   40.258  117.856   37.457 -30.62669 54.98880 
1 1 1    4   37   27 o  184.882   20.674   27.264   5.7504   23.005   8.0799   31.635   8.1857  164.540   33.227  196.200   28.056 -31.66064 43.48754 
1 1 1    4   37   28 o  293.778   14.492   67.097   6.5166   70.226   9.2219   63.976   9.2098  297.672   20.362  283.562   21.377 14.10916 29.52270 
1 1 1    4   37   29 o  166.685   27.228   22.980   6.7068   27.672   8.7210   16.188   10.492  180.484   32.776  134.923   44.120 45.56078 54.96239 
1 1 1    4   37   30 o  108.063   35.262   9.8055   6.7034   7.2179   8.2933   14.682   11.385  101.178   38.575  129.800   45.896 -28.62204 59.95355 
1 1 1    4   37   31 o  186.317   28.822   29.024   7.9542   26.795   10.721   31.755   11.863  171.690   41.300  186.481   42.508 -14.79056 59.26762 
1 1 1    4   37   32 o  129.199   32.244   14.526   6.3560   13.358   8.5317   15.983   9.5282  122.662   39.768  132.464   41.930 -9.802361 57.78926 
1 1 1    4   37   33 o  143.761   32.686   18.065   7.0296   18.711   8.9666   17.035   11.324  142.901   39.617  135.074   45.874 7.827042 60.61250 
1 1 1    4   37   34 o   78.537   32.953   2.1133   6.6864   7.4616   8.3729  -7.3015   11.109  100.574   38.660   78.494   36.781 22.07941 53.36133 
1 1 1    4   37   35 o  161.569   26.057   21.895   6.2248   17.297   8.5511   27.078   9.0790  136.701   38.970  174.254   35.251 -37.55284 52.54738 
1 1 1    4   37   36 o  129.841   31.065   14.882   6.0912   12.603   8.4818   17.309   8.7530  117.465   39.703  135.557   39.663 -18.09207 56.12048 
1 1 1    4   37   37 o  212.445   20.294   36.680   6.5188   40.335   9.1173   32.858   9.3242  217.384   28.056  192.395   32.842 24.98924 43.19391 
1 1 1    4   37   38 o  185.337   22.788   28.547   6.3284   25.102   9.1416   31.717   8.7694  163.254   37.388  189.249   31.373 -25.99420 48.80711 
1 1 1    4   37   39 o  119.918   31.653   13.133   5.8950   18.677   8.4911   7.9751   8.1907  138.437   38.614   98.455   38.129 39.98187 54.26614 
1 1 1    4   37   40 o   92.470   34.768   7.1187   6.6807   12.733   8.3784  -2.6814   11.070  114.318   39.442   81.773   37.769 32.54435 54.60941 
1 1 1    4   38    0 o  225.889   28.756   41.599   9.5030   41.599   9.5030   41.599   9.5030  225.889   28.756  225.889   28.756 0.000000 0.000000 
1 1 1    4   38    1 o   84.303   30.233   4.9369   4.9568  -1.4626   6.2199   16.075   8.2056   68.461   30.240  138.052   37.748 -69.59132 48.36744 
1 1 1    4   38    2 o  154.590   22.953   19.115   5.2663   16.603   6.2957   24.969   9.6103  141.895   29.929  172.092   37.541 -30.19780 48.01075 
1 1 1    4   38    3 o  257.734   18.085   51.861   7.0893   51.861   7.0893   0.0000   0.0000  257.734   18.085  ?   ?  0.000000 18.08515 
1 1 1    4   38    4 o  162.671   38.689   22.465   9.4927   22.465   9.4927   0.0000   0.0000  162.671   38.689  ?   ?  0.000000 38.68919 
1 1 1    4   38    5 o  463.842   19.108  167.526   13.566  167.526   13.566   0.0000   0.0000  463.842   19.108  ?   ?  0.000000 19.10799 
1 1 1    4   38    6 o  102.368   40.102   5.9387   9.1409   5.9387   9.1409   0.0000   0.0000  102.368   40.102  ?   ?  0.000000 40.10209 
1 1 1    4   38    7 o  296.833   24.492   69.825   11.029   69.825   11.029   0.0000   0.0000  296.833   24.492  ?   ?  0.000000 24.49239 
1 1 1    4   38    8 o  161.990   27.587   21.344   6.5949   15.953   9.5409   26.277   9.1262  137.383   41.710  177.446   34.845 -40.06306 54.34959 
1 1 1    4   38    9 o  306.147   16.859   72.952   7.8697   75.970   11.459   70.258   10.827  309.660   24.374  297.901   23.946 11.75964 34.16882 
1 1 1    4   38   10 o  270.007   18.449   56.997   7.5790   61.119   11.050   53.335   10.415  276.668   26.415  258.166   26.744 18.50208 37.58964 
1 1 1    4   38   11 o  295.745   17.497   68.208   7.8854   74.963   11.112   61.354   11.192  307.733   23.775  277.003   26.729 30.73047 35.77246 
1 1 1    4   38   12 f  210.944   22.651   35.325   7.1991   38.023   9.9928   32.414   10.380  215.654   31.178  196.872   35.765 18.78146 47.44671 
1 1 1    4   38   13 o  286.198   18.213   64.028   7.9371   69.156   11.427   59.246   11.033  294.555   25.599  271.931   26.858 22.62311 37.10372 
1 1 1    4   38   14 o  285.624   17.920   63.750   7.7945   55.547   10.844   72.516   11.211  262.923   27.347  302.102   24.454 -39.17886 36.68608 
1 1 1    4   38   15 o  471.806   13.854  172.154   10.005  169.503   14.193  174.773   14.104  465.576   19.917  472.976   19.483 -7.400299 27.86132 
1 1 1    4   38   16 o  101.430   34.622   7.9614   6.4506   7.1170   9.3741   8.7208   8.8902  105.960   40.859  109.815   40.328 -3.855499 57.40911 
1 1 1    4   38   17 o   77.652   33.091   0.7100   6.9181   4.0536   9.6887  -2.7679   9.8814   98.223   40.295   83.644   37.456 14.57890 55.01534 
1 1 1    4   38   18 o  107.040   35.983   9.1055   6.9667  -4.5307   9.5359   24.715   10.203   78.715   35.868  168.874   40.073 -90.15927 53.78098 
1 1 1    4   38   19 o  266.102   17.097   55.364   6.9266   54.913   8.4588   56.281   12.068  263.547   21.147  262.377   30.625 1.170685 37.21688 
1 1 1    4   38   20 o  120.508   32.083   12.237   6.0227   6.3351   7.1886   26.136   11.031   96.567   36.112  172.446   42.148 -75.87868 55.50319 
1 1 1    4   38   21 o  182.951   23.138   26.860   6.3343   31.444   7.6924   17.204   11.164  196.961   26.163  140.552   45.483 56.40881 52.47105 
1 1 1    4   38   22 o  101.126   33.893   8.1361   6.1804  -2.6291   7.3466   34.202   11.432   71.315   32.088  199.132   38.901 -127.8166 50.42754 
1 1 1    4   38   23 o  298.497   20.525   70.427   9.3207   78.549   13.370   62.747   13.001  310.938   28.406  275.932   31.338 35.00598 42.29617 
1 1 1    4   38   24 o  267.849   17.520   56.310   7.1432   54.230   12.963   57.217   8.5601  254.293   34.170  268.568   20.990 -14.27528 40.10198 
1 1 1    4   38   25 o  276.366   15.061   59.589   6.3471   59.109   9.1021   60.044   8.8553  272.331   22.025  274.879   21.211 -2.547638 30.57778 
1 1 1    4   38   26 o   73.689   30.254   2.0102   5.4672  -2.4364   7.5853   6.8178   7.8872   72.547   32.627   99.319   37.677 -26.77154 49.84065 
1 1 1    4   38   27 o  108.424   32.226   9.9624   5.7400   9.1588   8.0544   10.792   8.1822  107.650   38.545  113.887   38.993 -6.236992 54.82880 
1 1 1    4   38   28 o  243.933   19.557   47.278   7.2406   57.646   12.416   41.935   8.9131  262.249   31.566  226.372   26.209 35.87701 41.02819 
1 1 1    4   38   29 o  184.987   25.263   28.090   6.9662   37.882   11.487   22.395   8.7610  207.704   37.514  159.125   36.717 48.57924 52.49228 
1 1 1    4   38   30 o  171.257   24.922   24.164   6.3413   16.939   8.7252   32.252   9.2321  136.655   39.490  194.123   32.199 -57.46823 50.95366 
1 1 1    4   38   31 o   96.310   36.165   6.8705   7.2239  -0.1636   8.8561   20.856   12.488   82.157   36.197  146.935   48.137 -64.77771 60.22793 
1 1 1    4   38   32 o  343.612   15.712   92.679   8.2635  102.628   10.347   75.161   13.730  359.152   18.889  298.179   30.514 60.97256 35.88687 
1 1 1    4   38   33 o   86.148   34.110   4.5893   6.6781   8.0657   8.4236  -1.2922   10.957  102.262   38.903   87.146   39.201 15.11572 55.22811 
1 1 1    4   38   34 o  229.511   19.068   42.304   6.6378   46.522   9.0432   37.377   9.7737  236.626   25.364  207.335   31.814 29.29121 40.68674 
1 1 1    4   38   35 o  129.044   31.220   14.828   6.0994   25.383   8.9635   5.7253   8.3238  166.295   36.239   93.435   37.712 72.85977 52.30162 
1 1 1    4   38   36 o  109.262   32.650   10.797   5.8805   10.463   8.3269   11.129   8.3057  108.013   39.126  110.379   39.182 -2.365845 55.37234 
1 1 1    4   38   37 o   75.568   31.103   2.8866   5.7959  -7.0669   8.1949   12.848   8.1983   64.561   30.655  115.980   39.035 -51.41962 49.63269 
1 1 1    4   38   38 o  169.661   28.939   25.361   7.2456   26.355   9.0769   23.614   12.029  166.686   36.581  147.201   47.169 19.48546 59.69112 
1 1 1    4   39    0 o  401.103   19.022  125.080   11.619  125.080   11.619  125.080   11.619  401.103   19.022  401.103   19.022 0.000000 0.000000 
1 1 1    4   39    1 o  410.312   11.641  129.736   7.3110  129.088   8.9827  131.009   12.583  408.552   14.365  409.554   20.073 -1.001526 24.68350 
1 1 1    4   39    2 o  586.250   12.757  265.219   11.447  253.360   16.288  276.795   16.092  570.317   18.659  596.675   17.620 -26.35822 25.66307 
1 1 1    4   39    3 o  550.946   12.902  234.291   10.880  254.207   16.265  218.161   14.638  571.280   18.601  529.493   18.061 41.78674 25.92703 
1 1 1    4   39    4 o  180.146   24.063   25.984   6.4691   24.564   9.4304   27.247   8.8908  170.291   37.219  181.154   33.291 -10.86322 49.93561 
1 1 1    4   39    5 o  288.103   17.011   64.693   7.4683   62.295   10.839   66.860   10.305  279.525   25.619  290.621   23.363 -11.09583 34.67227 
1 1 1    4   39    6 o  377.219   14.673  110.127   8.4721  116.892   12.553  104.469   11.481  385.693   21.347  364.872   20.642 20.82047 29.69510 
1 1 1    4   39    7 f  168.894   27.591   23.219   6.8864   27.811   9.9586   19.011   9.5330  181.361   37.125  148.658   40.703 32.70248 55.09056 
1 1 1    4   39    8 o   85.957   33.233   4.2393   6.2144  -5.9246   8.9704   13.619   8.6172   73.806   34.058  127.548   39.804 -53.74183 52.38607 
1 1 1    4   39    9 o  430.816   13.957  143.537   9.2033  143.339   13.374  143.715   12.684  427.990   20.416  429.047   19.314 -1.057434 28.10441 
1 1 1    4   39   10 o  445.016   14.025  153.190   9.5531  161.126   14.093  146.444   12.994  453.768   20.291  432.915   19.610 20.85306 28.21823 
1 1 1    4   39   11 o  157.595   29.545   20.485   6.8649   13.355   9.6994   27.642   9.7176  127.265   42.459  180.837   36.368 -53.57162 55.90546 
1 1 1    4   39   12 o  119.876   33.936   12.057   6.5079   12.404   9.3979   11.736   9.0209  123.441   41.792  120.548   40.944 2.893349 58.50629 
1 1 1    4   39   13 o  327.936   17.184   83.919   8.5957   83.895   12.237   83.942   12.077  324.538   24.823  324.808   24.471 -0.2700195 34.85696 
1 1 1    4   39   14 o  151.031   31.009   19.021   6.9284   26.428   10.136   12.527   9.4918  175.343   38.796  123.773   41.999 51.56972 57.17580 
1 1 1    4   39   15 o  111.216   35.397   10.156   6.7833   11.586   9.4417   8.6314   9.7518  120.293   41.849  111.224   41.966 9.068436 59.26674 
1 1 1    4   39   16 o   96.588   36.355   6.2241   7.3085   9.0982   10.462   3.4842   10.214  114.185   43.374   98.340   40.954 15.84454 59.65354 
1 1 1    4   39   17 o  109.438   36.891   9.6038   7.3228   9.3721   10.361   9.8351   10.351  114.615   43.254  115.998   43.343 -1.382355 61.23332 
1 1 1    4   39   18 o  158.253   33.455   21.182   7.8503   23.416   11.365   19.143   10.856  162.065   44.472  147.246   44.445 14.81857 62.87357 
1 1 1    4   39   19 o  303.294   19.262   72.372   8.8955   67.698   12.513   77.147   12.648  288.558   28.713  309.216   26.994 -20.65756 39.40940 
1 1 1    4   39   20 o  369.509   17.459  106.632   9.8744  121.033   14.429   93.946   13.542  389.343   24.334  341.784   26.084 47.55887 35.67177 
1 1 1    4   39   21 o  149.782   36.708   19.442   8.3502   20.621   11.640   18.193   11.986  151.268   46.102  143.183   47.172 8.085251 65.95886 
1 1 1    4   39   22 o  147.968   29.280   18.313   6.3966   21.741   7.7545   11.012   11.316  160.041   32.759  120.192   45.237 39.84918 55.85278 
1 1 1    4   39   23 o  150.237   29.691   18.944   6.5856   19.612   7.9225   17.449   11.847  150.676   35.018  139.977   46.924 10.69951 58.55020 
1 1 1    4   39   24 o  140.466   31.582   16.825   6.6252   13.006   7.7944   26.767   12.576  122.573   37.792  169.787   46.860 -47.21357 60.20011 
1 1 1    4   39   25 o   67.429   30.006  -1.4579   6.2354  -5.2103   9.9240   0.9898   8.0152   78.056   35.948   82.276   35.353 -4.220512 50.41955 
1 1 1    4   39   26 o  221.810   21.091   39.400   7.0743   45.957   11.554   35.468   8.9477  232.456   33.434  206.299   29.148 26.15654 44.35629 
1 1 1    4   39   27 o  152.436   27.412   19.457   6.1606   16.004   8.6068   23.084   8.8220  133.398   39.416  161.548   36.534 -28.15021 53.74340 
1 1 1    4   39   28 o  331.176   14.737   85.674   7.4701   84.614   10.527   86.750   10.602  324.964   21.282  329.141   21.156 -4.176910 30.00858 
1 1 1    4   39   29 o  315.197   16.533   78.295   7.9487   80.748   10.009   74.107   13.079  317.532   20.707  297.866   29.058 19.66641 35.68109 
1 1 1    4   39   30 o  174.409   26.944   25.473   6.9610   30.606   8.8096   16.941   11.358  188.618   31.634  134.217   45.940 54.40152 55.77861 
1 1 1    4   39   31 o  230.604   18.984   42.565   6.6411   49.512   9.5514   36.063   9.2402  244.382   25.931  205.394   30.302 38.98752 39.88233 
1 1 1    4   39   32 o   86.378   32.616   5.4251   5.8934   3.3655   8.2289   7.5939   8.4443   87.162   36.564  100.103   38.729 -12.94115 53.26210 
1 1 1    4   39   33 o  167.566   24.440   23.498   6.0839   23.813   8.7153   23.198   8.4967  160.964   36.246  159.176   35.748 1.787750 50.90916 
1 1 1    4   39   34 o   79.163   33.115   2.7596   6.7208   0.0656   8.4392   7.4304   11.112   78.972   35.037  103.371   42.854 -24.39899 55.35389 
1 1 1    4   39   35 o  145.931   32.436   19.331   7.0572   32.310   8.8006  -4.0498   11.812  190.826   31.209   83.085   38.598 107.7409 49.63690 
1 1 1    4   39   36 o   88.808   35.075   5.7589   7.0448   7.1296   8.2797   2.1647   13.408   95.798   37.965   96.294   43.336 -0.4960861 57.61349 
1 1 1    4   40    0 o  111.120   40.888   13.009   6.4334   13.009   6.4334   13.009   6.4334  111.120   40.888  111.120   40.888 0.000000 0.000000 
1 1 1    4   40    1 o  426.301   11.604  140.126   7.5717  146.766   9.4189  127.998   12.730  435.501   14.130  403.688   20.671 31.81332 25.03920 
1 1 1    4   40    2 o  284.944   14.191   62.837   6.1891   67.134   7.7143   55.077   10.368  293.261   17.262  262.135   26.191 31.12585 31.36811 
1 1 1    4   40    3 o  220.310   17.319   37.991   5.7931   41.717   7.1584   30.917   9.8618  229.915   20.558  192.149   34.813 37.76588 40.43002 
1 1 1    4   40    4 o  325.092   13.515   81.715   6.7252   85.544   8.2681   74.229   11.561  331.861   16.277  305.207   24.966 26.65396 29.80379 
1 1 1    4   40    5 o   80.716   33.251   2.2111   6.6318  -2.7632   9.2574   7.4549   9.5049   80.878   36.234  107.283   41.202 -26.40462 54.86810 
1 1 1    4   40    6 o  276.901   17.841   59.980   7.5212   63.076   10.910   57.175   10.383  280.813   25.666  267.241   25.700 13.57208 36.32131 
1 1 1    4   40    7 o  246.633   19.370   47.831   7.2534   50.625   10.761   45.505   9.8196  249.957   28.643  237.330   27.544 12.62709 39.73758 
1 1 1    4   40    8 o  171.299   27.123   23.910   6.8747   24.169   9.7177   23.651   9.7268  167.629   38.663  165.652   39.007 1.976807 54.92187 
1 1 1    4   40    9 o  267.651   18.996   56.251   7.7314   46.644   11.029   65.533   10.841  238.611   30.926  286.445   24.976 -47.83418 39.75207 
1 1 1    4   40   10 o  100.351   35.614   7.5237   6.8613   7.8766   9.9107   7.1989   9.5086  109.364   42.056  106.279   41.104 3.084991 58.80637 
1 1 1    4   40   11 o  402.604   15.418  125.831   9.5014  121.880   13.783  129.409   13.116  392.202   23.061  405.224   21.220 -13.02179 31.33864 
1 1 1    4   40   12 o  538.172   14.141  224.376   11.649  207.525   16.341  241.784   16.609  513.976   20.772  555.611   19.530 -41.63513 28.51126 
1 1 1    4   40   13 o  176.963   28.505   25.709   7.4587   16.442   10.406   35.501   10.696  137.867   43.839  205.276   35.316 -67.40955 56.29431 
1 1 1    4   40   14 o  357.262   16.989   99.472   9.2904  110.868   13.667   89.683   12.667  373.127   24.059  334.986   24.882 38.14087 34.61152 
1 1 1    4   40   15 o  483.521   14.904  181.493   11.030  182.397   16.147  180.702   15.103  480.768   21.942  479.400   20.582 1.368256 30.08479 
1 1 1    4   40   16 f  300.365   19.550   71.071   8.9390   70.210   12.778   71.895   12.509  293.746   28.791  297.891   27.754 -4.145752 39.99007 
1 1 1    4   40   17 o  291.486   19.975   67.080   8.8581   72.573   13.116   62.474   12.011  298.271   29.100  276.764   28.774 21.50687 40.92375 
1 1 1    4   40   18 o  203.739   26.735   33.835   8.1360   38.333   11.866   29.844   11.177  210.907   38.161  184.133   40.738 26.77376 55.81955 
1 1 1    4   40   19 o  366.422   17.813  105.118   9.9903   99.198   13.905  111.433   14.362  350.649   26.095  372.262   25.357 -21.61346 36.38620 
1 1 1    4   40   20 o  144.859   37.284   18.363   8.3153   35.980   12.391   3.9303   11.216  201.468   41.562  101.434   42.625 100.0334 59.53442 
1 1 1    4   40   21 o   67.960   30.357  -1.7764   6.4474  -6.1954   7.6262   9.2968   12.072   65.443   30.604  116.298   45.920 -50.85511 55.18396 
1 1 1    4   40   22 o  554.165   14.875  239.255   12.617  225.972   16.660  257.125   19.323  534.449   20.365  568.344   22.212 -33.89551 30.13492 
1 1 1    4   40   23 o   78.244   34.420  -0.5598   7.9793  -5.8465   10.251   7.5697   12.711   78.281   36.222  112.696   46.185 -34.41531 58.69459 
1 1 1    4   40   24 o  224.111   22.342   40.487   7.5620   39.065   8.9219   44.112   14.250  217.402   27.422  219.511   43.944 -2.108261 51.79777 
1 1 1    4   40   25 o  182.181   27.379   27.629   7.3984   32.201   8.7681   16.329   13.786  195.245   30.323  134.836   50.091 60.40959 58.55420 
1 1 1    4   40   26 o   76.272   31.555   2.2329   6.0074   12.832   8.4258  -8.7251   8.5675  120.433   39.545   65.666   31.227 54.76660 50.38774 
1 1 1    4   40   27 o  300.852   17.451   71.601   8.0015   67.554   9.9276   79.104   13.517  289.029   22.621  307.725   29.042 -18.69656 36.81244 
1 1 1    4   40   28 o  176.226   27.303   26.084   7.1265   33.544   9.0640   14.004   11.533  197.945   30.928  125.002   45.929 72.94279 55.37138 
1 1 1    4   40   29 o  119.042   33.118   12.598   6.2545   10.092   9.0404   14.899   8.6621  109.690   40.600  126.884   39.959 -17.19382 56.96579 
1 1 1    4   40   30 o  174.447   24.303   25.318   6.3131   31.321   9.0081   19.522   8.8501  189.006   32.298  144.159   39.113 44.84695 50.72483 
1 1 1    4   40   31 o  239.406   17.869   45.900   6.5006   60.238   9.7849   34.571   8.6974  269.879   23.936  200.339   29.223 69.53922 37.77485 
1 1 1    4   40   32 o   70.461   30.324   0.9618   5.9137  -6.3940   8.6060   7.5426   8.1400   67.849   31.974   98.031   37.998 -30.18205 49.66061 
1 1 1    4   40   33 o   96.267   33.938   8.0056   6.2209   12.571   8.8441   3.5349   8.7520  115.079   40.477   87.648   37.282 27.43153 55.03027 
1 1 1    4   40   34 o   71.905   31.660   0.2633   6.7648   6.7930   8.5328 -10.7857   11.100   95.410   38.297   71.551   34.429 23.85947 51.49755 
1 1 1    4   41    0 o  502.806   14.145  195.109   10.867  195.109   10.867  195.109   10.867  502.806   14.145  502.806   14.145 0.000000 0.000000 
1 1 1    4   41    1 o  421.797   12.069  137.361   7.7919  142.053   9.8037  129.315   12.839  427.933   14.967  405.305   20.766 22.62805 25.59757 
1 1 1    4   41    2 o  379.599   12.610  111.344   7.3268  111.813   8.9642  110.398   12.716  379.497   15.432  373.575   22.342 5.921631 27.15343 
1 1 1    4   41    3 o  454.522   11.507  159.382   8.0054  158.934   9.8054  160.279   13.864  452.957   14.143  452.139   20.032 0.8179932 24.52186 
1 1 1    4   41    4 o   96.996   32.113   7.4348   5.5523   10.711   6.7146   0.3515   9.8736  113.507   35.090   89.772   38.906 23.73528 52.39268 
1 1 1    4   41    5 o  370.932   15.459  106.849   8.7770  107.198   12.803  106.539   12.056  367.752   22.858  367.324   21.537 0.4282837 31.40581 
1 1 1    4   41    6 o  258.292   20.165   52.636   7.9090   57.844   11.517   47.990   10.880  266.924   28.638  242.226   29.986 24.69890 41.46373 
1 1 1    4   41    7 o  457.371   14.379  162.163   10.066  171.385   14.864  154.350   13.682  466.955   20.796  443.496   20.155 23.45938 28.96057 
1 1 1    4   41    8 o  124.308   33.817   13.107   6.6054   16.216   9.9049   10.616   8.8643  136.853   42.669  115.678   40.532 21.17491 58.85206 
1 1 1    4   41    9 o  122.074   35.330   12.648   6.9790   22.974   10.404   4.2004   9.4104  161.505   41.772   97.133   39.764 64.37141 57.67271 
1 1 1    4   41   10 o  236.548   21.739   44.472   7.7829   35.058   11.061   53.703   10.953  202.781   37.000  256.979   28.317 -54.19743 46.59254 
1 1 1    4   41   11 o  216.623   24.564   37.760   8.0006   49.448   11.674   27.407   10.987  244.417   31.970  176.462   41.392 67.95406 52.30100 
1 1 1    4   41   12 o   90.768   35.591   4.7557   7.2052   8.3490   10.545   1.6094   9.8677  111.531   43.244   92.117   39.394 19.41340 58.49737 
1 1 1    4   41   13 o  554.695   14.130  238.717   11.996  246.395   17.250  231.525   16.695  559.641   20.137  542.514   20.105 17.12695 28.45572 
1 1 1    4   41   14 o  222.388   24.504   39.860   8.2025   42.371   12.053   37.693   11.195  222.898   36.599  210.298   36.077 12.60005 51.39101 
1 1 1    4   41   15 o  310.501   19.484   76.080   9.2133   71.735   13.288   80.102   12.785  295.633   29.771  314.487   26.817 -18.85382 40.06845 
1 1 1    4   41   16 o  105.059   38.430   8.3124   8.0617   8.8996   11.094   7.6554   11.735  113.595   44.268  111.831   44.903 1.763916 63.05519 
1 1 1    4   41   17 o  327.586   19.627   84.834   9.7958   92.563   14.140   77.702   13.583  337.073   27.651  307.601   29.200 29.47244 40.21437 
1 1 1    4   41   18 o  159.440   47.178   23.651   12.323   0.0000   0.0000   23.651   12.323  ?   ?   159.440   47.178 0.000000 47.17780 
1 1 1    4   41   19 o   96.192   41.996   1.0447   11.682   0.0000   0.0000   1.0447   11.682  ?   ?    96.192   41.996 0.000000 41.99643 
1 1 1    4   41   20 o  114.704   46.303   8.6220   12.550   0.0000   0.0000   8.6220   12.550  ?   ?   114.704   46.303 0.000000 46.30326 
1 1 1    4   41   21 f   67.554   32.210  -9.8918   9.2412  -6.7575   13.129 -12.9692   13.010   87.808   40.758   79.614   38.032 8.193375 55.74635 
1 1 1    4   41   22 o  152.569   33.202   20.218   7.5332   19.470   8.9725   22.004   13.868  146.739   39.203  150.899   50.768 -4.160614 64.14272 
1 1 1    4   41   23 f  142.784   34.300   17.937   7.4025   25.717   8.7749  -1.2659   13.786  171.487   34.623   97.574   43.924 73.91285 55.92942 
1 1 1    4   41   24 o  136.180   39.463   16.906   8.7024   16.906   8.7024   0.0000   0.0000  136.180   39.463  ?   ?  0.000000 39.46346 
1 1 1    4   41   25 o  151.453   38.926   21.001   9.0729   21.001   9.0729   0.0000   0.0000  151.453   38.926  ?   ?  0.000000 38.92572 
1 1 1    4   41   26 o   97.054   36.628   7.1278   7.4298   3.3725   9.0293   15.002   13.075   90.446   38.139  128.272   48.546 -37.82611 61.73608 
1 1 1    4   41   27 o  157.455   27.731   21.120   6.4392   16.146   9.4836   25.375   8.7710  130.653   41.882  168.083   35.220 -37.42920 54.72250 
1 1 1    4   41   28 o  202.501   20.776   33.352   6.3484   23.531   9.1562   42.443   8.8097  158.975   38.121  225.071   26.054 -66.09564 46.17416 
1 1 1    4   41   29 o  194.620   22.341   31.207   6.5345   37.076   9.6884   26.309   8.8507  205.348   31.856  169.989   35.176 35.35893 47.45714 
1 1 1    4   41   30 o  191.039   22.740   30.256   6.5187   42.454   9.8428   20.726   8.7001  220.987   29.864  147.568   38.215 73.41838 48.50003 
1 1 1    4   41   31 o  102.870   34.065   9.5293   6.2476   7.4300   9.4245   11.175   8.3446   99.481   40.136  110.011   39.250 -10.53039 56.13849 
1 1 1    4   41   32 f  232.951   21.672   44.791   7.6386   53.774   9.7155   30.249   12.362  251.949   25.546  169.396   46.337 82.55351 52.91261 
1 1 1    4   42    0 f  104.196   42.968   12.153   6.7917   12.153   6.7917   12.153   6.7917  104.196   42.968  104.196   42.968 0.000000 0.000000 
1 1 1    4   42    1 o  271.671   15.822   57.617   6.5508   51.686   8.0351   69.373   11.313  255.452   20.729  293.827   25.403 -38.37439 32.78740 
1 1 1    4   42    2 f  330.014   13.299   84.341   6.7175   82.707   8.3314   87.377   11.356  325.261   16.792  331.605   22.508 -6.343933 28.08143 
1 1 1    4   42    3 o  275.364   15.021   59.081   6.3071   61.436   7.7373   54.418   10.888  279.675   18.173  258.658   27.947 21.01691 33.33572 
1 1 1    4   42    4 o  114.744   31.597   11.111   5.7255   8.7942   6.8837   16.310   10.314  105.028   35.766  136.694   43.662 -31.66638 56.44109 
1 1 1    4   42    5 o  298.604   14.252   69.187   6.5141   65.988   7.8567   76.224   11.651  290.005   17.786  308.241   24.908 -18.23560 30.60628 
1 1 1    4   42    6 o   83.065   34.134   2.6694   6.9670   1.5397   10.085   3.7006   9.6359   92.665   39.732   96.218   39.899 -3.552406 56.30797 
1 1 1    4   42    7 o   88.748   35.202   4.2698   7.1241   2.9901   10.341   5.4258   9.8284   96.867   40.830  101.302   40.947 -4.434891 57.82474 
1 1 1    4   42    8 o  371.349   16.081  107.468   9.1406   99.292   13.072  115.292   12.787  352.113   24.404  381.080   22.015 -28.96725 32.86692 
1 1 1    4   42    9 f  341.339   17.427   91.335   9.0744   92.262   13.225   90.511   12.474  338.413   25.724  335.996   24.422 2.416321 35.47092 
1 1 1    4   42   10 o  343.855   17.595   92.763   9.2293   98.916   13.632   87.556   12.541  350.405   25.594  329.944   25.018 20.46130 35.79040 
1 1 1    4   42   11 o  494.752   15.029  190.497   11.381  194.538   16.379  186.726   15.826  495.610   21.592  485.790   21.283 9.820374 30.31818 
1 1 1    4   42   12 o  120.615   37.118   12.513   7.5228   6.6248   10.741   18.183   10.540  106.478   42.887  142.264   43.960 -35.78574 61.41509 
1 1 1    4   42   13 o  326.036   26.153   86.154   12.942   0.0000   0.0000   86.154   12.942  ?   ?   326.036   26.153 0.000000 26.15304 
1 1 1    4   42   14 o  353.182   26.427  101.269   14.183   0.0000   0.0000  101.269   14.183  ?   ?   353.182   26.427 0.000000 26.42715 
1 1 1    4   42   15 o  214.666   40.353   40.837   12.772   0.0000   0.0000   40.837   12.772  ?   ?   214.666   40.353 0.000000 40.35262 
1 1 1    4   42   16 o  202.050   40.573   36.460   12.112   0.0000   0.0000   36.460   12.112  ?   ?   202.050   40.573 0.000000 40.57291 
1 1 1    4   42   17 o  169.132   34.804   24.877   8.7095   31.021   12.209   18.513   12.428  183.285   44.064  141.449   48.058 41.83594 65.20135 
1 1 1    4   42   18 o  374.028   18.375  110.323   10.520  107.292   14.598  113.598   15.173  362.341   26.506  372.637   26.780 -10.29584 37.67952 
1 1 1    4   42   19 o  174.674   34.371   26.548   8.8622   17.317   12.244   36.705   12.844  137.022   47.657  199.701   43.270 -62.67825 64.36975 
1 1 1    4   42   20 o  462.550   17.035  168.270   12.061  167.809   16.884  168.750   17.234  455.059   24.328  455.849   24.793 -0.7903442 34.73563 
1 1 1    4   42   21 o  195.589   46.786   36.630   13.818   36.630   13.818   0.0000   0.0000  195.589   46.786  ?   ?  0.000000 46.78619 
1 1 1    4   42   22 o  267.060   36.857   62.869   14.664   62.869   14.664   0.0000   0.0000  267.060   36.857  ?   ?  0.000000 36.85678 
1 1 1    4   42   23 o  233.255   23.154   44.424   8.1575   46.627   9.7163   39.162   15.016  236.165   27.387  197.801   49.669 38.36360 56.71891 
1 1 1    4   42   24 o   80.501   34.470   1.6755   7.5724  -3.1239   9.0965   12.508   13.666   76.413   34.902  121.696   48.602 -45.28374 59.83511 
1 1 1    4   42   25 o  206.626   24.510   35.441   7.6005   36.561   9.5829   33.543   12.479  204.933   31.563  185.255   44.555 19.67833 54.60249 
1 1 1    4   42   26 o  380.993   15.118  114.351   8.8160  106.332   10.879  129.692   15.047  363.405   19.631  395.503   24.984 -32.09763 31.77369 
1 1 1    4   42   27 o  421.990   14.539  140.168   9.3909  144.116   11.690  132.986   15.768  424.788   17.980  398.473   25.995 26.31439 31.60722 
1 1 1    4   42   28 o  332.514   14.533   87.140   7.3967   97.388   11.154   79.096   9.8819  345.407   21.201  311.501   20.846 33.90598 29.73259 
1 1 1    4   42   29 o  241.064   22.121   47.974   8.0711   54.861   10.149   36.122   13.314  254.019   26.491  186.342   46.756 67.67636 53.73929 
1 1 1    4   43    0 o   74.094   41.317   6.2784   6.9740   6.2784   6.9740   6.2784   6.9740   74.094   41.317   74.094   41.317 0.000000 0.000000 
1 1 1    4   43    1 o  281.273   13.207   61.353   5.6861   51.309   7.7067   73.353   8.4239  254.383   19.953  305.302   18.107 -50.91832 26.94437 
1 1 1    4   43    2 o   60.110   27.394  -2.9002   5.5641 -11.3097   6.6187   17.364   10.274   52.068   25.408  139.395   43.457 -87.32701 50.33986 
1 1 1    4   43    4 f  428.638   12.427  142.290   8.1530  150.811   10.035  125.739   13.985  440.154   14.894  396.621   23.137 43.53296 27.51700 
1 1 1    4   43    5 o  360.672   16.390  101.642   9.0481  110.680   12.923   92.949   12.673  372.209   22.792  339.856   24.527 32.35223 33.48208 
1 1 1    4   43    6 o  281.790   26.476   64.592   11.286   0.0000   0.0000   64.592   11.286  ?   ?   281.790   26.476 0.000000 26.47598 
1 1 1    4   43    7 o  141.264   43.524   18.014   10.340   0.0000   0.0000   18.014   10.340  ?   ?   141.264   43.524 0.000000 43.52424 
1 1 1    4   43    8 o  220.747   35.625   41.835   11.627   0.0000   0.0000   41.835   11.627  ?   ?   220.747   35.625 0.000000 35.62513 
1 1 1    4   43    9 o  441.675   21.153  154.821   14.301   0.0000   0.0000  154.821   14.301  ?   ?   441.675   21.153 0.000000 21.15348 
1 1 1    4   43   10 o  418.516   22.534  140.139   14.382   0.0000   0.0000  140.139   14.382  ?   ?   418.516   22.534 0.000000 22.53436 
1 1 1    4   43   11 o   77.397   34.046  -0.5684   7.8064  -2.5214   11.086   1.3524   10.994   87.174   39.302   94.211   40.943 -7.036583 56.75354 
1 1 1    4   43   12 o  534.338   14.846  222.705   12.142  232.466   17.190  212.984   17.154  541.080   20.756  517.066   21.674 24.01416 30.00950 
1 1 1    4   43   13 o  311.229   19.221   76.821   9.1114   78.257   12.976   75.424   12.797  308.387   27.789  302.603   27.944 5.784393 39.40926 
1 1 1    4   43   14 f  397.154   16.840  123.817   10.237  110.586   14.332  137.597   14.627  368.644   25.558  413.492   23.205 -44.84802 34.52109 
1 1 1    4   43   15 o  157.809   35.798   21.981   8.4484   22.635   12.434   21.421   11.515  153.801   47.784  150.662   45.839 3.138794 66.21585 
1 1 1    4   43   16 o  330.327   19.976   86.948   10.053   70.681   14.110  103.716   14.326  288.495   32.521  355.672   26.505 -67.17688 41.95390 
1 1 1    4   43   17 o  281.328   23.114   64.099   9.8652   65.505   14.415   62.860   13.530  275.075   35.032  270.852   33.340 4.222595 48.36094 
1 1 1    4   43   18 o  141.836   49.001   19.397   12.934   19.397   12.934   0.0000   0.0000  141.836   49.001  ?   ?  0.000000 49.00149 
1 1 1    4   43   19 o  380.471   27.240  119.998   15.758  119.998   15.758   0.0000   0.0000  380.471   27.240  ?   ?  0.000000 27.23985 
1 1 1    4   43   20 o  263.294   26.748   57.727   10.630   57.467   14.803   58.004   15.274  251.155   39.837  251.013   41.184 0.1418762 57.29804 
1 1 1    4   43   21 o  137.879   40.648   17.968   9.1623   15.793   13.348   19.906   12.599  129.370   49.029  141.059   48.385 -11.68896 68.88380 
1 1 1    4   43   22 o  141.273   41.574   19.184   9.5923  -5.6470   13.453   44.865   13.681   87.788   40.918  217.216   42.671 -129.4288 59.11967 
1 1 1    4   43   23 o   70.343   32.794  -5.1932   8.6486   10.654   12.506 -19.7173   11.973  114.334   46.198   67.062   33.018 47.27148 56.78444 
1 1 1    4   43   24 o  339.391   16.537   91.368   8.5907   96.283   10.585   81.881   14.706  345.001   20.131  306.047   31.860 38.95398 37.68721 
1 1 1    4   43   25 o  189.769   27.230   30.799   7.6827   36.588   9.3381   18.673   13.515  204.223   30.833  133.625   49.606 70.59772 58.40752 
1 1 1    4   43   26 f  103.943   36.416   9.6664   7.1551   12.723   8.9757   4.3378   11.851  115.820   40.773   97.688   42.480 18.13215 58.88147 
1 1 1    4   44    0 o   53.248   35.312  -1.2820   7.6056  -1.2820   7.6056  -1.2820   7.6056   53.248   35.312   53.248   35.312 0.000000 0.000000 
1 1 1    4   44    1 o  130.599   27.214   14.329   5.2637   10.692   7.3064   18.254   7.5895  112.115   36.825  144.483   34.745 -32.36819 50.62874 
1 1 1    4   44    2 o  204.286   20.587   33.410   6.3496   37.647   7.8239   25.232   10.868  215.253   24.164  165.932   42.579 49.32069 48.95783 
1 1 1    4   44    3 f  311.731   14.949   75.822   7.1327   76.864   8.9813   74.041   11.737  311.560   18.923  301.579   25.671 9.981781 31.89175 
1 1 1    4   44    4 o  243.637   17.625   46.889   6.5281   47.124   7.8311   46.352   11.819  242.532   21.312  232.740   34.197 9.791626 40.29396 
1 1 1    4   44    5 o  101.915   32.780   8.6901   5.8057   9.7752   7.1541   6.5975   9.9354  108.090   36.464  103.164   41.355 4.926308 55.13464 
1 1 1    4   44    6 o  128.067   36.707   14.499   7.5664   21.110   10.687   7.8549   10.714  150.975   43.727  108.382   43.112 42.59249 61.40612 
1 1 1    4   44    7 o   99.996   36.186   7.7704   7.1198   5.2940   10.470   9.9010   9.7110  101.090   41.727  112.193   41.970 -11.10322 59.18270 
1 1 1    4   44    8 o  210.931   24.991   36.388   7.9115   30.974   11.216   41.750   11.162  185.042   40.705  220.376   34.198 -35.33379 53.16408 
1 1 1    4   44    9 o  225.271   23.411   41.165   7.9544   49.213   11.453   33.665   11.056  241.092   31.813  194.519   38.496 46.57381 49.93993 
1 1 1    4   44   10 o  452.621   15.162  160.175   10.504  156.703   14.736  163.762   14.977  442.767   21.744  452.746   21.612 -9.979004 30.65779 
1 1 1    4   44   11 o  317.748   18.973   80.192   9.1855   88.441   12.780   71.377   13.211  328.956   25.584  291.912   29.994 37.04410 39.42262 
1 1 1    4   44   12 o  417.074   16.392  136.640   10.464  142.586   14.492  130.162   15.126  420.708   22.587  399.835   24.839 20.87323 33.57295 
1 1 1    4   44   13 o  332.924   18.542   88.024   9.4113  102.304   13.278   73.608   13.341  354.171   24.648  295.947   29.860 58.22382 38.71840 
1 1 1    4   44   14 o  380.336   24.436  118.021   14.150  118.021   14.150   0.0000   0.0000  380.336   24.436  ?   ?  0.000000 24.43587 
1 1 1    4   44   15 o  148.462   46.524   21.562   11.758   21.562   11.758   0.0000   0.0000  148.462   46.524  ?   ?  0.000000 46.52380 
1 1 1    4   44   16 o  244.633   37.689   53.731   13.659   53.731   13.659   0.0000   0.0000  244.633   37.689  ?   ?  0.000000 37.68901 
1 1 1    4   44   17 o  137.812   39.947   17.848   8.9158   3.5284   12.353   33.421   12.882   99.838   43.393  184.525   45.819 -84.68755 63.10573 
1 1 1    4   44   18 o  188.499   32.792   31.266   9.1177   38.155   12.881   24.348   12.908  199.353   43.441  153.908   48.812 45.44502 65.34338 
1 1 1    4   44   19 o  161.919   36.363   24.023   8.7916   11.275   12.242   37.599   12.634  115.843   46.083  197.694   42.977 -81.85031 63.01305 
1 1 1    4   44   20 o   94.670   38.269   5.9314   8.5859   18.447   12.007  -7.1632   12.282  135.123   47.183   81.480   38.337 53.64346 60.79467 
1 1 1    4   44   21 o  267.091   23.936   59.136   9.6817   60.225   13.532   57.994   13.857  258.834   35.059  251.866   37.053 6.968811 51.01049 
1 1 1    4   44   22 o  161.322   38.278   24.635   9.3096   9.4116   12.754   41.995   13.620  110.573   45.882  205.631   44.559 -95.05818 63.95830 
1 1 1    4   44   23 o  257.861   25.055   55.791   9.7640   43.039   13.566   69.495   14.064  208.401   43.915  278.721   33.646 -70.32031 55.32315 
1 1 1    4   45    0 o   58.381   37.119   1.5471   7.2554   1.5471   7.2554   1.5471   7.2554   58.381   37.119   58.381   37.119 0.000000 0.000000 
1 1 1    4   45    1 o  155.812   23.474   19.956   5.4245   15.057   7.9207   24.283   7.4442  129.260   37.705  168.865   29.895 -39.60498 48.11807 
1 1 1    4   45    2 o  162.162   23.027   21.538   5.5550   23.233   7.9733   19.940   7.7437  163.309   33.033  150.273   34.408 13.03568 47.69740 
1 1 1    4   45    3 o  274.998   17.078   59.784   7.1529   63.885   8.7445   51.491   12.435  282.439   20.364  243.843   34.261 38.59584 39.85642 
1 1 1    4   45    4 o   84.389   32.886   4.5061   6.1223   4.7541   7.6641   4.0686   10.178   90.346   36.284   96.301   40.544 -5.955612 54.40922 
1 1 1    4   45    5 o  277.595   16.825   60.892   7.1149   63.550   8.9781   56.404   11.666  281.172   21.013  258.501   30.044 22.67065 36.66344 
1 1 1    4   45    6 o  188.947   24.060   29.340   6.8004   47.544   8.6771   0.3581   10.949  241.258   23.808   90.623   40.071 150.6348 46.60989 
1 1 1    4   45    7 o   99.618   37.321   7.6310   7.6845   9.6469   11.036   5.7335   10.707  112.091   44.018  101.391   42.052 10.69978 60.87618 
1 1 1    4   45    8 o  165.095   32.857   23.859   8.0109   24.084   11.096   23.614   11.578  158.417   44.125  155.858   45.620 2.558701 63.46771 
1 1 1    4   45    9 o  148.053   44.663   21.185   10.965   21.185   10.965   0.0000   0.0000  148.053   44.663  ?   ?  0.000000 44.66295 
1 1 1    4   45   10 o  242.817   33.069   51.208   11.971   51.208   11.971   0.0000   0.0000  242.817   33.069  ?   ?  0.000000 33.06942 
1 1 1    4   45   11 o  354.493   26.696  104.469   14.379  104.469   14.379   0.0000   0.0000  354.493   26.696  ?   ?  0.000000 26.69584 
1 1 1    4   45   12 o  198.441   29.231   33.628   8.6126   38.983   11.629   27.124   12.817  206.885   38.129  163.688   48.025 43.19643 61.32101 
1 1 1    4   45   13 o  227.658   25.463   43.145   8.7209   40.799   12.075   45.703   12.609  210.755   38.864  223.963   38.148 -13.20786 54.45834 
1 1 1    4   45   14 o  123.730   39.091   14.273   8.2847   22.240   11.735   6.3566   11.698  148.581   46.463  103.535   43.522 45.04620 63.66286 
1 1 1    4   45   15 o  194.934   29.008   32.626   8.3913   26.475   11.525   39.566   12.241  163.120   44.792  205.280   40.398 -42.15976 60.31897 
1 1 1    4   45   16 o   79.285   34.713   0.7249   8.0319   3.6997   11.175  -2.4536   11.552   95.966   41.491   85.833   39.253 10.13363 57.11683 
1 1 1    4   45   18 o  169.284   34.433   26.034   8.6183   15.294   12.023   37.383   12.360  124.961   46.709  196.168   42.400 -71.20701 63.08295 
1 1 1    4   46    0 o  104.447   53.374   14.456   10.778   14.456   10.778   14.456   10.778  104.447   53.374  104.447   53.374 0.000000 0.000000 
1 1 1    4   46    1 o  260.494   22.810   55.461   9.0033   53.063   12.870   57.759   12.600  244.394   35.439  257.673   32.681 -13.27873 48.20713 
1 1 1    4   46    2 o  127.656   33.736   14.651   6.6912   14.520   8.2755   14.899   11.371  125.125   39.001  125.951   45.707 -0.8266678 60.08500 
1 1 1    4   46    3 o   68.207   31.567  -4.3161   7.7904  -4.3161   7.7904   0.0000   0.0000   68.207   31.567  ?   ?  0.000000 31.56664 
1 1 1    4   46    4 o  159.062   34.547   22.732   8.1701   22.732   8.1701   0.0000   0.0000  159.062   34.547  ?   ?  0.000000 34.54668 
1 1 1    4   46    5 o   68.708   31.546  -3.4298   7.5630  -3.4298   7.5630   0.0000   0.0000   68.708   31.546  ?   ?  0.000000 31.54627 
1 1 1    4   46    6 o  273.666   17.758   59.741   7.3984   72.528   9.3004   37.703   12.209  299.744   20.393  200.038   41.247 99.70564 46.01230 
1 1 1    4   46    7 o  197.926   27.323   33.168   8.0568   30.691   11.899   35.265   10.948  177.192   44.060  196.083   37.850 -18.89075 58.08480 
1 1 1    4   46    8 o  335.756   18.199   90.074   9.3179   80.817   13.688   98.069   12.721  307.798   29.411  344.851   24.254 -37.05270 38.12156 
1 1 1    4   46    9 o  155.053   33.324   21.548   7.6733   28.941   11.340   15.303   10.422  172.312   43.103  126.189   43.964 46.12294 61.56915 
1 1 1    4   46   10 o   55.385   26.977 -11.1512   7.3645  -8.5787   11.040 -13.2139   9.8856   75.225   35.678   64.945   31.547 10.27991 47.62464 
1 1 1    4   46   11 o  148.819   35.040   20.262   7.8496   27.068   11.307   13.929   10.906  165.203   43.947  121.435   44.656 43.76850 62.65410 
1 1 1    4   46   12 o   85.601   35.278   3.9668   7.4683   10.372   10.788  -1.9266   10.349  110.883   43.528   82.449   37.491 28.43414 57.44789 
1 1 1    4   46   13 o  130.523   37.575   16.064   7.9128   23.896   10.831   7.1001   11.588  154.577   43.787  103.837   43.463 50.73978 61.69574 
1 1 1    5    0    2 o   19.008   12.420  -0.1166   0.8884  -0.1166   0.8884  -0.1166   0.8884   19.008   12.420   19.008   12.420 0.000000 0.000000 
1 1 1    5    0    3 o  447.878   6.3129  153.623   4.3258  153.623   4.3258  153.623   4.3258  447.878   6.3129  447.878   6.3129 0.000000 0.000000 
1 1 1    5    0    4 o   80.114   8.7586   5.0865   1.0414   5.0865   1.0414   5.0865   1.0414   80.114   8.7586   80.114   8.7586 0.000000 0.000000 
1 1 1    5    0    5 o  196.193   6.1664   29.548   1.8476   29.548   1.8476   29.548   1.8476  196.193   6.1664  196.193   6.1664 0.000000 0.000000 
1 1 1    5    0    6 o  314.547   4.2387   75.764   2.0399   75.764   2.0399   75.764   2.0399  314.547   4.2387  314.547   4.2387 0.000000 0.000000 
1 1 1    5    0    7 o  1139.84   7.7879  994.600   13.586  994.600   13.586  994.600   13.586  1139.84   7.7879  1139.84   7.7879 0.000000 0.000000 
1 1 1    5    0    8 o  1527.41   11.432  1786.30   26.723  1786.30   26.723  1786.30   26.723  1527.41   11.432  1527.41   11.432 0.000000 0.000000 
1 1 1    5    0    9 o  1153.73   7.8939  1019.00   13.939  1019.00   13.939  1019.00   13.939  1153.73   7.8939  1153.73   7.8939 0.000000 0.000000 
1 1 1    5    0   10 o  1218.43   8.2666  1136.51   15.415  1136.51   15.415  1136.51   15.415  1218.43   8.2666  1218.43   8.2666 0.000000 0.000000 
1 1 1    5    0   11 o  437.062   5.7297  146.280   3.8316  146.280   3.8316  146.280   3.8316  437.062   5.7297  437.062   5.7297 0.000000 0.000000 
1 1 1    5    0   12 o  1792.36   13.276  2460.19   36.418  2460.19   36.418  2460.19   36.418  1792.36   13.276  1792.36   13.276 0.000000 0.000000 
1 1 1    5    0   13 o  690.812   6.7209  365.375   7.1050  365.375   7.1050  365.375   7.1050  690.812   6.7209  690.812   6.7209 0.000000 0.000000 
1 1 1    5    0   14 o  149.196   8.2873   17.196   1.8792   17.196   1.8792   17.196   1.8792  149.196   8.2873  149.196   8.2873 0.000000 0.000000 
1 1 1    5    0   15 o  1014.24   7.3698  787.539   11.440  787.539   11.440  787.539   11.440  1014.24   7.3698  1014.24   7.3698 0.000000 0.000000 
1 1 1    5    0   16 o  774.376   6.3430  459.091   7.5171  459.091   7.5171  459.091   7.5171  774.376   6.3430  774.376   6.3430 0.000000 0.000000 
1 1 1    5    0   17 o  1004.38   8.5489  772.448   13.140  772.448   13.140  772.448   13.140  1004.38   8.5489  1004.38   8.5489 0.000000 0.000000 
1 1 1    5    0   18 o  372.611   5.6624  106.345   3.2278  106.345   3.2278  106.345   3.2278  372.611   5.6624  372.611   5.6624 0.000000 0.000000 
1 1 1    5    0   19 o  1186.83   8.3607  1078.53   15.186  1078.53   15.186  1078.53   15.186  1186.83   8.3607  1186.83   8.3607 0.000000 0.000000 
1 1 1    5    0   20 o  883.959   8.1136  598.345   10.976  598.345   10.976  598.345   10.976  883.959   8.1136  883.959   8.1136 0.000000 0.000000 
1 1 1    5    0   21 f  222.210   8.6236   37.973   2.9230   37.973   2.9230   37.973   2.9230  222.210   8.6236  222.210   8.6236 0.000000 0.000000 
1 1 1    5    0   22 o  138.980   13.070   15.181   2.7239   15.181   2.7239   15.181   2.7239  138.980   13.070  138.980   13.070 0.000000 0.000000 
1 1 1    5    0   23 o  229.923   7.8756   40.610   2.7643   40.610   2.7643   40.610   2.7643  229.923   7.8756  229.923   7.8756 0.000000 0.000000 
1 1 1    5    0   24 o  1760.40   13.363  2373.58   36.001  2373.58   36.001  2373.58   36.001  1760.40   13.363  1760.40   13.363 0.000000 0.000000 
1 1 1    5    0   25 o  1559.22   10.505  1861.50   25.068  1861.50   25.068  1861.50   25.068  1559.22   10.505  1559.22   10.505 0.000000 0.000000 
1 1 1    5    0   26 o  118.264   19.424   11.543   3.2310   11.543   3.2310   11.543   3.2310  118.264   19.424  118.264   19.424 0.000000 0.000000 
1 1 1    5    0   27 o  296.303   7.8867   67.345   3.5711   67.345   3.5711   67.345   3.5711  296.303   7.8867  296.303   7.8867 0.000000 0.000000 
1 1 1    5    0   28 o  1019.58   8.0047  795.855   12.490  795.855   12.490  795.855   12.490  1019.58   8.0047  1019.58   8.0047 0.000000 0.000000 
1 1 1    5    0   29 o  303.377   8.5752   70.620   3.9748   70.620   3.9748   70.620   3.9748  303.377   8.5752  303.377   8.5752 0.000000 0.000000 
1 1 1    5    0   30 o  493.641   8.6013  186.702   6.4945  186.702   6.4945  186.702   6.4945  493.641   8.6013  493.641   8.6013 0.000000 0.000000 
1 1 1    5    0   31 o  280.005   10.091   60.255   4.3122   60.255   4.3122   60.255   4.3122  280.005   10.091  280.005   10.091 0.000000 0.000000 
1 1 1    5    0   32 o  948.936   9.2930  689.544   13.495  689.544   13.495  689.544   13.495  948.936   9.2930  948.936   9.2930 0.000000 0.000000 
1 1 1    5    0   33 o   86.678   39.575   8.3956   5.7108   8.3956   5.7108   8.3956   5.7108   86.678   39.575   86.678   39.575 0.000000 0.000000 
1 1 1    5    0   34 o  360.611   9.7928   99.778   5.3962   99.778   5.3962   99.778   5.3962  360.611   9.7928  360.611   9.7928 0.000000 0.000000 
1 1 1    5    0   35 o  259.664   12.804   52.012   5.0605   52.012   5.0605   52.012   5.0605  259.664   12.804  259.664   12.804 0.000000 0.000000 
1 1 1    5    0   36 o  603.198   9.7706  278.798   9.0156  278.798   9.0156  278.798   9.0156  603.198   9.7706  603.198   9.7706 0.000000 0.000000 
1 1 1    5    0   37 o  775.563   9.4916  460.750   11.264  460.750   11.264  460.750   11.264  775.563   9.4916  775.563   9.4916 0.000000 0.000000 
1 1 1    5    0   38 o  1300.66   11.443  1295.94   22.778  1295.94   22.778  1295.94   22.778  1300.66   11.443  1300.66   11.443 0.000000 0.000000 
1 1 1    5    0   39 o   57.482   34.142   2.7773   5.2361   2.7773   5.2361   2.7773   5.2361   57.482   34.142   57.482   34.142 0.000000 0.000000 
1 1 1    5    0   40 o  421.065   10.187  136.031   6.5566  136.031   6.5566  136.031   6.5566  421.065   10.187  421.065   10.187 0.000000 0.000000 
1 1 1    5    0   41 o  415.363   10.477  132.416   6.6515  132.416   6.6515  132.416   6.6515  415.363   10.477  415.363   10.477 0.000000 0.000000 
1 1 1    5    0   42 o  449.692   11.296  155.257   7.7643  155.257   7.7643  155.257   7.7643  449.692   11.296  449.692   11.296 0.000000 0.000000 
1 1 1    5    0   43 o  750.208   8.5996  431.270   9.8719  431.270   9.8719  431.270   9.8719  750.208   8.5996  750.208   8.5996 0.000000 0.000000 
1 1 1    5    0   44 o  180.810   19.798   26.031   5.3120   26.031   5.3120   26.031   5.3120  180.810   19.798  180.810   19.798 0.000000 0.000000 
1 1 1    5    0   45 o  568.875   10.252  248.305   8.9202  248.305   8.9202  248.305   8.9202  568.875   10.252  568.875   10.252 0.000000 0.000000 
1 1 1    5    0   46 o  158.496   21.617   20.408   4.9681   20.408   4.9681   20.408   4.9681  158.496   21.617  158.496   21.617 0.000000 0.000000 
1 1 1    5    0   47 o  386.317   10.372  114.695   6.1228  114.695   6.1228  114.695   6.1228  386.317   10.372  386.317   10.372 0.000000 0.000000 
1 1 1    5    0   48 o   87.593   37.970   8.5847   5.2567   8.5847   5.2567   8.5847   5.2567   87.593   37.970   87.593   37.970 0.000000 0.000000 
1 1 1    5    0   49 o  182.993   18.760   26.632   5.1282   26.632   5.1282   26.632   5.1282  182.993   18.760  182.993   18.760 0.000000 0.000000 
1 1 1    5    0   50 o  320.170   14.564   79.378   7.1037   79.378   7.1037   79.378   7.1037  320.170   14.564  320.170   14.564 0.000000 0.000000 
1 1 1    5    0   51 o  394.653   10.836  119.886   6.5343  119.886   6.5343  119.886   6.5343  394.653   10.836  394.653   10.836 0.000000 0.000000 
1 1 1    5    0   52 o  308.329   12.955   73.538   6.0892   73.538   6.0892   73.538   6.0892  308.329   12.955  308.329   12.955 0.000000 0.000000 
1 1 1    5    0   53 o  190.658   23.723   29.592   6.6339   29.592   6.6339   29.592   6.6339  190.658   23.723  190.658   23.723 0.000000 0.000000 
1 1 1    5    0   54 o  422.439   11.088  137.494   7.1582  137.494   7.1582  137.494   7.1582  422.439   11.088  422.439   11.088 0.000000 0.000000 
1 1 1    5    0   55 o  163.408   24.291   22.180   5.6805   22.180   5.6805   22.180   5.6805  163.408   24.291  163.408   24.291 0.000000 0.000000 
1 1 1    5    0   56 o   73.324   39.861   6.3551   6.3121   6.3551   6.3121   6.3551   6.3121   73.324   39.861   73.324   39.861 0.000000 0.000000 
1 1 1    5    0   57 o   52.615   33.233   1.3230   5.7100   1.3230   5.7100   1.3230   5.7100   52.615   33.233   52.615   33.233 0.000000 0.000000 
1 1 1    5    0   58 o   50.361   32.709   0.1429   6.0325   0.1429   6.0325   0.1429   6.0325   50.361   32.709   50.361   32.709 0.000000 0.000000 
1 1 1    5    0   59 f  216.566   21.297   37.813   6.9028   37.813   6.9028   37.813   6.9028  216.566   21.297  216.566   21.297 0.000000 0.000000 
1 1 1    5    0   60 o  107.394   37.985   12.279   5.6777   12.279   5.6777   12.279   5.6777  107.394   37.985  107.394   37.985 0.000000 0.000000 
1 1 1    5    0   61 o  263.504   14.922   54.485   5.9742   54.485   5.9742   54.485   5.9742  263.504   14.922  263.504   14.922 0.000000 0.000000 
1 1 1    5    0   62 o   28.469   20.645  -9.4978   4.8985  -9.4978   4.8985  -9.4978   4.8985   28.469   20.645   28.469   20.645 0.000000 0.000000 
1 1 1    5    0   63 o   66.682   35.797   5.5744   5.0313   5.5744   5.0313   5.5744   5.0313   66.682   35.797   66.682   35.797 0.000000 0.000000 
1 1 1    5    0   64 o   59.901   35.606   4.0378   5.7023   4.0378   5.7023   4.0378   5.7023   59.901   35.606   59.901   35.606 0.000000 0.000000 
1 1 1    5    0   65 o  113.866   33.048   13.076   4.9989   13.076   4.9989   13.076   4.9989  113.866   33.048  113.866   33.048 0.000000 0.000000 
1 1 1    5    1    0 o  629.547   10.036  303.618   9.6654  303.618   9.6654  303.618   9.6654  629.547   10.036  629.547   10.036 0.000000 0.000000 
1 1 1    5    1    1 o  357.228   8.0173   97.692   4.3837   97.692   4.3837   0.0000   0.0000  357.228   8.0173  ?   ?  0.000000 8.017297 
1 1 1    5    1    2 o  807.538   8.3847  499.236   10.364  507.567   14.876  491.379   14.447  814.112   11.938  801.032   11.783 13.08081 16.77348 
1 1 1    5    1    3 o  1345.65   10.175  1386.48   20.958  1387.50   25.678  1384.44   36.272  1345.99   12.464  1344.03   17.632 1.962158 21.59228 
1 1 1    5    1    4 o  1136.55   6.8793  988.812   11.967  1028.98   19.746  965.493   15.046  1159.20   11.129  1122.99   8.7532 36.20618 14.15863 
1 1 1    5    1    5 o  1280.98   6.9376  1256.08   13.602  1276.11   19.599  1237.46   18.894  1291.00   9.9181  1271.31   9.7098 19.68726 13.87979 
1 1 1    5    1    6 o  1240.79   5.8526  1178.44   11.115  1170.30   15.603  1186.83   15.838  1236.40   8.2448  1245.10   8.3104 -8.698120 11.70641 
1 1 1    5    1    7 o  595.460   4.1892  271.381   3.8182  271.235   4.6801  271.672   6.6025  595.288   5.1364  595.731   7.2408 -0.4431763 8.877625 
1 1 1    5    1    8 o  646.534   4.0710  319.931   4.0286  319.149   6.1210  320.529   5.3510  645.711   6.1932  647.119   5.4023 -1.407898 8.218328 
1 1 1    5    1    9 o  826.197   4.4095  522.452   5.5762  510.201   7.7085  535.901   8.0763  816.417   6.1686  836.723   6.3061 -20.30676 8.821524 
1 1 1    5    1   10 o  704.750   4.0573  380.141   4.3766  387.160   6.2872  373.543   6.0961  711.197   5.7757  698.580   5.7012 12.61743 8.115510 
1 1 1    5    1   11 o  1076.04   5.7062  886.274   9.3983  878.273   12.302  897.489   14.565  1071.11   7.5037  1082.70   8.7888 -11.59558 11.55634 
1 1 1    5    1   12 o  1783.12   8.6486  2434.31   23.605  2451.67   36.414  2421.74   31.000  1788.97   13.298  1778.24   11.389 10.72656 17.50889 
1 1 1    5    1   13 o  325.806   3.8232   81.244   1.9066   82.099   2.9752   80.649   2.4836  327.494   5.9354  324.600   4.9987 2.894196 7.759884 
1 1 1    5    1   14 o  925.000   5.2182  654.935   7.3881  639.980   9.5647  677.058   11.633  914.321   6.8344  940.380   8.0822 -26.05804 10.58448 
1 1 1    5    1   15 o  240.653   4.1024   44.327   1.5111   42.725   2.1533   45.883   2.1212  236.247   5.9547  244.825   5.6604 -8.577209 8.215809 
1 1 1    5    1   16 o  404.108   3.7998  124.993   2.3503  124.404   3.3263  125.579   3.3214  403.133   5.3907  405.033   5.3576 -1.900330 7.600215 
1 1 1    5    1   17 o  453.988   4.1395  157.760   2.8765  162.666   4.4563  154.255   3.7662  460.947   6.3162  448.892   5.4814 12.05463 8.363015 
1 1 1    5    1   18 o  131.765   7.1599   13.333   1.4386   13.475   1.8841   13.134   2.2278  132.307   9.3642  130.442   11.269 1.865311 14.65170 
1 1 1    5    1   19 o  531.160   4.3778  215.960   3.5592  219.939   4.7608  210.917   5.3591  535.992   5.8030  524.857   6.6709 11.13538 8.841690 
1 1 1    5    1   20 f  298.293   5.5834   68.117   2.5492   70.211   3.3071   65.050   4.0017  302.815   7.1351  291.431   8.9710 11.38400 11.46245 
1 1 1    5    1   21 o  784.962   5.0214  471.671   6.0332  480.061   9.3473  465.680   7.8988  791.786   7.7127  779.893   6.6169 11.89264 10.16220 
1 1 1    5    1   22 o  1011.67   5.7839  783.510   8.9564  778.740   13.624  787.140   11.886  1008.40   8.8268  1013.91   7.6588 -5.507751 11.68625 
1 1 1    5    1   23 f  619.206   4.7550  293.485   4.5067  293.949   6.9331  293.145   5.9306  619.622   7.3102  618.808   6.2614 0.8144531 9.625175 
1 1 1    5    1   24 o  374.434   5.2902  107.318   3.0319  106.162   4.3094  108.451   4.2664  372.375   7.5608  376.370   7.4060 -3.995117 10.58365 
1 1 1    5    1   25 o  1569.12   7.9726  1885.05   19.148  1871.70   29.026  1895.34   25.478  1563.15   12.132  1573.17   10.581 -10.01428 16.09765 
1 1 1    5    1   26 o  1592.79   8.7317  1942.41   21.288  1959.59   30.409  1925.91   29.810  1599.46   12.421  1585.67   12.282 13.78979 17.46828 
1 1 1    5    1   27 f  855.017   5.1603  559.566   6.7534  565.740   9.6351  553.603   9.4685  859.660   7.3225  850.390   7.2744 9.269897 10.32160 
1 1 1    5    1   28 o  1235.70   6.3484  1168.85   12.007  1151.44   16.702  1187.48   17.274  1226.34   8.8979  1245.37   9.0622 -19.03552 12.70031 
1 1 1    5    1   29 o  1030.28   5.7650  812.512   9.0913  799.460   12.706  826.203   13.013  1021.88   8.1236  1038.83   8.1841 -16.94830 11.53136 
1 1 1    5    1   30 o  561.488   6.4441  241.337   5.5383  233.738   8.5616  246.805   7.2624  552.482   10.124  567.768   8.3568 -15.28607 13.12779 
1 1 1    5    1   31 o  1604.07   8.2892  1970.01   20.352  1977.93   31.244  1964.18   26.823  1606.83   12.704  1601.45   10.943 5.388062 16.76686 
1 1 1    5    1   32 o  859.316   5.5805  565.242   7.3400  565.579   10.421  564.911   10.341  859.482   7.9212  858.977   7.8649 0.5053711 11.16251 
1 1 1    5    1   33 o  234.823   11.275   42.239   4.0526   40.833   5.3817   44.081   6.1591  230.282   15.356  239.156   16.935 -8.874435 22.86049 
1 1 1    5    1   34 o  863.377   6.1253  570.646   8.0946  569.225   10.747  572.509   12.306  862.206   8.1433  864.622   9.2986 -2.416321 12.36033 
1 1 1    5    1   35 o  565.051   5.9578  244.424   5.1528  254.104   7.3176  234.905   7.2570  576.050   8.2993  553.850   8.5604 22.19983 11.92304 
1 1 1    5    1   36 o  405.863   7.3381  126.128   4.5586  130.949   6.2543  120.664   6.6583  413.464   9.8826  396.854   10.961 16.61026 14.75861 
1 1 1    5    1   37 o  438.805   7.3097  147.440   4.9095  146.534   7.3755  148.161   6.5788  437.306   11.019  439.784   9.7733 -2.478455 14.72857 
1 1 1    5    1   38 o  119.583   24.539   11.417   4.3410   14.668   6.4591   8.7401   5.8625  135.006   31.784  106.297   32.776 28.70975 45.65589 
1 1 1    5    1   39 o  373.525   7.6899  106.859   4.3965  111.235   6.3551  102.841   6.0887  380.951   10.899  366.297   10.860 14.65390 15.38580 
1 1 1    5    1   40 o  443.417   7.0744  150.589   4.8015  157.718   6.8319  143.630   6.7495  453.633   9.8393  432.876   10.187 20.75751 14.16273 
1 1 1    5    1   41 o  491.251   6.6783  184.837   5.0216  183.103   7.0337  186.639   7.1714  488.754   9.4021  493.443   9.4951 -4.688873 13.36247 
1 1 1    5    1   42 o  603.209   7.1933  278.762   6.6415  279.105   9.2872  278.402   9.5015  603.277   10.058  602.486   10.303 0.7907715 14.39838 
1 1 1    5    1   43 o  308.026   8.6928   72.742   4.0984   65.403   5.7841   80.142   5.8081  291.761   12.952  323.079   11.745 -31.31833 17.48429 
1 1 1    5    1   44 o  127.909   19.143   12.915   3.6327   13.558   5.1538   12.280   5.1212  129.555   26.871  123.037   27.843 6.517570 38.69498 
1 1 1    5    1   45 o  180.178   15.380   25.202   4.2010   22.401   5.8604   28.162   6.0254  168.166   23.402  189.422   21.143 -21.25601 31.53828 
1 1 1    5    1   46 o  500.885   6.6207  192.292   5.0759  195.143   7.2112  189.492   7.1461  504.214   9.3437  496.851   9.3967 7.362915 13.25155 
1 1 1    5    1   47 o  166.015   14.283   21.410   3.5940   21.793   5.1927   21.058   4.9794  166.134   20.882  163.394   20.351 2.739975 29.15848 
1 1 1    5    1   48 o  166.408   15.523   21.590   3.9082   23.578   5.5104   19.579   5.5439  172.631   21.306  156.385   23.921 16.24617 32.03389 
1 1 1    5    1   49 o  173.501   13.899   23.396   3.6602   21.902   5.2011   24.861   5.1518  166.218   20.906  177.684   19.251 -11.46626 28.41900 
1 1 1    5    1   50 o  575.088   7.7582  253.925   6.8291  262.979   9.8161  245.431   9.5069  584.312   10.975  564.471   11.003 19.84064 15.54146 
1 1 1    5    1   51 o  390.446   7.7564  117.092   4.6354  120.318   6.5536  113.862   6.5573  395.112   10.837  384.286   11.148 10.82623 15.54704 
1 1 1    5    1   52 o  301.538   9.3043   69.981   4.2943   74.911   6.0214   64.879   6.1262  311.234   12.640  289.350   13.832 21.88409 18.73765 
1 1 1    5    1   53 o  239.427   11.799   44.301   4.3239   32.447   6.5423   53.495   5.7616  201.615   21.533  262.096   14.417 -60.48166 25.91404 
1 1 1    5    1   54 o  133.467   20.937   14.390   4.1365   16.661   5.4857   11.396   6.2978  141.935   26.216  115.553   33.596 26.38167 42.61475 
1 1 1    5    1   55 o  106.141   24.066   9.3608   3.8197   15.275   5.5240   3.9415   5.2876  134.960   27.670   79.905   30.721 55.05437 41.34481 
1 1 1    5    1   56 o   92.878   28.053   7.1821   4.3241   9.7039   6.0342   4.5205   6.1994  106.797   33.306   85.279   33.131 21.51762 46.97791 
1 1 1    5    1   57 o  219.596   12.886   37.616   4.3123   35.475   6.1961   39.628   6.0054  210.713   19.430  223.578   17.693 -12.86507 26.27887 
1 1 1    5    1   58 o   78.497   27.569   4.6961   4.1022   1.7767   5.8670   7.4885   5.7379   73.891   30.928   95.524   32.654 -21.63277 44.97532 
1 1 1    5    1   59 o  206.998   14.660   33.753   4.6147   28.559   6.2665   39.907   6.8210  186.813   22.360  222.401   20.260 -35.58829 30.17290 
1 1 1    5    1   60 o   65.829   26.872   1.9109   4.2823  -9.3285   6.3273   11.411   5.8171   52.078   25.283  112.952   32.122 -60.87433 40.87856 
1 1 1    5    1   61 o   61.525   24.984   1.7424   3.6773   6.9109   5.2918  -3.0842   5.1138   90.417   31.338   55.420   25.623 34.99676 40.47926 
1 1 1    5    1   62 o  202.342   12.620   32.237   3.8890   27.369   5.4991   37.107   5.5007  182.539   20.010  214.848   16.862 -32.30873 26.16756 
1 1 1    5    1   63 o  174.118   15.784   24.401   4.1609   24.462   6.7391   24.364   5.2895  166.660   27.368  171.119   20.610 -4.458878 34.26055 
1 1 1    5    1   64 o   50.026   22.956  -1.8981   3.9976  -3.7543   5.6419  -0.0264   5.6653   55.842   26.181   64.466   28.649 -8.623974 38.80968 
1 1 1    5    1   65 o   79.805   25.178   5.6948   3.4378   7.2266   4.8607   4.1616   4.8630   88.056   30.054   74.266   29.202 13.79047 41.90469 
1 1 1    5    2    0 o  376.262   8.1173  108.516   4.6700  108.516   4.6700  108.516   4.6700  376.262   8.1173  376.262   8.1173 0.000000 0.000000 
1 1 1    5    2    1 o  456.613   8.7319  159.620   6.1028  159.620   6.1028   0.0000   0.0000  456.613   8.7319  ?   ?  0.000000 8.731902 
1 1 1    5    2    2 o  388.886   5.9725  115.759   3.5551  116.327   5.0422  115.198   5.0132  389.807   8.4509  387.910   8.4433 1.896759 11.94595 
1 1 1    5    2    3 o  514.179   5.4187  202.361   4.2646  200.955   5.1952  205.267   7.4676  512.373   6.6243  517.786   9.4223 -5.413696 11.51791 
1 1 1    5    2    4 o  964.286   6.7846  711.777   10.014  727.557   14.489  697.347   13.855  974.809   9.7110  954.366   9.4849 20.44336 13.57449 
1 1 1    5    2    5 o  458.541   5.3086  160.936   3.7259   0.0000   0.0000  160.936   3.7259  ?   ?   458.541   5.3086 0.000000 5.308568 
1 1 1    5    2    6 o  832.945   5.0075  531.034   6.3842  530.234   9.0275  531.834   9.0298  832.269   7.0865  833.524   7.0777 -1.254639 10.01561 
1 1 1    5    2    7 o  467.746   3.8144  167.451   2.7309  161.037   3.8044  174.269   3.9223  458.684   5.4188  477.157   5.3705 -18.47266 7.629277 
1 1 1    5    2    8 o  1163.70   5.9733  1036.55   10.640  1017.00   15.886  1052.46   14.328  1152.55   9.0051  1172.52   7.9834 -19.96973 12.03438 
1 1 1    5    2    9 f  1389.94   6.4830  1478.83   13.792  1485.18   19.610  1472.62   19.402  1392.78   9.1987  1386.88   9.1400 5.894165 12.96748 
1 1 1    5    2   10 o  1324.17   6.6797  1342.21   13.538  1347.35   17.975  1335.46   20.582  1326.59   8.8522  1320.64   10.182 5.949219 13.49193 
1 1 1    5    2   11 o  1162.40   5.6521  1034.25   10.056  1043.48   14.348  1025.33   14.098  1167.48   8.0295  1157.29   7.9589 10.19666 11.30559 
1 1 1    5    2   12 o  1308.75   6.6606  1311.17   13.343  1314.88   20.481  1308.44   17.587  1310.38   10.211  1307.27   8.7892 3.115723 13.47302 
1 1 1    5    2   13 o  1433.58   7.1887  1573.32   15.774  1597.76   24.486  1555.98   20.624  1444.37   11.075  1425.50   9.4523 18.86853 14.56064 
1 1 1    5    2   14 o  668.528   4.3751  342.084   4.4769  339.739   5.9104  345.241   6.8574  666.201   5.7961  671.550   6.6713 -5.349121 8.837485 
1 1 1    5    2   15 o  204.054   4.3782   31.871   1.3674   32.038   1.9696   31.715   1.9000  204.575   6.2901  203.541   6.0986 1.034409 8.761136 
1 1 1    5    2   16 f  443.741   4.0586  150.714   2.7566  151.059   4.2203  150.458   3.6405  444.208   6.2071  443.342   5.3648 0.8664551 8.204231 
1 1 1    5    2   17 o  358.495   4.4992   98.375   2.4688  101.582   3.5009   95.202   3.4820  364.260   6.2790  352.633   6.4512 11.62741 9.002472 
1 1 1    5    2   18 o  982.146   5.5576  738.446   8.3547  747.180   11.175  727.378   12.580  987.827   7.3911  974.573   8.4330 13.25409 11.21358 
1 1 1    5    2   19 o  577.276   4.1763  255.083   3.6901  252.826   5.1886  257.392   5.2492  574.667   5.8988  579.833   5.9145 -5.165588 8.353274 
1 1 1    5    2   20 o  629.032   4.9557  302.892   4.7714  301.291   6.7275  304.512   6.7683  627.293   7.0067  630.638   7.0118 -3.344543 9.912618 
1 1 1    5    2   21 o  278.302   4.7397   59.288   2.0190   58.962   2.8719   59.606   2.8390  277.507   6.7612  279.021   6.6474 -1.514313 9.481682 
1 1 1    5    2   22 o  1039.07   5.5036  826.494   8.7531  818.108   12.283  835.147   12.477  1033.65   7.7634  1044.36   7.8053 -10.70581 11.00881 
1 1 1    5    2   23 o  438.300   4.4029  147.044   2.9538  145.543   4.2011  148.512   4.1540  436.024   6.2948  440.451   6.1616 -4.427399 8.808556 
1 1 1    5    2   24 o  1150.71   6.8395  1013.70   12.047  1008.13   16.996  1019.33   17.077  1147.36   9.6777  1153.72   9.6705 -6.353516 13.68124 
1 1 1    5    2   25 o  392.665   5.3318  118.021   3.2046  126.393   5.7335  114.217   3.8645  406.284   9.2198  386.269   6.5364 20.01474 11.30172 
1 1 1    5    2   26 o  650.870   6.0082  324.277   5.9856  316.610   7.6885  336.073   9.5367  643.085   7.8110  662.506   9.4046 -19.42065 12.22528 
1 1 1    5    2   27 f  443.208   4.8250  150.352   3.2732  149.628   4.6387  151.070   4.6195  442.112   6.8547  444.239   6.7937 -2.126343 9.650974 
1 1 1    5    2   28 o  1035.17   6.1219  820.249   9.6998  820.298   14.853  820.212   12.808  1035.06   9.3754  1035.07   8.0843 -0.6958008E-02 12.37959 
1 1 1    5    2   29 o  867.236   6.1410  575.709   8.1516  583.416   14.236  571.949   9.9429  872.843   10.656  864.356   7.5154 8.487427 13.03962 
1 1 1    5    2   30 o  1372.91   7.9934  1443.05   16.798  1428.75   23.557  1457.85   23.959  1365.84   11.268  1379.67   11.345 -13.83240 15.99018 
1 1 1    5    2   31 o  1417.16   7.0718  1537.48   15.340  1536.27   21.686  1538.70   21.702  1416.38   10.003  1417.50   10.002 -1.121948 14.14586 
1 1 1    5    2   32 o  132.282   14.192   13.563   2.8286   15.265   4.0423   11.931   3.9594  139.727   19.426  122.840   21.859 16.88682 29.24390 
1 1 1    5    2   33 o  866.649   6.5129  574.988   8.6395  563.978   12.028  586.722   12.417  858.184   9.1570  875.311   9.2681 -17.12659 13.02875 
1 1 1    5    2   34 o  1139.78   6.3628  994.526   11.100  992.001   15.633  997.093   15.765  1138.15   8.9735  1141.07   9.0264 -2.912964 12.72789 
1 1 1    5    2   35 o  810.923   6.1228  503.427   7.5998  506.615   10.241  499.519   11.338  813.383   8.2255  807.611   9.1723 5.772461 12.32034 
1 1 1    5    2   36 o  757.649   6.1640  439.468   7.1483  431.155   9.5032  450.302   10.848  750.343   8.2744  766.763   9.2433 -16.41998 12.40586 
1 1 1    5    2   37 o  769.429   6.3281  453.266   7.4527  451.515   11.387  454.578   9.8573  767.732   9.6899  770.426   8.3590 -2.693481 12.79719 
1 1 1    5    2   38 o   71.586   27.821   2.4622   4.3725   0.7265   6.3913   3.9893   5.9949   76.846   32.229   86.013   32.796 -9.166458 45.98118 
1 1 1    5    2   39 o  106.749   23.105   9.1180   3.6658   9.6251   5.2977   8.6521   5.0776  109.845   30.451  104.546   30.101 5.299858 42.81713 
1 1 1    5    2   40 f  283.244   9.4414   61.482   4.0932   64.241   5.8316   58.803   5.7467  289.344   13.168  276.805   13.564 12.53943 18.90386 
1 1 1    5    2   41 o  488.254   6.6768  182.589   4.9898  180.374   7.0240  184.846   7.0897  485.089   9.4601  491.069   9.4323 -5.979309 13.35894 
1 1 1    5    2   42 o  713.283   7.0586  389.770   7.7064  384.451   10.669  395.573   11.144  708.057   9.8442  718.183   10.137 -10.12628 14.13048 
1 1 1    5    2   43 o  236.814   10.529   43.032   3.8166   48.746   5.4369   37.481   5.3590  251.383   14.188  220.064   16.020 31.31966 21.39947 
1 1 1    5    2   44 o  198.819   12.120   30.484   3.6708   34.087   5.1742   26.832   5.2086  209.681   16.249  185.477   18.597 24.20435 24.69593 
1 1 1    5    2   45 f  435.408   7.9411  145.367   5.2923  157.100   7.5475  134.018   7.4231  452.254   10.903  417.609   11.613 34.64514 15.92921 
1 1 1    5    2   46 o  218.138   11.089   36.663   3.6903   35.089   5.2979   38.147   5.1432  212.531   16.413  221.870   15.237 -9.339874 22.39569 
1 1 1    5    2   47 o  106.989   21.237   9.2118   3.3551   2.8417   4.7955   15.319   4.6956   74.681   29.104  138.355   22.979 -63.67314 37.08241 
1 1 1    5    2   48 o   57.628   24.069   0.5953   3.5427  -2.2543   4.8133   3.9640   5.2333   57.462   25.903   81.251   30.722 -23.78880 40.18448 
1 1 1    5    2   49 o  355.208   8.3628   96.887   4.5468   93.671   6.9660   99.274   6.0015  348.421   13.062  359.133   10.918 -10.71130 17.02387 
1 1 1    5    2   50 o  101.770   27.540   8.5276   4.3945   9.2111   6.6136   7.9873   5.8803  107.250   35.026  100.547   33.037 6.702362 48.14823 
1 1 1    5    2   51 o  414.477   7.4432  131.914   4.7220  127.724   6.7369  135.960   6.6206  407.089   10.812  420.146   10.295 -13.05695 14.92926 
1 1 1    5    2   52 o   68.732   25.674   2.9741   3.6314   5.5604   5.0653   0.2390   5.2090   86.824   30.623   66.740   28.584 20.08350 41.89024 
1 1 1    5    2   53 o   60.512   25.064   0.9948   3.7963  -1.8188   5.5658   3.4425   5.1913   62.925   28.150   77.928   30.306 -15.00313 41.36231 
1 1 1    5    2   54 o  138.433   20.879   15.455   4.2865   22.847   5.6632   5.5391   6.5591  168.222   22.563   90.877   34.387 77.34483 41.12822 
1 1 1    5    2   55 o   68.817   26.139   2.9044   3.7991   6.8707   5.3241  -1.2105   5.4229   92.918   31.456   63.341   28.095 29.57663 42.17536 
1 1 1    5    2   56 o  319.922   10.373   79.084   5.0795   78.781   7.0829   79.405   7.2885  317.841   14.559  318.945   14.930 -1.104126 20.85336 
1 1 1    5    2   57 o  149.643   17.759   17.881   3.9882   16.844   5.6594   18.903   5.6211  141.472   27.122  150.931   25.222 -9.459183 37.03727 
1 1 1    5    2   58 o   85.503   26.948   6.0344   3.9389   13.618   5.7246  -0.7831   5.4280  125.321   30.200   63.978   28.255 61.34264 41.35684 
1 1 1    5    2   59 o  283.436   11.218   62.371   4.8670   59.971   6.5725   65.285   7.2420  275.679   15.640  287.156   16.547 -11.47754 22.76881 
1 1 1    5    2   60 o   92.893   28.807   7.4145   4.5215   15.957   6.4072  -1.0595   6.3816  133.721   31.773   67.718   30.229 66.00242 43.85571 
1 1 1    5    2   61 o  187.747   13.544   27.823   3.8660   23.087   5.2783   33.304   5.6784  167.340   21.075  202.941   18.483 -35.60075 28.03167 
1 1 1    5    2   62 o  101.816   23.862   8.9470   3.6538   8.5585   5.1209   9.3499   5.2150   97.689   30.717  101.665   30.831 -3.976227 43.52086 
1 1 1    5    2   63 o  160.991   15.685   20.878   3.8160   23.486   5.5580   18.552   5.2486  166.807   22.329  146.830   24.197 19.97633 32.92553 
1 1 1    5    2   64 o   61.954   25.907   1.6036   4.1114   3.6661   5.7149  -0.6091   5.9193   75.755   30.998   64.152   28.839 11.60373 42.33871 
1 1 1    5    2   65 o  112.286   21.088   10.898   3.4913   8.3329   4.8435   13.673   5.0372   93.612   29.923  121.402   27.717 -27.79074 40.78777 
1 1 1    5    3    0 o   77.614   9.5563   4.8169   1.0891   4.8169   1.0891   4.8169   1.0891   77.614   9.5563   77.614   9.5563 0.000000 0.000000 
1 1 1    5    3    1 f  1583.25   14.353  1920.22   34.782  1944.43   49.920  1897.38   48.489  1592.42   20.481  1573.09   20.138 19.33716 28.72283 
1 1 1    5    3    2 o  475.254   6.4219  172.892   4.6715  173.267   6.5997  172.514   6.6135  475.726   9.0635  474.690   9.1023 1.035522 12.84516 
1 1 1    5    3    3 o  413.423   5.1203  130.822   3.2401  132.375   3.9887  127.809   5.5558  415.857   6.2664  408.585   8.8837 7.271362 10.87140 
1 1 1    5    3    4 o  255.336   4.2955   49.900   1.6788   52.572   2.4283   47.454   2.3235  262.072   6.0535  248.987   6.0966 13.08435 8.591519 
1 1 1    5    3    5 o  1476.16   9.6007  1668.35   21.692  1669.41   30.698  1667.31   30.657  1476.31   13.585  1475.38   13.576 0.9279785 19.20539 
1 1 1    5    3    6 o  1184.11   8.0056  1073.38   14.510  1079.44   20.643  1067.47   20.399  1187.27   11.359  1180.68   11.288 6.592529 16.01390 
1 1 1    5    3    7 o  1240.33   6.7788  1177.62   12.869  1203.35   22.748  1165.51   15.607  1253.53   11.856  1233.87   8.2638 19.66162 14.45187 
1 1 1    5    3    8 o  569.854   4.1504  248.543   3.6202  252.029   6.2327  246.768   4.4472  573.792   7.0966  567.803   5.1171 5.989014 8.749087 
1 1 1    5    3    9 f  847.342   4.8112  549.549   6.2400  543.722   8.1613  557.749   9.6816  842.804   6.3265  853.575   7.4103 -10.77130 9.743573 
1 1 1    5    3   10 o  1447.78   6.7314  1604.51   14.917  1576.78   20.657  1634.72   21.563  1435.06   9.4043  1461.17   9.6415 -26.11084 13.46845 
1 1 1    5    3   11 o  240.039   3.5491   44.099   1.3040   44.445   1.8597   43.765   1.8289  240.970   5.0420  239.118   4.9970 1.851669 7.098694 
1 1 1    5    3   12 o  973.022   5.7788  724.715   8.6065  713.125   14.731  730.721   10.605  965.030   9.9731  976.999   7.0913 -11.96893 12.23722 
1 1 1    5    3   13 o  313.209   4.1219   75.085   1.9760   73.842   2.8426   76.247   2.7489  310.588   5.9794  315.609   5.6903 -5.020447 8.254273 
1 1 1    5    3   14 o  744.398   4.6043  424.142   5.2461  422.547   6.9315  426.283   8.0268  742.957   6.0953  746.203   7.0277 -3.246704 9.302746 
1 1 1    5    3   15 o  567.467   3.9278  246.473   3.4116  250.604   4.8555  242.446   4.7945  572.169   5.5442  562.779   5.5659 9.389832 7.856007 
1 1 1    5    3   16 o  573.320   4.6121  251.600   4.0473  249.592   5.6570  253.705   5.7930  570.979   6.4728  575.661   6.5746 -4.682739 9.226201 
1 1 1    5    3   17 o  466.559   4.1790  166.618   2.9844  165.294   3.9227  168.438   4.5985  464.675   5.5152  469.049   6.4051 -4.374664 8.452400 
1 1 1    5    3   18 o  586.805   4.4303  263.578   3.9792  258.552   5.1828  270.794   6.2104  581.144   5.8266  594.708   6.8225 -13.56329 8.971924 
1 1 1    5    3   19 o  1354.76   6.5387  1405.22   13.559  1411.49   19.297  1399.10   19.055  1357.49   9.2874  1351.53   9.2113 5.959595 13.08064 
1 1 1    5    3   20 o  1498.67   8.1925  1720.01   18.793  1703.20   26.290  1737.58   26.874  1490.87   11.521  1505.81   11.660 -14.94653 16.39141 
1 1 1    5    3   21 o  580.872   4.2844  258.269   3.8093  262.360   5.4725  254.423   5.3056  585.405   6.1075  576.484   6.0128 8.920837 8.570562 
1 1 1    5    3   22 o  885.310   5.0221  599.959   6.8054  600.416   9.6506  599.506   9.5981  885.554   7.1198  884.884   7.0864 0.6699829 10.04539 
1 1 1    5    3   23 o  689.481   4.8937  363.882   5.1645  369.893   6.9459  356.451   7.7232  695.104   6.5284  682.326   7.3950 12.77765 9.864396 
1 1 1    5    3   24 o  866.689   5.0567  574.963   6.7081  565.268   9.3854  585.088   9.5914  859.279   7.1359  874.213   7.1679 -14.93372 10.11438 
1 1 1    5    3   25 o  1324.10   7.5751  1342.23   15.352  1317.31   26.141  1355.35   18.968  1311.31   13.024  1330.44   9.3147 -19.12634 16.01201 
1 1 1    5    3   26 o  1415.89   8.7390  1534.91   18.939  1478.79   28.790  1577.72   25.146  1389.36   13.538  1435.29   11.446 -45.93152 17.72847 
1 1 1    5    3   27 o  1142.88   6.9411  999.891   12.142  1021.44   21.556  989.877   14.695  1154.82   12.195  1137.07   8.4435 17.74939 14.83274 
1 1 1    5    3   28 o  285.214   6.4451   62.269   2.8136   59.166   4.4234   64.379   3.6464  277.966   10.397  289.984   8.2153 -12.01843 13.25066 
1 1 1    5    3   29 o  520.790   5.3109  207.602   4.2335  212.839   6.5425  203.830   5.5526  527.265   8.1067  516.007   7.0303 11.25720 10.73052 
1 1 1    5    3   30 o  523.323   5.6290  209.633   4.5089  210.465   5.9932  208.548   6.8443  524.325   7.4677  521.904   8.5678 2.420227 11.36547 
1 1 1    5    3   31 f  524.810   5.3487  210.824   4.2965  207.200   6.0836  214.431   6.0688  520.231   7.6400  529.235   7.4918 -9.003784 10.70034 
1 1 1    5    3   32 o  640.177   5.7914  313.716   5.6749  319.055   7.6179  307.061   8.5063  645.544   7.7098  633.257   8.7759 12.28699 11.68147 
1 1 1    5    3   33 o  550.098   6.5723  231.663   5.5339  224.410   7.7078  239.379   7.9500  541.333   9.3024  559.097   9.2898 -17.76367 13.14672 
1 1 1    5    3   34 o  1318.37   6.8916  1330.69   13.907  1342.75   19.898  1319.17   19.444  1324.08   9.8181  1312.41   9.6795 11.66248 13.78723 
1 1 1    5    3   35 o  666.462   5.7889  340.028   5.9053  346.654   8.5361  333.947   8.1781  672.823   8.2887  660.386   8.0907 12.43750 11.58283 
1 1 1    5    3   36 o  495.352   6.6837  187.866   5.0676  186.572   6.8585  189.421   7.5205  493.557   9.0786  497.276   9.8806 -3.718964 13.41816 
1 1 1    5    3   37 o  557.163   6.9083  237.693   5.8915  243.344   8.6519  232.808   8.0448  563.593   10.029  551.285   9.5338 12.30811 13.83773 
1 1 1    5    3   38 o  518.568   8.1092  205.959   6.4366  203.415   8.9212  208.722   9.2958  515.170   11.314  521.825   11.638 -6.654846 16.23115 
1 1 1    5    3   39 o  130.377   18.940   13.340   3.6690   19.052   5.2288   7.8007   5.1496  155.662   22.607  100.231   30.687 55.43104 38.11542 
1 1 1    5    3   40 o  925.646   6.1614  656.122   8.7296  654.775   12.387  657.451   12.305  924.418   8.7542  926.315   8.6785 -1.896851 12.32693 
1 1 1    5    3   41 o  724.063   6.3916  401.525   7.0837  407.172   10.817  397.284   9.3734  728.787   9.6966  720.024   8.5051 8.762939 12.89804 
1 1 1    5    3   42 o  172.120   15.428   22.965   4.0213   28.992   5.3028   14.810   6.1689  193.136   18.151  135.204   30.531 57.93193 35.51902 
1 1 1    5    3   43 o  432.385   6.9713  143.247   4.6137  151.589   6.6212  135.374   6.4325  444.552   9.7306  420.076   10.004 24.47623 13.95602 
1 1 1    5    3   44 o  264.031   10.618   53.516   4.2913   58.173   5.9763   48.560   6.1656  274.574   14.269  250.490   16.168 24.08478 21.56388 
1 1 1    5    3   45 o  124.297   19.035   12.222   3.5061   6.4694   4.9075   18.220   5.0110   92.198   30.175  151.607   22.257 -59.40820 37.49513 
1 1 1    5    3   46 o  326.851   8.0796   81.944   4.0421   76.838   5.7345   86.986   5.6985  316.095   11.852  336.425   11.066 -20.33044 16.21556 
1 1 1    5    3   47 o  320.565   8.1508   78.848   3.9993   78.690   5.6943   79.001   5.6182  319.818   11.632  320.475   11.453 -0.6573181 16.32462 
1 1 1    5    3   48 o  296.083   8.9073   67.322   4.0367   67.833   5.5130   66.732   5.9270  296.768   12.137  294.186   13.163 2.582642 17.90407 
1 1 1    5    3   49 o  573.936   8.2370  252.929   7.2361  248.210   11.966  255.650   9.0854  566.875   13.791  576.481   10.296 -9.605835 17.21090 
1 1 1    5    3   50 o  242.356   11.742   45.289   4.3558   49.140   7.1096   42.975   5.5113  250.372   18.687  234.969   15.409 15.40218 24.22077 
1 1 1    5    3   51 o  196.556   12.775   29.983   3.8225   26.316   5.3640   33.766   5.4486  182.366   19.520  207.484   17.315 -25.11775 26.09254 
1 1 1    5    3   52 o  122.368   20.249   12.055   3.6600   5.6333   5.0672   19.060   5.2923   87.153   30.639  153.557   23.244 -66.40400 38.45820 
1 1 1    5    3   53 o  259.721   10.995   52.068   4.3708   48.170   6.4326   55.412   5.9572  247.776   17.065  266.666   14.651 -18.88936 22.49173 
1 1 1    5    3   54 o  164.147   17.162   21.299   4.2481   26.120   5.5395   14.416   6.6190  180.854   20.365  129.469   33.232 51.38487 38.97618 
1 1 1    5    3   55 o  410.211   7.9466  129.457   4.9895  126.501   7.0275  132.462   7.0853  404.403   11.353  413.886   11.184 -9.483582 15.93685 
1 1 1    5    3   56 o  293.264   11.195   66.562   5.0253   61.720   6.8114   72.346   7.4445  280.375   15.938  303.552   16.080 -23.17722 22.63995 
1 1 1    5    3   57 o  171.841   16.002   23.344   4.1604   20.775   5.8689   25.939   5.8987  158.439   25.032  178.795   22.019 -20.35609 33.33839 
1 1 1    5    3   58 o  163.883   17.517   21.430   4.3261   26.540   6.2090   16.608   6.0309  180.066   23.057  139.074   29.258 40.99182 37.25179 
1 1 1    5    3   59 o  142.341   20.651   16.551   4.3678   20.286   5.8496   11.845   6.5665  155.511   25.456  115.079   34.528 40.43124 42.89746 
1 1 1    5    3   60 o  192.384   18.165   29.757   5.2857   31.384   8.4675   28.718   6.7657  190.167   30.092  185.485   24.425 4.681870 38.75673 
1 1 1    5    3   61 o  230.981   11.787   41.759   4.1533   32.669   5.8726   50.855   5.8747  200.416   19.386  253.122   15.234 -52.70604 24.65563 
1 1 1    5    3   62 o   77.328   26.306   4.9256   3.7239   5.9856   5.2818   3.8779   5.2510   85.564   31.136   76.755   30.292 8.809357 43.44001 
1 1 1    5    3   63 o  179.198   14.272   25.625   3.8821   27.150   5.4464   24.051   5.5350  181.046   19.987  169.036   21.908 12.00916 29.65554 
1 1 1    5    3   64 o  154.322   20.731   20.117   4.7730   4.3463   7.3792   31.461   6.2585   82.431   34.604  192.699   21.590 -110.2675 40.78677 
1 1 1    5    3   65 o  145.995   16.326   17.506   3.5857   16.556   4.8659   18.635   5.3043  136.727   24.133  144.651   24.853 -7.924057 34.64216 
1 1 1    5    4    0 o  445.031   6.0941  151.670   4.1494  151.670   4.1494  151.670   4.1494  445.031   6.0941  445.031   6.0941 0.000000 0.000000 
1 1 1    5    4    1 o  281.569   4.5169   60.681   1.9467   64.215   3.4475   59.026   2.3587  289.627   7.7767  277.697   5.5491 11.92963 9.553503 
1 1 1    5    4    2 o  1865.15   16.672  2665.75   47.595  2675.71   67.602  2655.95   67.022  1867.43   23.651  1860.54   23.535 6.886230 33.36522 
1 1 1    5    4    3 o  1052.57   10.273  848.301   16.551  851.090   23.460  845.537   23.353  1054.04   14.541  1050.60   14.523 3.442871 20.55119 
1 1 1    5    4    4 o  1171.35   7.9285  1050.37   14.215  1044.74   19.977  1056.14   20.231  1168.05   11.174  1174.40   11.255 -6.352051 15.85961 
1 1 1    5    4    5 o  495.385   6.8110  187.853   5.1644  187.853   5.1644   0.0000   0.0000  495.385   6.8110  ?   ?  0.000000 6.811013 
1 1 1    5    4    6 o  988.639   6.2485  748.158   9.4554  744.549   12.097  753.825   15.158  986.195   8.0142  992.238   9.9809 -6.043701 12.80023 
1 1 1    5    4    7 o  1221.34   9.4787  1142.07   17.720  1146.06   21.696  1134.10   30.708  1223.34   11.587  1216.55   16.491 6.789551 20.15464 
1 1 1    5    4    8 o  781.913   5.3780  467.969   6.4365  459.877   8.1798  481.126   10.430  775.089   6.8948  792.743   8.5956 -17.65485 11.01920 
1 1 1    5    4    9 o  1047.47   5.5633  839.827   8.9196  817.168   13.223  858.744   12.082  1033.14   8.3620  1059.14   7.4529 -25.99426 11.20129 
1 1 1    5    4   10 o  1178.93   6.0969  1063.90   11.002  1049.53   16.548  1075.30   14.729  1170.79   9.2339  1185.14   8.1194 -14.34570 12.29590 
1 1 1    5    4   11 o  1069.81   5.6902  876.057   9.3176  860.691   13.970  888.370   12.506  1060.27   8.6081  1077.23   7.5845 -16.96252 11.47273 
1 1 1    5    4   12 o  799.220   5.1272  488.922   6.2721  494.444   11.055  486.301   7.6167  803.592   8.9876  797.045   6.2433 6.547241 10.94333 
1 1 1    5    4   13 o  907.310   5.5450  630.138   7.7006  630.142   9.4342  630.131   13.330  907.268   6.7936  907.127   9.6002 0.1405640 11.76085 
1 1 1    5    4   14 o  848.035   4.9785  550.482   6.4623  544.961   8.4421  558.294   10.043  843.719   6.5371  853.930   7.6837 -10.21069 10.08823 
1 1 1    5    4   15 o   86.797   9.2017   5.8343   1.2038   6.2840   1.6245   5.2867   1.7929   89.750   12.137   81.780   14.871 7.970367 19.19499 
1 1 1    5    4   16 o  1330.46   6.3906  1355.19   13.014  1354.67   18.392  1355.72   18.417  1329.97   9.0348  1330.48   9.0438 -0.5118408 12.78349 
1 1 1    5    4   17 o  762.626   4.4941  445.189   5.2460  450.328   7.4895  440.240   7.3502  766.942   6.3800  758.306   6.3327 8.636597 8.989288 
1 1 1    5    4   18 o  1062.58   5.8561  864.388   9.5244  860.327   12.524  869.958   14.667  1059.95   7.7196  1065.76   8.9914 -5.806152 11.85063 
1 1 1    5    4   19 o  420.722   4.3148  135.490   2.7786  135.763   3.6997  135.137   4.2083  421.117   5.7398  420.124   6.5443 0.9922791 8.704780 
1 1 1    5    4   20 o  864.251   5.2233  571.783   6.9096  581.087   10.672  565.068   9.0666  871.102   8.0039  859.078   6.8951 12.02429 10.56431 
1 1 1    5    4   21 f  1210.16   6.0595  1121.15   11.224  1126.41   15.976  1116.02   15.772  1212.80   8.6063  1207.20   8.5356 5.602661 12.12129 
1 1 1    5    4   22 f  724.036   4.9312  401.277   5.4649  404.941   7.3201  396.664   8.2139  727.279   6.5758  719.772   7.4556 7.506592 9.941184 
1 1 1    5    4   23 o  971.818   5.6899  722.952   8.4637  732.981   11.390  710.588   12.647  978.447   7.6056  963.331   8.5770 15.11572 11.46342 
1 1 1    5    4   24 o  1300.31   6.9102  1294.40   13.753  1307.98   21.359  1284.78   17.976  1306.84   10.678  1295.33   9.0665 11.50793 14.00788 
1 1 1    5    4   25 o  632.522   5.3785  306.241   5.2073  322.714   9.7170  299.605   6.1676  649.186   9.7790  625.609   6.4409 23.57745 11.70959 
1 1 1    5    4   26 o  888.007   6.6152  603.636   8.9914  621.939   15.027  593.430   11.222  901.187   10.894  880.407   8.3273 20.77972 13.71242 
1 1 1    5    4   27 o  529.787   5.0512  214.832   4.0961  212.332   6.1810  216.790   5.4695  526.648   7.6678  532.168   6.7147 -5.519775 10.19227 
1 1 1    5    4   28 o  988.053   5.9655  747.277   9.0219  742.567   13.701  750.883   11.988  984.812   9.0893  990.364   7.9081 -5.551392 12.04795 
1 1 1    5    4   29 o  482.856   5.4006  178.461   3.9915  177.800   6.0726  178.964   5.2963  481.909   8.2326  483.507   7.1565 -1.597015 10.90831 
1 1 1    5    4   30 o  297.375   7.0042   67.698   3.1881   66.311   4.2148   69.552   4.8741  294.281   9.3572  301.364   10.566 -7.083069 14.11406 
1 1 1    5    4   31 o  402.035   6.0846  123.728   3.7443  123.086   5.0224  124.532   5.6179  400.952   8.1836  403.280   9.1011 -2.327698 12.23938 
1 1 1    5    4   32 o  463.624   6.5837  164.551   4.6721  162.145   6.4654  167.180   6.7590  460.159   9.1794  467.240   9.4509 -7.080963 13.17503 
1 1 1    5    4   33 o  838.466   5.6565  538.162   7.2594  545.650   10.533  531.387   10.019  844.172   8.1516  833.080   7.8574 11.09155 11.32199 
1 1 1    5    4   34 o  300.618   7.8422   69.196   3.6085   73.878   5.2695   65.062   4.9516  310.546   11.086  291.429   11.100 19.11780 15.68822 
1 1 1    5    4   35 o  562.918   6.2626  242.592   5.3960  244.368   7.3868  240.561   7.9014  564.892   8.5432  560.445   9.2108 4.446472 12.56286 
1 1 1    5    4   36 o  389.655   7.0208  116.253   4.1873  114.033   5.9466  118.436   5.8972  385.823   10.070  393.210   9.7983 -7.387085 14.05006 
1 1 1    5    4   37 o  276.244   10.536   58.470   4.4550   58.575   6.5374   58.378   6.0872  275.870   15.546  275.507   14.486 0.3628540 21.24866 
1 1 1    5    4   38 o  142.138   21.921   15.907   4.6158   15.869   6.8213   15.939   6.2690  140.381   32.403  140.950   29.980 -0.5696564 44.14450 
1 1 1    5    4   39 o  711.161   6.3020  387.267   6.8599  393.445   9.3492  380.063   10.096  716.650   8.5231  704.285   9.3659 12.36469 12.66346 
1 1 1    5    4   40 o  153.094   15.620   18.192   3.6090   15.291   5.0933   21.117   5.1146  138.615   24.922  164.264   20.809 -25.64914 32.46711 
1 1 1    5    4   41 o  479.097   7.0209  175.826   5.1486  174.442   7.7287  176.930   6.9034  476.932   10.587  480.427   9.3878 -3.495392 14.14991 
1 1 1    5    4   42 o  608.434   6.6864  283.584   6.2270  287.142   8.2190  278.789   9.5405  612.029   8.7736  602.870   10.339 9.159424 13.55991 
1 1 1    5    4   43 o  445.465   6.8970  152.044   4.7027  154.727   6.6333  149.334   6.6679  449.127   9.6492  441.207   9.8737 7.919983 13.80569 
1 1 1    5    4   44 o   90.891   26.632   6.5665   3.9438   3.8768   5.3002   9.9030   5.9031   81.749   30.916  111.049   32.595 -29.30013 44.92519 
1 1 1    5    4   45 o  512.309   6.5454  201.134   5.1326  195.691   7.2425  206.626   7.2749  504.975   9.3702  518.923   9.1591 -13.94806 13.10302 
1 1 1    5    4   46 o   58.343   23.918   0.9548   3.4107   2.6611   4.9520  -0.5851   4.7043   74.849   29.456   61.719   26.802 13.12923 39.82466 
1 1 1    5    4   47 o  116.665   21.066   10.907   3.6233   14.282   5.1277   7.5420   5.1205  132.668   26.181   97.719   30.714 34.94878 40.35865 
1 1 1    5    4   48 o  131.617   17.886   13.679   3.5099   11.198   5.0217   16.049   4.9079  116.669   28.390  141.354   23.510 -24.68498 36.86071 
1 1 1    5    4   49 o   74.851   28.612   3.2202   4.5702   8.0652   8.4308   1.2040   5.4387  107.008   39.276   71.681   29.870 35.32764 49.34415 
1 1 1    5    4   50 o  209.321   12.154   33.917   3.8773   30.805   5.5821   36.817   5.3897  197.914   18.647  217.154   16.335 -19.24017 24.78964 
1 1 1    5    4   51 o  267.625   9.7003   55.131   3.9736   58.662   5.6805   51.749   5.5604  275.323   13.479  258.081   14.130 17.24219 19.52798 
1 1 1    5    4   52 f   54.574   23.416  -0.0132   3.5071   3.5745   5.0250  -3.4205   4.8970   77.872   29.946   54.665   25.203 23.20734 39.14058 
1 1 1    5    4   53 o  151.505   17.531   18.176   3.9903   21.968   6.1405   15.404   5.2500  164.068   25.262  136.588   26.063 27.47987 36.29655 
1 1 1    5    4   54 o  317.879   10.013   77.933   4.8719   80.957   6.4031   73.775   7.5079  323.153   12.945  307.050   16.031 16.10339 20.60487 
1 1 1    5    4   55 o  148.386   17.145   17.476   3.8224   10.113   5.4021   24.859   5.4094  108.990   30.941  176.118   20.447 -67.12792 37.08645 
1 1 1    5    4   56 o   66.997   26.443   2.3328   4.0014   10.119   5.4008  -7.1420   5.9578  108.682   30.966   53.883   25.739 54.79855 40.26659 
1 1 1    5    4   57 o  119.911   22.668   11.882   4.0080   17.156   5.8501   7.2168   5.5023  142.423   27.834   94.187   31.977 48.23577 42.39400 
1 1 1    5    4   58 o  255.116   11.614   50.521   4.5352   39.163   6.4778   61.440   6.3515  221.141   19.332  279.708   14.889 -58.56702 24.40106 
1 1 1    5    4   59 o  136.906   21.712   15.437   4.3979   11.056   5.9986   20.528   6.4669  111.669   32.881  154.865   28.325 -43.19617 43.39916 
1 1 1    5    4   60 o   50.502   24.009  -5.4009   5.0578  -9.2578   8.3908  -3.1998   6.3387   62.950   30.197   62.592   28.790 0.3585243 41.72243 
1 1 1    5    4   61 o   51.844   23.144  -0.9521   3.7417   5.3330   5.1399  -8.0376   5.4574   82.884   30.626   48.395   23.492 34.48908 38.59851 
1 1 1    5    4   62 o  146.953   17.660   17.562   3.8927   23.533   5.4275   11.236   5.5862  168.111   21.592  110.653   31.481 57.45713 38.17401 
1 1 1    5    4   63 o   71.390   26.688   3.8209   3.9254   5.7133   5.8066   2.2283   5.3270   84.458   32.259   70.296   29.450 14.16167 43.67991 
1 1 1    5    4   64 o   70.421   26.498   3.7916   3.8819   6.3261   5.0366   0.0828   6.0927   84.666   30.463   66.531   29.630 18.13506 42.49617 
1 1 1    5    4   65 o  127.426   18.867   13.686   3.5687   12.445   4.8700   15.126   5.2445  115.402   27.882  127.821   27.613 -12.41877 39.24144 
1 1 1    5    5    0 f  107.533   6.8417   8.9575   1.1156   8.9575   1.1156   8.9575   1.1156  107.533   6.8417  107.533   6.8417 0.000000 0.000000 
1 1 1    5    5    1 o  1175.32   9.0957  1057.59   16.363  1081.80   20.538  1015.51   27.076  1188.58   11.289  1151.30   15.365 37.27917 19.06622 
1 1 1    5    5    2 o  1655.97   14.987  2100.83   37.988  2156.20   55.406  2051.73   52.185  1676.72   21.589  1635.72   20.843 41.00525 30.00867 
1 1 1    5    5    3 f  804.621   8.5274  495.641   10.502  511.896   15.289  481.120   14.451  817.566   12.218  792.622   11.911 24.94403 17.06312 
1 1 1    5    5    4 o  386.252   5.2531  114.192   3.1057  115.612   3.8005  111.339   5.3882  388.633   6.3889  381.346   9.2312 7.287415 11.22643 
1 1 1    5    5    5 o  519.876   5.7191  206.873   4.5509  206.108   5.5369  208.467   7.9896  518.894   6.9714  521.794   10.004 -2.899597 12.19309 
1 1 1    5    5    6 o  897.408   7.5920  616.505   10.428  647.988   18.932  602.791   12.495  919.771   13.447  887.314   9.2000 32.45709 16.29335 
1 1 1    5    5    7 o  691.805   6.5476  366.351   6.9333  367.052   11.988  365.999   8.4989  692.325   11.313  691.437   8.0304 0.8884888 13.87308 
1 1 1    5    5    8 o  755.672   5.3152  437.087   6.1478  437.299   7.9102  436.763   9.7699  755.821   6.8375  755.311   8.4508 0.5099487 10.87047 
1 1 1    5    5    9 o  927.796   6.0704  658.912   8.6207  662.407   11.156  653.732   13.582  930.194   7.8355  924.009   9.6029 6.184387 12.39403 
1 1 1    5    5   10 o  202.062   4.7811   31.251   1.4787   34.156   1.8819   26.562   2.3907  211.238   5.8203  186.264   8.3854 24.97403 10.20741 
1 1 1    5    5   11 o  785.040   5.0612  471.723   6.0816  475.930   10.723  469.728   7.3842  788.411   8.8856  783.350   6.1585 5.060852 10.81112 
1 1 1    5    5   12 o  919.982   5.6015  647.864   7.8878  646.505   11.091  649.253   11.220  918.930   7.8856  920.877   7.9599 -1.947510 11.20460 
1 1 1    5    5   13 o  617.180   5.0069  291.566   4.7299  288.803   6.0811  295.796   7.5256  614.214   6.4683  621.562   7.9101 -7.347778 10.21811 
1 1 1    5    5   14 f  551.565   4.4814  232.862   3.7834  229.602   5.2693  236.331   5.4355  547.651   6.2861  555.615   6.3914 -7.964172 8.964683 
1 1 1    5    5   15 o  783.502   4.4913  469.886   5.3862  471.272   7.6579  468.529   7.5772  784.590   6.3767  782.306   6.3279 2.284363 8.983576 
1 1 1    5    5   16 o  739.956   4.4072  419.110   4.9916  418.188   7.0472  420.038   7.0713  739.077   6.2296  740.710   6.2371 -1.633240 8.815239 
1 1 1    5    5   17 o  868.035   5.1647  576.798   6.8620  573.830   8.9971  580.926   10.610  865.719   6.7898  870.984   7.9584 -5.265503 10.46120 
1 1 1    5    5   18 f  854.928   5.1390  559.514   6.7247  556.862   8.8339  563.169   10.370  852.819   6.7674  857.566   7.9005 -4.747131 10.40266 
1 1 1    5    5   19 o  533.516   4.3916  217.878   3.5863  215.441   4.7357  221.156   5.4913  530.486   5.8323  537.449   6.6753 -6.962952 8.864244 
1 1 1    5    5   20 o  482.172   4.3652  177.959   3.2216  179.712   4.9254  176.648   4.2590  484.486   6.6418  480.362   5.7926 4.123962 8.812951 
1 1 1    5    5   21 o  1218.83   6.0967  1137.26   11.374  1130.99   15.992  1143.68   16.180  1215.27   8.5970  1222.07   8.6500 -6.797729 12.19555 
1 1 1    5    5   22 o  441.185   4.5919  148.988   3.1008  147.031   4.1311  151.513   4.6929  438.250   6.1585  444.864   6.8920 -6.613342 9.242675 
1 1 1    5    5   23 o  505.646   4.7187  195.703   3.6520  201.891   5.7839  191.601   4.7096  513.521   7.3586  500.291   6.1502 13.23010 9.590310 
1 1 1    5    5   24 o  274.227   5.8105   57.564   2.4389   49.205   4.2149   61.771   2.9903  253.472   10.864  284.059   6.8776 -30.58762 12.85807 
1 1 1    5    5   25 o  1137.42   7.5040  990.416   13.064  999.823   21.190  984.648   16.593  1142.52   12.117  1133.99   9.5597 8.527222 15.43403 
1 1 1    5    5   26 o  448.759   4.7354  154.141   3.2526  149.711   4.5936  158.595   4.6063  442.235   6.7862  455.171   6.6116 -12.93597 9.474505 
1 1 1    5    5   27 o  543.533   4.7529  226.122   3.9542  222.065   5.5712  230.239   5.6131  538.603   6.7579  548.428   6.6867 -9.824829 9.506885 
1 1 1    5    5   28 o  1190.93   6.6349  1085.70   12.095  1094.92   18.669  1079.03   15.877  1195.78   10.200  1187.16   8.7374 8.619507 13.43076 
1 1 1    5    5   29 o  903.255   5.7831  624.513   7.9954  632.581   12.392  618.758   10.465  908.954   8.9069  899.023   7.6051 9.931335 11.71196 
1 1 1    5    5   30 o  528.201   5.9636  213.565   4.8215  213.317   6.7103  213.830   6.9322  527.841   8.3056  528.469   8.5700 -0.6281738 11.93433 
1 1 1    5    5   31 o  378.094   6.0313  109.431   3.4905  105.256   4.9882  113.436   4.8859  370.763   8.7897  384.911   8.2931 -14.14764 12.08448 
1 1 1    5    5   32 o  1033.56   6.8961  817.815   10.910  819.255   15.465  816.388   15.393  1034.30   9.7683  1032.49   9.7402 1.809570 13.79462 
1 1 1    5    5   33 o  475.462   5.8533  173.055   4.2597  176.331   6.1902  170.108   5.8708  479.876   8.4277  471.340   8.1376 8.535156 11.71521 
1 1 1    5    5   34 o  624.989   5.6460  299.017   5.4011  298.014   7.7590  299.960   7.5230  623.853   8.1256  625.898   7.8527 -2.044739 11.29996 
1 1 1    5    5   35 o  807.408   6.1127  499.078   7.5543  505.517   10.237  491.379   11.194  812.491   8.2316  800.993   9.1301 11.49786 12.29305 
1 1 1    5    5   36 o  975.721   6.0923  728.863   9.0987  731.519   12.990  726.305   12.748  977.316   8.6836  973.838   8.5526 3.478516 12.18822 
1 1 1    5    5   37 o  303.017   9.0100   70.332   4.1789   67.730   6.6322   72.045   5.3815  297.150   14.582  306.603   11.467 -9.452698 18.55074 
1 1 1    5    5   38 o  663.254   6.9425  336.864   7.0480  342.743   10.442  331.944   9.5522  668.790   10.200  658.226   9.4811 10.56366 13.92621 
1 1 1    5    5   39 o   57.969   23.737   0.8843   3.3543   1.0370   4.7236   0.7289   4.7640   67.898   28.027   67.044   27.949 0.8535233 39.58097 
1 1 1    5    5   40 o  674.402   6.3949  348.313   6.6012  331.569   8.8167  369.672   9.9582  657.800   8.7568  694.505   9.3677 -36.70490 12.82325 
1 1 1    5    5   41 o  174.915   14.474   23.668   3.8404   14.542   5.3734   33.196   5.4908  134.592   27.022  206.940   17.499 -72.34781 32.19316 
1 1 1    5    5   42 o  346.371   8.3648   91.958   4.4347   91.491   5.7644   92.636   6.9417  345.305   10.906  347.263   13.060 -1.957306 17.01499 
1 1 1    5    5   43 o  723.283   6.0051  400.727   6.6481  398.635   9.3701  402.848   9.4340  721.067   8.4899  724.866   8.5029 -3.798889 12.01571 
1 1 1    5    5   44 o  319.355   9.1552   78.239   4.4752   80.822   6.1937   75.417   6.4733  324.253   12.479  313.105   13.507 11.14743 18.38975 
1 1 1    5    5   45 o  142.661   15.648   15.881   3.3608   24.638   4.8860   8.0175   4.6302  177.581   18.235   99.859   28.742 77.72234 34.03796 
1 1 1    5    5   46 o  353.977   7.6212   96.093   4.1292   97.663   5.9393   94.624   5.7447  356.472   10.885  350.909   10.696 5.563568 15.26060 
1 1 1    5    5   47 o  399.339   7.4472  122.317   4.5520  124.146   6.2853  120.301   6.6015  401.920   10.217  395.532   10.904 6.387238 14.94265 
1 1 1    5    5   48 o  330.552   8.0928   83.867   4.0946   80.118   5.8298   87.516   5.7522  322.547   11.808  337.225   11.144 -14.67795 16.23658 
1 1 1    5    5   49 o  157.797   19.475   19.694   4.6041   19.336   8.8175   19.829   5.3984  150.712   38.180  157.333   23.105 -6.621277 44.62654 
1 1 1    5    5   50 o  167.950   14.023   21.972   3.5719   22.572   5.0861   21.389   5.0173  168.728   20.089  164.093   20.418 4.634735 28.64320 
1 1 1    5    5   51 o  294.527   9.0608   66.728   4.0847   76.377   5.8949   57.817   5.6652  314.438   12.248  273.297   13.543 41.14096 18.26000 
1 1 1    5    5   52 o  253.806   10.741   49.682   4.1727   53.047   6.1471   46.806   5.6823  260.750   15.471  244.952   15.231 15.79825 21.71048 
1 1 1    5    5   53 o  199.073   12.490   30.789   3.7865   24.923   5.2906   36.950   5.4216  176.922   19.881  217.022   16.443 -40.09952 25.80009 
1 1 1    5    5   54 o  245.708   11.985   46.723   4.5076   43.605   5.7357   51.758   7.2893  235.844   15.983  255.938   18.737 -20.09421 24.62841 
1 1 1    5    5   55 o  123.659   20.953   12.432   3.8242   5.4215   5.4042   19.463   5.4123   86.462   31.489  154.345   23.664 -67.88335 39.39012 
1 1 1    5    5   56 o   70.198   26.586   3.1128   3.9230   4.7368   5.1536   0.8751   6.0494   82.415   30.625   72.454   30.911 9.961273 43.51301 
1 1 1    5    5   57 o   51.136   22.844  -1.1807   3.6518  -3.1812   5.2873   0.6443   5.0498   57.205   26.306   66.218   28.246 -9.012470 38.59869 
1 1 1    5    5   58 o   74.182   27.271   3.8881   4.0670   8.1055   5.6165  -0.7611   5.8969   98.047   32.290   66.580   29.425 31.46685 43.68663 
1 1 1    5    5   59 o  323.721   9.7001   81.094   4.8064   84.609   6.8390   77.664   6.7562  328.928   13.584  314.920   14.016 14.00806 19.51864 
1 1 1    5    5   60 o  191.039   18.095   29.363   5.2280   34.058   8.8868   26.878   6.4651  197.823   30.316  179.380   24.161 18.44347 38.76598 
1 1 1    5    5   61 o  101.854   24.379   8.9422   3.7501   1.7256   5.2287   16.586   5.3813   69.276   29.107  138.549   26.338 -69.27349 39.25494 
1 1 1    5    5   62 o   77.055   26.382   4.8864   3.7456   6.2062   5.2571   3.5256   5.3380   86.349   31.117   75.599   30.310 10.74965 43.43935 
1 1 1    5    5   63 o   81.899   28.051   5.7738   4.2343   10.820   5.7184  -0.3519   6.3003  106.983   32.249   67.143   29.999 39.84039 44.04467 
1 1 1    5    5   64 o  128.725   20.778   14.105   3.9544   13.353   5.0217   15.332   6.4158  120.595   27.778  125.244   33.004 -4.648972 43.13741 
1 1 1    5    5   65 o   67.400   25.754   3.4174   3.7020  -3.7805   5.3090   10.229   5.1648   53.304   25.118  102.579   30.587 -49.27491 39.57849 
1 1 1    5    6    0 o  2096.20   18.594  3366.27   59.647  3366.27   59.647  3366.27   59.647  2096.20   18.594  2096.20   18.594 0.000000 0.000000 
1 1 1    5    6    1 o  1371.06   10.375  1439.34   21.772  1464.32   27.201  1394.80   36.321  1382.72   12.852  1349.05   17.590 33.66797 21.78467 
1 1 1    5    6    2 o  810.408   8.5668  502.797   10.627  522.720   15.576  485.450   14.535  826.160   12.317  796.180   11.927 29.97998 17.14541 
1 1 1    5    6    3 o  1192.22   11.371  1088.46   20.750  1116.21   30.155  1063.51   28.596  1206.94   16.323  1178.15   15.858 28.79846 22.75771 
1 1 1    5    6    4 o  1164.93   9.1601  1038.99   16.333  1049.54   20.239  1019.28   27.659  1170.71   11.295  1153.39   15.667 17.32324 19.31373 
1 1 1    5    6    5 o  946.525   7.8862  685.856   11.425  693.634   20.031  682.105   13.910  951.589   13.753  943.864   9.6283 7.724304 16.78806 
1 1 1    5    6    6 o  955.002   7.9543  698.205   11.627  690.058   19.917  702.417   14.321  949.125   13.710  957.803   9.7684 -8.678772 16.83366 
1 1 1    5    6    7 o  529.316   5.1137  214.450   4.1430  212.401   5.8296  216.541   5.8892  526.746   7.2305  531.855   7.2342 -5.108459 10.22806 
1 1 1    5    6    8 o  1719.64   11.061  2264.59   29.113  2278.84   41.492  2250.78   40.859  1724.47   15.719  1713.84   15.576 10.62903 22.12931 
1 1 1    5    6    9 o  500.454   5.1419  191.704   3.9387  190.625   5.5688  192.785   5.5717  499.007   7.2909  501.827   7.2537 -2.819916 10.28466 
1 1 1    5    6   10 o  826.328   6.3978  522.694   8.0919  511.611   11.207  534.766   11.696  817.428   8.9571  835.713   9.1435 -18.28516 12.79975 
1 1 1    5    6   11 o  498.357   5.2843  190.106   4.0308  199.122   5.8532  181.973   5.5591  509.994   7.4982  487.539   7.4495 22.45505 10.56967 
1 1 1    5    6   12 o  660.958   6.5561  334.435   6.6327  333.423   8.1196  336.464   11.499  659.909   8.0386  662.771   11.335 -2.862000 13.89596 
1 1 1    5    6   13 o  724.494   5.4140  401.792   6.0037  405.618   9.4780  399.228   7.7589  727.821   8.5079  722.126   7.0196 5.695068 11.02992 
1 1 1    5    6   14 o  250.326   4.1700   47.964   1.5978   50.560   2.5154   46.208   2.0687  256.988   6.3948  245.689   5.5010 11.29916 8.435325 
1 1 1    5    6   15 o  178.439   5.0305   24.374   1.3740   24.784   2.1659   24.097   1.7774  179.908   7.8652  177.410   6.5454 2.497452 10.23245 
1 1 1    5    6   16 o  1105.60   5.9689  935.800   10.101  933.161   15.397  937.795   13.384  1103.80   9.1134  1106.65   7.9013 -2.843384 12.06167 
1 1 1    5    6   17 o  781.851   4.8981  467.938   5.8616  464.441   7.6830  472.809   9.0671  778.857   6.4447  785.783   7.5387 -6.926270 9.917981 
1 1 1    5    6   18 o  131.699   6.7825   13.315   1.3626   14.041   1.7893   12.313   2.1023  135.124   8.6975  126.290   10.985 8.833961 14.01155 
1 1 1    5    6   19 o  653.651   4.5949  327.052   4.5972  336.637   7.1033  320.145   6.0304  663.073   6.9989  646.662   6.0926 16.41046 9.279256 
1 1 1    5    6   20 o  657.875   4.6682  331.291   4.7007  313.251   6.8830  347.061   6.4352  639.636   7.0303  673.301   6.2443 -33.66486 9.403006 
1 1 1    5    6   21 o  750.008   5.3854  430.599   6.1824  431.499   8.8188  429.728   8.6695  750.701   7.6749  749.165   7.5604 1.536560 10.77329 
1 1 1    5    6   22 o  524.589   4.6665  210.642   3.7470  213.567   5.9505  208.721   4.8233  528.157   7.3607  522.163   6.0349 5.994141 9.518385 
1 1 1    5    6   23 o  692.344   4.9708  366.905   5.2677  368.047   8.2262  366.111   6.8582  693.342   7.7515  691.557   6.4790 1.785217 10.10262 
1 1 1    5    6   24 f  1708.11   9.2377  2234.01   24.152  2291.59   43.392  2208.17   29.071  1729.05   16.396  1698.00   11.185 31.05237 19.84773 
1 1 1    5    6   25 o  102.439   13.124   8.1702   2.0105   7.8820   3.2846   8.3428   2.5423   99.406   22.154  103.020   16.694 -3.614471 27.73939 
1 1 1    5    6   26 o  273.346   5.5734   57.192   2.3318   57.058   3.3381   57.319   3.2588  273.003   7.9884  273.629   7.7808 -0.6264954 11.15148 
1 1 1    5    6   27 o  560.096   5.0319  240.117   4.3138  237.359   6.4975  242.291   5.7687  556.823   7.6236  562.597   6.6990 -5.774109 10.14865 
1 1 1    5    6   28 o  851.040   5.3042  554.377   6.9094  554.646   9.8688  554.119   9.6768  851.180   7.5748  850.780   7.4309 0.3998413 10.61115 
1 1 1    5    6   29 o  940.664   5.5516  677.306   7.9932  681.285   11.448  673.520   11.166  943.337   7.9284  937.952   7.7774 5.384705 11.10619 
1 1 1    5    6   30 o  1232.25   7.4430  1162.47   14.038  1155.58   19.661  1169.64   20.052  1228.39   10.457  1235.83   10.600 -7.438477 14.88990 
1 1 1    5    6   31 o  1170.59   7.2599  1049.05   13.008  1033.46   18.061  1065.85   18.749  1161.66   10.158  1179.71   10.383 -18.04358 14.52574 
1 1 1    5    6   32 o  749.195   6.3142  429.687   7.2407  420.733   10.080  439.233   10.408  741.245   8.8844  757.362   8.9782 -16.11731 12.63090 
1 1 1    5    6   33 f  471.185   5.8810  169.957   4.2414  170.450   6.1002  169.495   5.9013  471.802   8.4473  470.487   8.1946 1.315094 11.76892 
1 1 1    5    6   34 f   48.601   21.414  -0.9230   3.1000  -0.7599   4.2581  -1.1069   4.5219   58.551   25.463   59.386   26.023 -0.8349609 36.40779 
1 1 1    5    6   35 o  486.740   6.4499  181.383   4.8053  193.974   6.6737  167.828   6.9246  503.274   8.6635  468.090   9.6649 35.18387 12.97945 
1 1 1    5    6   36 f  517.745   6.1383  205.226   4.8644  209.507   7.0130  201.257   6.7531  523.015   8.7603  512.622   8.6067 10.39368 12.28078 
1 1 1    5    6   37 o  504.709   8.2041  195.094   6.3378  194.886   11.828  195.178   7.5063  503.974   15.333  504.741   9.7161 -0.7673950 18.15252 
1 1 1    5    6   38 o  290.341   8.5895   64.574   3.8172   66.451   5.5140   62.847   5.2897  294.390   12.237  286.301   12.071 8.088623 17.18852 
1 1 1    5    6   39 o  207.849   11.199   33.219   3.5497   36.987   5.0902   29.652   4.9526  218.936   15.285  195.735   16.690 23.20111 22.63219 
1 1 1    5    6   40 o  524.285   6.6077  210.522   5.3026  211.322   7.9013  209.867   7.1525  525.043   9.8318  523.307   8.9296 1.735901 13.28160 
1 1 1    5    6   41 o  322.995   8.4544   79.954   4.1797   73.671   5.6652   87.460   6.1919  309.827   11.946  337.575   11.983 -27.74844 16.92082 
1 1 1    5    6   42 o  304.706   9.4235   71.199   4.3951   77.282   5.4382   59.744   7.4626  317.325   11.197  277.877   17.637 39.44791 20.89085 
1 1 1    5    6   43 o  300.849   8.4359   69.396   3.8846   71.094   5.5198   67.729   5.4680  304.236   11.853  296.932   12.031 7.304108 16.88928 
1 1 1    5    6   44 o  553.872   7.1349  235.129   6.0488  234.976   8.2865  235.303   8.8498  553.329   9.7841  553.607   10.444 -0.2777100 14.31093 
1 1 1    5    6   45 o  360.178   7.4536   99.463   4.1091   98.508   5.9096  100.358   5.7176  358.090   10.782  361.492   10.333 -3.402161 14.93416 
1 1 1    5    6   46 f  735.269   6.0564  414.300   6.8160  423.159   9.8321  406.103   9.4573  742.570   8.6505  727.488   8.4932 15.08264 12.12289 
1 1 1    5    6   47 o  171.398   13.079   22.769   3.4052   22.264   4.6784   23.339   4.9658  168.427   18.449  172.327   19.150 -3.899521 26.59159 
1 1 1    5    6   48 o  193.995   11.890   29.095   3.5136   29.658   4.9902   28.542   4.9481  194.883   16.896  191.110   17.096 3.772278 24.03673 
1 1 1    5    6   49 o  155.745   20.215   19.248   4.7054   9.3942   9.6839   22.293   5.3836  114.283   42.072  167.426   21.505 -53.14313 47.24923 
1 1 1    5    6   50 o  155.114   14.721   18.804   3.4533   12.684   4.8095   25.317   4.9616  124.182   26.130  179.277   18.339 -55.09482 31.92366 
1 1 1    5    6   51 o  456.720   7.3916  160.192   5.1672  158.259   7.0482  162.439   7.5980  453.260   10.159  459.010   10.814 -5.749359 14.83782 
1 1 1    5    6   52 f  332.093   8.7718   84.844   4.4588   81.837   6.5726   87.409   6.0689  325.084   13.209  336.371   11.787 -11.28693 17.70367 
1 1 1    5    6   53 o  290.733   9.3028   65.102   4.1398   71.390   5.9074   59.034   5.8030  303.617   12.712  275.821   13.745 27.79633 18.72228 
1 1 1    5    6   54 o  163.921   17.194   21.258   4.2497   17.341   5.3601   27.888   6.9733  145.203   25.020  184.811   25.317 -39.60851 35.59421 
1 1 1    5    6   55 o  115.365   24.095   11.043   4.1175   11.932   5.5416   9.9464   6.1523  118.086   30.460  108.196   33.612 9.890572 45.35987 
1 1 1    5    6   56 o   72.949   26.116   3.8419   3.6973   2.5193   5.1419   5.2578   5.3202   73.395   29.634   85.163   31.209 -11.76838 43.03710 
1 1 1    5    6   57 f  103.803   24.743   9.0690   3.8756   5.2257   5.5477   12.733   5.4167   85.422   31.768  121.626   29.418 -36.20324 43.29632 
1 1 1    5    6   58 o  238.367   12.314   44.313   4.4775   42.785   6.0438   46.172   6.6662  232.196   17.126  240.696   18.229 -8.499817 25.01237 
1 1 1    5    6   59 f   54.602   24.042  -0.5695   3.9006  -1.9221   5.4571   0.8434   5.5774   60.764   27.468   69.028   29.571 -8.263527 40.36029 
1 1 1    5    6   60 o  191.925   17.831   29.615   5.1783   36.598   8.7922   25.907   6.4074  206.287   28.616  175.754   24.483 30.53270 37.66053 
1 1 1    5    6   61 o  114.922   22.090   11.139   3.7444   9.4877   5.1421   13.004   5.4634  102.806   30.489  120.412   29.803 -17.60571 42.63572 
1 1 1    5    6   62 o  212.798   12.487   35.665   4.0495   32.872   5.6078   38.708   5.8537  200.955   18.437  218.717   17.635 -17.76233 25.51341 
1 1 1    5    6   63 o  114.230   23.294   11.323   3.9348   14.657   5.7939   8.4703   5.3605  125.561   30.459   95.718   31.547 29.84316 43.85162 
1 1 1    5    6   64 o   49.678   22.635  -1.4668   3.7966   0.9804   4.8955  -5.1600   6.0139   63.396   27.435   55.021   26.164 8.375214 37.91135 
1 1 1    5    6   65 o   79.140   26.394   5.6217   3.7483   4.2302   5.3666   6.9471   5.2375   75.529   30.352   86.430   31.068 -10.90133 43.43383 
1 1 1    5    7    1 f  1611.77   11.972  1989.51   29.535  2016.37   36.773  1940.67   49.578  1622.33   14.809  1590.84   20.361 31.48718 25.17660 
1 1 1    5    7    2 f  1132.77   10.927  982.588   18.946  1003.28   27.442  963.747   26.190  1144.29   15.668  1121.55   15.256 22.73450 21.86860 
1 1 1    5    7    3 o  1091.01   10.648  911.452   17.782  932.877   25.787  892.030   24.553  1103.43   15.268  1079.04   14.866 24.39563 21.30997 
1 1 1    5    7    4 o  431.775   6.7522  142.710   4.4624  135.150   6.2112  150.774   6.4154  420.135   9.6586  443.759   9.4451 -23.62411 13.50920 
1 1 1    5    7    5 o  1934.75   14.180  2867.66   41.994  2922.30   74.496  2842.22   50.841  1951.02   24.946  1925.68   17.249 25.34387 30.32877 
1 1 1    5    7    6 o  444.632   4.8931  151.320   3.3301  151.667   4.6878  150.966   4.7314  445.116   6.8806  444.083   6.9607 1.032013 9.787496 
1 1 1    5    7    7 f  876.577   6.5585  588.193   8.7997  597.619   12.629  579.299   12.268  883.468   9.3395  869.827   9.2142 13.64178 13.11977 
1 1 1    5    7    8 o  620.090   5.5174  294.322   5.2367  296.903   7.4393  291.786   7.3729  622.750   7.8046  617.360   7.8024 5.389832 11.03582 
1 1 1    5    7    9 o  763.846   6.1186  446.629   7.1537  453.138   10.240  440.424   9.9983  769.305   8.6960  758.440   8.6126 10.86536 12.23915 
1 1 1    5    7   10 o  982.661   7.1612  739.242   10.771  718.538   14.814  762.460   15.688  968.657   9.9918  997.805   10.272 -29.14825 14.33019 
1 1 1    5    7   11 o  694.006   8.3068  368.780   8.8241  370.628   12.696  367.052   12.273  695.573   11.925  692.227   11.583 3.345520 16.62455 
1 1 1    5    7   12 f  1274.02   8.6551  1242.88   16.878  1224.52   19.166  1306.33   35.622  1264.47   9.9026  1304.99   17.834 -40.51819 20.39849 
1 1 1    5    7   13 o  222.903   5.1910   38.033   1.7711   35.194   2.1853   43.469   3.0234  214.407   6.6588  238.260   8.2905 -23.85318 10.63347 
1 1 1    5    7   14 o  974.175   5.8956  726.518   8.7910  725.495   12.369  727.562   12.496  973.342   8.3026  974.723   8.3758 -1.380493 11.79351 
1 1 1    5    7   15 o  602.494   4.7153  277.865   4.3484  279.694   6.1607  276.050   6.1386  604.412   6.6593  600.461   6.6790 3.950623 9.431618 
1 1 1    5    7   16 f  715.476   5.0660  391.865   5.5479  405.344   8.0265  379.534   7.6770  727.585   7.2073  704.044   7.1240 23.54102 10.13391 
1 1 1    5    7   17 o  502.012   5.0973  192.919   3.9167  190.460   4.9421  197.074   6.4226  498.763   6.4736  507.284   8.2716 -8.521423 10.50367 
1 1 1    5    7   18 o  481.344   5.0107  177.359   3.6917  185.054   5.9371  172.509   4.7137  491.588   7.8904  474.678   6.4877 16.90988 10.21516 
1 1 1    5    7   19 o  656.431   4.9703  329.848   4.9939  316.884   8.3462  337.077   6.2327  643.267   8.4768  663.547   6.1367 -20.28046 10.46494 
1 1 1    5    7   20 o  1076.50   6.4675  887.195   10.657  881.915   15.054  892.498   15.088  1073.11   9.1653  1079.53   9.1309 -6.421875 12.93740 
1 1 1    5    7   21 o  691.903   4.8633  366.443   5.1505  376.272   8.1139  359.809   6.6656  701.033   7.5617  685.569   6.3521 15.46466 9.875679 
1 1 1    5    7   22 o  111.130   8.5605   9.5123   1.4449   9.0172   2.1117   9.9482   1.9814  107.695   13.079  113.372   11.580 -5.677216 17.46907 
1 1 1    5    7   23 o  640.982   4.5061  314.474   4.4209  322.626   6.4317  307.173   6.0869  649.194   6.4726  633.461   6.2777 15.73279 9.016935 
1 1 1    5    7   24 o  1084.41   6.6519  900.181   11.041  944.754   20.383  881.672   13.135  1110.62   11.990  1073.14   7.9966 37.47986 14.41208 
1 1 1    5    7   25 o  686.929   4.9986  361.178   5.2557  357.760   7.0118  365.560   7.9398  683.636   6.7010  691.027   7.5066 -7.391602 10.06241 
1 1 1    5    7   26 o  439.977   4.7854  148.167   3.2227  140.597   4.4900  156.210   4.6282  428.564   6.8448  451.736   6.6936 -23.17188 9.573688 
1 1 1    5    7   27 o  362.020   5.4974  100.317   3.0462  105.227   4.7276   96.831   3.9834  370.735   8.3312  355.654   7.3173 15.08136 11.08838 
1 1 1    5    7   28 o  352.078   5.4614   94.883   2.9432   95.992   4.2629   93.873   4.0684  354.098   7.8653  350.173   7.5906 3.925201 10.93068 
1 1 1    5    7   29 o  202.297   7.9886   31.331   2.4736   28.827   3.6100   33.548   3.3962  193.608   12.245  209.030   10.650 -15.42165 16.22850 
1 1 1    5    7   30 o  1522.63   7.9765  1775.02   18.590  1779.88   24.652  1768.61   28.306  1524.48   10.565  1519.47   12.171 5.009888 16.11633 
1 1 1    5    7   31 o  681.179   5.7271  355.188   5.9712  352.559   7.9248  358.642   9.0821  678.594   7.6297  684.384   8.6700 -5.789795 11.54909 
1 1 1    5    7   32 o  336.271   7.1780   86.573   3.6946   88.610   5.8773   85.241   4.7505  340.111   11.290  333.632   9.3026 6.478912 14.62868 
1 1 1    5    7   33 o  977.093   6.2780  730.880   9.3892  735.040   14.365  727.778   12.406  979.667   9.5796  974.903   8.3140 4.764526 12.68428 
1 1 1    5    7   34 o  270.035   8.5300   55.841   3.5256   57.150   4.9460   54.488   5.0270  273.104   11.832  266.656   12.316 6.448273 17.07896 
1 1 1    5    7   35 o  420.236   6.4458  135.205   4.1461  141.081   6.0907  130.130   5.6599  429.182   9.2717  412.199   8.9709 16.98273 12.90118 
1 1 1    5    7   36 o  301.501   9.8935   69.639   4.5657   49.553   9.7702   75.251   5.1643  252.332   25.653  313.385   10.766 -61.05226 27.82079 
1 1 1    5    7   37 o  416.107   8.7529  132.627   5.5748  159.075   11.481  124.467   6.3770  455.202   16.478  403.033   10.337 52.16809 19.45200 
1 1 1    5    7   38 o  714.526   5.8597  390.906   6.4086  395.426   9.2183  386.678   8.9154  718.474   8.3825  710.497   8.1980 7.976868 11.72491 
1 1 1    5    7   39 o  540.317   6.1380  223.557   5.0762  222.044   7.2937  224.977   7.0693  538.319   8.8520  541.886   8.5231 -3.567139 12.28826 
1 1 1    5    7   40 o  593.676   6.3101  269.927   5.7340  276.874   8.6326  264.442   7.6706  601.009   9.3841  587.442   8.5309 13.56744 12.68215 
1 1 1    5    7   41 o  172.480   13.200   22.981   3.4583   18.714   4.8675   27.331   4.9145  154.269   21.172  187.620   17.308 -33.35062 27.34673 
1 1 1    5    7   42 o  607.820   7.0327  283.070   6.5428  279.270   8.0878  290.267   11.130  603.535   8.7550  614.847   11.827 -11.31268 14.71478 
1 1 1    5    7   43 o  444.544   6.9141  151.434   4.7046  155.565   6.4885  146.856   6.8314  450.321   9.4135  437.443   10.203 12.87747 13.88200 
1 1 1    5    7   44 o  348.679   9.1997   93.282   4.9099   94.568   6.4067   91.451   7.6429  350.771   11.933  344.592   14.490 6.179169 18.77142 
1 1 1    5    7   45 o  263.109   9.0547   53.126   3.6465   55.427   5.2835   51.032   5.0391  268.372   12.862  257.521   12.784 10.85071 18.13473 
1 1 1    5    7   46 o  195.434   11.698   29.485   3.4833   26.479   4.8354   32.728   5.0221  184.176   17.357  205.178   16.121 -21.00233 23.68899 
1 1 1    5    7   47 o  287.267   8.5197   63.349   3.7461   61.834   5.4122   64.741   5.1904  283.320   12.480  290.018   11.692 -6.698395 17.10183 
1 1 1    5    7   48 o  264.155   9.9370   53.650   4.0178   55.243   6.2553   52.531   5.2420  266.759   15.385  260.602   13.185 6.156830 20.26185 
1 1 1    5    7   49 o   77.623   26.933   4.3793   3.9092   3.8146   6.4663   4.7045   4.9076   85.491   33.655   82.845   30.033 2.646416 45.10670 
1 1 1    5    7   50 o  141.395   15.575   15.698   3.3149   18.874   4.7067   12.572   4.6697  153.900   20.489  123.741   25.503 30.15994 32.71420 
1 1 1    5    7   51 o  258.084   9.9362   51.299   3.9251   49.246   5.9213   52.909   5.2424  251.286   15.470  261.161   13.157 -9.874359 20.30817 
1 1 1    5    7   52 o   83.817   24.576   5.7162   3.3573  -0.1460   4.7303   11.666   4.7657   62.507   27.010  118.380   26.911 -55.87264 38.12772 
1 1 1    5    7   53 o   78.407   25.167   4.8597   3.4235   2.4200   4.7334   7.5358   4.9574   71.554   28.594   95.950   30.231 -24.39527 41.61147 
1 1 1    5    7   54 o  351.149   9.3813   95.036   5.0422   93.509   6.4243   97.485   8.1371  347.515   12.078  353.701   15.030 -6.186340 19.28141 
1 1 1    5    7   55 o  103.932   25.644   9.0628   4.0544   11.998   5.5235   5.6335   5.9701  118.371   30.344   88.924   32.977 29.44707 44.81394 
1 1 1    5    7   56 o  203.090   12.799   32.171   3.9584   30.230   5.7038   33.974   5.4979  194.478   19.421  207.065   17.511 -12.58731 26.14970 
1 1 1    5    7   57 o  169.885   15.657   22.810   4.0254   24.929   5.9134   20.981   5.4950  174.798   22.634  159.942   23.117 14.85530 32.35209 
1 1 1    5    7   58 f  147.770   19.005   17.626   4.1990   13.447   5.7238   22.496   6.1788  124.112   30.376  164.171   25.410 -40.05842 39.60266 
1 1 1    5    7   59 o  139.375   19.104   15.778   3.9683   15.417   5.6895   16.119   5.5376  133.252   28.740  137.048   27.357 -3.795456 39.67871 
1 1 1    5    7   60 o  116.314   27.972   11.863   4.9190   7.0850   8.7092   14.102   5.9608   97.702   38.868  125.339   31.194 -27.63711 49.83770 
1 1 1    5    7   61 o   80.558   26.321   5.4568   3.7346  -0.3797   5.0865   12.283   5.5008   61.936   27.353  116.530   30.489 -54.59402 40.96035 
1 1 1    5    7   62 o  173.826   16.370   24.357   4.3040   17.525   5.8204   32.601   6.3936  140.496   28.048  197.926   21.447 -57.43057 35.30841 
1 1 1    5    7   63 o   44.248   20.872  -3.3480   3.6831  -9.8603   5.3071   2.7029   5.1157   44.283   21.837   70.682   29.171 -26.39952 36.43933 
1 1 1    5    7   64 f   77.745   26.627   5.2736   3.8155  -0.0917   4.8497   13.990   6.1813   59.858   26.558  119.189   32.834 -59.33097 42.23050 
1 1 1    5    7   65 o   57.268   24.749   0.7185   3.9726  -6.2111   5.3095   9.5313   5.9877   48.882   23.594   97.577   33.357 -48.69490 40.85765 
1 1 1    5    8    0 o  289.149   8.8416   64.178   3.9048   64.178   3.9048   64.178   3.9048  289.149   8.8416  289.149   8.8416 0.000000 0.000000 
1 1 1    5    8    1 o  957.943   7.9025  702.518   11.587  701.229   14.172  705.116   20.123  956.989   9.6752  959.407   13.703 -2.418518 16.77471 
1 1 1    5    8    2 o  707.151   11.337  382.957   12.271   0.0000   0.0000  382.957   12.271  ?   ?   707.151   11.337 0.000000 11.33686 
1 1 1    5    8    3 o  1762.95   22.576  2384.90   60.919   0.0000   0.0000  2384.90   60.919  ?   ?   1762.95   22.576 0.000000 22.57567 
1 1 1    5    8    4 o  1401.81   10.708  1504.82   22.977  1513.11   28.343  1488.91   39.242  1405.45   13.175  1393.56   18.397 11.89148 22.62837 
1 1 1    5    8    5 o  658.083   6.4475  331.512   6.4945  333.214   7.9844  328.182   11.164  659.734   7.9069  654.624   11.142 5.109741 13.66274 
1 1 1    5    8    6 o  642.616   5.5683  316.095   5.4770  306.292   7.5353  327.076   7.9747  632.520   7.7831  653.623   7.9711 -21.10321 11.14070 
1 1 1    5    8    7 o  668.447   5.7045  342.023   5.8365  339.897   8.1815  344.226   8.3286  666.304   8.0222  670.531   8.1149 -4.226685 11.41083 
1 1 1    5    8    8 o  1118.22   9.0199  957.430   15.438  959.982   26.805  956.164   18.885  1119.15   15.648  1117.34   11.042 1.810303 19.15200 
1 1 1    5    8    9 o  754.362   7.0668  435.651   8.1597  424.274   13.824  441.734   10.108  744.214   12.136  759.548   8.6948 -15.33392 14.92908 
1 1 1    5    8   10 o  243.129   6.3446   45.252   2.3611   45.786   2.9842   44.357   3.8608  244.542   7.9728  240.656   10.481 3.885574 13.16883 
1 1 1    5    8   11 o  605.794   6.4624  280.947   5.9922  286.818   7.5123  270.677   9.9353  612.041   8.0191  594.449   10.919 17.59137 13.54762 
1 1 1    5    8   12 o  461.220   5.3482  162.838   3.7756  163.842   5.3457  161.838   5.3332  462.587   7.5500  459.749   7.5788 2.838440 10.69766 
1 1 1    5    8   13 o  633.723   5.1647  307.426   5.0097  314.785   6.5504  297.057   7.7757  641.213   6.6741  622.835   8.1564 18.37732 10.53900 
1 1 1    5    8   14 o  488.621   4.8812  182.758   3.6506  180.979   4.6289  185.686   5.9375  486.203   6.2200  492.432   7.8775 -6.229095 10.03710 
1 1 1    5    8   15 o  113.860   8.6206   9.9855   1.4912   9.9023   1.8407   10.144   2.5438  113.178   10.755  114.044   14.931 -0.8657990 18.40135 
1 1 1    5    8   16 o  677.405   5.4582  351.286   5.6594  351.353   7.2379  351.180   9.0782  677.408   6.9806  677.151   8.7588 0.2569580 11.20026 
1 1 1    5    8   17 o  599.761   5.2785  275.366   4.8457  274.921   6.1977  276.065   7.7723  599.227   6.7573  600.399   8.4574 -1.171936 10.82539 
1 1 1    5    8   18 o  283.091   7.6667   61.365   3.3220   66.625   5.6902   58.645   4.0917  294.841   12.609  276.704   9.6610 18.13696 15.88444 
1 1 1    5    8   19 o  385.658   5.3319  113.854   3.1474  116.439   5.3461  112.483   3.8937  389.928   8.9574  383.303   6.6367 6.624420 11.14813 
1 1 1    5    8   20 o  128.502   8.3663   12.698   1.6366   5.2630   3.4268   14.895   1.8627   82.515   24.985  139.189   8.7884 -56.67400 26.48574 
1 1 1    5    8   21 o  720.245   4.9182  397.075   5.4219  397.726   8.3610  396.602   7.1225  720.752   7.5789  719.772   6.4650 0.9797974 9.961697 
1 1 1    5    8   22 o  205.724   6.0799   32.397   1.9145   31.070   3.1098   33.207   2.4294  201.169   10.132  208.266   7.6210 -7.097702 12.67835 
1 1 1    5    8   23 o  805.212   5.7029  496.296   7.0287  482.657   12.250  502.990   8.5820  793.914   10.080  810.589   6.9170 -16.67468 12.22534 
1 1 1    5    8   24 o  544.017   5.1717  226.530   4.3064  222.979   6.3137  229.620   5.8889  539.689   7.6431  547.681   7.0248 -7.991882 10.38097 
1 1 1    5    8   25 o  1457.08   7.5572  1625.30   16.854  1654.01   26.263  1605.19   21.977  1469.59   11.675  1447.88   9.9167 21.70996 15.31852 
1 1 1    5    8   26 o  827.787   5.4143  524.497   6.8601  523.718   10.424  525.091   9.1110  827.090   8.2342  828.209   7.1871 -1.118469 10.92966 
1 1 1    5    8   27 o  981.734   5.5603  737.732   8.3553  740.729   11.911  734.828   11.724  983.643   7.9109  979.721   7.8180 3.921753 11.12225 
1 1 1    5    8   28 o  642.433   5.2169  315.910   5.1299  315.792   7.8190  315.999   6.7974  642.249   7.9539  642.487   6.9121 -0.2379761 10.53760 
1 1 1    5    8   29 o  709.581   5.5516  385.411   6.0296  393.720   8.0253  374.642   9.1366  717.140   7.3112  699.509   8.5334 17.63147 11.23712 
1 1 1    5    8   30 o  211.833   8.1487   34.357   2.6421   34.781   3.7500   33.939   3.7231  212.775   11.558  210.174   11.618 2.601013 16.38818 
1 1 1    5    8   31 o  288.345   8.0649   63.659   3.5595   63.918   4.8393   63.354   5.2538  288.875   10.945  287.576   11.936 1.298950 16.19418 
1 1 1    5    8   32 o  411.209   6.0682  129.445   3.8194  124.033   5.4902  134.520   5.3168  402.457   8.9125  419.143   8.2874 -16.68558 12.17024 
1 1 1    5    8   33 o  141.428   14.500   15.494   3.0945   16.211   4.3908   14.786   4.3618  143.862   20.522  137.112   21.490 6.750275 29.71476 
1 1 1    5    8   34 o  315.440   7.5532   76.189   3.6469   74.875   5.5007   77.219   4.8713  312.604   11.496  317.505   10.024 -4.900665 15.25243 
1 1 1    5    8   35 o  619.268   6.0191  293.595   5.7053  301.547   8.7604  287.738   7.5184  627.457   9.1216  612.978   8.0133 14.47974 12.14151 
1 1 1    5    8   36 o  439.983   7.0921  148.232   4.7762  145.014   7.7396  150.212   6.0698  434.984   11.625  442.840   8.9548 -7.856201 14.67376 
1 1 1    5    8   37 o  604.406   6.8687  279.733   6.3544  283.556   9.8199  276.979   8.3345  608.287   10.547  601.297   9.0557 6.989685 13.90127 
1 1 1    5    8   38 o  365.240   7.1636  102.166   4.0048   99.068   5.7369  105.111   5.5930  359.516   10.425  370.347   9.8666 -10.83176 14.35401 
1 1 1    5    8   39 o  844.394   6.2931  546.019   8.1336  533.115   12.055  556.804   11.020  834.021   9.4430  852.473   8.4456 -18.45178 12.66880 
1 1 1    5    8   40 f  797.237   5.9486  486.745   7.2589  476.382   10.237  497.225   10.295  788.435   8.4828  805.515   8.3496 -17.08038 11.90265 
1 1 1    5    8   41 o  138.556   15.415   14.947   3.2137   18.202   4.6369   11.938   4.4580  152.219   20.416  121.964   24.727 30.25539 32.06604 
1 1 1    5    8   42 o  626.762   6.5239  300.952   6.2586  294.888   8.1404  309.718   9.7874  620.181   8.5755  635.368   10.064 -15.18774 13.22209 
1 1 1    5    8   43 o  319.866   8.7191   78.468   4.2688   82.327   5.7297   73.653   6.3998  327.389   11.434  309.441   13.512 17.94858 17.70062 
1 1 1    5    8   44 o  163.720   13.304   20.760   3.3050   27.214   4.5360   13.458   4.8253  187.162   15.987  129.202   25.305 57.95993 29.93246 
1 1 1    5    8   45 o  250.660   9.3240   48.230   3.5773   51.524   5.0251   44.846   5.0938  258.745   12.688  240.873   13.875 17.87180 18.80163 
1 1 1    5    8   46 o  151.183   14.252   17.783   3.2590   19.446   4.5344   16.006   4.6873  157.151   19.254  141.623   22.366 15.52835 29.51158 
1 1 1    5    8   47 o  352.654   7.3935   95.404   3.9909   97.739   5.7629   93.252   5.5322  356.505   10.561  348.256   10.378 8.249329 14.80689 
1 1 1    5    8   48 o  189.887   13.039   27.951   3.7667   27.444   5.7923   28.322   4.9583  186.375   20.652  190.264   17.212 -3.888199 26.88397 
1 1 1    5    8   49 o  210.198   12.407   34.212   3.9741   26.413   6.7959   38.264   4.8991  181.143   25.193  221.885   14.505 -40.74187 29.06985 
1 1 1    5    8   50 o  493.800   6.6857  187.116   5.0532  180.162   7.1353  194.113   7.1574  483.837   9.6348  502.314   9.3091 -18.47675 13.39736 
1 1 1    5    8   51 o  370.641   7.7257  105.545   4.3829  105.274   6.4774  105.774   5.9525  369.303   11.459  370.434   10.498 -1.131012 15.54104 
1 1 1    5    8   52 o  149.466   15.003   17.532   3.3861   18.480   4.8311   16.618   4.7473  151.625   21.412  143.336   22.369 8.289383 30.96532 
1 1 1    5    8   53 o  524.457   8.3260  211.608   6.6837  220.865   7.8890  188.065   12.581  535.335   9.6278  490.533   16.756 44.80182 19.32538 
1 1 1    5    8   54 o  201.705   12.151   31.622   3.7341   32.629   5.3529   30.668   5.2115  203.304   17.368  197.026   17.462 6.277649 24.62893 
1 1 1    5    8   55 o   52.178   23.315  -1.2687   3.8062   0.6104   5.2274  -3.3889   5.5527   67.386   28.742   58.639   26.963 8.746353 39.40906 
1 1 1    5    8   56 o  154.837   15.964   18.976   3.7292   18.606   5.3903   19.315   5.1646  150.181   24.278  153.776   22.618 -3.595001 33.18084 
1 1 1    5    8   57 o  282.953   10.236   61.931   4.4334   70.776   6.2235   52.818   6.3170  301.307   13.494  258.867   16.022 42.43997 20.94734 
1 1 1    5    8   58 o  230.386   11.825   41.366   4.1558   40.923   6.0705   41.756   5.7014  226.680   17.635  229.621   16.328 -2.941025 24.03324 
1 1 1    5    8   59 o  129.634   22.493   13.994   4.3013   21.138   6.2564   7.5911   5.9233  157.535   26.913   95.159   33.145 62.37639 42.69525 
1 1 1    5    8   60 f  196.831   14.835   30.730   4.4364   32.599   7.1571   29.564   5.6536  197.255   24.213  190.549   19.667 6.706039 31.19423 
1 1 1    5    8   61 o  195.229   13.444   30.118   3.9929   24.232   5.4968   36.693   5.8099  170.869   21.493  213.028   17.986 -42.15912 28.02607 
1 1 1    5    8   62 o  175.904   15.643   24.861   4.1678   28.333   5.9650   21.549   5.8259  184.115   21.576  158.154   24.889 25.96136 32.93894 
1 1 1    5    8   63 o   70.527   25.912   3.8894   3.6708   0.4328   5.1602   7.4302   5.2228   63.425   27.796   90.294   31.142 -26.86925 41.74217 
1 1 1    5    8   64 o   57.436   24.622   0.8329   3.8715  -2.1674   4.9806   5.4130   6.1538   55.117   25.414   82.137   32.673 -27.02065 41.39317 
1 1 1    5    9    0 o  842.842   12.641  544.272   16.300  544.272   16.300  544.272   16.300  842.842   12.641  842.842   12.641 0.000000 0.000000 
1 1 1    5    9    1 o  632.030   6.2426  305.780   6.0391  308.702   7.4615  300.230   10.283  635.008   7.6768  626.136   10.729 8.871887 13.19298 
1 1 1    5    9    2 o  817.760   8.8005  512.011   11.016  517.826   15.746  506.438   15.416  822.209   12.512  813.125   12.386 9.084229 17.60576 
1 1 1    5    9    3 f  1282.52   12.187  1259.89   23.923  1273.39   34.253  1247.04   33.427  1288.81   17.364  1275.44   17.122 13.37537 24.38581 
1 1 1    5    9    4 o  816.577   8.8456  510.542   11.056  507.567   15.540  513.590   15.732  814.013   12.473  818.824   12.553 -4.811035 17.69563 
1 1 1    5    9    5 f  1052.82   10.515  848.859   16.944  854.196   24.113  843.655   23.814  1055.77   14.922  1049.25   14.828 6.525757 21.03636 
1 1 1    5    9    6 o  617.055   6.3675  291.472   6.0140  301.265   10.602  286.825   7.3027  627.178   11.044  612.079   7.7948 15.09924 13.51742 
1 1 1    5    9    7 o  928.655   7.9424  660.275   11.290  670.011   19.740  655.543   13.762  935.094   13.792  925.228   9.7179 9.865540 16.87177 
1 1 1    5    9    8 o  716.989   5.9641  393.522   6.5452  398.632   9.3460  388.604   9.1692  721.541   8.4624  712.409   8.4088 9.131653 11.92981 
1 1 1    5    9    9 o  1004.76   8.4074  773.014   12.930  761.700   15.584  798.008   23.163  997.263   10.209  1020.33   14.831 -23.06818 18.00551 
1 1 1    5    9   10 o  389.032   5.9583  115.859   3.5479  115.356   4.3972  116.798   6.0061  388.158   7.4011  390.507   10.048 -2.349091 12.47974 
1 1 1    5    9   11 o  726.639   6.1084  404.215   6.7938  403.168   9.5610  405.282   9.6555  725.586   8.6088  727.482   8.6712 -1.896118 12.21893 
1 1 1    5    9   12 o  571.500   5.6275  250.031   4.9227  249.629   6.9617  250.434   6.9617  570.959   7.9660  571.880   7.9532 -0.9208984 11.25658 
1 1 1    5    9   13 f  778.617   6.4119  464.142   7.6415  464.373   10.796  463.910   10.817  778.664   9.0586  778.274   9.0804 0.3894043 12.82618 
1 1 1    5    9   14 f  601.823   5.8429  277.281   5.3823  275.064   7.5695  279.548   7.6547  599.316   8.2517  604.179   8.2773 -4.863403 11.68778 
1 1 1    5    9   15 o  452.506   4.9340  156.743   3.4173  162.011   4.4155  148.875   5.3965  460.014   6.2710  440.919   7.9962 19.09528 10.16194 
1 1 1    5    9   16 o  738.273   6.3936  417.292   7.2249  420.809   10.267  413.842   10.169  741.236   9.0496  735.075   9.0378 6.161377 12.78968 
1 1 1    5    9   17 o  430.771   6.7770  142.073   4.4685  140.139   7.6711  143.067   5.4974  427.653   11.719  432.230   8.3095 -4.577301 14.36613 
1 1 1    5    9   18 o  1030.73   8.9096  813.616   14.056  826.808   24.695  807.293   17.096  1038.35   15.538  1026.55   10.880 11.79834 18.96858 
1 1 1    5    9   19 o  265.145   5.3736   53.815   2.1808   53.718   3.0190   53.920   3.1536  264.880   7.4464  265.372   7.7641 -0.4917603 10.75775 
1 1 1    5    9   20 o   96.774   11.387   7.2727   1.6544   7.2161   2.3853   7.3252   2.2965   95.595   16.921   96.452   16.124 -0.8576202 23.37355 
1 1 1    5    9   21 o  205.378   6.6702   32.290   2.0968   31.032   2.9832   33.518   2.9479  201.306   9.6816  209.220   9.2052 -7.914352 13.35926 
1 1 1    5    9   22 o  314.896   4.9478   75.899   2.3848   78.770   3.7762   73.994   3.0758  320.765   7.6913  310.904   6.4633 9.860291 10.04642 
1 1 1    5    9   23 o  159.867   8.2116   19.618   2.0026   21.885   4.2212   18.960   2.2749  168.162   16.617  157.071   9.5069 11.09032 19.14459 
1 1 1    5    9   24 o  656.429   5.2868  329.821   5.3119  344.750   7.9239  317.636   7.1585  671.066   7.7144  644.148   7.2605 26.91785 10.59373 
1 1 1    5    9   25 o  552.170   5.2995  233.371   4.4790  232.295   7.7120  233.919   5.5020  550.817   9.1472  552.797   6.5025 -1.980530 11.22297 
1 1 1    5    9   26 o  515.116   4.7387  203.096   3.7362  204.915   5.3814  201.403   5.1913  517.386   6.7954  512.936   6.6122 4.449890 9.481463 
1 1 1    5    9   27 o  1485.45   7.2419  1689.19   16.466  1693.60   23.385  1684.86   23.188  1487.17   10.273  1483.33   10.213 3.835327 14.48620 
1 1 1    5    9   28 o  895.703   5.4096  614.104   7.4166  611.762   10.499  616.437   10.479  893.916   7.6731  897.328   7.6292 -3.411377 10.82039 
1 1 1    5    9   29 o  988.119   6.1420  747.412   9.2894  757.100   12.389  734.970   14.040  994.413   8.1394  979.706   9.3627 14.70673 12.40601 
1 1 1    5    9   30 o  561.749   5.6095  241.555   4.8232  244.360   6.3945  237.852   7.3462  564.957   7.3947  557.347   8.6113 7.610596 11.35059 
1 1 1    5    9   31 o   44.346   19.457  -0.6649   2.5350   4.0200   3.8825  -4.1463   3.3469   76.793   26.830   41.371   19.628 35.42246 33.24290 
1 1 1    5    9   32 o  224.634   8.7973   38.641   3.0248   37.328   4.1613   40.113   4.4044  220.370   12.387  228.450   12.645 -8.079956 17.70138 
1 1 1    5    9   33 o  1076.86   6.5888  887.799   10.860  899.179   14.692  874.092   16.125  1083.58   8.8584  1068.27   9.8616 15.30713 13.25601 
1 1 1    5    9   34 f  1084.18   6.2768  899.916   10.416  892.987   14.803  906.710   14.659  1079.80   8.9567  1088.08   8.8020 -8.279297 12.55781 
1 1 1    5    9   35 o  634.895   5.9890  308.603   5.8201  308.667   8.8419  308.554   7.7312  634.811   9.0997  634.757   7.9574 0.5413818E-01 12.08821 
1 1 1    5    9   36 o  465.026   8.5797  165.635   6.1069  167.056   15.842  165.387   6.6184  465.922   22.214  464.644   9.3060 1.278687 24.08426 
1 1 1    5    9   37 o  469.936   6.2811  169.097   4.5180  164.690   6.5040  173.206   6.2806  463.640   9.1650  475.505   8.6293 -11.86469 12.58815 
1 1 1    5    9   38 o  643.010   6.0941  316.602   5.9978  322.114   9.0971  312.364   7.9772  648.359   9.1668  638.553   8.1618 9.806274 12.27378 
1 1 1    5    9   39 o  588.328   6.2140  265.073   5.5958  269.815   8.4785  261.414   7.4484  593.320   9.3360  584.099   8.3312 9.220703 12.51280 
1 1 1    5    9   40 o  339.777   7.3825   88.449   3.8394   96.134   5.6628   81.910   5.2233  354.040   10.450  326.801   10.442 27.23956 14.77296 
1 1 1    5    9   41 o  213.112   10.145   34.839   3.3093   32.868   4.6639   36.837   4.6963  206.196   14.877  218.452   14.121 -12.25597 20.51181 
1 1 1    5    9   42 o  492.815   6.8226  186.091   5.1464  184.877   6.6780  187.867   8.0758  491.001   8.8857  494.736   10.665 -3.735229 13.88127 
1 1 1    5    9   43 o  173.756   13.672   23.372   3.6069   23.023   4.7076   23.870   5.6128  171.688   18.191  174.176   21.510 -2.488052 28.17115 
1 1 1    5    9   44 o  580.112   5.9619  257.846   5.2937  254.887   7.5396  260.724   7.4345  576.426   8.5454  583.022   8.3310 -6.595947 11.93440 
1 1 1    5    9   45 o   70.509   23.390   3.6982   2.9451   7.2282   4.1421   0.0888   4.1884   94.760   27.158   60.408   25.745 34.35252 37.42192 
1 1 1    5    9   46 o  369.443   7.3203  104.682   4.1395  104.239   5.6228  105.205   6.1164  368.322   9.9737  369.896   10.803 -1.574280 14.70313 
1 1 1    5    9   47 o  345.359   7.6590   91.522   4.0487   91.422   5.6147   91.630   5.8435  344.750   10.640  345.070   11.064 -0.3203430 15.34984 
1 1 1    5    9   48 o  212.691   13.844   35.097   4.4823   16.788   9.8707   39.854   5.0309  140.467   42.375  226.538   14.586 -86.07079 44.81555 
1 1 1    5    9   49 o  469.455   6.6132  169.079   4.7520  168.590   6.7659  169.556   6.6756  468.181   9.4414  469.558   9.2882 -1.376648 13.24431 
1 1 1    5    9   50 o  266.525   9.2110   54.651   3.7576   59.707   5.4434   50.047   5.1936  277.906   12.797  253.969   13.408 23.93716 18.53451 
1 1 1    5    9   51 o  230.267   10.432   40.873   3.6769   37.033   5.3042   44.425   5.1015  217.562   16.041  238.983   14.007 -21.42094 21.29632 
1 1 1    5    9   52 o  300.196   8.6845   69.342   3.9904   70.624   5.6944   68.106   5.5936  302.136   12.313  296.699   12.317 5.437256 17.41629 
1 1 1    5    9   53 o   77.779   26.239   4.6419   3.7045   6.1109   4.6081   1.9580   6.2287   87.932   29.262   77.174   32.047 10.75723 43.39658 
1 1 1    5    9   54 o  262.212   10.142   53.069   4.0703   54.019   5.9567   52.237   5.5748  262.875   14.865  258.753   14.129 4.122894 20.50894 
1 1 1    5    9   55 o  288.351   10.082   64.216   4.4497   66.749   5.9445   60.987   6.7107  293.019   13.254  278.761   15.793 14.25745 20.61742 
1 1 1    5    9   56 f  324.877   8.8640   81.390   4.4078   79.114   6.3591   83.494   6.1151  318.910   13.027  327.951   12.182 -9.040497 17.83582 
1 1 1    5    9   57 o   70.072   25.743   3.4089   3.6229   8.0514   5.0555  -1.4922   5.1944   97.410   30.503   60.647   27.158 36.76352 40.84059 
1 1 1    5    9   58 o  104.004   23.873   9.1347   3.7200   7.7933   5.3169   10.421   5.2066   95.865   31.410  109.184   30.158 -13.31877 43.54414 
1 1 1    5    9   59 f  157.268   21.273   20.325   4.9893   8.9849   9.5572   24.574   5.8497  105.548   41.100  172.352   22.728 -66.80499 46.96572 
1 1 1    5    9   60 o  156.537   16.509   19.681   3.8958   23.751   5.5009   15.584   5.5182  169.385   21.717  133.448   27.913 35.93723 35.36656 
1 1 1    5    9   61 o   84.731   25.890   6.1941   3.6675   2.4120   5.0829   10.302   5.2970   70.679   29.113  106.459   30.771 -35.77955 42.36066 
1 1 1    5    9   62 o  111.973   23.538   10.864   3.9061   6.5557   5.6471   14.817   5.4086   87.707   32.152  128.232   28.313 -40.52537 42.84108 
1 1 1    5    9   63 o  129.401   19.949   14.112   3.8243   15.662   5.2675   12.386   5.5611  131.731   27.031  114.062   31.029 17.66901 41.15158 
1 1 1    5    9   64 f   43.631   20.778  -3.9132   3.8204  -4.7459   4.8204  -2.5067   6.2648   48.680   23.226   60.908   28.230 -12.22777 36.55675 
1 1 1    5   10    0 o  2254.68   28.370  3902.04   97.872  3902.04   97.872  3902.04   97.872  2254.68   28.370  2254.68   28.370 0.000000 0.000000 
1 1 1    5   10    1 o  1931.15   14.172  2857.67   41.892  2885.09   51.923  2806.53   70.905  1939.77   17.488  1911.51   24.234 28.25330 29.88524 
1 1 1    5   10    2 o  859.510   9.1640  565.679   12.056  586.248   17.643  547.660   16.513  874.752   13.177  845.502   12.760 29.25006 18.34221 
1 1 1    5   10    3 o  926.028   9.6244  656.664   13.642  672.646   19.775  642.153   18.843  936.938   13.789  915.482   13.447 21.45667 19.26048 
1 1 1    5   10    4 o  328.910   5.6979   82.811   2.8686   84.960   3.5780   78.944   4.7993  333.132   7.0171  321.075   9.7657 12.05746 12.02529 
1 1 1    5   10    5 o  938.163   8.0008  673.881   11.489  671.005   14.042  679.705   19.982  936.058   9.8009  941.804   13.861 -5.745300 16.97618 
1 1 1    5   10    6 o  690.508   8.2800  365.077   8.7512  365.077   8.7512   0.0000   0.0000  690.508   8.2800  ?   ?  0.000000 8.280029 
1 1 1    5   10    7 o  1108.51   7.7993  940.834   13.233  960.817   19.117  922.450   18.336  1119.96   11.152  1097.40   10.916 22.56775 15.60561 
1 1 1    5   10    8 o  967.934   8.2218  717.394   12.181  719.995   14.956  712.269   20.992  969.561   10.078  963.971   14.228 5.589905 17.43542 
1 1 1    5   10    9 o  509.528   5.3848  198.738   4.1996  203.383   5.9909  194.250   5.8888  515.388   7.5943  503.681   7.6384 11.70618 10.77115 
1 1 1    5   10   10 o  320.586   5.4416   78.676   2.6702   77.228   3.7078   80.235   3.8485  317.584   7.6277  323.705   7.7674 -6.120880 10.88640 
1 1 1    5   10   11 o  794.813   6.4262  483.650   7.8178  482.465   10.999  484.860   11.114  793.693   9.0540  795.656   9.1258 -1.962830 12.85514 
1 1 1    5   10   12 o  663.043   5.9813  336.564   6.0703  339.205   8.6099  333.954   8.5597  665.529   8.4521  660.356   8.4686 5.172424 11.96469 
1 1 1    5   10   13 o  418.494   5.5519  134.075   3.5563  133.795   5.0208  134.357   5.0380  417.995   7.8474  418.872   7.8580 -0.8768921 11.10541 
1 1 1    5   10   14 o  1135.56   8.1080  987.489   14.093  981.539   19.808  993.588   20.055  1131.79   11.434  1138.71   11.506 -6.916260 16.22143 
1 1 1    5   10   15 o  106.136   16.545   8.8480   2.6002   0.0000   0.0000   8.8480   2.6002  ?   ?   106.136   16.545 0.000000 16.54519 
1 1 1    5   10   16 o  658.868   12.670  332.700   12.777   0.0000   0.0000  332.700   12.777  ?   ?   658.868   12.670 0.000000 12.66963 
1 1 1    5   10   17 o  695.150   13.019  370.346   13.853   0.0000   0.0000  370.346   13.853  ?   ?   695.150   13.019 0.000000 13.01932 
1 1 1    5   10   18 o  811.506   6.8082  504.170   8.4566  514.422   12.139  494.502   11.788  819.567   9.6765  803.547   9.5842 16.01947 13.61950 
1 1 1    5   10   19 o  445.668   4.8867  152.032   3.3335  152.188   4.6736  151.870   4.7559  445.861   6.8484  445.392   6.9763 0.4682617 9.775907 
1 1 1    5   10   20 o  684.522   5.8223  358.681   6.1003  351.042   7.7160  371.414   9.9625  677.148   7.4446  696.448   9.3456 -19.30078 11.94832 
1 1 1    5   10   21 o  625.979   5.1948  299.935   4.9773  295.218   6.9669  304.853   7.1134  620.989   7.3297  631.040   7.3647 -10.05115 10.39051 
1 1 1    5   10   22 o  674.899   5.9564  348.659   6.1531  354.599   10.079  345.129   7.7688  680.516   9.6763  671.435   7.5593 9.081665 12.27903 
1 1 1    5   10   23 o  819.528   6.2632  514.109   7.8565  494.691   9.9004  547.133   12.911  803.849   8.0465  845.308   9.9789 -41.45880 12.81888 
1 1 1    5   10   24 o  774.813   6.2366  459.537   7.3964  444.529   11.187  471.191   9.8584  761.953   9.5924  784.520   8.2098 -22.56647 12.62592 
1 1 1    5   10   25 o  199.243   7.1496   30.389   2.1804   30.893   3.5195   30.075   2.7776  200.514   11.516  198.195   9.1562 2.319901 14.71210 
1 1 1    5   10   26 o  440.814   5.2706  148.736   3.5562  146.039   5.6073  150.550   4.5995  436.750   8.3878  443.474   6.7761 -6.723999 10.78288 
1 1 1    5   10   27 o  399.896   5.5538  122.408   3.3994  124.742   5.4134  120.889   4.3681  403.637   8.7621  397.383   7.1814 6.254089 11.32907 
1 1 1    5   10   28 o  327.008   6.9835   81.862   3.4954   79.546   4.9266   84.210   4.9602  322.298   9.9866  331.617   9.7722 -9.319305 13.97236 
1 1 1    5   10   29 f  544.145   5.5899  226.651   4.6557  229.443   6.0415  222.567   7.3056  547.450   7.2099  539.138   8.8529 8.312256 11.41740 
1 1 1    5   10   30 o  420.517   6.3903  135.373   4.1131  144.946   5.7830  125.572   5.8513  435.079   8.6839  404.941   9.4404 30.13815 12.82697 
1 1 1    5   10   31 o  569.255   5.3624  248.055   4.6724  246.849   6.7190  249.184   6.5019  567.804   7.7310  570.492   7.4459 -2.687988 10.73362 
1 1 1    5   10   32 o  317.744   7.1308   77.299   3.4680   81.412   4.8072   72.835   5.0080  326.032   9.6330  308.355   10.611 17.67706 14.33117 
1 1 1    5   10   33 o  511.324   5.7443  200.151   4.4957  203.540   6.4294  196.908   6.2888  515.559   8.1475  507.092   8.1023 8.466675 11.49038 
1 1 1    5   10   34 o  471.441   5.9294  170.153   4.2787  171.919   6.0925  168.435   6.0103  473.801   8.4009  468.976   8.3728 4.824219 11.86087 
1 1 1    5   10   35 o  167.247   11.901   21.547   3.0268   24.737   4.4380   18.773   4.1387  178.786   16.400  155.365   17.721 23.42104 24.14527 
1 1 1    5   10   36 o  656.857   7.8675  330.446   7.9100  336.088   18.714  329.219   8.7280  661.339   18.487  655.582   8.6980 5.757263 20.43122 
1 1 1    5   10   37 o  647.248   6.0219  320.773   5.9659  324.754   8.9947  317.645   7.9717  651.052   9.0261  643.957   8.0877 7.095093 12.11946 
1 1 1    5   10   38 o  440.883   6.5720  148.862   4.4350  154.461   6.6359  144.342   5.9621  448.920   9.6574  434.009   8.9749 14.91022 13.18386 
1 1 1    5   10   39 o  229.844   9.5414   40.498   3.3567   33.913   4.8489   46.557   4.6515  209.518   15.224  245.990   12.394 -36.47260 19.63101 
1 1 1    5   10   40 o  259.372   8.7048   51.567   3.4558   46.152   4.9437   56.742   4.8328  244.766   13.245  271.908   11.612 -27.14229 17.61434 
1 1 1    5   10   41 o  612.449   6.4601  287.349   6.0559  283.997   7.8054  292.419   9.5988  608.660   8.3782  617.378   10.158 -8.717163 13.16714 
1 1 1    5   10   42 o  241.393   9.2001   44.697   3.3993   46.394   4.9458   43.178   4.6799  245.284   13.222  236.639   12.970 8.645111 18.52134 
1 1 1    5   10   43 o  487.696   7.1309  182.307   5.3231  185.943   7.1999  177.923   7.9054  492.235   9.5562  481.331   10.730 10.90421 14.36873 
1 1 1    5   10   44 o  562.148   6.0432  242.144   5.1998  237.234   7.4229  246.876   7.2864  556.050   8.7214  567.291   8.3915 -11.24084 12.10290 
1 1 1    5   10   45 o  339.672   7.4762   88.485   3.8869   84.985   5.4179   92.197   5.5796  332.528   10.645  346.367   10.524 -13.83881 14.96902 
1 1 1    5   10   46 o  362.210   7.0397  100.614   3.9028   99.499   5.5886  101.676   5.4528  359.796   10.148  363.764   9.7934 -3.968201 14.10284 
1 1 1    5   10   47 o  302.599   8.1071   70.292   3.7549   71.429   5.2463   69.097   5.3766  304.605   11.252  299.515   11.728 5.089996 16.25297 
1 1 1    5   10   48 o  160.021   18.075   20.169   4.3496   27.564   10.320   18.572   4.7964  180.001   38.615  152.687   21.086 27.31337 43.99720 
1 1 1    5   10   49 o  396.073   6.9538  120.395   4.2157  118.699   5.9723  122.079   5.9514  392.701   9.9360  398.293   9.7622 -5.591949 13.92927 
1 1 1    5   10   50 o  359.134   7.5653   99.066   4.1586   98.942   6.0594   99.177   5.7178  358.175   11.053  358.756   10.413 -0.5806885 15.18503 
1 1 1    5   10   51 o  246.841   9.4006   46.910   3.5518   50.679   5.0992   43.359   4.9500  255.533   13.081  236.128   13.755 19.40446 18.98230 
1 1 1    5   10   52 o   73.160   24.124   4.1294   3.1344   4.4461   4.4095   3.8061   4.4563   79.129   28.500   76.271   28.451 2.857857 40.27041 
1 1 1    5   10   53 o  243.517   11.353   45.845   4.2318   44.261   5.3220   48.568   6.9784  238.042   14.678  247.946   18.522 -9.904495 23.63270 
1 1 1    5   10   54 o  304.700   10.061   71.665   4.6924   75.821   6.3516   66.671   6.9624  312.422   13.282  291.739   15.649 20.68350 20.52579 
1 1 1    5   10   55 o  316.596   10.060   77.422   4.8751   70.931   8.5814   80.515   5.9239  299.070   18.843  322.228   12.011 -23.15820 22.34517 
1 1 1    5   10   56 o  108.880   22.530   9.8358   3.6310   13.623   5.2355   6.3262   5.0401  126.550   27.790   89.085   30.600 37.46422 41.33551 
1 1 1    5   10   57 o  167.663   14.929   22.191   3.7910   27.536   5.5873   17.632   5.1607  184.763   20.080  145.776   23.961 38.98654 31.26287 
1 1 1    5   10   58 o  240.967   10.787   45.054   3.9787   45.661   5.7301   44.489   5.5288  240.306   15.664  237.365   15.299 2.940872 21.89595 
1 1 1    5   10   59 o  218.473   19.411   38.617   6.4234   41.672   9.8199   36.331   8.4923  219.221   30.057  206.411   27.569 12.80986 40.78528 
1 1 1    5   10   60 f  295.397   10.729   67.920   4.8512   60.418   7.5852   73.113   6.3105  273.816   18.202  304.982   13.518 -31.16675 22.67287 
1 1 1    5   10   61 o  105.268   23.967   9.5832   3.7751   11.124   5.5204   8.2293   5.1740  110.061   31.289   95.820   30.959 14.24125 44.01665 
1 1 1    5   10   62 o  127.515   19.379   13.556   3.6633   13.083   5.1436   14.043   5.2186  119.922   28.451  124.634   28.035 -4.712601 39.94242 
1 1 1    5   10   63 o  267.982   11.109   56.418   4.5568   59.552   5.8375   51.529   7.2909  272.932   14.021  249.167   19.267 23.76581 23.82824 
1 1 1    5   10   64 o  136.977   20.970   16.102   4.2567   19.755   5.6445   11.285   6.4817  148.096   25.841  105.049   34.693 43.04733 43.25923 
1 1 1    5   11    0 o  924.619   13.652  655.141   19.312  655.141   19.312  655.141   19.312  924.619   13.652  924.619   13.652 0.000000 0.000000 
1 1 1    5   11    1 o  386.688   6.8857  114.474   4.0755  108.233   5.6173  121.410   5.9219  375.936   9.7621  398.163   9.7169 -22.22726 13.77380 
1 1 1    5   11    2 o  1445.38   13.523  1600.94   29.917  1626.32   43.123  1577.38   41.538  1455.80   19.353  1433.81   18.927 21.98853 27.06964 
1 1 1    5   11    3 o  887.955   9.4303  603.813   12.817  614.577   18.451  593.777   17.817  895.533   13.461  880.269   13.224 15.26428 18.86977 
1 1 1    5   11    4 o  1013.80   8.4567  786.997   13.123  789.679   16.168  781.821   22.463  1015.38   10.403  1009.93   14.532 5.453186 17.87162 
1 1 1    5   11    5 o  834.978   7.4822  533.799   9.5625  542.872   11.924  517.449   16.008  841.948   9.2526  821.755   12.727 20.19293 15.73458 
1 1 1    5   11    6 o  1051.54   10.661  847.003   17.160  847.003   17.160   0.0000   0.0000  1051.54   10.661  ?   ?  0.000000 10.66134 
1 1 1    5   11    7 o  202.006   6.9779   31.243   2.1575   27.576   2.5614   40.197   4.0029  189.760   8.8188  229.053   11.418 -39.29265 14.42678 
1 1 1    5   11    8 o  264.058   5.5405   53.377   2.2393   54.181   3.1552   52.561   3.1786  266.005   7.7495  261.994   7.9265 4.010803 11.08527 
1 1 1    5   11    9 o  485.870   5.3915  180.715   4.0096  180.965   5.6414  180.459   5.6998  486.145   7.5815  485.462   7.6707 0.6827087 10.78508 
1 1 1    5   11   10 o  603.335   5.7430  278.669   5.3036  279.763   7.4945  277.571   7.5063  604.428   8.1008  602.052   8.1456 2.375366 11.48798 
1 1 1    5   11   11 o  275.251   5.8140   58.001   2.4495   59.616   3.4619   56.382   3.4663  279.015   8.1063  271.335   8.3462 7.679382 11.63489 
1 1 1    5   11   12 o  776.147   6.4398  461.209   7.6504  456.849   10.702  465.764   10.941  772.323   9.0531  779.815   9.1660 -7.491394 12.88308 
1 1 1    5   11   13 o  839.526   6.7312  539.623   8.6496  545.659   12.306  533.728   12.160  844.031   9.5254  834.752   9.5173 9.278442 13.46520 
1 1 1    5   11   14 o  1087.37   9.1272  905.569   15.191  904.967   18.521  906.807   26.555  1086.80   11.134  1087.26   15.956 -0.4564209 19.45675 
1 1 1    5   11   15 o  188.673   9.2774   27.263   2.6792   24.882   3.1592   33.364   5.0561  179.837   11.538  207.954   16.008 -28.11600 19.73243 
1 1 1    5   11   16 o  528.674   6.8673  213.985   5.5570  216.467   9.6706  212.761   6.7900  531.528   11.887  527.110   8.4158 4.418274 14.56428 
1 1 1    5   11   17 o  261.988   6.9697   52.548   2.7949   56.117   4.0599   49.334   3.8533  270.689   9.7988  253.800   9.9192 16.88870 13.94294 
1 1 1    5   11   18 f  289.589   6.9314   64.202   3.0724   64.681   4.4632   63.770   4.2357  290.616   10.034  288.571   9.5896 2.044525 13.87925 
1 1 1    5   11   19 o  614.060   6.3613  288.650   5.9790  286.276   8.4044  291.082   8.5077  611.453   8.9800  616.563   9.0150 -5.109680 12.72437 
1 1 1    5   11   20 o  810.779   5.6037  503.181   6.9542  510.408   9.9240  496.207   9.7479  816.507   7.9407  805.070   7.9105 11.43719 11.20851 
1 1 1    5   11   21 o  1384.87   8.5856  1468.36   18.199  1448.20   28.421  1482.38   23.694  1374.93   13.505  1391.28   11.126 -16.35034 17.49791 
1 1 1    5   11   22 o  836.568   10.291  535.893   13.178  535.893   13.178   0.0000   0.0000  836.568   10.291  ?   ?  0.000000 10.29116 
1 1 1    5   11   23 o  1396.65   8.6580  1493.42   18.509  1492.44   29.123  1494.08   23.973  1395.81   13.632  1396.78   11.213 -0.9763184 17.65082 
1 1 1    5   11   24 f  317.210   6.0792   77.022   2.9516   75.847   4.1143   78.268   4.2369  314.752   8.5400  319.735   8.6574 -4.982941 12.16068 
1 1 1    5   11   25 o  280.463   6.7406   60.214   2.8937   57.786   4.1142   62.590   4.0706  274.715   9.7844  285.913   9.3016 -11.19794 13.50016 
1 1 1    5   11   26 o  639.588   5.7196  313.126   5.5993  305.056   7.7615  321.885   8.0858  631.235   8.0331  648.411   8.1471 -17.17499 11.44144 
1 1 1    5   11   27 o  527.540   5.9173  213.030   4.7780  214.151   6.7136  211.879   6.8015  528.873   8.2934  526.056   8.4470 2.817566 11.83775 
1 1 1    5   11   28 o  479.197   6.5208  175.787   4.7829  167.581   6.2322  187.544   7.4603  467.831   8.7032  494.878   9.8489 -27.04785 13.14330 
1 1 1    5   11   29 o  524.235   6.2309  210.381   4.9998  210.909   7.1599  209.879   6.9848  524.820   8.9131  523.543   8.7163 1.277344 12.46664 
1 1 1    5   11   30 o  1066.83   6.9133  871.331   11.289  883.403   19.821  865.535   13.734  1073.81   12.059  1063.19   8.4397 10.62817 14.71907 
1 1 1    5   11   31 o  783.633   6.3303  470.112   7.5929  464.249   10.961  475.522   10.528  778.594   9.1972  788.018   8.7287 -9.423157 12.67985 
1 1 1    5   11   32 o  292.021   7.9025   65.297   3.5322   68.548   5.8559   63.438   4.4286  299.074   12.792  287.786   10.054 11.28741 16.27011 
1 1 1    5   11   33 o  207.995   9.1775   33.135   2.9218   37.075   4.2217   29.512   4.0479  219.578   12.614  195.737   13.595 23.84154 18.54568 
1 1 1    5   11   34 o  245.260   8.5870   46.070   3.2236   44.453   4.7949   47.403   4.3545  240.447   13.078  248.712   11.438 -8.264771 17.37416 
1 1 1    5   11   35 o  448.323   7.9826  153.933   5.4778  135.761   11.000  159.925   6.3167  420.491   17.092  456.919   9.0319 -36.42740 19.33126 
1 1 1    5   11   36 o  554.007   6.1118  235.005   5.1827  243.491   8.0048  228.880   6.8004  563.745   9.2768  546.640   8.1276 17.10577 12.33357 
1 1 1    5   11   37 o   92.852   20.767   6.9008   2.8776   5.9249   4.1681   7.7895   3.9776   88.031   27.718   98.631   25.984 -10.60063 37.99300 
1 1 1    5   11   38 o  179.257   11.310   24.743   3.0874   29.521   4.6034   20.836   4.1623  195.394   15.520  163.754   16.846 31.63950 22.90554 
1 1 1    5   11   39 o  423.191   6.4815  137.173   4.1984  133.248   6.1615  140.575   5.7361  416.885   9.6560  428.262   8.7506 -11.37729 13.03117 
1 1 1    5   11   40 o  381.626   6.8013  111.573   3.9728  110.262   5.6268  112.876   5.6101  379.176   9.6951  383.656   9.5533 -4.479675 13.61109 
1 1 1    5   11   41 o  440.768   6.9286  148.862   4.6744  148.720   6.0039  149.081   7.4484  440.384   8.9071  440.681   11.043 -0.2974243 14.18709 
1 1 1    5   11   42 o  564.016   6.7999  243.777   5.8703  241.018   7.8517  247.274   8.8396  560.517   9.1518  567.586   10.175 -7.069275 13.68523 
1 1 1    5   11   43 o  515.133   6.0164  203.317   4.7438  201.449   6.6733  205.226   6.7447  512.468   8.5075  517.248   8.5191 -4.780640 12.03964 
1 1 1    5   11   44 o  323.610   7.3825   80.300   3.6568   74.339   4.9896   87.217   5.3748  311.064   10.480  336.939   10.422 -25.87491 14.77950 
1 1 1    5   11   45 o  194.286   10.110   29.082   2.9961   27.920   4.1944   30.293   4.2811  189.669   14.559  197.665   14.245 -7.996338 20.36890 
1 1 1    5   11   46 o  317.508   7.4416   77.339   3.6165   79.149   5.2134   75.660   5.0211  320.802   10.617  313.674   10.458 7.127228 14.90289 
1 1 1    5   11   47 f  328.716   9.8247   83.085   4.9432   83.554   11.119   82.970   5.5186  325.724   22.439  328.296   10.982 -2.571991 24.98244 
1 1 1    5   11   48 o  142.746   17.646   16.085   3.7735   17.392   10.223   15.879   4.0602  142.248   43.172  141.406   19.260 0.8419037 47.27360 
1 1 1    5   11   49 o  152.295   13.799   18.095   3.1817   14.628   4.4024   21.886   4.6037  134.679   22.125  166.480   18.372 -31.80107 28.75841 
1 1 1    5   11   50 o  373.468   7.4029  107.124   4.2318  109.996   5.9365  104.157   6.0341  377.825   10.265  367.546   10.726 10.27841 14.84652 
1 1 1    5   11   51 o  130.656   15.921   13.480   3.1182   6.5917   4.5126   19.775   4.3137   90.550   28.877  157.973   18.171 -67.42271 34.11815 
1 1 1    5   11   52 o   55.917   22.693   1.1481   3.0319  -1.6826   4.3729   3.7686   4.2074   55.312   24.833   75.026   27.712 -19.71413 37.21050 
1 1 1    5   11   53 o   94.998   24.573   7.5079   3.6000   6.0181   4.5236   10.082   5.9454   87.149   28.992  109.018   32.887 -21.86940 43.84230 
1 1 1    5   11   54 o  223.060   11.905   38.655   4.0500   41.574   5.3873   34.860   6.1417  230.230   15.376  209.213   19.400 21.01643 24.75421 
1 1 1    5   11   55 o  238.209   10.365   43.864   3.7790   41.600   5.4844   45.911   5.2145  230.016   15.671  242.285   14.122 -12.26866 21.09540 
1 1 1    5   11   56 o  174.809   14.513   24.035   3.8482   22.868   5.3069   25.330   5.5884  167.999   21.103  176.948   21.046 -8.948837 29.80426 
1 1 1    5   11   57 o  114.348   20.955   10.776   3.5325   10.777   5.1229   10.775   4.8777  111.361   29.561  111.678   28.454 -0.3172531 41.03051 
1 1 1    5   11   58 o   54.787   23.567   0.1585   3.5686   2.1462   4.9800  -1.9394   5.1162   70.306   28.871   58.592   26.531 11.71427 39.21061 
1 1 1    5   11   59 o  215.920   18.292   37.559   5.9885   44.762   10.156   33.720   7.4146  226.917   29.975  200.502   24.681 26.41513 38.82870 
1 1 1    5   11   60 o  184.459   13.749   26.922   3.8539   26.484   5.4510   27.359   5.4496  179.642   20.173  182.840   19.788 -3.198273 28.25827 
1 1 1    5   11   61 o  121.160   21.698   12.411   3.8762   5.3123   5.7040   18.501   5.2835   83.259   31.932  146.879   24.355 -63.61991 40.15956 
1 1 1    5   11   62 o  199.821   12.420   31.594   3.7798   38.535   5.4710   25.256   5.2283  218.095   16.511  174.084   19.984 44.01073 25.92238 
1 1 1    5   11   63 o  128.959   18.678   13.921   3.5794   11.301   5.1044   16.456   5.0208  109.173   29.740  136.114   25.021 -26.94157 38.86521 
1 1 1    5   11   64 o   91.103   27.607   7.7648   4.1827  -0.1948   5.3804   19.922   6.6496   61.761   27.650  143.688   31.134 -81.92683 41.63926 
1 1 1    5   12    0 o  884.864   13.352  600.083   18.075  600.083   18.075  600.083   18.075  884.864   13.352  884.864   13.352 0.000000 0.000000 
1 1 1    5   12    1 o  839.566   9.1374  539.825   11.742  551.331   16.952  529.214   16.280  848.158   13.058  830.995   12.799 17.16327 18.28487 
1 1 1    5   12    2 o  407.030   7.1549  126.848   4.4576  122.445   6.2254  131.480   6.3857  399.816   10.173  414.308   10.070 -14.49219 14.31365 
1 1 1    5   12    3 o  724.622   11.999  402.345   13.309  402.345   13.309   0.0000   0.0000  724.622   11.999  ?   ?  0.000000 11.99939 
1 1 1    5   12    4 o  283.354   7.5673   61.477   3.2820   61.477   3.2820   0.0000   0.0000  283.354   7.5673  ?   ?  0.000000 7.567317 
1 1 1    5   12    5 o  860.841   9.4294  567.576   12.424  567.576   12.424   0.0000   0.0000  860.841   9.4294  ?   ?  0.000000 9.429379 
1 1 1    5   12    6 o  610.726   6.5569  285.561   6.1294  283.131   7.5020  290.442   10.631  608.062   8.0604  615.692   11.280 -7.629639 13.86422 
1 1 1    5   12    7 o  876.699   6.7586  588.465   9.0693  587.354   12.803  589.584   12.849  875.689   9.5522  877.349   9.5679 -1.659729 13.51999 
1 1 1    5   12    8 o  657.771   5.8968  331.230   5.9369  326.962   8.3215  335.653   8.4725  653.416   8.3203  662.041   8.3610 -8.625000 11.79555 
1 1 1    5   12    9 o  1134.00   8.0294  984.768   13.937  986.534   19.745  983.014   19.675  1134.67   11.369  1132.65   11.349 2.023804 16.06372 
1 1 1    5   12   10 o  768.265   6.3583  451.883   7.4769  448.901   10.503  454.948   10.647  765.583   8.9628  770.718   9.0250 -5.134949 12.71936 
1 1 1    5   12   11 o  717.545   6.2005  394.178   6.8100  399.595   9.7252  388.965   9.5390  722.329   8.7962  712.660   8.7449 9.669312 12.40344 
1 1 1    5   12   12 o  548.897   6.6677  230.673   5.6019  227.257   6.7407  238.301   10.072  544.766   8.0839  557.658   11.800 -12.89252 14.30365 
1 1 1    5   12   13 o  790.557   7.6163  478.548   9.2161  475.756   11.168  484.509   16.317  788.152   9.2576  795.043   13.409 -6.891113 16.29395 
1 1 1    5   12   14 o  465.094   6.6852  165.608   4.7591  172.609   8.3280  162.214   5.7993  474.652   11.463  460.259   8.2319 14.39285 14.11248 
1 1 1    5   12   15 o  139.933   11.408   15.101   2.4221   18.061   4.1154   13.532   2.9959  152.376   17.992  131.997   15.100 20.37950 23.48904 
1 1 1    5   12   16 o  310.604   6.4185   73.855   3.0515   71.707   4.2594   76.121   4.3737  306.007   9.0940  315.286   9.0631 -9.279144 12.83898 
1 1 1    5   12   17 o  1490.93   10.069  1702.33   22.979  1701.55   32.490  1703.12   32.504  1490.08   14.245  1490.77   14.245 -0.6892090 20.14559 
1 1 1    5   12   18 o  1410.04   9.6700  1522.48   20.870  1503.15   29.113  1542.92   29.934  1400.67   13.579  1419.06   13.781 -18.38196 19.34764 
1 1 1    5   12   19 o  895.885   6.4458  614.393   8.8390  605.060   11.196  629.834   14.401  888.989   8.2279  906.904   10.374 -17.91510 13.24115 
1 1 1    5   12   20 o  193.195   9.6523   28.579   2.8543   27.536   3.9863   29.677   4.0888  189.081   13.870  196.344   13.691 -7.263245 19.48943 
1 1 1    5   12   21 o  592.153   9.0154  268.465   8.1713  278.489   12.130  260.136   11.056  602.966   13.143  582.788   12.395 20.17816 18.06555 
1 1 1    5   12   22 o  366.476   6.2877  102.806   3.5270  101.278   4.9657  104.361   5.0104  363.707   8.9200  369.202   8.8662 -5.494965 12.57679 
1 1 1    5   12   23 o  812.813   5.8075  505.703   7.2252  493.608   9.9641  519.115   10.492  802.969   8.1072  823.447   8.3245 -20.47827 11.62000 
1 1 1    5   12   24 o  760.985   5.7473  443.269   6.6944  441.354   9.3766  445.260   9.5606  759.276   8.0682  762.625   8.1904 -3.348938 11.49688 
1 1 1    5   12   25 o  837.784   6.0368  537.268   7.7412  532.789   10.848  541.916   11.050  834.202   8.4956  841.314   8.5813 -7.112061 12.07535 
1 1 1    5   12   26 o  188.447   9.0499   27.191   2.6104   25.278   3.6492   29.196   3.7356  181.164   13.252  194.821   12.594 -13.65680 18.28205 
1 1 1    5   12   27 o   86.047   19.133   5.9035   2.4547   6.9951   3.4034   4.7199   3.5439   93.641   23.719   79.529   25.614 14.11209 34.90955 
1 1 1    5   12   28 o  1360.57   8.7573  1417.43   18.237  1408.18   23.234  1432.27   29.435  1355.90   11.195  1367.12   14.067 -11.21521 17.97767 
1 1 1    5   12   29 o  1216.08   8.1694  1132.33   15.206  1175.15   24.751  1106.37   19.273  1238.41   13.058  1201.88   10.476 36.52942 16.74076 
1 1 1    5   12   30 o  1018.69   7.5794  794.541   11.818  789.092   15.206  802.853   18.781  1015.04   9.7873  1023.67   11.986 -8.625610 15.47448 
1 1 1    5   12   31 o  572.683   6.4938  251.084   5.6923  253.814   8.0581  248.365   8.0421  575.690   9.1448  569.473   9.2263 6.216492 12.99046 
1 1 1    5   12   32 o  641.966   6.6070  315.524   6.4921  319.228   9.3750  312.111   8.9991  645.590   9.4873  638.368   9.2099 7.221985 13.22241 
1 1 1    5   12   33 o  202.574   10.379   31.521   3.2072   29.659   5.4197   32.524   3.9786  195.695   18.306  205.597   12.705 -9.901566 22.28324 
1 1 1    5   12   34 o  689.396   6.0996  363.874   6.4364  353.172   10.048  371.321   8.3820  678.978   9.6680  696.324   7.8644 -17.34540 12.46266 
1 1 1    5   12   35 o  389.259   8.2578  116.058   4.9201  109.370   10.381  117.996   5.5875  377.296   17.976  392.451   9.3017 -15.15558 20.24002 
1 1 1    5   12   36 o  457.699   6.9546  160.432   4.8722  166.334   8.6666  157.705   5.8912  465.720   12.158  453.718   8.4830 12.00272 14.82475 
1 1 1    5   12   37 o  159.107   11.955   19.527   2.8901   21.596   4.1894   17.649   3.9921  166.797   16.631  150.465   17.670 16.33250 24.26589 
1 1 1    5   12   38 o  557.364   5.8242  237.896   4.9688  236.302   7.0315  239.487   7.0223  555.317   8.2725  559.053   8.2065 -3.736084 11.65248 
1 1 1    5   12   39 o  332.600   7.1876   84.753   3.6591   85.280   5.3907   84.303   4.9829  333.424   10.563  331.561   9.8185 1.862579 14.42132 
1 1 1    5   12   40 f  621.811   6.6151  296.215   6.2960  298.512   8.5099  293.436   9.3582  623.954   8.9105  618.493   9.8853 5.461548 13.30849 
1 1 1    5   12   41 o  420.397   7.5986  135.465   4.8895  140.981   6.7048  129.201   7.1459  428.602   10.220  410.167   11.382 18.43515 15.29730 
1 1 1    5   12   42 o  728.316   6.7001  406.501   7.4691  399.449   10.145  414.849   11.038  721.547   9.1854  735.195   9.8086 -13.64758 13.43804 
1 1 1    5   12   43 o  384.048   6.7806  113.051   3.9859  110.711   5.4841  115.671   5.8032  379.781   9.4341  388.155   9.7676 -8.373779 13.57973 
1 1 1    5   12   44 o  258.383   8.1414   51.219   3.2198   52.445   4.5583   49.998   4.5488  261.150   11.404  254.957   11.656 6.193390 16.30679 
1 1 1    5   12   45 o  177.944   10.461   24.425   2.8366   21.018   3.9356   28.108   4.0922  164.135   15.863  190.351   14.146 -26.21582 21.25460 
1 1 1    5   12   46 o  470.699   6.2649  169.866   4.5136  177.181   6.5321  163.182   6.2441  480.291   8.8854  460.933   8.8504 19.35800 12.54108 
1 1 1    5   12   47 o   90.198   25.562   6.6084   3.6905  -7.9223   9.6875   9.0751   3.9914   74.180   34.625  105.188   25.134 -31.00793 42.78568 
1 1 1    5   12   48 o  119.088   15.911   11.195   2.8278   8.3899   3.9892   14.029   4.0089  100.922   25.743  132.395   20.441 -31.47280 32.87132 
1 1 1    5   12   49 o  258.629   8.6731   51.430   3.4334   47.998   4.9069   54.722   4.8057  248.819   12.929  266.254   11.792 -17.43422 17.49870 
1 1 1    5   12   50 o   64.587   23.219   2.8481   2.9253   0.6219   3.9181   5.6521   4.3973   59.930   25.190   85.440   28.589 -25.50980 38.10271 
1 1 1    5   12   51 o  164.854   12.909   21.171   3.2314   18.564   4.3973   24.232   4.7646  152.624   19.251  175.049   18.041 -22.42485 26.38360 
1 1 1    5   12   52 f  402.311   9.1238  124.662   5.6183  130.361   6.3381  103.760   12.139  411.117   10.072  360.907   22.080 50.21069 24.26878 
1 1 1    5   12   53 o  181.682   12.292   25.690   3.3981   27.295   4.8925   24.193   4.7233  185.788   17.408  174.652   17.922 11.13611 24.98476 
1 1 1    5   12   54 o  111.825   21.087   10.240   3.4770   9.8561   4.4571   10.836   5.5574  107.988   27.029  112.319   31.207 -4.330894 41.28464 
1 1 1    5   12   55 o   62.403   24.204   2.1835   3.3043   1.7090   4.5179   2.7292   4.8452   67.076   27.517   72.694   28.968 -5.617737 39.95400 
1 1 1    5   12   56 f  270.140   9.5769   56.383   3.9599   60.921   5.6360   51.958   5.5650  279.626   13.168  257.514   14.173 22.11258 19.34623 
1 1 1    5   12   57 o  271.974   9.8169   57.236   4.0867   58.522   5.8353   55.997   5.7251  273.140   14.005  267.145   14.051 5.994965 19.83805 
1 1 1    5   12   58 o  133.204   19.131   14.457   3.7885   10.358   5.1811   19.166   5.5538  108.329   30.144  150.853   24.923 -42.52390 39.11292 
1 1 1    5   12   59 o   69.683   25.976   3.4299   3.7135   6.7959   5.5230   0.6525   5.0169   90.269   31.961   64.888   27.927 25.38159 42.44369 
1 1 1    5   12   60 o   69.715   25.905   3.5148   3.6876  -0.8769   5.3368   7.5276   5.1014   61.878   27.631   92.654   30.787 -30.77621 41.36796 
1 1 1    5   12   61 o  228.117   14.312   41.425   4.9718   22.486   9.8334   47.929   5.7626  146.620   41.787  244.652   15.468 -98.03253 44.55786 
1 1 1    5   12   62 o   88.680   25.242   7.0252   3.5904   11.889   5.0392   2.0100   5.1170  113.244   28.958   68.090   28.712 45.15424 40.77916 
1 1 1    5   12   63 o   90.350   26.316   7.4724   3.8609   6.2968   4.9322   9.3327   6.2045   83.824   30.147   97.472   33.924 -13.64790 45.38396 
1 1 1    5   13    3 o  905.615   9.7672  628.211   13.539  631.518   19.473  625.118   18.837  907.576   14.018  903.010   13.628 4.566040 19.55062 
1 1 1    5   13    4 f  577.711   11.059  255.713   9.7793   0.0000   0.0000  255.713   9.7793  ?   ?   577.711   11.059 0.000000 11.05928 
1 1 1    5   13    5 o  977.420   8.3585  731.622   12.505  731.126   15.357  732.598   21.542  976.926   10.270  977.443   14.399 -0.5171509 17.68643 
1 1 1    5   13    6 o  435.776   6.1827  145.386   4.1239  145.926   5.1067  144.374   6.9921  436.543   7.6427  434.109   10.523 2.433838 13.00552 
1 1 1    5   13    7 o  763.547   7.2956  446.402   8.5264  447.950   10.485  443.380   14.650  764.774   8.9573  760.587   12.584 4.186890 15.44613 
1 1 1    5   13    8 o  808.976   6.5363  501.051   8.0936  507.916   11.569  494.471   11.327  814.336   9.2819  803.491   9.2097 10.84509 13.07567 
1 1 1    5   13    9 o  483.529   6.4080  178.998   4.7426  178.853   5.7931  179.291   8.2585  483.289   7.8313  483.741   11.154 -0.4515991 13.62842 
1 1 1    5   13   10 o  512.753   6.5195  201.290   5.1168  200.191   6.2287  203.573   8.9732  511.302   7.9588  515.450   11.373 -4.147675 13.88156 
1 1 1    5   13   11 o  421.728   6.5081  136.164   4.2010  137.907   5.1512  132.703   7.2594  424.381   7.9302  416.177   11.396 8.204010 13.88365 
1 1 1    5   13   12 o  454.341   5.7245  158.024   3.9810  153.978   5.4982  162.482   5.7717  448.430   8.0105  460.641   8.1860 -12.21069 11.45329 
1 1 1    5   13   13 o  1118.47   9.3336  958.047   15.979  959.982   27.745  957.087   19.546  1118.82   16.201  1117.72   11.425 1.107300 19.82455 
1 1 1    5   13   14 o  820.041   7.8533  514.882   9.8573  524.226   17.275  510.371   12.003  827.071   13.646  816.349   9.6061 10.72144 16.68823 
1 1 1    5   13   15 o  274.289   6.7464   57.596   2.8324   58.917   3.9858   56.248   4.0257  277.378   9.3881  271.016   9.7045 6.361938 13.50237 
1 1 1    5   13   16 o  265.719   6.8843   54.052   2.7999   52.319   3.9006   55.895   4.0216  261.384   9.7495  270.170   9.7251 -8.785736 13.77062 
1 1 1    5   13   17 o  347.842   6.3945   92.621   3.4045   91.672   4.7371   93.635   4.8963  346.016   8.9443  349.697   9.1476 -3.681030 12.79376 
1 1 1    5   13   18 o  1081.01   8.0597  894.650   13.336  884.258   18.646  905.532   19.081  1074.52   11.337  1087.36   11.464 -12.84021 16.12337 
1 1 1    5   13   19 o  664.622   6.5709  338.133   6.6845  338.889   9.4907  337.388   9.4164  665.289   9.3201  663.816   9.2676 1.473206 13.14349 
1 1 1    5   13   20 o  535.517   8.8315  219.562   7.2390  212.796   10.302  226.160   10.174  527.088   12.769  543.406   12.232 -16.31799 17.68282 
1 1 1    5   13   21 o  869.666   7.1910  578.971   9.5722  579.121   11.075  578.530   19.030  869.740   8.3196  869.003   14.307 0.7374878 16.54980 
1 1 1    5   13   22 o  916.037   6.7271  642.340   9.4322  644.372   12.103  639.196   15.053  917.417   8.6188  913.630   10.764 3.787598 13.78958 
1 1 1    5   13   23 o  1211.43   7.2081  1123.45   13.366  1128.28   18.938  1118.66   18.866  1213.87   10.193  1208.68   10.197 5.187988 14.41807 
1 1 1    5   13   24 f  292.347   6.4429   65.424   2.8830   68.869   4.0861   62.008   4.0684  299.915   8.9011  284.578   9.3400 15.33646 12.90215 
1 1 1    5   13   25 o  526.213   5.6276  211.955   4.5327  211.201   6.3015  212.763   6.5247  525.231   7.8383  527.165   8.0862 -1.933777 11.26170 
1 1 1    5   13   26 o  420.134   5.9672  135.117   3.8373  137.345   5.3523  132.761   5.5045  423.541   8.2561  416.405   8.6364 7.136719 11.94780 
1 1 1    5   13   27 o  895.354   7.0358  613.720   9.6422  615.256   12.284  611.255   15.563  896.383   8.9531  893.318   11.382 3.064148 14.48119 
1 1 1    5   13   28 o  925.923   7.0878  656.361   10.045  679.109   16.090  641.831   12.859  941.586   11.164  915.508   9.1765 26.07782 14.45157 
1 1 1    5   13   29 o  547.717   6.8242  229.670   5.7211  228.130   7.4277  231.916   8.9708  545.812   8.8908  550.251   10.651 -4.439758 13.87426 
1 1 1    5   13   30 o  1068.34   7.8324  873.930   12.808  858.807   16.023  900.690   21.314  1058.91   9.8861  1084.12   12.845 -25.21936 16.20864 
1 1 1    5   13   31 o  285.677   8.7358   62.500   3.8199   62.288   5.4204   62.709   5.3840  285.095   12.421  286.062   12.296 -0.9664917 17.47831 
1 1 1    5   13   32 o  389.533   7.6393  116.189   4.5548  114.214   6.4513  118.153   6.4316  386.097   10.917  392.707   10.700 -6.609924 15.28596 
1 1 1    5   13   33 o  441.237   7.5058  149.086   5.0692  155.367   7.2437  143.056   7.0965  450.311   10.509  432.091   10.730 18.21954 15.01930 
1 1 1    5   13   34 o  161.574   19.124   20.341   4.6377   11.102   8.8507   23.838   5.4450  122.224   40.549  174.842   20.751 -52.61870 45.55015 
1 1 1    5   13   35 o  930.424   7.5223  663.019   10.713  662.446   16.601  663.428   14.023  929.534   11.668  930.462   9.8462 -0.9288330 15.26762 
1 1 1    5   13   36 o  267.467   8.7381   54.813   3.5773   51.702   5.9316   56.591   4.4847  259.042   15.024  271.689   10.784 -12.64761 18.49427 
1 1 1    5   13   37 o  588.854   6.3110  265.556   5.6882  271.181   9.1903  262.062   7.2421  594.738   10.096  584.838   8.0902 9.900208 12.93729 
1 1 1    5   13   38 o  505.587   6.4188  195.788   4.9673  196.650   8.0047  195.248   6.3344  506.371   10.328  504.759   8.1989 1.611511 13.18653 
1 1 1    5   13   39 o  487.191   6.5323  181.826   4.8712  175.649   7.8296  185.726   6.2220  478.461   10.691  492.248   8.2580 -13.78766 13.50903 
1 1 1    5   13   40 o  754.208   7.0305  435.880   8.1161  429.445   11.442  442.396   11.514  748.142   9.9919  759.356   9.9065 -11.21387 14.07038 
1 1 1    5   13   41 o  424.759   7.4511  138.296   4.8443  141.648   6.7614  134.761   6.9440  429.569   10.283  418.927   10.829 10.64273 14.93389 
1 1 1    5   13   42 o  420.403   6.6575  135.450   4.2839  132.849   6.0102  138.135   6.1078  416.055   9.4378  424.256   9.4056 -8.200745 13.32431 
1 1 1    5   13   43 o  292.096   7.6171   65.429   3.4055   64.509   4.7186   66.430   4.9199  289.755   10.639  294.004   10.933 -4.248688 15.25532 
1 1 1    5   13   44 o  602.214   5.8559  277.921   5.3978  274.183   7.6981  281.536   7.5707  597.726   8.4142  605.736   8.1655 -8.009583 11.72492 
1 1 1    5   13   45 o  633.149   5.8848  307.257   5.7031  307.927   8.1920  306.626   7.9445  633.336   8.4506  632.051   8.2119 1.285522 11.78335 
1 1 1    5   13   46 o  151.442   12.490   17.802   2.8694   17.369   4.0721   18.229   4.0441  148.387   18.318  152.212   17.688 -3.824600 25.46365 
1 1 1    5   13   47 o   45.069   20.761  -2.4382   3.3129   4.4129   10.045  -3.2744   3.5092  100.715   41.140   44.505   20.796 56.21074 46.09704 
1 1 1    5   13   48 o  189.920   10.549   27.870   3.0545   27.469   4.4404   28.231   4.2084  187.485   15.615  190.336   14.556 -2.851212 21.34719 
1 1 1    5   13   49 o  251.556   8.6548   48.661   3.3324   49.614   4.6658   47.668   4.7611  253.447   12.027  248.014   12.583 5.433762 17.40674 
1 1 1    5   13   50 o  130.698   14.492   13.416   2.8503   19.104   4.2223   8.6529   3.8634  155.288   18.104  102.230   24.917 53.05711 30.79945 
1 1 1    5   13   51 o   72.749   22.847   4.1877   2.8339  -2.2117   3.9384   11.059   4.0809   50.619   23.060  115.897   23.801 -65.27834 33.14007 
1 1 1    5   13   52 o   83.956   25.153   5.7547   3.4865   2.1379   4.0748   15.639   6.7363   66.807   26.583  134.811   32.929 -68.00396 42.31977 
1 1 1    5   13   53 o   98.136   23.612   8.0097   3.5036   4.6368   4.3053   14.624   6.0290   79.363   28.206  130.746   30.658 -51.38261 41.65917 
1 1 1    5   13   54 o  265.452   9.3679   54.360   3.8063   60.330   5.4309   48.597   5.3361  278.709   12.731  249.380   14.037 29.32910 18.94979 
1 1 1    5   13   55 o  232.666   10.581   41.885   3.7681   38.623   5.2090   45.465   5.4576  221.562   15.457  240.699   14.887 -19.13649 21.45972 
1 1 1    5   13   56 o   75.439   24.601   4.5571   3.2629   2.6599   4.5072   6.6463   4.7298   70.487   27.987   89.782   29.635 -19.29476 40.76141 
1 1 1    5   13   57 o   59.268   23.918   1.5667   3.3477   0.1309   4.6163   3.1594   4.8620   61.535   26.636   73.768   29.137 -12.23352 39.47707 
1 1 1    5   13   58 o   52.865   24.094  -2.0391   4.3058  -4.1273   9.6777  -1.5237   4.8079   76.157   35.224   57.547   25.920 18.61028 43.73259 
1 1 1    5   13   59 o   56.546   23.537   1.0223   3.3715   1.7973   4.7764   0.2527   4.7596   67.399   28.031   62.119   26.967 5.279701 38.89729 
1 1 1    5   13   60 o  122.108   20.386   12.439   3.6759   7.3087   5.2888   17.233   5.1127   91.453   31.349  141.869   24.426 -50.41623 39.74181 
1 1 1    5   13   61 o   95.885   24.056   8.0757   3.5247   7.4987   4.8996   8.6946   5.0743   91.154   30.166   97.140   30.582 -5.985306 42.95663 
1 1 1    5   13   62 o   50.449   22.254  -0.2813   3.3571  -3.7448   4.6895   3.3595   4.8081   50.138   23.620   71.534   28.736 -21.39556 37.19768 
1 1 1    5   13   63 o  114.044   23.282   11.502   3.9265   10.759   5.1117   12.571   6.1325  105.710   30.128  111.896   33.321 -6.186134 44.92220 
1 1 1    5   14    0 o  510.354   10.869  199.714   8.4817  199.714   8.4817  199.714   8.4817  510.354   10.869  510.354   10.869 0.000000 0.000000 
1 1 1    5   14    1 o  520.331   10.921  207.431   8.6978   0.0000   0.0000  207.431   8.6978  ?   ?   520.331   10.921 0.000000 10.92091 
1 1 1    5   14    2 o  217.002   12.027   36.197   3.9790   0.0000   0.0000   36.197   3.9790  ?   ?   217.002   12.027 0.000000 12.02668 
1 1 1    5   14    3 o  1166.93   16.330  1044.69   29.168   0.0000   0.0000  1044.69   29.168  ?   ?   1166.93   16.330 0.000000 16.33002 
1 1 1    5   14    4 o  305.027   10.933   71.283   5.1046   0.0000   0.0000   71.283   5.1046  ?   ?   305.027   10.933 0.000000 10.93343 
1 1 1    5   14    5 o  951.745   8.3096  693.669   12.105  692.247   14.876  696.458   20.827  950.616   10.224  953.075   14.277 -2.458557 17.56002 
1 1 1    5   14    6 f  159.652   8.6572   19.577   2.1076   17.244   2.5780   24.282   3.6601  149.589   11.344  177.459   13.578 -27.87007 17.69279 
1 1 1    5   14    7 o  317.993   6.4954   77.417   3.1615   77.574   3.9052   77.119   5.3853  318.284   8.0161  317.265   11.090 1.018616 13.68351 
1 1 1    5   14    8 o  555.926   8.0883  236.656   6.8825  236.656   6.8825   0.0000   0.0000  555.926   8.0883  ?   ?  0.000000 8.088297 
1 1 1    5   14    9 o  294.953   5.9663   66.600   2.6936   65.979   3.7628   67.253   3.8575  293.532   8.3750  296.350   8.5041 -2.818268 11.93572 
1 1 1    5   14   10 o  866.776   6.8878  575.201   9.1382  575.825   12.938  574.580   12.909  867.080   9.7485  866.143   9.7369 0.9366455 13.77830 
1 1 1    5   14   11 o  1037.74   7.6929  824.540   12.219  811.002   17.050  838.838   17.521  1028.95   10.826  1046.45   10.939 -17.49927 15.39018 
1 1 1    5   14   12 o  317.090   7.1404   76.978   3.4656   76.149   6.1684   77.360   4.1892  315.250   12.783  317.849   8.6108 -2.598938 15.41306 
1 1 1    5   14   13 o  716.435   6.3942  392.929   7.0118  387.188   9.7859  398.987   10.052  711.085   8.9910  721.835   9.0979 -10.74939 12.79099 
1 1 1    5   14   14 o  310.988   6.3832   74.036   3.0384   73.718   4.3096   74.350   4.2845  310.279   9.0743  311.607   8.9831 -1.328522 12.76865 
1 1 1    5   14   15 o  1186.24   8.4902  1077.39   15.416  1073.96   21.692  1080.89   21.912  1184.10   11.968  1187.91   12.051 -3.805420 16.98448 
1 1 1    5   14   16 o  913.092   7.2707  638.260   10.162  636.422   14.287  640.142   14.456  911.644   10.239  914.300   10.330 -2.655396 14.54405 
1 1 1    5   14   17 o  334.334   6.5848   85.566   3.3697   85.949   4.7381   85.174   4.7934  335.044   9.2391  333.528   9.3894 1.515808 13.17280 
1 1 1    5   14   18 o  199.270   10.241   30.486   3.1130   31.943   5.2367   29.690   3.8713  203.446   16.972  196.453   12.947 6.993469 21.34620 
1 1 1    5   14   19 o  1050.08   11.172  844.407   17.956  823.326   24.771  867.748   26.066  1036.58   15.613  1064.14   16.003 -27.56433 22.35726 
1 1 1    5   14   20 o  275.375   8.9626   58.058   3.7777   53.359   4.7645   66.013   6.1994  263.959   11.793  293.556   13.797 -29.59659 18.15010 
1 1 1    5   14   21 o  171.077   11.898   22.523   3.0961   21.990   4.5755   22.974   4.2051  168.412   18.030  172.395   16.123 -3.982285 24.18780 
1 1 1    5   14   22 o  379.321   6.3493  110.140   3.6864  104.638   4.4798  121.679   6.4878  369.704   7.9166  398.621   10.633 -28.91772 13.25669 
1 1 1    5   14   23 o  1419.19   8.8612  1542.09   19.249  1520.88   24.359  1577.35   31.409  1409.21   11.293  1434.83   14.301 -25.62354 18.22278 
1 1 1    5   14   24 o  2182.62   11.486  3648.61   38.371  3600.45   53.212  3700.79   55.383  2167.39   16.040  2197.29   16.467 -29.90552 22.98803 
1 1 1    5   14   25 o  757.459   5.9022  439.188   6.8429  435.177   9.5501  443.419   9.8097  753.914   8.2759  761.015   8.4216 -7.100220 11.80736 
1 1 1    5   14   26 o  836.543   6.8123  535.732   8.7227  536.297   11.105  534.823   14.094  836.906   8.6693  835.628   11.019 1.277466 14.02041 
1 1 1    5   14   27 f  379.027   11.306  110.044   6.5592   0.0000   0.0000  110.044   6.5592  ?   ?   379.027   11.306 0.000000 11.30605 
1 1 1    5   14   28 o  746.501   6.8297  426.630   7.8037  418.949   9.9597  438.843   12.559  739.667   8.7971  756.913   10.840 -17.24622 13.96081 
1 1 1    5   14   29 o  308.032   7.7062   72.650   3.6333   65.898   5.0067   80.161   5.2808  293.294   11.153  323.494   10.665 -30.20059 15.43135 
1 1 1    5   14   30 o  1119.46   7.2516  959.522   12.426  961.374   17.589  957.677   17.556  1120.29   10.258  1118.14   10.258 2.156006 14.50653 
1 1 1    5   14   31 o  535.178   6.6252  219.287   5.4271  228.071   7.8221  211.134   7.5360  545.682   9.3652  525.029   9.3776 20.65326 13.25313 
1 1 1    5   14   32 o  1145.60   7.4758  1004.97   13.109  1011.55   18.636  998.528   18.443  1149.02   10.596  1141.61   10.555 7.412598 14.95599 
1 1 1    5   14   33 o  516.452   8.4671  204.291   6.6932  216.079   11.099  197.554   8.3906  530.802   13.661  507.737   10.797 23.06418 17.41223 
1 1 1    5   14   34 o  433.677   12.622  144.229   8.3785  157.268   14.114  137.134   10.412  452.120   20.395  422.608   16.096 29.51221 25.98100 
1 1 1    5   14   35 o  563.787   7.4043  243.454   6.3896  262.746   10.066  230.435   8.2691  585.396   11.234  548.338   9.8523 37.05884 14.94238 
1 1 1    5   14   36 o  378.400   8.0836  109.702   4.6819  111.159   6.8487  108.423   6.4150  380.674   11.754  376.004   11.146 4.670746 16.19875 
1 1 1    5   14   37 o  561.084   6.9980  241.156   6.0100  251.422   8.6349  231.511   8.3700  572.641   9.8515  549.488   9.9517 23.15247 14.00322 
1 1 1    5   14   38 o  353.477   8.3141   95.765   4.4983   96.224   6.4835   95.338   6.2462  354.043   11.964  352.444   11.579 1.599792 16.64951 
1 1 1    5   14   39 o  392.416   7.9182  118.030   4.7560  123.096   6.8078  113.200   6.6471  400.457   11.107  384.000   11.309 16.45609 15.85100 
1 1 1    5   14   40 o  242.676   13.599   45.437   5.0309   49.254   6.0852   37.193   8.9425  252.344   15.835  216.585   27.602 35.75847 31.82210 
1 1 1    5   14   41 o  753.332   6.3823  434.856   7.3593  442.351   11.803  430.089   9.4130  759.082   10.159  748.891   8.2118 10.19165 13.06275 
1 1 1    5   14   42 o  299.069   8.5787   68.620   3.9270   60.496   6.2142   74.021   5.0670  279.792   14.561  310.407   10.665 -30.61588 18.04852 
1 1 1    5   14   43 o  270.001   8.7409   55.950   3.6124   63.457   6.5464   52.664   4.3315  286.376   14.987  261.755   10.811 24.62061 18.47936 
1 1 1    5   14   44 f  229.996   9.6477   40.639   3.3964   33.685   5.9137   44.062   4.1489  207.474   18.827  239.313   11.326 -31.83920 21.97140 
1 1 1    5   14   45 o  143.656   14.271   16.093   3.0965   9.5016   5.3256   19.460   3.8060  107.674   30.774  157.762   15.982 -50.08823 34.67680 
1 1 1    5   14   46 o  384.684   10.626  113.901   6.2568  132.480   12.200  107.271   7.2882  412.171   19.338  372.849   12.771 39.32178 23.17480 
1 1 1    5   14   47 o  246.368   9.4430   46.686   3.5609   53.781   4.8098   38.079   5.2973  264.039   11.901  220.982   15.765 43.05754 19.75256 
1 1 1    5   14   48 o   64.392   22.115   3.0167   2.6325   5.6518   3.9404   0.8926   3.5378   84.552   26.986   58.518   24.214 26.03427 36.25638 
1 1 1    5   14   49 o  113.244   16.313   10.178   2.7460   12.285   3.9403   8.1890   3.8289  123.159   21.695   99.522   25.130 23.63686 33.19940 
1 1 1    5   14   50 o   70.117   22.176   3.8594   2.6656   0.8527   3.8638   6.5902   3.6823   60.385   25.171   89.537   25.589 -29.15269 35.89415 
1 1 1    5   14   51 o  267.170   8.3171   54.914   3.4012   50.750   4.8413   58.973   4.7793  256.038   12.353  276.258   11.303 -20.22021 16.74391 
1 1 1    5   14   52 o   92.541   23.920   7.1098   3.4128   5.3292   4.2497   10.344   5.7274   82.891   28.103  110.233   32.036 -27.34224 42.61519 
1 1 1    5   14   53 o  265.319   10.061   54.352   4.0858   56.343   5.1389   50.931   6.7367  269.503   12.458  254.056   17.429 15.44736 21.42372 
1 1 1    5   14   54 o   48.871   21.439  -0.5305   3.0768   2.4576   4.4850  -3.1870   4.2289   69.913   27.867   49.975   23.174 19.93811 36.24383 
1 1 1    5   14   55 o  266.968   9.3272   55.029   3.8114   60.603   5.5583   50.082   5.2363  279.005   13.016  253.108   13.565 25.89691 18.79952 
1 1 1    5   14   56 o  100.453   21.639   8.4029   3.2289   7.9059   4.5448   8.9095   4.5884   96.179   28.695  101.717   28.390 -5.537666 40.36569 
1 1 1    5   14   57 o  173.323   13.711   23.664   3.6077   26.662   4.8818   20.056   5.3551  182.366   17.712  155.398   23.227 26.96764 29.20973 
1 1 1    5   14   58 o  243.535   12.960   46.572   4.8134   33.129   10.448   50.195   5.4232  188.516   37.528  252.270   14.101 -63.75415 40.08981 
1 1 1    5   14   59 o  206.654   11.913   33.490   3.7521   31.245   5.3710   35.631   5.2438  196.545   18.056  210.968   16.367 -14.42281 24.36983 
1 1 1    5   14   60 o  150.115   15.723   18.147   3.5590   15.441   5.0069   20.911   5.0600  133.180   25.491  158.058   21.471 -24.87897 33.32824 
1 1 1    5   14   61 o  228.537   10.610   40.862   3.7113   42.032   5.3901   39.807   5.1176  228.532   15.501  222.651   15.106 5.881012 21.64418 
1 1 1    5   14   62 o  168.992   13.878   22.918   3.5579   23.560   5.0980   22.308   4.9679  167.083   20.355  162.489   20.426 4.594391 28.83631 
1 1 1    5   15    0 o   48.691   27.198   2.4555   3.0277   2.4555   3.0277   2.4555   3.0277   48.691   27.198   48.691   27.198 0.000000 0.000000 
1 1 1    5   15    1 o  786.323   12.859  473.873   15.476   0.0000   0.0000  473.873   15.476  ?   ?   786.323   12.859 0.000000 12.85860 
1 1 1    5   15    2 o  878.099   13.655  591.048   18.353   0.0000   0.0000  591.048   18.353  ?   ?   878.099   13.655 0.000000 13.65512 
1 1 1    5   15    3 f  772.323   9.0628  456.815   10.714  451.474   14.991  462.391   15.317  767.531   12.760  776.745   12.883 -9.214355 18.13281 
1 1 1    5   15    4 o  666.092   8.5052  339.759   8.6714  320.182   11.814  362.629   12.768  646.427   11.940  687.929   12.126 -41.50208 17.01768 
1 1 1    5   15    5 o  1009.20   10.625  780.185   16.412  790.009   23.672  771.091   22.775  1015.03   15.236  1002.86   14.837 12.17694 21.26704 
1 1 1    5   15    6 o  635.818   8.5100  309.570   8.2819  305.406   11.814  313.594   11.614  631.331   12.225  639.761   11.860 -8.429871 17.03280 
1 1 1    5   15    7 f  391.670   6.6065  117.444   3.9606  113.648   4.8876  124.703   6.7593  385.251   8.2886  403.473   10.945 -18.22223 13.72927 
1 1 1    5   15    8 o  639.183   6.9700  312.789   6.8191  305.988   8.2694  327.241   12.054  632.137   8.5466  653.541   12.051 -21.40381 14.77362 
1 1 1    5   15    9 o  639.055   6.0925  312.633   5.9594  310.299   8.4168  314.979   8.4391  636.578   8.6382  641.363   8.5965 -4.784912 12.18684 
1 1 1    5   15   10 o  1016.76   8.7774  791.606   13.660  795.467   23.913  789.736   16.643  1018.68   15.337  1015.43   10.708 3.252563 18.70480 
1 1 1    5   15   11 o  1067.99   7.9074  873.273   12.926  877.130   18.483  869.582   18.084  1070.11   11.284  1065.52   11.088 4.598877 15.82050 
1 1 1    5   15   12 o  714.643   6.4121  390.957   7.0139  398.184   10.061  384.124   9.7830  721.123   9.1152  708.281   9.0240 12.84149 12.82650 
1 1 1    5   15   13 o  886.532   7.0888  601.668   9.6191  598.440   13.534  604.963   13.674  884.021   10.002  888.823   10.051 -4.801819 14.17986 
1 1 1    5   15   14 o  378.908   6.2407  109.901   3.6194  105.636   5.0664  114.346   5.1724  371.441   8.9114  386.455   8.7442 -15.01434 12.48494 
1 1 1    5   15   15 o  850.450   7.0097  553.670   9.1247  548.271   12.804  559.242   13.007  846.184   9.8859  854.606   9.9435 -8.421631 14.02152 
1 1 1    5   15   16 o  400.761   12.165  123.009   7.4621  123.009   7.4621   0.0000   0.0000  400.761   12.165  ?   ?  0.000000 12.16485 
1 1 1    5   15   17 o  1273.30   10.412  1241.46   20.292  1227.27   34.546  1248.94   25.073  1265.34   17.837  1276.95   12.828 -11.60791 21.97113 
1 1 1    5   15   18 o  722.487   7.7727  399.603   8.5955  397.740   10.547  403.286   14.833  720.746   9.5604  725.599   13.355 -4.852783 16.42454 
1 1 1    5   15   19 o  420.546   6.9059  135.385   4.4453  142.317   6.2891  128.463   6.2842  431.132   9.5304  409.602   10.024 21.53021 13.83108 
1 1 1    5   15   20 o  294.743   8.1160   66.507   3.6615   63.895   4.9958   69.539   5.3820  288.851   11.300  301.332   11.669 -12.48093 16.24318 
1 1 1    5   15   21 o  669.352   6.9836  342.973   7.1549  343.605   10.042  342.321   10.198  669.886   9.7933  668.627   9.9642 1.258972 13.97115 
1 1 1    5   15   22 o  812.606   7.4048  505.510   9.2101  503.978   13.018  507.047   13.032  811.250   10.484  813.717   10.464 -2.467041 14.81188 
1 1 1    5   15   23 o  616.630   6.2264  291.063   5.8767  287.855   7.4173  296.471   9.6315  613.180   7.9030  622.218   10.113 -9.037659 12.83475 
1 1 1    5   15   24 o  337.303   8.6031   87.112   4.4416   81.961   6.1903   92.578   6.3767  327.099   12.364  347.650   11.984 -20.55096 17.21847 
1 1 1    5   15   25 o  581.623   6.3964  258.964   5.6944  261.033   7.1537  255.385   9.4078  583.898   8.0043  577.454   10.644 6.444275 13.31765 
1 1 1    5   15   26 o  1028.75   8.2139  810.327   12.934  824.452   18.395  796.516   18.189  1037.44   11.584  1019.70   11.654 17.73364 16.43185 
1 1 1    5   15   27 o  506.607   9.9841  196.563   7.7419  196.563   7.7419   0.0000   0.0000  506.607   9.9841  ?   ?  0.000000 9.984061 
1 1 1    5   15   28 o  468.093   6.7931  167.750   4.8671  169.274   7.5492  166.666   6.3671  470.096   10.492  466.517   8.9166 3.578857 13.76882 
1 1 1    5   15   29 o  608.138   6.2621  283.131   5.8290  281.408   8.1892  284.901   8.2987  606.185   8.8261  609.933   8.8891 -3.748169 12.52660 
1 1 1    5   15   30 o  411.929   7.1083  129.923   4.4819  129.684   6.3020  130.166   6.3753  411.459   10.006  412.219   10.104 -0.7601013 14.22055 
1 1 1    5   15   31 o  274.864   10.645   57.885   4.4785   41.868   8.1483   64.817   5.3608  232.131   23.246  290.813   12.043 -58.68196 26.18025 
1 1 1    5   15   32 o  529.615   6.7737  214.773   5.4910  222.633   7.7657  206.913   7.7653  539.093   9.4112  519.693   9.7621 19.39966 13.55984 
1 1 1    5   15   33 o  188.799   16.714   27.587   4.7802   21.383   10.606   29.168   5.3549  162.381   42.263  193.977   18.250 -31.59541 46.03525 
1 1 1    5   15   34 o  492.116   7.3631  185.484   5.5463  195.031   8.4363  178.217   7.3605  504.391   10.927  482.225   9.9721 22.16547 14.79358 
1 1 1    5   15   35 o  573.688   6.9153  252.072   6.0723  258.468   8.6753  245.929   8.5025  580.698   9.7603  566.433   9.8068 14.26483 13.83608 
1 1 1    5   15   36 o  913.616   7.9214  639.537   11.077  679.767   19.120  619.212   13.590  940.937   13.276  898.694   9.8799 42.24261 16.54882 
1 1 1    5   15   37 o  561.188   7.0737  241.272   6.0761  246.226   8.6823  236.517   8.5063  566.626   10.011  555.343   10.007 11.28345 14.15478 
1 1 1    5   15   38 o  173.593   13.028   23.283   3.4363   26.963   4.9751   19.925   4.7519  186.206   17.667  159.415   19.909 26.79184 26.61735 
1 1 1    5   15   39 o  324.285   8.6264   80.638   4.2818   81.368   6.0771   79.918   6.0339  325.434   12.200  322.520   12.223 2.914246 17.26958 
1 1 1    5   15   40 o   77.443   27.512   4.0864   4.0956   2.9710   4.7123   7.5305   8.2807   75.089   28.965  106.351   38.942 -31.26181 48.53283 
1 1 1    5   15   41 o  457.602   8.0861  160.593   5.6637  160.189   7.4333  161.152   8.7447  456.677   10.634  457.735   12.481 -1.057892 16.39729 
1 1 1    5   15   42 o  459.166   7.7863  161.702   5.4723  162.403   7.8781  161.049   7.6071  459.631   11.198  457.773   10.857 1.858429 15.59697 
1 1 1    5   15   43 o   72.850   24.741   3.8780   3.2938   5.8110   4.6159   1.8726   4.7016   87.753   29.291   70.241   28.345 17.51205 40.76040 
1 1 1    5   15   44 o  286.923   10.077   63.284   4.4255   70.272   6.7487   58.012   5.8617  301.614   14.618  273.795   14.034 27.81912 20.26468 
1 1 1    5   15   45 o  349.021   8.1223   93.525   4.3391   78.363   7.0941  102.588   5.4847  318.359   14.558  365.274   9.8099 -46.91510 17.55503 
1 1 1    5   15   46 o  334.952   8.9398   86.232   4.5833   87.148   11.469   86.057   4.9999  332.174   22.694  334.475   9.7663 -2.301239 24.70598 
1 1 1    5   15   47 o  302.573   8.7518   70.382   4.0532   69.986   7.0299   70.579   4.9608  299.940   15.364  302.657   10.709 -2.717682 18.72768 
1 1 1    5   15   48 o  163.699   13.367   20.873   3.3201   22.162   5.7153   20.216   4.0789  165.961   23.128  160.253   16.883 5.708267 28.63444 
1 1 1    5   15   49 o  154.404   14.057   18.636   3.2858   20.995   5.8717   17.561   3.9648  160.727   24.654  148.914   17.744 11.81346 30.37574 
1 1 1    5   15   50 o  348.690   8.1410   93.498   4.3450   84.171   7.4054   98.395   5.3656  329.061   14.703  357.317   9.8106 -28.25586 17.67554 
1 1 1    5   15   51 o  188.761   15.304   27.939   4.3836   23.172   6.2727   32.490   6.1284  168.341   25.113  201.977   20.090 -33.63539 32.15963 
1 1 1    5   15   52 o  144.299   16.071   16.468   3.4892   24.041   4.7476   7.5734   5.1454  173.998   18.091   95.978   30.859 78.02077 35.77071 
1 1 1    5   15   53 o  200.066   11.154   31.069   3.4021   31.287   4.8095   30.851   4.8130  199.343   15.895  197.895   16.027 1.447952 22.57247 
1 1 1    5   15   54 o  380.319   7.9455  111.373   4.6253  121.212   7.2143  104.506   6.0269  395.262   11.924  367.496   10.715 27.76620 16.03104 
1 1 1    5   15   55 o  125.995   18.011   12.791   3.3746   11.714   4.7580   13.881   4.7869  117.164   27.075  128.540   25.231 -11.37623 37.00863 
1 1 1    5   15   56 o  332.015   8.4799   85.074   4.3094   88.153   5.9191   81.602   6.2862  336.798   11.482  323.495   12.696 13.30310 17.11774 
1 1 1    5   15   57 f  217.983   13.314   37.337   4.4210   23.896   7.0086   46.219   5.6976  166.419   28.542  241.534   15.493 -75.11533 32.47558 
1 1 1    5   15   58 o  101.686   24.730   8.9157   3.8120   11.399   6.0764   7.3041   4.8950  111.682   33.148   91.905   30.139 19.77668 44.80177 
1 1 1    5   15   59 o  203.765   12.033   32.612   3.7364   28.653   5.3968   36.257   5.1780  187.344   19.087  212.837   16.012 -25.49272 24.91365 
1 1 1    5   15   60 o  101.850   22.102   8.9177   3.3466   10.397   4.9118   7.6360   4.5721  106.539   29.236   92.093   29.034 14.44637 41.20352 
1 1 1    5   15   61 o   90.087   23.274   7.1512   3.2320   11.969   4.8094   3.1839   4.3644  114.321   27.762   69.416   27.546 44.90525 39.10925 
1 1 1    5   15   62 o  198.623   12.819   31.442   3.8765   32.509   5.5570   30.430   5.4104  197.777   18.574  191.183   18.729 6.594040 26.37795 
1 1 1    5   16    0 o  699.604   12.324  375.146   13.188  375.146   13.188  375.146   13.188  699.604   12.324  699.604   12.324 0.000000 0.000000 
1 1 1    5   16    1 o  828.631   13.360  526.202   16.945   0.0000   0.0000  526.202   16.945  ?   ?   828.631   13.360 0.000000 13.35975 
1 1 1    5   16    2 o  619.692   11.846  294.206   11.236   0.0000   0.0000  294.206   11.236  ?   ?   619.692   11.846 0.000000 11.84594 
1 1 1    5   16    3 o  332.466   11.473   84.676   5.8384   0.0000   0.0000   84.676   5.8384  ?   ?   332.466   11.473 0.000000 11.47292 
1 1 1    5   16    4 o  552.650   8.1717  233.858   6.9124  230.866   9.7433  236.890   9.8083  548.969   11.595  556.087   11.523 -7.118713 16.34762 
1 1 1    5   16    5 o  340.475   6.7619   88.747   3.5239   89.033   4.3459   88.196   6.0212  340.996   8.3264  339.310   11.594 1.686005 14.27375 
1 1 1    5   16    6 o  753.347   7.4807  434.509   8.6260  439.689   10.746  425.121   14.465  757.747   9.2648  744.895   12.687 12.85187 15.70978 
1 1 1    5   16    7 o  850.353   9.7257  553.749   12.659  558.201   18.268  549.637   17.557  853.476   13.984  846.938   13.544 6.538513 19.46748 
1 1 1    5   16    8 o  300.810   8.7992   69.285   4.0514   79.010   6.2749   62.333   5.3054  321.139   12.766  285.254   12.151 35.88516 17.62418 
1 1 1    5   16    9 o  508.621   5.9711  198.027   4.6486  198.280   6.7103  197.794   6.4459  508.885   8.6150  508.270   8.2855 0.6152649 11.95269 
1 1 1    5   16   10 o  1092.38   8.0018  913.583   13.379  928.427   19.244  899.697   18.613  1101.00   11.419  1083.84   11.220 17.15454 16.00908 
1 1 1    5   16   11 o  1367.20   9.3952  1431.26   19.661  1461.02   28.432  1403.99   27.218  1380.97   13.451  1353.79   13.135 27.18494 18.80047 
1 1 1    5   16   12 o  1035.79   7.7707  821.343   12.320  828.721   17.566  814.201   17.283  1040.26   11.032  1031.11   10.951 9.148193 15.54434 
1 1 1    5   16   13 o  708.145   7.5008  383.894   8.1301  390.204   14.247  380.847   9.9005  713.729   13.041  705.277   9.1713 8.451538 15.94310 
1 1 1    5   16   14 o  586.344   7.1768  263.183   6.4410  259.948   11.040  264.852   7.9307  582.580   12.380  588.162   8.8094 -5.581787 15.19461 
1 1 1    5   16   15 o  1707.44   13.029  2233.03   34.050  2269.13   60.115  2215.98   41.317  1719.70   22.838  1700.57   15.873 19.13440 27.81232 
1 1 1    5   16   16 o  1752.94   16.361  2354.73   43.897  2354.73   43.897   0.0000   0.0000  1752.94   16.361  ?   ?  0.000000 16.36059 
1 1 1    5   16   17 o  415.058   7.5088  131.879   4.7703  139.778   6.0392  118.774   7.7789  427.277   9.2342  393.791   12.906 33.48578 15.86907 
1 1 1    5   16   18 o  393.570   6.9432  118.574   4.1827  108.548   5.6310  130.914   6.2473  376.520   9.7707  413.492   9.8709 -36.97189 13.88888 
1 1 1    5   16   19 o  760.929   7.0807  443.240   8.2469  444.179   11.591  442.277   11.736  761.640   9.9429  760.003   10.088 1.637878 14.16470 
1 1 1    5   16   20 o  234.191   9.5769   41.994   3.4329   47.804   4.9699   36.693   4.7476  249.472   13.061  218.380   14.282 31.09253 19.35351 
1 1 1    5   16   21 o  398.134   7.4193  121.348   4.5213  112.093   6.0936  132.683   6.7440  382.595   10.405  416.249   10.585 -33.65396 14.84308 
1 1 1    5   16   22 o  910.513   7.7721  634.696   10.832  614.324   14.817  658.079   15.874  895.633   10.809  926.957   11.188 -31.32416 15.55622 
1 1 1    5   16   23 o  407.545   7.8283  127.161   4.8833  134.564   6.9423  119.912   6.8703  419.166   10.821  395.676   11.344 23.49060 15.67704 
1 1 1    5   16   24 o  689.077   7.4505  363.524   7.8582  371.882   11.284  355.653   10.950  696.825   10.579  681.454   10.498 15.37042 14.90409 
1 1 1    5   16   25 o  525.084   8.4834  211.113   6.8181  220.440   7.9915  186.161   13.071  536.516   9.7314  492.688   17.333 43.82742 19.87765 
1 1 1    5   16   26 o  562.094   7.3755  241.898   6.3456  241.270   8.3884  242.738   9.7024  561.279   9.7640  562.919   11.261 -1.639771 14.90427 
1 1 1    5   16   27 o   46.248   19.906  -0.2491   2.5489   0.4998   3.6088  -0.9945   3.6005   58.324   24.320   52.634   23.138 5.689713 33.56878 
1 1 1    5   16   28 o  521.846   6.8080  208.495   5.4379  226.304   8.4816  196.064   7.0860  543.546   10.195  505.971   9.1497 37.57529 13.69845 
1 1 1    5   16   29 o  740.626   6.3440  419.948   7.1917  429.465   10.318  410.958   10.029  748.833   9.0021  732.524   8.9450 16.30890 12.69060 
1 1 1    5   16   30 o  501.596   6.6065  192.635   5.0722  197.218   7.2644  188.275   7.0852  507.419   9.3532  495.782   9.3367 11.63718 13.21577 
1 1 1    5   16   31 o  366.029   7.4410  102.596   4.1689  101.082   5.8768  104.130   5.9147  363.207   10.571  368.645   10.482 -5.437836 14.88710 
1 1 1    5   16   32 o  282.357   11.819   61.119   5.1081   86.784   11.997   55.436   5.6454  334.802   23.562  268.477   13.784 66.32495 27.29752 
1 1 1    5   16   33 o  443.944   7.1741  150.940   4.8749  153.919   7.0067  148.145   6.7868  448.140   10.215  439.661   10.085 8.478760 14.35448 
1 1 1    5   16   34 o  666.809   6.6310  340.521   6.7678  347.893   9.6154  333.283   9.5276  673.761   9.3238  659.450   9.4391 14.31116 13.26761 
1 1 1    5   16   35 o  241.138   9.8842   44.579   3.6482   43.341   5.1935   45.785   5.1258  237.105   14.378  243.792   13.793 -6.687393 19.92438 
1 1 1    5   16   36 f  173.395   12.447   23.199   3.2815   25.227   4.5804   21.061   4.7036  180.278   16.792  164.211   19.068 16.06702 25.40851 
1 1 1    5   16   37 o  172.906   12.625   23.084   3.3183   22.337   4.5954   23.897   4.7966  169.286   18.012  175.137   18.157 -5.851089 25.57514 
1 1 1    5   16   38 o  282.926   8.9226   61.385   3.8640   60.382   5.4167   62.424   5.5136  280.323   12.624  285.022   12.638 -4.698853 17.86334 
1 1 1    5   16   39 o  280.011   21.589   61.139   9.1814   0.0000   0.0000   61.139   9.1814  ?   ?   280.011   21.589 0.000000 21.58874 
1 1 1    5   16   40 o  148.992   15.934   17.313   3.5774   18.005   4.9584   16.562   5.1665  150.709   22.156  143.919   24.320 6.789459 32.89926 
1 1 1    5   16   41 o  447.477   7.5620  153.544   5.1793  154.821   7.3023  152.251   7.3473  448.904   10.628  445.138   10.784 3.766632 15.14039 
1 1 1    5   16   42 o  104.472   20.947   8.7829   3.2330   6.1037   4.4697   11.723   4.6819   88.966   28.778  119.986   26.225 -31.02005 38.93467 
1 1 1    5   16   43 o  324.933   8.8613   81.069   4.4072   87.058   6.3949   75.652   6.0822  336.188   12.428  313.349   12.681 22.83847 17.75555 
1 1 1    5   16   44 o  185.290   13.481   26.634   3.7971   19.908   5.1276   34.801   5.6502  158.171   21.756  211.009   17.656 -52.83795 28.01884 
1 1 1    5   16   45 o  310.773   12.846   74.541   6.1105   61.627   14.095   77.530   6.7809  273.826   34.387  316.695   13.989 -42.86908 37.12346 
1 1 1    5   16   46 o  141.721   19.010   15.947   4.0198   20.542   6.0534   12.323   5.3763  159.072   25.742  121.667   29.234 37.40429 38.95181 
1 1 1    5   16   47 o  181.805   19.846   26.189   5.4330   0.0000   0.0000   26.189   5.4330  ?   ?   181.805   19.846 0.000000 19.84621 
1 1 1    5   16   48 o  274.769   10.670   58.209   4.4874   65.971   6.4047   50.724   6.2890  291.649   14.347  254.782   16.211 36.86667 21.64817 
1 1 1    5   16   49 o  568.984   7.8848  248.848   6.8669  249.135   9.8400  248.575   9.5875  568.004   11.318  567.489   11.038 0.5148315 15.80919 
1 1 1    5   16   50 o  235.013   12.463   42.880   4.4672   38.551   6.4953   46.766   6.1538  220.535   19.441  244.157   16.565 -23.62204 25.54077 
1 1 1    5   16   51 o  250.133   12.715   48.628   4.8521   50.551   7.3979   47.177   6.4276  252.571   19.282  244.785   17.266 7.786667 25.88258 
1 1 1    5   16   52 o   71.941   26.677   3.4597   3.9068  -2.7460   6.1572   7.6416   5.0545   63.775   28.968   96.091   30.553 -32.31622 42.10240 
1 1 1    5   16   53 o  130.419   19.836   13.763   3.8349   14.027   6.7100   13.635   4.6733  126.463   33.951  128.009   24.747 -1.545929 42.01311 
1 1 1    5   16   54 o  193.338   13.516   29.268   3.9746   28.655   7.3892   29.517   4.7148  185.405   26.817  193.267   16.084 -7.862610 31.27052 
1 1 1    5   16   55 o  223.426   12.699   39.004   4.3248   38.036   8.1537   39.383   5.1015  214.275   25.352  223.617   14.992 -9.341980 29.45292 
1 1 1    5   16   56 o  228.416   12.903   40.868   4.4926   34.494   6.8621   45.649   5.9434  205.198   22.202  239.848   16.286 -34.65041 27.53461 
1 1 1    5   16   57 o  242.894   13.354   46.384   4.9458   39.346   10.481   48.400   5.6097  209.425   33.852  247.343   14.887 -37.91808 36.98084 
1 1 1    5   16   58 f  204.421   13.719   33.014   4.2678   33.763   8.3294   32.747   4.9697  197.205   28.415  202.367   16.180 -5.162231 32.69852 
1 1 1    5   16   59 o  153.480   17.224   19.128   3.9764   11.662   6.8950   22.849   4.8673  110.515   35.742  166.636   19.449 -56.12099 40.69092 
1 1 1    5   16   60 o   57.543   23.288   1.6636   3.1832   5.8148   4.5883  -2.1885   4.4200   82.362   29.135   52.266   24.041 30.09508 37.77313 
1 1 1    5   16   61 o  119.954   18.380   12.023   3.2671   3.1460   4.6269   20.849   4.6137   69.956   28.158  157.779   19.521 -87.82301 34.26312 
1 1 1    5   17    0 o  651.814   12.114  325.641   12.076  325.641   12.076  325.641   12.076  651.814   12.114  651.814   12.114 0.000000 0.000000 
1 1 1    5   17    1 o  831.972   13.447  530.343   17.123   0.0000   0.0000  530.343   17.123  ?   ?   831.972   13.447 0.000000 13.44659 
1 1 1    5   17    2 o  557.002   11.618  237.643   9.9052   0.0000   0.0000  237.643   9.9052  ?   ?   557.002   11.618 0.000000 11.61812 
1 1 1    5   17    3 o  868.579   13.772  578.060   18.310   0.0000   0.0000  578.060   18.310  ?   ?   868.579   13.772 0.000000 13.77229 
1 1 1    5   17    4 o  731.545   12.691  409.969   14.211   0.0000   0.0000  409.969   14.211  ?   ?   731.545   12.691 0.000000 12.69138 
1 1 1    5   17    5 o  869.222   9.8657  578.569   13.126  586.436   18.994  571.378   18.160  874.839   14.185  863.566   13.739 11.27277 19.74717 
1 1 1    5   17    6 o  858.227   9.8198  564.014   12.900  571.566   18.639  557.072   17.871  863.695   14.099  852.702   13.693 10.99298 19.65361 
1 1 1    5   17    7 o  132.180   12.056   13.493   2.4123   14.397   2.9505   11.670   4.1897  136.326   14.356  121.258   23.422 15.06863 27.47107 
1 1 1    5   17    8 o  1084.74   9.2469  900.942   15.353  896.981   18.798  908.877   26.607  1082.22   11.348  1089.00   15.963 -6.774292 19.58535 
1 1 1    5   17    9 o  745.914   9.3300  426.010   10.652  413.263   14.927  439.239   15.206  734.494   13.277  757.235   13.119 -22.74030 18.66571 
1 1 1    5   17   10 o  668.303   8.9235  341.953   9.1280   0.0000   0.0000  341.953   9.1280  ?   ?   668.303   8.9235 0.000000 8.923476 
1 1 1    5   17   11 o  522.850   7.0038  209.268   5.6051  211.761   9.7958  208.054   6.8345  525.824   12.171  521.300   8.5654 4.523926 14.88299 
1 1 1    5   17   12 f  628.274   7.2784  302.170   6.9993  303.806   12.046  301.337   8.6002  629.813   12.496  627.365   8.9561 2.447876 15.37367 
1 1 1    5   17   13 o  969.335   7.5669  719.297   11.227  719.504   15.922  719.093   15.833  969.338   10.731  969.064   10.674 0.2740479 15.13608 
1 1 1    5   17   14 o  970.932   7.6090  721.671   11.308  726.760   16.169  716.799   15.820  974.210   10.844  967.518   10.683 6.691895 15.22187 
1 1 1    5   17   15 o  976.776   8.8299  730.453   13.201  728.716   16.178  733.916   22.837  975.521   10.835  978.724   15.245 -3.203552 18.70286 
1 1 1    5   17   16 o  485.429   7.4748  180.389   5.5539  176.794   6.8030  187.573   9.6171  480.533   9.2493  494.873   12.696 -14.33997 15.70818 
1 1 1    5   17   17 o  1383.54   9.6695  1465.63   20.477  1483.77   29.329  1448.37   28.602  1391.74   13.768  1375.05   13.590 16.68445 19.34516 
1 1 1    5   17   18 o  170.730   11.746   22.430   3.0509   25.273   4.2471   19.398   4.3853  180.950   15.484  157.993   18.483 22.95708 24.11183 
1 1 1    5   17   19 o  584.851   6.8042  261.842   6.0910  253.413   8.3885  271.243   8.8587  575.291   9.5264  595.180   9.7242 -19.88861 13.61294 
1 1 1    5   17   20 o  877.600   7.5613  589.622   10.157  590.280   14.343  588.961   14.386  877.948   10.673  876.964   10.717 0.9836426 15.12527 
1 1 1    5   17   21 o  542.140   7.0780  225.005   5.8734  222.898   8.2492  227.171   8.3645  539.515   9.9894  544.661   10.033 -5.146118 14.15827 
1 1 1    5   17   22 o  569.821   7.2198  248.576   6.2970  254.210   8.8779  242.872   8.9329  576.153   10.067  563.148   10.363 13.00543 14.44802 
1 1 1    5   17   23 o  203.841   15.268   32.027   4.7290   34.094   5.6074   26.936   8.8003  210.118   17.597  184.313   32.375 25.80466 36.84862 
1 1 1    5   17   24 o  1163.15   12.793  1036.60   22.777  1033.39   31.794  1039.98   32.645  1160.72   17.896  1164.35   18.318 -3.631836 25.60832 
1 1 1    5   17   25 o  1260.04   10.905  1216.17   21.033  1221.62   36.857  1213.53   25.612  1261.71   19.085  1258.41   13.297 3.309570 23.26059 
1 1 1    5   17   26 o  330.549   8.2010   83.665   4.1493   86.443   5.0779   78.083   7.1979  335.953   9.8750  319.143   14.735 16.80963 17.73807 
1 1 1    5   17   27 o  240.286   10.230   44.226   3.7623   42.566   4.4695   48.263   6.9695  235.355   12.451  250.103   18.334 -14.74748 22.16216 
1 1 1    5   17   28 o  655.426   6.2430  328.882   6.2631  326.776   8.7922  331.052   8.9239  653.211   8.7938  657.467   8.8677 -4.256348 12.48866 
1 1 1    5   17   29 o  220.419   9.6836   37.217   3.2670   37.299   4.5729   37.131   4.6692  220.143   13.638  219.614   13.963 0.5285797 19.51829 
1 1 1    5   17   30 o   70.982   23.295   3.7119   2.9241   2.7839   4.0930   4.6792   4.1789   71.502   27.138   81.388   27.866 -9.885956 38.89700 
1 1 1    5   17   31 o  488.126   8.9608  182.527   6.6950  170.161   13.005  186.986   7.8093  470.602   18.054  493.974   10.329 -23.37122 20.80007 
1 1 1    5   17   32 o  646.944   6.5106  320.498   6.4470  321.909   9.0489  319.044   9.1877  648.186   9.1207  645.280   9.3022 2.906067 13.02761 
1 1 1    5   17   33 o  137.013   14.842   14.584   3.0628   17.536   4.2323   11.337   4.4380  149.795   18.878  118.923   25.166 30.87216 31.45983 
1 1 1    5   17   34 o  805.951   6.7628  497.515   8.3427  497.383   11.723  497.651   11.876  805.529   9.5077  805.729   9.6293 -0.2001343 13.53216 
1 1 1    5   17   35 o  548.468   6.8193  230.432   5.7248  230.326   8.1442  230.535   8.0488  548.084   9.7080  548.345   9.5898 -0.2604980 13.64584 
1 1 1    5   17   36 o  250.448   9.3416   48.097   3.5810   47.971   5.0551   48.223   5.0737  249.525   13.283  250.182   13.297 -0.6571503 18.79532 
1 1 1    5   17   37 o  527.104   6.8975  212.885   5.5649  205.669   7.7875  220.414   7.9551  517.781   9.8261  536.037   9.6958 -18.25647 13.80436 
1 1 1    5   17   38 o  444.207   9.3278  151.373   6.3421  160.757   8.1503  136.969   10.098  457.464   11.640  421.633   15.646 35.83087 19.50118 
1 1 1    5   17   39 o  352.959   8.6693   95.560   4.6836   88.764   5.9538  106.592   7.5860  339.892   11.444  372.204   13.316 -32.31247 17.55781 
1 1 1    5   17   40 o  330.786   8.2552   83.931   4.1797   80.614   5.7890   87.542   6.0409  323.815   11.680  337.442   11.696 -13.62671 16.52915 
1 1 1    5   17   41 o   64.076   23.925   2.4615   3.1530   4.3345   4.5234   0.6915   4.3972   80.169   28.867   63.971   26.775 16.19842 39.37255 
1 1 1    5   17   42 o  264.929   9.4800   53.911   3.8442   55.572   5.4745   52.296   5.3994  268.503   13.321  260.080   13.611 8.422791 19.04442 
1 1 1    5   17   43 o  117.578   18.198   10.978   3.1692   11.094   4.5018   10.864   4.4623  116.482   25.918  115.248   25.924 1.233589 36.65806 
1 1 1    5   17   44 o  141.362   16.228   15.687   3.4477   19.714   4.7961   11.382   4.9594  157.665   20.349  117.451   27.985 40.21388 34.60132 
1 1 1    5   17   45 o  194.310   16.352   29.517   4.8180   19.247   12.547   31.293   5.2181  149.019   48.218  199.886   17.223 -50.86731 51.20157 
1 1 1    5   17   46 o  125.737   18.839   12.609   3.5141   13.772   4.9411   11.418   4.9987  129.523   25.829  117.179   28.209 12.34364 38.24793 
1 1 1    5   17   47 o  174.482   14.672   23.776   3.8820   20.546   5.5718   26.823   5.4117  159.557   23.520  184.054   19.507 -24.49683 30.55663 
1 1 1    5   17   48 o  320.508   10.080   79.162   4.9448   88.850   7.4213   71.428   6.6312  338.365   14.329  303.398   14.279 34.96735 20.22949 
1 1 1    5   17   49 o  276.253   10.675   58.890   4.5140   56.911   6.5065   60.726   6.2676  269.810   15.824  279.124   14.722 -9.313721 21.61370 
1 1 1    5   17   50 o  220.221   13.572   37.785   4.5526   34.248   6.8479   40.586   6.0944  206.650   21.988  226.897   17.688 -20.24759 28.21903 
1 1 1    5   17   51 o   60.974   27.191  -1.4497   5.1498  -4.4562   5.9648   7.3522   10.206   59.021   27.422  106.317   42.145 -47.29680 50.28051 
1 1 1    5   17   52 o  226.311   14.479   40.088   4.9892   42.269   6.8858   37.678   7.2389  230.264   19.728  216.169   22.193 14.09511 29.69352 
1 1 1    5   17   53 o  266.846   12.361   55.298   5.0486   52.760   7.3097   57.614   6.9813  257.666   18.661  270.161   16.969 -12.49545 25.22230 
1 1 1    5   17   54 o  317.213   12.030   78.186   5.8409   76.018   7.9715   80.698   8.5830  310.131   16.856  319.082   17.642 -8.950897 24.40048 
1 1 1    5   17   55 o   47.058   22.458  -5.3502   4.5141  -4.7320   6.2418  -6.0281   6.5361   59.332   27.728   58.652   27.709 0.6801605 39.19940 
1 1 1    5   17   56 o   73.166   27.806   3.6215   4.3005   0.9308   6.1958   6.1230   5.9740   71.951   31.001   88.874   32.982 -16.92307 45.26513 
1 1 1    5   17   57 o   69.234   29.745   0.9891   5.6723 -32.1970   15.756   5.9309   6.0800   70.242   35.127   87.762   33.131 -17.51980 48.28679 
1 1 1    5   17   58 o  150.243   16.702   18.223   3.7759   23.452   6.4777   15.531   4.6471  164.714   26.600  135.354   23.270 29.35983 35.34152 
1 1 1    5   17   59 o  144.442   25.598   18.204   5.4523   11.094   8.7263   22.757   6.9832  106.961   39.830  158.548   29.871 -51.58633 49.78637 
1 1 1    5   17   60 o   72.498   25.633   4.3166   3.5512   12.275   6.0153   0.0589   4.3998  112.544   32.866   58.258   25.595 54.28628 41.65705 
1 1 1    5   17   61 o   74.998   26.214   4.8079   3.7067   3.6966   6.8208   5.2737   4.4156   78.410   33.111   78.481   28.482 -0.7032776E-01 43.67549 
1 1 1    5   18    1 o  640.343   12.298  314.065   12.053   0.0000   0.0000  314.065   12.053  ?   ?   640.343   12.298 0.000000 12.29768 
1 1 1    5   18    2 o  1044.57   15.496  836.125   24.775   0.0000   0.0000  836.125   24.775  ?   ?   1044.57   15.496 0.000000 15.49574 
1 1 1    5   18    3 f  674.177   12.490  348.135   12.888   0.0000   0.0000  348.135   12.888  ?   ?   674.177   12.490 0.000000 12.48986 
1 1 1    5   18    4 o  687.886   12.614  362.440   13.281   0.0000   0.0000  362.440   13.281  ?   ?   687.886   12.614 0.000000 12.61381 
1 1 1    5   18    5 o  565.418   8.5368  244.762   7.3882  254.113   10.728  236.325   10.190  576.005   12.168  555.486   11.985 20.51959 17.07886 
1 1 1    5   18    6 o  840.816   9.7935  541.321   12.604  536.649   17.675  546.154   17.979  836.978   13.797  844.351   13.911 -7.373230 19.59256 
1 1 1    5   18    7 o  487.463   8.4953  181.920   6.3386  178.161   8.9027  185.785   9.0267  482.312   12.059  492.526   11.974 -10.21335 16.99411 
1 1 1    5   18    8 o  1205.35   12.179  1112.71   22.469  1124.69   32.065  1101.16   31.496  1211.37   17.294  1198.64   17.167 12.72522 24.36756 
1 1 1    5   18    9 o  1047.83   9.1224  840.612   14.631  817.665   17.444  895.042   26.867  1033.33   11.029  1080.75   16.241 -47.41626 19.63215 
1 1 1    5   18   10 o  1970.73   12.779  2974.64   38.548  2964.07   54.436  2985.26   54.593  1966.45   18.086  1973.47   18.073 -7.019165 25.56833 
1 1 1    5   18   11 o  292.938   8.2057   65.695   3.6793   52.733   6.3698   72.185   4.5072  261.850   15.969  307.049   9.5902 -45.19849 18.62756 
1 1 1    5   18   12 o  1649.99   12.713  2085.14   32.107  2206.08   59.600  2035.70   38.110  1695.69   22.963  1630.03   15.275 65.65723 27.57922 
1 1 1    5   18   13 o  324.528   8.1479   80.627   4.0473   75.905   4.9654   89.975   6.9862  314.852   10.303  342.733   13.317 -27.88113 16.83787 
1 1 1    5   18   14 o  1400.27   11.215  1501.52   24.038  1497.99   29.373  1508.68   41.825  1398.41   13.723  1402.73   19.480 -4.324829 23.82825 
1 1 1    5   18   15 o  1069.52   8.1396  875.705   13.325  891.684   19.163  860.747   18.541  1079.05   11.603  1060.17   11.426 18.87378 16.28387 
1 1 1    5   18   16 o   73.849   22.035   4.2281   2.6798   4.2644   3.6747   4.1869   3.9165   77.354   26.133   77.892   26.962 -0.5383377 37.54827 
1 1 1    5   18   17 o  702.373   6.9660  377.649   7.4890  372.969   10.408  382.675   10.785  697.921   9.7426  706.935   9.9667 -9.014587 13.93749 
1 1 1    5   18   18 o  1139.24   8.5672  993.685   14.939  1000.46   21.248  987.062   21.008  1142.88   12.146  1135.21   12.090 7.674438 17.13809 
1 1 1    5   18   19 o  476.501   7.0267  173.817   5.1249  173.420   7.1596  174.235   7.3392  475.890   9.8290  477.002   10.052 -1.111694 14.05897 
1 1 1    5   18   20 o  339.093   8.2032   88.035   4.2577   80.024   5.7618   97.672   6.3193  323.229   11.646  357.097   11.561 -33.86841 16.41019 
1 1 1    5   18   21 f  309.176   10.301   73.206   4.8747   74.771   5.8346   69.589   8.8706  312.420   12.201  300.561   19.385 11.85876 22.90541 
1 1 1    5   18   22 o  747.005   8.6297  427.273   9.8671  429.618   11.969  422.298   17.432  748.965   10.441  742.240   15.344 6.725159 18.55913 
1 1 1    5   18   23 o  182.481   16.639   25.746   4.5964   29.364   8.0370   23.987   5.6031  193.375   27.966  175.479   21.297 17.89673 35.15191 
1 1 1    5   18   24 o  1257.58   9.4656  1211.16   18.220  1164.17   24.695  1267.31   26.993  1232.56   13.090  1285.92   13.714 -53.36230 18.95817 
1 1 1    5   18   25 o  475.640   8.4740  173.239   6.1693  170.458   8.5490  176.261   8.9118  471.678   11.841  479.625   12.139 -7.947021 16.95819 
1 1 1    5   18   26 o  1097.92   8.9327  923.161   15.011  955.244   21.765  894.054   20.731  1116.44   12.737  1080.12   12.540 36.32678 17.87364 
1 1 1    5   18   27 o  412.887   7.7675  130.540   4.9089  135.628   6.1026  121.212   8.2626  420.801   9.4748  397.637   13.576 23.16418 16.55505 
1 1 1    5   18   28 o  365.326   8.2484  102.210   4.6123   98.557   5.5659  110.217   8.2403  358.676   10.138  379.115   14.201 -20.43869 17.44817 
1 1 1    5   18   29 o  1212.27   13.501  1126.94   25.052   0.0000   0.0000  1126.94   25.052  ?   ?   1212.27   13.501 0.000000 13.50147 
1 1 1    5   18   30 o  719.740   8.8266  396.830   9.7239  372.417   17.516  407.705   11.691  696.435   16.432  729.395   10.472 -32.96039 19.48469 
1 1 1    5   18   31 o  188.910   11.318   27.457   3.2576   26.520   4.5096   28.480   4.7109  185.134   16.074  191.888   16.191 -6.753815 22.81434 
1 1 1    5   18   32 o  359.515   7.4043   99.002   4.0745  102.688   5.7487   95.281   5.7757  366.004   10.262  352.531   10.704 13.47241 14.82808 
1 1 1    5   18   33 o  370.381   7.3398  105.086   4.1610  106.160   5.8256  103.968   5.9454  372.104   10.228  368.221   10.549 3.882874 14.69348 
1 1 1    5   18   34 f  574.396   6.6714  252.721   5.8654  255.743   8.2284  249.599   8.3631  577.582   9.3075  570.574   9.5761 7.008240 13.35403 
1 1 1    5   18   35 o  402.556   7.2237  124.161   4.4510  115.771   6.0741  133.892   6.5412  388.496   10.215  417.793   10.229 -29.29779 14.45569 
1 1 1    5   18   36 o  125.829   15.810   12.379   2.9778   16.576   4.1117   7.7498   4.3183  145.346   18.931   98.335   27.576 47.01159 33.44870 
1 1 1    5   18   37 o  663.871   8.5828  337.964   8.7213  350.202   11.697  322.645   13.088  675.287   11.317  647.772   13.200 27.51556 17.38669 
1 1 1    5   18   38 o  381.339   8.5444  111.532   4.9872  116.118   6.9781  106.745   7.1305  388.728   11.728  372.606   12.503 16.12207 17.14227 
1 1 1    5   18   39 o  199.925   10.890   30.798   3.3199   32.124   4.6442   29.413   4.7477  203.589   15.009  194.573   16.086 9.015732 22.00077 
1 1 1    5   18   40 o  438.605   7.3211  147.511   4.9149  140.294   6.8078  155.367   7.1032  427.321   10.408  449.707   10.319 -22.38568 14.65685 
1 1 1    5   18   41 o  163.454   13.320   20.724   3.3036   23.010   4.7080   18.507   4.6367  171.344   18.231  152.992   20.302 18.35213 27.28626 
1 1 1    5   18   42 o  278.380   9.3370   59.534   3.9785   52.424   5.4919   67.387   5.7713  260.279   13.835  295.686   12.752 -35.40704 18.81523 
1 1 1    5   18   43 o   50.975   22.250  -0.5597   3.2773   0.2354   4.5260  -1.4360   4.7519   62.933   26.791   59.193   26.275 3.739880 37.52469 
1 1 1    5   18   44 o  438.927   9.7236  148.184   6.5326  152.750   15.378  147.178   7.2161  440.111   22.907  437.183   10.784 2.927948 25.31803 
1 1 1    5   18   45 o  126.112   18.043   12.637   3.3836   11.953   4.6472   13.408   4.9361  120.501   25.962  127.736   26.127 -7.235275 36.83287 
1 1 1    5   18   46 o  308.302   9.3717   73.137   4.4225   74.895   6.2622   71.388   6.2465  311.174   13.148  303.730   13.436 7.444183 18.79892 
1 1 1    5   18   47 o  116.119   20.923   10.915   3.5820   6.3282   5.0848   15.433   5.0469   90.510   30.740  137.324   24.929 -46.81394 39.57798 
1 1 1    5   18   48 f  321.128   9.8901   79.467   4.8613   75.481   7.0265   83.126   6.7327  311.673   14.729  327.492   13.431 -15.81918 19.93336 
1 1 1    5   18   49 o  128.730   20.084   13.349   3.8282   12.305   5.5606   14.290   5.2782  120.451   30.213  130.876   27.235 -10.42441 40.67648 
1 1 1    5   18   50 o  197.556   19.025   31.003   5.6816   30.803   6.7822   31.475   10.404  195.233   23.147  190.043   37.099 5.190552 43.72770 
1 1 1    5   18   51 o  177.265   17.183   24.877   4.6036   24.162   6.2943   25.699   6.7505  171.743   24.651  176.726   25.709 -4.983170 35.61772 
1 1 1    5   18   52 o  147.434   19.712   17.504   4.3370   19.966   6.3016   15.289   5.9780  154.209   27.716  133.587   29.973 20.62137 40.82406 
1 1 1    5   18   53 o  150.036   20.812   18.275   4.6509   16.724   6.4601   19.943   6.7011  138.844   31.163  152.672   29.745 -13.82799 43.08028 
1 1 1    5   18   54 o   71.396   27.772   3.0537   4.3604   6.6032   6.3823  -0.0533   5.9714   92.656   34.148   68.753   30.021 23.90299 45.46819 
1 1 1    5   18   55 o   88.807   28.855   6.6267   4.4905   6.9210   6.2049   6.3030   6.5071   92.929   33.757   91.146   34.304 1.782982 48.12841 
1 1 1    5   18   56 o  119.755   32.196   12.969   6.0290  -2.3698   16.100   15.471   6.5021   97.878   45.327  130.674   32.612 -32.79628 55.83968 
1 1 1    5   18   57 o   88.496   28.288   6.7559   4.3286   7.0820   6.4375   6.4868   5.8480   92.652   34.267   89.221   32.717 3.431221 47.37743 
1 1 1    5   18   58 o  145.473   20.579   17.616   4.4543   18.270   6.4613   17.024   6.1491  141.678   30.683  137.006   30.141 4.671707 43.01111 
1 1 1    5   18   59 o  109.716   26.793   10.837   4.4606   10.274   6.0708   11.497   6.5761  103.671   33.539  108.600   34.883 -4.928268 48.39064 
1 1 1    5   18   60 o  113.083   25.947   11.535   4.3958   10.947   5.8739   12.284   6.6273  105.914   32.832  110.639   34.964 -4.724464 47.96294 
1 1 1    5   19    0 o  574.760   12.375  253.266   10.876  253.266   10.876  253.266   10.876  574.760   12.375  574.760   12.375 0.000000 0.000000 
1 1 1    5   19    3 o  897.802   14.433  617.494   19.833   0.0000   0.0000  617.494   19.833  ?   ?   897.802   14.433 0.000000 14.43252 
1 1 1    5   19    4 o  425.456   12.380  138.633   8.0622   0.0000   0.0000  138.633   8.0622  ?   ?   425.456   12.380 0.000000 12.38019 
1 1 1    5   19    5 o  967.141   8.7402  716.106   12.938  704.004   15.645  742.292   23.013  958.849   10.660  984.298   15.275 -25.44855 18.62697 
1 1 1    5   19    6 o  560.271   7.2809  240.295   6.2439  233.805   7.5453  254.395   11.121  552.618   8.9203  576.330   12.607 -23.71136 15.44378 
1 1 1    5   19    7 o  702.201   7.6113  377.470   8.1807  376.971   10.064  378.440   14.045  701.688   9.3706  702.916   13.054 -1.228149 16.06903 
1 1 1    5   19    8 o  994.269   8.8971  756.850   13.540  759.459   16.674  751.798   23.201  995.887   10.939  990.583   15.302 5.303650 18.80966 
1 1 1    5   19    9 o  1072.97   9.3190  881.445   15.305  872.803   18.586  899.654   26.977  1067.59   11.374  1083.55   16.266 -15.95264 19.84764 
1 1 1    5   19   10 o  1106.72   9.5249  937.783   16.135  933.324   19.723  946.806   28.056  1103.96   11.672  1111.55   16.490 -7.585449 20.20312 
1 1 1    5   19   11 o  1361.57   10.991  1419.62   22.906  1426.56   28.179  1406.09   39.327  1364.69   13.490  1354.28   18.972 10.40857 23.27916 
1 1 1    5   19   12 o  428.614   7.7575  140.637   5.0893  136.505   6.2464  148.797   8.7776  422.236   9.6650  440.755   13.011 -18.51959 16.20796 
1 1 1    5   19   13 o  328.225   8.4669   82.478   4.2537   82.747   7.4882   82.351   5.1686  328.635   14.886  327.943   10.297 0.6923828 18.10059 
1 1 1    5   19   14 o  764.279   8.1564  447.191   9.5416  447.615   16.546  446.980   11.679  764.378   14.142  764.033   9.9869 0.3442993 17.31273 
1 1 1    5   19   15 o  742.371   7.0307  421.887   7.9889  412.313   11.073  432.282   11.537  733.805   9.8585  751.358   10.032 -17.55273 14.06530 
1 1 1    5   19   16 o  1520.98   10.416  1771.53   24.249  1776.33   34.399  1766.79   34.188  1522.58   14.761  1518.49   14.709 4.089233 20.83828 
1 1 1    5   19   17 o  399.582   7.2936  122.232   4.4609  119.682   6.1584  125.047   6.4704  395.334   10.177  404.091   10.461 -8.756744 14.59498 
1 1 1    5   19   18 o  804.844   7.3385  495.911   9.0405  496.650   12.727  495.158   12.844  805.315   10.325  804.099   10.436 1.215942 14.68029 
1 1 1    5   19   19 o  1570.53   12.411  1889.53   29.835  1925.13   37.252  1825.85   49.822  1584.85   15.357  1542.42   21.103 42.42371 26.09912 
1 1 1    5   19   20 f  807.276   8.7257  499.002   10.782  503.261   13.217  490.532   18.641  810.614   10.652  799.985   15.223 10.62891 18.58025 
1 1 1    5   19   21 o  849.053   7.7278  551.936   10.043  550.005   14.072  553.941   14.338  847.396   10.849  850.412   11.015 -3.015747 15.46059 
1 1 1    5   19   22 o   79.999   28.558   4.1951   4.4180  -3.7025   8.1156   7.5214   5.2668   75.630   33.901   99.328   31.139 -23.69804 46.03140 
1 1 1    5   19   23 o  413.896   8.7158  131.183   5.5217  134.038   7.7042  128.167   7.9179  418.266   12.034  408.978   12.648 9.288300 17.45843 
1 1 1    5   19   24 o   73.326   27.181   3.1914   4.0551   8.0351   5.6623  -1.9085   5.8100  102.673   32.303   65.957   29.176 36.71635 43.52802 
1 1 1    5   19   25 o  956.605   8.4749  700.770   12.409  708.431   17.516  693.050   17.582  961.529   11.901  951.016   12.079 10.51318 16.95691 
1 1 1    5   19   26 o  622.743   8.2408  296.984   7.8550  299.793   11.067  294.132   11.151  625.490   11.559  619.543   11.759 5.947021 16.48921 
1 1 1    5   19   27 o  324.147   10.922   80.510   5.4191   72.906   7.6109   88.329   7.7177  307.813   16.211  339.349   14.858 -31.53610 21.99031 
1 1 1    5   19   28 o  1314.56   11.431  1324.44   23.000  1359.03   40.290  1307.72   28.013  1329.69   19.796  1305.76   14.016 23.93042 24.25532 
1 1 1    5   19   29 o  789.436   9.7650  477.515   11.799  471.076   14.894  488.367   19.336  783.810   12.415  797.587   15.838 -13.77789 20.12403 
1 1 1    5   19   30 o  254.428   10.326   49.615   4.0214   50.109   4.7160   48.299   7.6982  255.622   12.053  249.689   20.319 5.932907 23.62518 
1 1 1    5   19   31 f  418.828   6.8936  134.349   4.4193  135.115   6.1246  133.517   6.3831  419.879   9.5297  417.358   9.9921 2.520782 13.80787 
1 1 1    5   19   32 o  409.408   6.9991  128.388   4.3860  127.810   6.1022  129.005   6.3084  408.320   9.7638  410.205   10.047 -1.884857 14.00995 
1 1 1    5   19   33 o  274.813   8.5978   57.882   3.6165   61.364   5.0527   54.223   5.1788  282.788   11.673  265.756   12.731 17.03131 17.27279 
1 1 1    5   19   34 o  494.285   7.8195  187.228   5.9159  194.235   7.2805  173.609   10.150  503.295   9.4508  475.279   13.952 28.01590 16.85187 
1 1 1    5   19   35 o  330.905   7.6988   83.921   3.8994   82.351   5.4249   85.599   5.6089  327.568   10.820  333.950   10.973 -6.382904 15.41016 
1 1 1    5   19   36 o  472.914   8.8427  171.519   6.4008  176.105   8.0739  163.760   10.501  478.920   11.014  461.214   14.876 17.70621 18.50947 
1 1 1    5   19   37 o  675.824   7.9652  350.197   8.2395  351.674   11.544  348.663   11.764  676.647   11.146  673.686   11.408 2.960876 15.94953 
1 1 1    5   19   38 f  302.817   8.1589   70.328   3.7817   65.155   5.1860   76.203   5.5263  291.144   11.637  314.884   11.466 -23.73969 16.33712 
1 1 1    5   19   39 o  439.484   7.1569  148.085   4.8144  147.712   6.7566  148.470   6.8617  438.543   10.066  439.646   10.197 -1.102783 14.32802 
1 1 1    5   19   40 o   59.503   22.503   2.0186   2.8079   1.6576   3.8812   2.4149   4.0673   64.493   25.849   68.957   26.823 -4.463745 37.25134 
1 1 1    5   19   41 o  312.074   8.2805   74.752   3.9553   71.692   5.4607   78.130   5.7368  305.177   11.690  318.572   11.765 -13.39426 16.58563 
1 1 1    5   19   42 o  203.139   11.546   31.879   3.5753   29.444   4.8845   34.691   5.2474  194.211   16.591  210.968   16.379 -16.75742 23.31335 
1 1 1    5   19   43 o  217.522   14.051   36.729   4.6531   39.199   12.439   36.327   5.0174  215.287   39.191  216.048   15.271 -0.7606659 42.06112 
1 1 1    5   19   44 o   72.229   24.130   3.9285   3.1326   4.1835   4.6055   3.7089   4.2735   79.146   29.032   75.531   27.923 3.615593 40.28089 
1 1 1    5   19   45 o  291.817   9.3003   65.512   4.1541   63.098   5.8702   67.934   5.8793  285.586   13.429  296.437   12.958 -10.85153 18.66124 
1 1 1    5   19   46 o  229.659   11.027   40.681   3.8763   36.493   5.4656   44.920   5.4984  215.833   16.674  240.077   15.039 -24.24406 22.45379 
1 1 1    5   19   47 o  327.115   9.3962   82.390   4.7046   82.780   6.6321   81.994   6.6747  326.913   13.254  325.312   13.405 1.600372 18.85101 
1 1 1    5   19   48 o  464.140   8.2122  165.688   5.8342  171.111   8.5115  160.883   8.0126  470.428   11.821  456.287   11.473 14.14090 16.47283 
1 1 1    5   19   49 o  373.283   10.207  107.516   5.8319  104.337   8.2838  110.639   8.2118  366.090   14.783  377.222   14.222 -11.13123 20.51395 
1 1 1    5   19   50 o  107.221   31.231   9.7735   5.4377   11.831   5.7291  -8.9269   17.271  117.445   31.302   98.740   46.137 18.70574 55.75319 
1 1 1    5   19   51 o  166.216   16.921   21.895   4.2450   15.838   6.0223   27.877   5.9845  136.268   29.711  185.969   21.415 -49.70201 36.62474 
1 1 1    5   19   52 o  129.047   22.834   13.728   4.3452   10.771   6.3398   16.347   5.9672  111.347   34.042  138.388   29.094 -27.04111 44.78134 
1 1 1    5   19   53 o  209.309   14.735   34.461   4.6907   27.717   6.6639   41.084   6.6039  183.316   24.352  226.561   19.225 -43.24489 31.02637 
1 1 1    5   19   54 o  208.575   15.668   34.432   4.9656   29.516   6.5085   41.279   7.6812  189.500   22.903  224.618   22.651 -35.11784 32.21229 
1 1 1    5   19   55 o  169.342   17.163   23.000   4.3872   32.334   6.2456   13.908   6.1640  199.063   20.806  124.333   32.151 74.73048 38.29576 
1 1 1    5   19   56 o  195.003   32.006   33.836   9.2215   41.599   17.444   30.824   10.864  188.299   56.226  178.334   40.697 9.965332 69.40881 
1 1 1    5   19   57 o  188.680   18.811   29.009   5.3602   5.0629   10.016   38.618   6.3453   93.724   39.876  217.618   19.248 -123.8933 44.27828 
1 1 1    5   19   58 o   71.057   27.539   3.4885   4.2752   4.5785   6.0590   2.4078   6.0331   80.931   32.347   73.732   31.138 7.198631 44.89882 
1 1 1    5   19   59 o   68.863   26.703   3.3247   4.0213   7.2857   5.8521  -0.2187   5.5351   89.980   32.769   63.413   28.241 26.56708 43.25895 
1 1 1    5   19   60 o  173.608   24.207   26.372   6.2575   0.0000   0.0000   26.372   6.2575  ?   ?   173.608   24.207 0.000000 24.20712 
1 1 1    5   20    0 o  1127.47   16.518  974.099   28.492  974.099   28.492  974.099   28.492  1127.47   16.518  1127.47   16.518 0.000000 0.000000 
1 1 1    5   20    1 o  1629.91   21.759  2037.61   54.284   0.0000   0.0000  2037.61   54.284  ?   ?   1629.91   21.759 0.000000 21.75911 
1 1 1    5   20    2 o  364.295   12.983  101.645   7.2395   0.0000   0.0000  101.645   7.2395  ?   ?   364.295   12.983 0.000000 12.98337 
1 1 1    5   20    4 o  1031.16   16.229  814.761   25.615  814.761   25.615   0.0000   0.0000  1031.16   16.229  ?   ?  0.000000 16.22947 
1 1 1    5   20    5 o  862.609   10.225  569.747   13.501  578.907   19.553  561.401   18.665  869.287   14.695  856.070   14.244 13.21771 20.46573 
1 1 1    5   20    6 o  1126.02   9.6364  970.781   16.608  957.706   20.140  998.570   29.362  1118.29   11.766  1141.51   16.805 -23.21814 20.51454 
1 1 1    5   20    7 o  450.939   7.3871  155.665   5.0987  160.299   6.3810  147.480   8.4799  457.572   9.1109  438.814   12.625 18.75800 15.56941 
1 1 1    5   20    8 o  350.234   9.6887   93.919   5.1939   93.919   5.1939   0.0000   0.0000  350.234   9.6887  ?   ?  0.000000 9.688671 
1 1 1    5   20    9 o  789.434   9.9003  477.178   11.963  477.178   11.963   0.0000   0.0000  789.434   9.9003  ?   ?  0.000000 9.900284 
1 1 1    5   20   10 o  397.931   9.4938  121.241   5.7825  121.241   5.7825   0.0000   0.0000  397.931   9.4938  ?   ?  0.000000 9.493769 
1 1 1    5   20   11 o  365.498   6.9865  102.263   3.9085  107.349   5.5128   97.122   5.5423  374.435   9.6189  356.143   10.167 18.29156 13.99619 
1 1 1    5   20   12 o  940.576   7.6545  677.269   11.020  665.760   15.226  689.931   15.970  932.415   10.668  949.172   10.993 -16.75726 15.31829 
1 1 1    5   20   13 o  1621.29   10.947  2012.99   27.166  1950.09   36.914  2087.29   40.123  1595.29   15.118  1650.35   15.883 -55.06116 21.92787 
1 1 1    5   20   14 o  459.181   6.9975  161.409   4.9181  162.384   6.9943  160.455   6.9167  460.503   9.9230  457.761   9.8717 2.742096 13.99702 
1 1 1    5   20   15 o  623.232   7.9814  297.372   7.6137  291.665   13.046  300.319   9.3761  616.995   13.814  626.255   9.7814 -9.259521 16.92652 
1 1 1    5   20   16 o  1021.65   16.235  800.079   25.388  800.079   25.388   0.0000   0.0000  1021.65   16.235  ?   ?  0.000000 16.23539 
1 1 1    5   20   17 o  578.793   8.1249  256.487   7.1980  251.037   8.7207  268.136   12.750  572.552   9.9510  591.545   14.081 -18.99365 17.24255 
1 1 1    5   20   18 o  464.121   8.4963  164.933   6.0358  161.390   7.1933  173.361   11.095  459.060   10.237  475.583   15.242 -16.52335 18.36051 
1 1 1    5   20   19 o  476.519   7.5313  173.848   5.4931  174.557   7.7508  173.131   7.7863  477.400   10.607  475.443   10.699 1.957520 15.06609 
1 1 1    5   20   20 o  370.641   9.7578  105.206   5.5358  101.645   9.6525  106.952   6.7575  364.047   17.323  373.644   11.816 -9.596222 20.96856 
1 1 1    5   20   21 o  892.910   9.1813  610.563   12.548  606.765   21.646  612.485   15.400  889.566   15.897  894.173   11.252 -4.606689 19.47651 
1 1 1    5   20   22 o  438.698   8.3558  147.370   5.6108  143.258   7.8036  151.771   8.0728  432.415   11.790  445.076   11.850 -12.66058 16.71636 
1 1 1    5   20   23 o  421.642   8.6758  136.145   5.5991  138.645   7.8782  133.593   7.9592  425.369   12.100  417.532   12.454 7.837585 17.36424 
1 1 1    5   20   24 o  409.545   8.9483  128.455   5.6093  128.317   7.8034  128.603   8.0688  409.187   12.459  409.625   12.869 -0.4375916 17.91231 
1 1 1    5   20   25 o  595.801   8.0872  271.840   7.3751  276.163   10.456  267.561   10.404  600.335   11.379  590.904   11.503 9.430664 16.18035 
1 1 1    5   20   26 o  614.584   9.3716  289.335   8.8158  295.241   14.930  286.173   10.923  620.312   15.725  611.063   11.679 9.249207 19.58751 
1 1 1    5   20   27 o  533.515   10.090  218.092   8.2394  236.796   14.045  208.278   10.174  555.377   16.522  521.191   12.753 34.18652 20.87193 
1 1 1    5   20   28 o   70.719   29.267   1.0435   5.1698   0.9727   6.6578   1.1510   8.2046   78.999   32.995   87.422   36.581 -8.422844 49.26293 
1 1 1    5   20   29 o  467.073   9.3636  167.168   6.6942  178.872   9.5692  155.950   9.3681  482.873   12.947  450.819   13.576 32.05380 18.76010 
1 1 1    5   20   30 o  443.804   7.7097  150.880   5.2372  149.770   6.2942  153.380   9.4419  442.073   9.3020  446.999   13.800 -4.926239 16.64249 
1 1 1    5   20   31 o  635.169   7.2531  309.047   7.0515  305.271   8.6041  316.770   12.306  631.128   8.9067  642.465   12.514 -11.33698 15.36031 
1 1 1    5   20   32 o  150.742   12.715   17.569   2.9063   21.475   3.8774   12.560   4.3905  166.424   15.396  125.404   23.743 41.02008 28.29776 
1 1 1    5   20   33 o  363.284   7.2774  101.119   4.0466  102.315   5.6214   99.834   5.8298  365.233   10.055  360.737   10.558 4.496216 14.58052 
1 1 1    5   20   34 o   48.441   20.419   0.1903   2.5865  -3.7927   3.5004   4.9806   3.8388   43.429   20.443   81.505   26.688 -38.07635 33.61860 
1 1 1    5   20   35 o  414.723   9.2109  131.928   5.8470  131.657   6.3163  133.550   15.457  414.218   9.9624  413.744   24.517 0.4739075 26.46391 
1 1 1    5   20   36 o  457.305   8.0188  160.348   5.6129  163.108   7.7864  157.362   8.0983  460.840   11.039  452.552   11.691 8.288269 16.07905 
1 1 1    5   20   37 f  181.620   11.045   25.435   3.0558   24.537   4.1643   26.483   4.4980  177.724   15.462  184.578   16.082 -6.853516 22.30942 
1 1 1    5   20   38 o  488.302   6.9401  182.788   5.1871  184.828   7.2918  180.698   7.3802  490.624   9.7099  485.074   9.9402 5.550354 13.89564 
1 1 1    5   20   39 o  205.890   10.370   32.657   3.2575   32.016   4.5439   33.335   4.6724  203.175   14.711  207.319   14.822 -4.144287 20.88285 
1 1 1    5   20   40 o  478.272   7.1431  175.436   5.2292  177.415   7.3620  173.422   7.4288  480.466   10.011  474.986   10.218 5.479950 14.30466 
1 1 1    5   20   41 o  155.827   13.047   18.857   3.0833   17.302   4.2449   20.595   4.4859  147.932   19.200  161.781   18.446 -13.84818 26.62479 
1 1 1    5   20   42 o  137.452   20.673   15.077   4.2146   8.1918   11.091   16.239   4.5565  114.253   44.335  142.512   21.562 -28.25889 49.30013 
1 1 1    5   20   43 o  145.747   19.170   16.854   4.1727   5.9377   9.1111   19.751   4.6939  101.686   39.975  157.769   19.879 -56.08266 44.64492 
1 1 1    5   20   44 o  289.628   9.1793   64.519   4.0693   65.817   5.7041   63.173   5.8070  291.850   12.769  285.819   13.274 6.031311 18.41846 
1 1 1    5   20   45 o  213.169   11.443   35.161   3.7200   32.023   5.1751   38.517   5.3511  202.084   16.886  222.055   15.848 -19.97067 23.15778 
1 1 1    5   20   46 o  455.764   9.7504  159.990   6.8020  173.418   8.2484  131.452   12.025  473.962   11.370  409.393   19.190 64.56897 22.30530 
1 1 1    5   20   47 f  261.818   10.386   52.869   4.1621   48.306   5.9173   57.336   5.8555  248.593   15.631  271.413   14.144 -22.81931 21.08006 
1 1 1    5   20   48 o  303.992   10.165   71.285   4.7297   77.614   7.1954   66.469   6.2760  315.781   14.887  292.509   14.018 23.27219 20.44762 
1 1 1    5   20   49 f  294.306   13.848   67.336   6.2383   72.524   6.7069   34.051   16.988  305.257   14.354  184.675   55.566 120.5812 57.38998 
1 1 1    5   20   50 o  210.965   13.266   34.718   4.2619   45.679   6.2920   25.426   5.7932  240.636   17.196  177.449   21.787 63.18665 27.75580 
1 1 1    5   20   51 o  205.886   14.901   33.281   4.6641   24.391   6.4427   43.071   6.7609  171.953   25.229  232.530   19.167 -60.57655 31.68385 
1 1 1    5   20   52 o  102.697   27.022   8.9860   4.3051   14.176   6.4450   4.8045   5.7851  126.877   32.908   84.333   32.202 42.54433 46.04242 
1 1 1    5   20   53 o  248.234   12.912   48.172   4.8889   47.285   6.9656   49.034   6.8635  243.061   18.871  247.907   18.215 -4.845856 26.22800 
1 1 1    5   20   54 o  134.096   22.331   14.938   4.4223   8.5571   5.9099   23.056   6.6664   99.439   33.141  164.325   27.474 -64.88599 43.04876 
1 1 1    5   20   55 o  113.614   31.092   11.582   5.5642   4.5100   16.059   12.546   5.9316  107.221   47.901  117.805   32.046 -10.58370 57.63190 
1 1 1    5   20   56 o  198.307   14.876   31.259   4.4824   21.279   6.2217   42.029   6.4634  156.869   26.879  227.751   18.706 -70.88255 32.74776 
1 1 1    5   20   57 o  107.752   25.446   10.208   4.1297   7.0528   5.8342   13.376   5.8465   90.458   32.753  120.121   31.434 -29.66341 45.39660 
1 1 1    5   20   58 o   50.502   23.100  -1.7987   4.0035  -4.5812   5.7411   0.8352   5.5856   55.059   25.998   66.804   29.106 -11.74510 39.02699 
1 1 1    5   20   59 o   88.853   28.225   7.2235   4.3145   7.3014   6.6136   7.1659   5.6926   90.257   34.439   88.859   32.325 1.398125 47.23284 
1 1 1    5   21    0 o  464.485   12.729  165.550   9.0342  165.550   9.0342  165.550   9.0342  464.485   12.729  464.485   12.729 0.000000 0.000000 
1 1 1    5   21    1 o  1285.09   12.845  1264.90   25.267  1267.74   35.837  1262.09   35.630  1286.02   18.206  1283.16   18.141 2.859863 25.70129 
1 1 1    5   21    2 o  1306.82   18.404  1309.15   36.813   0.0000   0.0000  1309.15   36.813  ?   ?   1306.82   18.404 0.000000 18.40392 
1 1 1    5   21    3 o  2186.92   28.036  3674.28   93.847   0.0000   0.0000  3674.28   93.847  ?   ?   2186.92   28.036 0.000000 28.03601 
1 1 1    5   21    4 o  1172.21   17.335  1053.16   31.102  1053.16   31.102   0.0000   0.0000  1172.21   17.335  ?   ?  0.000000 17.33465 
1 1 1    5   21    5 o  390.318   13.713  116.704   8.1926  116.704   8.1926   0.0000   0.0000  390.318   13.713  ?   ?  0.000000 13.71294 
1 1 1    5   21    6 o  901.706   10.495  622.602   14.485  622.602   14.485   0.0000   0.0000  901.706   10.495  ?   ?  0.000000 10.49484 
1 1 1    5   21    7 o  908.881   10.559  632.560   14.689  632.560   14.689   0.0000   0.0000  908.881   10.559  ?   ?  0.000000 10.55861 
1 1 1    5   21    8 f  1459.96   11.600  1632.40   25.921  1627.97   31.668  1641.38   45.123  1457.73   14.193  1462.94   20.151 -5.213379 24.64764 
1 1 1    5   21    9 o  206.042   10.879   32.601   3.4189   28.087   4.0472   43.849   6.3887  190.967   13.943  238.518   17.624 -47.55167 22.47229 
1 1 1    5   21   10 o  966.498   8.9372  715.205   13.221  701.517   15.878  746.151   23.875  957.107   10.839  986.731   15.808 -29.62360 19.16669 
1 1 1    5   21   11 o  393.099   8.1081  118.305   4.8786  124.324   6.0490  107.104   8.2517  402.940   9.8078  373.879   14.419 29.06143 17.43871 
1 1 1    5   21   12 o  602.723   6.7880  278.093   6.2622  282.986   8.8438  273.173   8.8686  607.925   9.5043  597.286   9.7007 10.63910 13.58066 
1 1 1    5   21   13 o  880.140   7.5248  593.046   10.137  605.457   14.463  581.060   14.213  889.154   10.627  871.053   10.660 18.10040 15.05216 
1 1 1    5   21   14 o  731.605   8.2072  409.799   9.1906  411.776   11.247  405.828   15.943  733.293   10.021  727.745   14.313 5.547913 17.47203 
1 1 1    5   21   15 o  825.041   8.5757  521.186   10.830  511.306   13.049  543.049   19.411  817.093   10.434  841.759   15.066 -24.66650 18.32627 
1 1 1    5   21   16 o  658.655   10.375  332.248   10.460  332.248   10.460   0.0000   0.0000  658.655   10.375  ?   ?  0.000000 10.37530 
1 1 1    5   21   17 o  654.129   8.4214  327.624   8.4317  345.782   15.287  319.685   10.108  671.667   14.869  646.080   10.222 25.58673 18.04393 
1 1 1    5   21   18 o  814.548   8.8109  508.058   10.985  505.873   19.128  509.133   13.419  812.336   15.384  815.299   10.753 -2.963867 18.76930 
1 1 1    5   21   19 o  408.967   9.4458  128.087   5.9129  117.927   10.097  133.390   7.2945  392.130   16.822  417.283   11.421 -25.15277 20.33288 
1 1 1    5   21   20 o  624.127   7.5636  298.249   7.2255  296.966   10.052  299.621   10.393  622.652   10.547  625.412   10.857 -2.760071 15.13684 
1 1 1    5   21   21 f  639.465   7.5857  313.096   7.4248  309.919   10.389  316.415   10.616  636.065   10.670  642.689   10.791 -6.624512 15.17598 
1 1 1    5   21   22 f   77.285   27.017   4.0755   3.9374   6.0830   5.4657   1.9097   5.6770   92.890   31.868   76.833   31.098 16.05650 44.52662 
1 1 1    5   21   23 o  569.309   7.9894  248.195   6.9620  252.129   9.7766  244.148   9.9162  573.644   11.135  564.472   11.477 9.171997 15.99084 
1 1 1    5   21   24 o  573.624   11.629  252.162   10.210   0.0000   0.0000  252.162   10.210  ?   ?   573.624   11.629 0.000000 11.62883 
1 1 1    5   21   25 f  297.126   12.572   67.681   5.7174   63.218   9.6076   70.128   7.1142  285.805   22.135  301.925   15.446 -16.12082 26.99130 
1 1 1    5   21   26 o  490.876   9.8685  184.625   7.4147  177.428   9.2759  197.361   12.340  481.038   12.598  507.054   15.900 -26.01657 20.28578 
1 1 1    5   21   27 o  221.898   16.692   38.034   5.6279   34.893   7.2854   42.682   8.8625  211.588   22.858  233.863   25.154 -22.27466 33.98879 
1 1 1    5   21   28 o  240.256   13.965   44.452   5.1132   41.311   7.1121   47.813   7.3565  230.749   20.345  248.500   19.497 -17.75063 28.17899 
1 1 1    5   21   29 o  559.559   8.9025  239.935   7.6248  240.743   10.605  239.071   10.970  560.162   12.369  558.159   12.841 2.002258 17.82900 
1 1 1    5   21   30 o  430.338   9.8528  141.979   6.4899  142.822   9.0679  141.093   9.2925  431.257   13.737  428.592   14.165 2.665253 19.73226 
1 1 1    5   21   31 o  456.474   7.6799  159.656   5.3659  156.875   6.3984  166.248   9.8514  452.362   9.2409  465.186   13.836 -12.82397 16.63793 
1 1 1    5   21   32 o  526.284   7.3871  212.229   5.9506  211.367   7.1947  214.096   10.587  525.066   8.9521  527.910   13.102 -2.844360 15.86841 
1 1 1    5   21   33 o  791.255   6.6067  479.661   8.0014  472.054   11.013  488.167   11.645  784.568   9.1704  797.780   9.5367 -13.21143 13.23049 
1 1 1    5   21   34 o  181.272   15.310   25.482   4.2082   26.298   4.4660   19.021   12.568  184.060   16.012  152.954   48.125 31.10565 50.71921 
1 1 1    5   21   35 o  140.795   13.495   15.389   2.8727   22.635   4.2796   9.4471   3.8756  170.505   16.609  108.138   24.038 62.36650 29.21791 
1 1 1    5   21   36 o  474.774   6.6967  172.756   4.8665  167.214   6.7416  178.786   7.0322  466.769   9.4360  482.638   9.5192 -15.86938 13.40350 
1 1 1    5   21   37 o  340.515   7.6085   88.917   3.9656   92.088   5.5954   85.717   5.6211  346.211   10.559  333.966   10.996 12.24500 15.24490 
1 1 1    5   21   38 o  353.634   7.5148   95.913   4.0676   96.952   5.6584   94.802   5.8513  355.194   10.408  351.167   10.886 4.027069 15.06089 
1 1 1    5   21   39 o  178.214   11.157   24.527   3.0281   27.361   4.2625   21.639   4.3024  187.627   14.967  166.286   17.150 21.34155 22.76250 
1 1 1    5   21   40 o   56.770   21.898   1.6861   2.6934   2.7319   3.7677   0.5932   3.8517   68.662   26.042   59.755   25.038 8.906815 36.12641 
1 1 1    5   21   41 o  187.072   11.661   27.067   3.3223   29.283   4.6816   24.819   4.7156  193.755   15.927  177.896   17.547 15.85887 23.69704 
1 1 1    5   21   42 o  147.574   17.453   17.167   3.8659   14.364   9.0054   17.800   4.2804  130.539   40.684  149.893   19.090 -19.35378 44.93977 
1 1 1    5   21   43 o  568.775   7.2759  248.347   6.3343  247.124   8.9310  249.585   8.9852  566.498   10.300  569.308   10.311 -2.809692 14.57429 
1 1 1    5   21   44 f   61.652   23.062   2.3267   2.9323   3.2273   4.1347   1.4155   4.1590   72.472   27.331   64.687   26.453 7.784897 38.03603 
1 1 1    5   21   45 o  347.053   8.7470   92.646   4.6465   87.383   6.5010   98.142   6.6436  336.132   12.636  356.357   12.180 -20.22498 17.55040 
1 1 1    5   21   46 o   47.460   21.235  -1.2156   3.1683   2.7853   4.4243  -5.4270   4.5392   71.641   27.945   47.692   22.694 23.94876 35.99954 
1 1 1    5   21   47 o  123.591   19.205   12.271   3.5150   12.300   5.0421   12.244   4.9029  121.104   27.790  121.010   27.139 0.9383392E-01 38.84370 
1 1 1    5   21   48 o  274.089   15.221   58.737   6.3607   58.125   6.8292   62.738   17.474  272.166   16.471  263.676   44.907 8.490326 47.83210 
1 1 1    5   21   49 o   88.770   25.854   6.5287   3.7268   8.2770   5.1617   4.6248   5.3865   99.467   30.768   82.952   31.213 16.51501 43.82845 
1 1 1    5   21   50 o   77.135   26.667   4.5271   3.8309   9.4983   5.4828  -0.2147   5.3548  105.499   31.527   65.497   28.519 40.00205 42.51223 
1 1 1    5   21   51 o  105.763   24.722   9.4107   3.9302   11.286   5.5690   7.5497   5.5474  114.052   31.061   95.704   32.110 18.34767 44.67503 
1 1 1    5   21   52 o  352.801   12.128   96.793   6.5494  106.475   7.8308   74.253   11.948  369.131   13.860  299.423   26.338 69.70822 29.76200 
1 1 1    5   21   53 o  231.197   14.834   42.156   5.2217   39.749   7.3942   44.550   7.3750  220.490   22.212  234.447   20.767 -13.95764 30.40763 
1 1 1    5   21   54 o  125.707   24.370   13.399   4.5197   15.253   6.8974   12.004   5.9833  129.001   34.328  115.329   32.501 13.67245 47.27316 
1 1 1    5   21   55 o  123.520   27.754   13.384   5.1193   11.119   10.025   14.183   5.9543  110.961   42.385  125.362   31.165 -14.40080 52.60915 
1 1 1    5   21   56 o   71.837   26.939   3.7579   4.0059  -3.1529   5.6269   10.860   5.7042   57.902   26.808  108.417   32.102 -50.51475 41.82396 
1 1 1    5   21   57 o  143.155   20.025   17.099   4.2676   15.265   5.8533   19.181   6.2355  128.644   30.237  145.650   28.989 -17.00583 41.88860 
1 1 1    5   21   58 o   80.924   27.261   5.7376   3.9985   8.7939   5.5986   2.5556   5.7126   96.475   32.258   72.145   30.375 24.32956 44.30807 
1 1 1    5   22    3 o  1010.03   16.156  781.821   24.977   0.0000   0.0000  781.821   24.977  ?   ?   1010.03   16.156 0.000000 16.15634 
1 1 1    5   22    4 o  153.914   17.158   18.383   3.9734   13.779   5.6121   23.011   5.6263  131.355   28.714  171.802   21.893 -40.44659 36.10837 
1 1 1    5   22    5 o  1998.42   18.375  3062.02   56.205  3053.12   79.316  3071.00   79.657  1993.69   25.992  1999.51   26.027 -5.819824 36.78288 
1 1 1    5   22    6 o  654.416   9.8252  327.928   9.8416  326.770   13.557  329.217   14.309  653.102   13.562  655.508   14.262 -2.405701 19.68054 
1 1 1    5   22    7 o  388.190   9.8560  115.389   5.8562  115.389   5.8562   0.0000   0.0000  388.190   9.8560  ?   ?  0.000000 9.856050 
1 1 1    5   22    8 f  390.697   9.8016  116.885   5.8615  116.885   5.8615   0.0000   0.0000  390.697   9.8016  ?   ?  0.000000 9.801599 
1 1 1    5   22    9 o  943.139   8.9007  681.070   12.849  688.566   15.871  666.811   21.890  948.204   10.935  932.791   15.332 15.41223 18.83178 
1 1 1    5   22   10 o  838.213   8.4851  537.942   10.886  526.958   13.094  562.531   19.591  829.527   10.313  856.770   14.939 -27.24359 18.15299 
1 1 1    5   22   11 o  1508.99   11.995  1744.20   27.705  1719.91   33.417  1797.61   49.549  1498.14   14.573  1530.51   21.151 -32.37122 25.68531 
1 1 1    5   22   12 o  620.703   7.9938  294.973   7.5946  292.836   9.2534  299.383   13.293  618.389   9.7762  625.072   13.894 -6.683289 16.98889 
1 1 1    5   22   13 o  658.721   7.1245  332.189   7.1833  341.394   10.260  323.338   10.060  667.677   10.039  649.778   10.115 17.89990 14.25172 
1 1 1    5   22   14 o  1267.63   9.2321  1230.46   17.913  1223.16   25.207  1237.92   25.460  1263.50   13.034  1271.09   13.086 -7.595215 18.46967 
1 1 1    5   22   15 o  1228.73   9.0978  1156.11   17.111  1171.92   24.532  1141.14   23.878  1236.74   12.959  1220.41   12.783 16.33167 18.20259 
1 1 1    5   22   16 o  565.873   7.3114  245.157   6.3327  226.993   8.6579  266.055   9.2866  544.400   10.390  589.387   10.294 -44.98657 14.62620 
1 1 1    5   22   17 o  807.048   8.9005  498.764   10.995  461.262   18.102  520.686   13.840  775.671   15.247  824.466   10.967 -48.79565 18.78139 
1 1 1    5   22   18 f  1077.27   9.8848  888.833   16.299  888.266   28.379  889.113   19.911  1076.09   17.229  1077.24   12.075 -1.145264 21.03967 
1 1 1    5   22   19 o  1569.01   12.596  1886.48   30.250  1858.79   51.709  1900.89   37.298  1555.47   21.719  1574.47   15.477 -19.00012 26.66885 
1 1 1    5   22   20 o  855.761   9.2962  560.875   12.177  544.272   20.921  569.381   14.974  842.362   16.226  862.069   11.348 -19.70764 19.80095 
1 1 1    5   22   21 o  537.917   8.0771  221.579   6.6503  210.777   9.1739  233.541   9.6543  524.486   11.427  552.082   11.425 -27.59644 16.15892 
1 1 1    5   22   22 o  374.319   10.679  107.351   6.1183  106.916   10.470  107.576   7.5396  373.158   18.330  374.605   13.149 -1.446930 22.55901 
1 1 1    5   22   23 o  667.470   9.0049  341.251   9.1999  351.146   15.853  336.226   11.297  676.533   15.309  662.387   11.142 14.14612 18.93436 
1 1 1    5   22   24 o  378.956   9.6860  110.023   5.6183  103.395   7.9265  116.716   7.9645  367.142   14.105  390.123   13.338 -22.98062 19.41275 
1 1 1    5   22   25 o  580.356   9.4415  258.058   8.3870  251.404   10.228  271.713   14.652  572.654   11.669  594.875   16.092 -22.22076 19.87766 
1 1 1    5   22   26 o  422.508   9.5075  136.791   6.1485  137.998   8.7160  135.595   8.6747  424.103   13.427  420.389   13.481 3.714325 19.02707 
1 1 1    5   22   27 o  453.269   9.2092  157.441   6.3892  154.296   8.9596  160.695   9.1137  448.423   13.054  457.632   13.011 -9.208649 18.43053 
1 1 1    5   22   28 o  436.185   9.4276  145.827   6.2942  149.677   8.8828  141.945   8.9199  441.591   13.142  429.995   13.553 11.59650 18.87832 
1 1 1    5   22   29 o  298.968   12.011   68.590   5.4965   63.746   7.7062   73.606   7.8421  287.242   17.613  308.882   16.648 -21.63971 24.23577 
1 1 1    5   22   30 o  438.355   9.6351  147.340   6.4647  141.214   8.9528  154.014   9.3448  428.735   13.643  447.745   13.635 -19.00992 19.28857 
1 1 1    5   22   31 o  917.737   8.8248  645.715   12.396  645.152   17.327  646.305   17.743  916.565   12.351  917.309   12.637 -0.7444458 17.66984 
1 1 1    5   22   32 o  218.494   11.181   36.744   3.7267   42.763   4.3158   19.099   7.3895  235.658   12.005  153.232   32.513 82.42537 34.65816 
1 1 1    5   22   33 o  117.470   21.159   11.005   3.6645   11.300   3.8207   7.6102   12.945  118.953   21.788  120.800   47.598 -1.847672 52.34735 
1 1 1    5   22   34 o  402.419   7.3621  124.132   4.5347  124.906   6.6594  123.463   6.1922  403.304   10.788  401.054   10.087 2.250580 14.76916 
1 1 1    5   22   35 o   40.441   18.251  -1.2559   2.3979  -3.9734   3.1604   2.4310   3.6811   39.870   18.962   67.015   25.664 -27.14523 31.90886 
1 1 1    5   22   36 o  124.344   13.610   12.049   2.5481   9.7829   3.4475   14.776   3.7828  110.425   21.168  136.937   18.523 -26.51172 28.12792 
1 1 1    5   22   37 o  283.504   8.1649   61.668   3.5431   68.088   5.0491   55.439   4.9731  297.579   11.085  268.401   12.105 29.17822 16.41385 
1 1 1    5   22   38 o   77.738   21.049   4.8665   2.5661   1.7075   3.5462   8.3385   3.7177   62.555   24.828  101.179   24.309 -38.62398 34.74751 
1 1 1    5   22   39 o  183.163   10.805   25.900   3.0158   23.015   4.1506   29.125   4.3893  171.709   15.976  193.546   14.932 -21.83670 21.86728 
1 1 1    5   22   40 o  305.543   8.6145   71.710   4.0287   67.730   5.6000   75.980   5.8003  296.370   12.345  313.954   12.070 -17.58466 17.26509 
1 1 1    5   22   41 f  394.493   9.2017  119.646   5.5562  114.143   10.753  121.651   6.4895  382.727   18.356  397.472   10.667 -14.74561 21.23063 
1 1 1    5   22   42 o  112.670   18.009   10.128   3.0012   11.650   4.2910   8.6713   4.1992  119.366   24.312  102.487   26.554 16.87811 36.00243 
1 1 1    5   22   43 o  160.238   13.000   19.979   3.1610   20.214   4.4748   19.744   4.4658  159.827   18.642  157.876   18.854 1.950745 26.51386 
1 1 1    5   22   44 o  239.912   10.188   44.348   3.7412   38.208   5.1891   50.995   5.3990  221.216   15.422  256.183   13.820 -34.96703 20.70777 
1 1 1    5   22   45 o  141.439   15.873   15.761   3.3770   17.308   4.8212   14.272   4.7315  146.423   22.209  132.026   24.310 14.39729 32.92699 
1 1 1    5   22   46 f  294.150   9.5786   66.667   4.3126   57.569   5.9052   77.065   6.3133  271.885   14.239  315.345   13.080 -43.46027 19.33487 
1 1 1    5   22   47 o  213.027   17.002   35.732   5.4975   38.077   5.8358   17.251   16.383  219.768   17.494  141.689   54.170 78.07933 56.92447 
1 1 1    5   22   48 o  104.620   22.518   9.0374   3.4991   9.6644   4.8560   8.3604   5.0464  106.811   28.970   99.891   30.336 6.919128 41.94683 
1 1 1    5   22   49 o  119.419   21.122   11.645   3.7195   14.315   5.4194   9.2679   5.1141  130.096   28.042  104.395   30.253 25.70071 41.24992 
1 1 1    5   22   50 o   49.092   22.450  -2.1950   3.7783  -0.1077   5.2054  -4.5192   5.4928   64.799   28.166   55.647   26.007 9.152168 38.33687 
1 1 1    5   22   51 o  266.355   11.544   55.064   4.7063   55.933   6.6746   54.204   6.6371  266.071   16.470  261.823   16.648 4.248199 23.41837 
1 1 1    5   22   52 o   63.639   25.992   1.6755   4.0087  -0.5669   5.3979   4.4332   5.9861   64.051   28.238   82.968   32.466 -18.91683 43.02821 
1 1 1    5   22   53 o  200.277   14.928   31.741   4.5434   27.443   6.6069   35.597   6.2579  181.246   24.439  209.665   19.732 -28.41891 31.41002 
1 1 1    5   22   54 o  117.542   30.371   12.357   5.5032   26.870   15.530   10.273   5.8851  153.311   53.653  106.700   32.829 46.61052 62.89973 
1 1 1    5   22   55 o  108.743   26.212   10.370   4.3118   3.6921   6.3582   16.056   5.8671   79.932   32.700  134.024   29.408 -54.09214 43.97848 
1 1 1    5   22   56 o   70.838   26.954   3.5986   4.0444   6.5314   5.6244   0.4583   5.8200   87.680   32.095   67.298   29.505 20.38206 43.59656 
1 1 1    5   22   57 o   81.141   27.337   5.7342   4.0209   3.1951   5.5304   8.5815   5.8564   73.855   30.388   95.816   32.981 -21.96159 44.84590 
1 1 1    5   22   58 o   54.841   24.443  -0.5124   4.1553  -5.7516   6.1559   3.8731   5.6320   54.828   26.183   75.912   30.884 -21.08474 40.48875 
1 1 1    5   23    0 o  494.764   13.451  187.855   10.169  187.855   10.169  187.855   10.169  494.764   13.451  494.764   13.451 0.000000 0.000000 
1 1 1    5   23    1 o  998.954   11.103  764.261   16.977  751.704   23.661  777.585   24.373  990.367   15.609  1007.25   15.809 -16.88702 22.21588 
1 1 1    5   23    2 o  726.446   13.775  404.322   15.316   0.0000   0.0000  404.322   15.316  ?   ?   726.446   13.775 0.000000 13.77453 
1 1 1    5   23    3 o  1131.05   16.908  980.688   29.271   0.0000   0.0000  980.688   29.271  ?   ?   1131.05   16.908 0.000000 16.90793 
1 1 1    5   23    4 o  1004.23   11.296  772.388   17.363  773.350   24.830  771.468   24.289  1004.46   16.150  1003.27   15.817 1.191589 22.60507 
1 1 1    5   23    5 o  655.026   9.7819  328.552   9.8073  328.747   14.096  328.370   13.654  655.020   14.060  654.668   13.626 0.3516846 19.57898 
1 1 1    5   23    6 o  932.729   10.915  666.290   15.583  662.105   22.156  670.387   21.922  929.448   15.574  935.265   15.314 -5.817810 21.84181 
1 1 1    5   23    7 o  342.740   10.832   89.967   5.6827   90.398   8.1594   89.561   7.9190  343.430   15.522  341.848   15.134 1.582336 21.67918 
1 1 1    5   23    8 o  385.731   10.419  113.947   6.1516  113.947   6.1516   0.0000   0.0000  385.731   10.419  ?   ?  0.000000 10.41919 
1 1 1    5   23    9 o  744.996   10.115  425.042   11.534  425.042   11.534   0.0000   0.0000  744.996   10.115  ?   ?  0.000000 10.11471 
1 1 1    5   23   10 o  779.412   10.364  465.241   12.364  465.241   12.364   0.0000   0.0000  779.412   10.364  ?   ?  0.000000 10.36384 
1 1 1    5   23   11 o  702.921   8.3615  378.317   8.9962  386.946   11.142  362.158   15.248  710.809   10.241  687.423   14.491 23.38635 17.74486 
1 1 1    5   23   12 f  802.780   8.5834  493.461   10.547  501.388   13.116  478.956   17.742  809.095   10.591  790.509   14.663 18.58606 18.08808 
1 1 1    5   23   13 o  1642.22   11.176  2065.81   28.093  2056.54   39.536  2075.25   39.927  1637.82   15.771  1645.24   15.855 -7.417847 22.36297 
1 1 1    5   23   14 o  634.963   8.5227  308.723   8.2832  304.371   14.370  310.888   10.137  630.128   14.899  637.104   10.395 -6.976257 18.16681 
1 1 1    5   23   15 f  1043.06   9.6676  833.241   15.435  835.937   27.035  831.937   18.800  1043.99   16.919  1042.07   11.787 1.919312 20.61948 
1 1 1    5   23   16 o  472.522   7.7747  170.958   5.6231  165.896   7.8723  176.232   8.0347  465.361   11.052  479.642   10.944 -14.28101 15.55389 
1 1 1    5   23   17 o  155.841   16.708   18.842   3.9232   21.507   5.4714   16.022   5.6286  165.858   22.102  141.960   26.888 23.89758 34.80629 
1 1 1    5   23   18 o  626.656   7.6320  300.688   7.3205  297.278   10.309  304.156   10.397  622.935   10.812  630.102   10.780 -7.167053 15.26796 
1 1 1    5   23   19 o  553.521   7.7729  234.610   6.5854  233.137   9.2956  236.095   9.3310  551.628   11.009  555.118   10.982 -3.489990 15.55007 
1 1 1    5   23   20 o  625.091   9.0696  299.276   8.6776  288.277   15.201  304.593   10.569  612.962   16.202  630.505   10.952 -17.54224 19.55598 
1 1 1    5   23   21 o  564.067   11.377  243.830   9.8226   0.0000   0.0000  243.830   9.8226  ?   ?   564.067   11.377 0.000000 11.37694 
1 1 1    5   23   22 f  370.706   11.072  105.317   6.2823  116.798   11.449  100.370   7.5148  389.851   19.186  361.770   13.571 28.08063 23.50065 
1 1 1    5   23   23 o  367.580   17.826  103.810   10.029   0.0000   0.0000  103.810   10.029  ?   ?   367.580   17.826 0.000000 17.82581 
1 1 1    5   23   24 o  191.845   17.392   28.511   5.0517   19.642   6.3031   44.442   8.4470  157.242   27.171  238.979   23.393 -81.73654 35.85382 
1 1 1    5   23   25 o  278.731   12.018   59.585   5.1274   57.906   7.1863   61.327   7.3179  273.932   17.227  281.963   17.036 -8.030548 24.22802 
1 1 1    5   23   26 o  432.115   9.1911  143.098   6.0791  143.936   8.4744  142.210   8.7252  433.100   12.784  430.455   13.243 2.645477 18.40627 
1 1 1    5   23   27 o  252.661   12.736   49.120   4.9094   46.128   6.8646   52.253   7.0240  244.074   18.513  259.973   17.758 -15.89868 25.65272 
1 1 1    5   23   28 o  307.415   11.235   72.503   5.2863   74.041   7.4695   70.959   7.4825  309.891   15.800  303.301   16.176 6.590576 22.61199 
1 1 1    5   23   29 o  298.292   11.573   68.291   5.2841   62.019   7.2522   75.388   7.7149  283.332   16.798  312.574   16.181 -29.24222 23.32314 
1 1 1    5   23   30 o  528.582   8.9622  214.228   7.2510  213.201   10.170  215.291   10.341  526.831   12.611  529.384   12.762 -2.552856 17.94239 
1 1 1    5   23   31 o   46.886   22.987 -11.0192   5.6097  -4.7030   6.4522 -30.5783   11.354   63.051   29.019   59.553   29.788 3.498192 41.58586 
1 1 1    5   23   32 o   92.739   37.434   3.3604   8.2019   6.7923   11.482  -0.2155   11.720  114.213   44.883   98.718   42.586 15.49515 61.87143 
1 1 1    5   23   33 o  337.740   9.3824   87.527   4.8503   84.768   5.8607   93.522   8.6406  332.154   11.528  348.213   16.212 -16.05856 19.89236 
1 1 1    5   23   34 o  629.821   7.3719  304.114   7.1067  299.571   8.5976  313.914   12.627  624.832   8.9897  638.729   12.916 -13.89722 15.73650 
1 1 1    5   23   35 o  189.813   10.045   27.748   2.9079   27.936   3.8777   27.506   4.3955  189.992   13.421  188.184   15.395 1.807236 20.42329 
1 1 1    5   23   36 o  342.730   7.3427   90.082   3.8519   89.713   5.3375   90.482   5.5644  341.701   10.205  343.110   10.595 -1.408966 14.71084 
1 1 1    5   23   37 o  236.131   8.8428   42.811   3.1960   37.923   4.3724   48.420   4.6833  221.457   12.956  250.754   12.202 -29.29713 17.79727 
1 1 1    5   23   38 o   34.177   16.340  -3.2699   2.4116  -3.9886   3.4425  -2.5773   3.3794   42.253   20.006   45.340   20.915 -3.086254 28.94306 
1 1 1    5   23   39 o  148.533   12.946   17.150   2.9138   19.173   4.1733   15.226   4.0700  156.102   17.784  138.405   19.774 17.69693 26.59484 
1 1 1    5   23   40 o  260.925   11.030   52.445   4.4053   37.764   9.0914   56.949   5.0361  216.002   28.169  271.719   12.109 -55.71735 30.66091 
1 1 1    5   23   41 o  188.203   11.249   27.399   3.2256   27.590   4.3941   27.175   4.7501  187.997   15.406  186.210   16.848 1.786469 22.82994 
1 1 1    5   23   42 o  179.441   11.773   24.952   3.2155   26.224   4.4830   23.604   4.6146  182.993   16.172  173.154   17.659 9.838776 23.94472 
1 1 1    5   23   43 o  137.525   15.582   14.879   3.2221   14.988   4.4835   14.763   4.6336  136.181   22.280  134.823   23.296 1.358658 32.23530 
1 1 1    5   23   44 f  181.104   12.304   25.474   3.3905   22.923   4.8279   27.957   4.7626  170.046   18.867  188.652   16.665 -18.60556 25.17329 
1 1 1    5   23   45 o   98.420   21.524   7.9404   3.1521   16.553   4.8316   1.5586   4.1591  142.796   22.878   65.011   26.504 77.78506 35.01273 
1 1 1    5   23   46 o  397.223   34.335  132.515   20.671   0.0000   0.0000  132.515   20.671  ?   ?   397.223   34.335 0.000000 34.33530 
1 1 1    5   23   47 o  208.932   12.127   33.923   3.8616   39.186   5.3701   28.288   5.5571  223.461   15.802  188.387   19.557 35.07425 25.14323 
1 1 1    5   23   48 o  173.031   14.839   23.517   3.8920   32.271   5.6408   15.563   5.3769  201.569   18.489  136.387   26.712 65.18178 32.48698 
1 1 1    5   23   49 o  154.874   17.321   19.094   4.0358   17.415   5.6524   20.840   5.7643  144.191   26.590  159.019   24.467 -14.82809 36.13402 
1 1 1    5   23   50 o  228.947   13.187   40.966   4.6017   38.161   6.4307   43.909   6.5878  218.300   19.449  234.758   18.483 -16.45790 26.83129 
1 1 1    5   23   51 o  153.620   25.309   19.768   5.7438   19.768   5.7438   0.0000   0.0000  153.620   25.309  ?   ?  0.000000 25.30935 
1 1 1    5   23   52 o   94.339   26.832   7.6549   4.0587   5.3791   6.1040   9.4585   5.4340   86.475   33.064  103.618   31.482 -17.14235 45.65461 
1 1 1    5   23   53 o  166.486   19.911   22.619   4.9733   20.548   9.4550   23.411   5.8476  145.198   40.834  167.481   23.454 -22.28293 47.09037 
1 1 1    5   23   54 o  149.234   18.580   18.160   4.1521   25.567   5.9116   10.949   5.8330  175.045   22.591  109.392   32.480 65.65318 39.56390 
1 1 1    5   23   55 f   66.785   29.388   0.1968   5.8205   0.0000   0.0000   0.1968   5.8205  ?   ?    66.785   29.388 0.000000 29.38773 
1 1 1    5   23   56 f  204.829   15.283   33.709   4.7570   36.481   7.2346   31.598   6.3139  206.957   23.240  193.769   21.659 13.18835 31.76799 
1 1 1    5   23   57 o  116.516   24.928   12.067   4.3113   25.924   6.4242   0.7125   5.8153  171.873   25.165   67.029   29.438 104.8447 38.72811 
1 1 1    5   24    0 o  297.441   15.974   68.347   7.2244   68.347   7.2244   68.347   7.2244  297.441   15.974  297.441   15.974 0.000000 0.000000 
1 1 1    5   24    1 o  701.897   9.8338  377.272   10.565  387.099   15.160  367.993   14.731  710.758   13.935  692.999   13.888 17.75897 19.67385 
1 1 1    5   24    2 o  516.145   13.911  204.137   10.990   0.0000   0.0000  204.137   10.990  ?   ?   516.145   13.911 0.000000 13.91083 
1 1 1    5   24    3 o  1184.41   17.587  1075.74   31.883   0.0000   0.0000  1075.74   31.883  ?   ?   1184.41   17.587 0.000000 17.58687 
1 1 1    5   24    4 o  1119.14   12.148  959.463   20.809  931.088   28.880  990.099   30.009  1101.95   17.122  1136.32   17.254 -34.36670 24.30753 
1 1 1    5   24    5 o  370.780   10.964  105.297   6.2226  107.104   8.9711  103.622   8.6385  373.793   15.680  367.679   15.350 6.114410 21.94253 
1 1 1    5   24    6 o  702.858   10.205  378.335   10.979  382.299   15.955  374.769   15.131  706.263   14.759  699.315   14.136 6.947449 20.43681 
1 1 1    5   24    7 o  586.115   10.049  263.089   9.0153  250.254   12.697  276.136   12.802  571.427   14.517  600.283   13.934 -28.85608 20.12213 
1 1 1    5   24    8 o  772.180   8.5192  456.556   10.069  449.984   12.242  470.297   17.702  766.506   10.435  783.321   14.764 -16.81531 18.07959 
1 1 1    5   24    9 o  780.157   8.5077  466.042   10.159  469.954   12.556  458.627   17.288  783.321   10.472  773.542   14.601 9.779480 17.96844 
1 1 1    5   24   10 o  485.641   10.358  180.637   7.6994  180.637   7.6994   0.0000   0.0000  485.641   10.358  ?   ?  0.000000 10.35787 
1 1 1    5   24   11 o  790.827   10.652  479.034   12.894  479.034   12.894   0.0000   0.0000  790.827   10.652  ?   ?  0.000000 10.65204 
1 1 1    5   24   12 o  1032.23   16.881  817.208   26.671  817.208   26.671   0.0000   0.0000  1032.23   16.881  ?   ?  0.000000 16.88051 
1 1 1    5   24   13 o  1440.35   14.468  1590.34   31.897  1637.62   46.746  1549.15   43.634  1460.30   20.914  1420.50   20.068 39.80042 28.98485 
1 1 1    5   24   14 o  665.860   7.5067  339.472   7.6507  338.417   10.795  340.537   10.845  664.673   10.611  666.751   10.627 -2.077576 15.01691 
1 1 1    5   24   15 o  1855.92   12.397  2639.48   35.216  2661.49   50.290  2618.30   49.331  1862.41   17.642  1847.28   17.447 15.12048 24.81152 
1 1 1    5   24   16 o  1235.55   9.3258  1169.20   17.636  1168.84   24.881  1169.57   25.003  1234.88   13.164  1235.26   13.224 -0.3797607 18.65886 
1 1 1    5   24   17 o  656.220   8.7932  329.799   8.8322  335.523   15.169  326.864   10.864  661.439   14.983  653.169   10.866 8.269592 18.50839 
1 1 1    5   24   18 o  123.961   24.418   12.237   4.4683   6.2333   7.3630   15.738   5.6218  100.066   36.708  140.557   27.113 -40.49090 45.63585 
1 1 1    5   24   19 f  582.655   9.0662  260.039   8.0855  258.442   13.927  260.850   9.9303  580.365   15.678  583.437   11.120 -3.071594 19.22138 
1 1 1    5   24   20 o  382.753   9.1335  112.224   5.3509  115.464   7.6832  109.173   7.4564  388.054   12.935  377.336   12.910 10.71796 18.27556 
1 1 1    5   24   21 o  757.258   11.301  439.549   13.099  439.549   13.099   0.0000   0.0000  757.258   11.301  ?   ?  0.000000 11.30146 
1 1 1    5   24   22 o  1052.87   10.199  849.551   16.437  817.840   19.572  925.442   30.277  1032.69   12.382  1097.28   18.027 -64.58386 21.87012 
1 1 1    5   24   23 o  409.144   10.775  128.329   6.7481  133.739   12.112  125.893   8.1262  416.941   18.978  405.079   13.106 11.86194 23.06405 
1 1 1    5   24   24 o  217.418   16.529   36.540   5.4594   28.988   9.6655   40.079   6.6159  190.050   34.497  227.387   19.188 -37.33658 39.47424 
1 1 1    5   24   25 o  1006.47   8.8261  776.286   13.597  757.426   18.904  796.501   19.571  993.512   12.431  1018.79   12.551 -25.27887 17.66493 
1 1 1    5   24   26 o  707.929   8.2638  384.039   8.9545  381.474   12.533  386.713   12.798  705.121   11.612  709.921   11.778 -4.799316 16.53995 
1 1 1    5   24   27 o  463.036   8.9336  164.352   6.3315  167.300   8.8445  161.254   9.0680  466.821   12.378  458.243   12.928 8.577911 17.89860 
1 1 1    5   24   28 o   57.222   25.281  -1.3074   4.3492   5.1631   6.2821  -7.2635   6.0272   91.270   33.832   55.496   26.333 35.77364 42.87209 
1 1 1    5   24   29 o  315.490   13.474   76.508   6.5065   82.648   7.8743   63.293   11.552  327.649   15.701  283.908   26.905 43.74066 31.15118 
1 1 1    5   24   30 o  127.749   30.048   13.279   5.7771   14.446   6.7275   10.005   11.274  132.944   33.169  122.766   45.359 10.17832 56.19268 
1 1 1    5   24   31 o  352.893   12.809   95.746   6.9190   80.469   12.211  102.971   8.3971  320.511   25.090  365.653   15.003 -45.14224 29.23396 
1 1 1    5   24   32 o  116.296   27.685   11.004   4.8572   13.110   6.7812   8.7856   6.9605  126.500   34.202  107.576   35.968 18.92391 49.63390 
1 1 1    5   24   33 o  158.434   21.213   19.825   5.0152   17.270   7.0081   22.507   7.1800  145.042   32.386  166.930   29.162 -21.88780 43.58113 
1 1 1    5   24   34 o  219.278   10.854   36.953   3.6431   37.301   4.1702   35.832   7.4857  219.818   12.446  213.124   23.328 6.693604 26.44043 
1 1 1    5   24   35 o  234.436   10.524   42.242   3.7762   41.809   4.2890   43.736   7.9642  232.765   12.080  235.800   22.332 -3.035660 25.39008 
1 1 1    5   24   36 o  359.453   7.2586   99.103   3.9936   97.504   5.4650  100.935   5.8503  356.184   10.024  362.314   10.549 -6.130615 14.55237 
1 1 1    5   24   37 o   71.711   21.457   4.0674   2.5384   5.2210   3.4655   2.7320   3.7286   81.418   25.215   68.455   25.920 12.96346 36.16183 
1 1 1    5   24   38 o  244.101   11.598   45.907   4.3333   38.072   8.5143   48.646   5.0341  218.009   26.030  250.701   13.165 -32.69148 29.16986 
1 1 1    5   24   39 o   95.789   23.140   7.5027   3.3548   15.812   8.3983   5.9252   3.6594  136.280   38.540   85.889   25.777 50.39119 46.36596 
1 1 1    5   24   40 o  194.529   10.488   29.224   3.1112   28.944   4.3399   29.521   4.4625  192.728   14.826  194.583   15.101 -1.854843 21.16250 
1 1 1    5   24   41 o  255.202   9.0385   50.088   3.5306   49.930   5.0130   50.243   4.9733  253.830   12.946  254.984   12.743 -1.154083 18.16515 
1 1 1    5   24   42 o  173.047   12.335   23.254   3.2458   24.077   4.5422   22.395   4.6399  174.935   17.185  168.343   18.302 6.591660 25.10571 
1 1 1    5   24   43 o  225.064   10.303   39.045   3.5494   39.789   5.0277   38.305   5.0115  225.933   14.617  221.595   14.861 4.338593 20.84494 
1 1 1    5   24   44 o   59.586   22.828   2.0060   2.9131   4.4880   4.2144  -0.2650   4.0312   78.707   27.914   57.381   24.864 21.32615 37.38184 
1 1 1    5   24   45 o  139.758   23.029   15.912   4.7547   15.715   4.9187   18.720   18.572  138.503   24.076  147.340   57.316 -8.837158 62.16682 
1 1 1    5   24   46 o  201.130   12.517   31.471   3.8344   33.160   5.4333   29.795   5.4122  204.926   17.489  193.832   18.465 11.09329 25.43326 
1 1 1    5   24   47 o  182.635   13.513   26.066   3.7507   26.893   5.2189   25.182   5.3940  183.789   18.817  177.249   20.245 6.539703 27.63973 
1 1 1    5   24   48 o  217.384   12.265   36.786   4.0643   38.767   5.6176   34.611   5.8874  221.618   16.683  208.546   18.640 13.07227 25.01587 
1 1 1    5   24   49 o  162.852   15.864   20.996   3.9042   20.531   5.4164   21.500   5.6327  158.194   23.046  161.768   23.431 -3.574097 32.86549 
1 1 1    5   24   50 o  116.425   23.640   11.356   4.0689   12.526   5.3707   9.7802   6.2339  120.064   29.448  105.956   33.956 14.10827 44.94672 
1 1 1    5   24   51 o  140.975   19.180   16.147   4.0311   13.981   5.9376   18.000   5.4904  125.616   31.057  145.958   25.504 -20.34289 40.18695 
1 1 1    5   24   52 o  131.727   24.246   14.669   4.7086   9.8468   9.9614   16.057   5.3431  108.266   42.015  136.793   26.476 -28.52734 49.66129 
1 1 1    5   24   53 o  110.498   25.199   10.552   4.1675   4.9758   5.8963   16.119   5.8911   83.451   32.342  134.823   29.378 -51.37196 43.69230 
1 1 1    5   24   54 o   63.649   25.979   1.9487   4.0017   3.9209   5.5687  -0.1572   5.7543   77.698   31.026   65.679   29.045 12.01898 42.50003 
1 1 1    5   24   55 o  156.726   18.021   20.145   4.2444   26.083   6.1276   14.669   5.8847  174.756   23.504  125.608   30.836 49.14800 38.77196 
1 1 1    5   24   56 o  267.279   14.379   57.127   5.8608   70.214   7.8759   40.887   8.7734  293.287   17.626  214.369   27.362 78.91814 32.54820 
1 1 1    5   25    0 o  674.405   14.206  348.793   14.649  348.793   14.649  348.793   14.649  674.405   14.206  674.405   14.206 0.000000 0.000000 
1 1 1    5   25    1 o  226.725   14.049   39.546   4.8513   43.773   6.9415   35.510   6.7829  238.078   19.212  214.055   20.972 24.02312 28.44156 
1 1 1    5   25    2 o  1671.07   22.627  2144.90   57.875   0.0000   0.0000  2144.90   57.875  ?   ?   1671.07   22.627 0.000000 22.62716 
1 1 1    5   25    3 o  574.202   14.327  252.701   12.592   0.0000   0.0000  252.701   12.592  ?   ?   574.202   14.327 0.000000 14.32701 
1 1 1    5   25    4 f  1217.55   12.853  1135.87   23.952  1102.10   33.165  1172.68   34.630  1198.61   18.077  1236.36   18.299 -37.75269 25.72240 
1 1 1    5   25    5 o  577.088   10.203  255.066   9.0126  247.901   12.933  261.830   12.566  568.683   14.859  584.491   14.046 -15.80835 20.44656 
1 1 1    5   25    6 o  538.735   10.328  222.296   8.5162  221.455   12.369  223.055   11.742  537.477   15.036  539.463   14.221 -1.985535 20.69548 
1 1 1    5   25    7 o  928.057   11.294  659.789   16.043  663.893   23.136  655.988   22.266  930.463   16.245  924.964   15.727 5.499207 22.61075 
1 1 1    5   25    8 o  611.907   10.421  286.795   9.7603  276.607   13.852  296.841   13.755  600.668   15.066  622.295   14.441 -21.62683 20.86939 
1 1 1    5   25    9 o  824.346   10.911  520.551   13.767  520.743   19.689  520.367   19.257  824.098   15.609  823.833   15.272 0.2644653 21.83702 
1 1 1    5   25   10 o  538.798   10.613  222.374   8.7526  217.972   12.413  226.725   12.343  533.186   15.210  543.811   14.829 -10.62469 21.24268 
1 1 1    5   25   11 o  130.595   22.102   13.464   4.2604   10.722   5.1978   19.077   7.4371  115.734   29.311  154.363   32.504 -38.62853 43.76807 
1 1 1    5   25   12 o  380.848   11.907  111.139   6.9410  111.139   6.9410   0.0000   0.0000  380.848   11.907  ?   ?  0.000000 11.90700 
1 1 1    5   25   13 o  748.317   10.731  428.995   12.291  428.995   12.291   0.0000   0.0000  748.317   10.731  ?   ?  0.000000 10.73060 
1 1 1    5   25   14 o  903.345   11.220  625.244   15.514  624.365   21.761  626.153   22.124  902.202   15.758  903.461   15.999 -1.259460 22.45630 
1 1 1    5   25   15 o  293.913   11.264   66.193   5.0672   69.938   8.5237   64.146   6.3016  301.229   18.577  289.227   14.234 12.00128 23.40383 
1 1 1    5   25   16 o  885.800   9.2552  601.023   12.549  580.789   21.094  612.106   15.611  870.029   15.840  893.727   11.412 -23.69781 19.52287 
1 1 1    5   25   17 o  641.449   7.7013  315.096   7.5613  318.321   10.779  311.972   10.610  644.513   10.926  638.057   10.864 6.455627 15.40791 
1 1 1    5   25   18 o  672.614   7.7856  346.479   8.0154  339.447   11.163  353.961   11.516  665.524   10.959  679.593   11.071 -14.06934 15.57743 
1 1 1    5   25   19 o  1070.36   8.7715  877.638   14.371  883.594   20.399  871.771   20.248  1073.47   12.415  1066.26   12.406 7.204224 17.55139 
1 1 1    5   25   20 o  167.086   19.007   21.743   4.7746   14.510   5.8549   36.103   8.2494  134.369   29.294  214.770   25.599 -80.40016 38.90295 
1 1 1    5   25   21 o  100.813   26.475   8.1420   4.1377   10.971   5.7547   5.1142   5.9535  116.913   31.465   90.172   33.019 26.74118 45.60993 
1 1 1    5   25   22 o  226.727   13.384   39.588   4.6241   37.164   6.4347   42.177   6.6497  218.872   19.409  233.369   18.775 -14.49648 27.00351 
1 1 1    5   25   23 o  273.973   11.675   57.579   4.8959   57.699   6.8325   57.452   7.0190  273.467   16.399  272.811   16.892 0.6554871 23.54281 
1 1 1    5   25   24 o  160.809   18.398   20.169   4.4471   23.254   6.2569   17.019   6.3218  171.697   24.503  145.448   29.407 26.24960 38.27795 
1 1 1    5   25   25 o  198.111   17.716   30.461   5.3153   34.409   10.267   29.015   6.2128  207.283   33.501  192.679   21.429 14.60455 39.76871 
1 1 1    5   25   26 o  201.174   17.489   31.407   5.3316   28.564   9.6846   32.644   6.3866  187.931   34.954  204.576   20.680 -16.64409 40.61348 
1 1 1    5   25   27 o  764.516   9.9233  448.339   11.612  436.733   13.904  475.097   21.112  754.147   12.045  785.085   17.569 -30.93756 21.30146 
1 1 1    5   25   28 o  457.965   10.652  160.968   7.4668  162.822   8.9437  156.703   13.565  460.321   12.694  450.317   19.680 10.00381 23.41839 
1 1 1    5   25   29 o  236.976   13.957   43.351   5.0403   40.255   7.1332   46.439   7.1229  227.120   20.748  244.391   19.196 -17.27150 28.26611 
1 1 1    5   25   30 o  336.155   12.831   86.893   6.6021   69.523   12.015   94.407   7.9021  297.226   26.694  350.120   14.745 -52.89450 30.49570 
1 1 1    5   25   31 o  162.381   19.809   20.718   4.8213   24.286   6.9344   17.378   6.7078  174.296   26.855  145.917   30.991 28.37860 41.00739 
1 1 1    5   25   32 o  643.808   8.9166  318.066   8.7867  316.996   12.391  319.148   12.462  641.866   12.612  644.033   12.642 -2.167053 17.85728 
1 1 1    5   25   33 o  123.059   28.544   12.388   5.2723   15.244   6.8005   8.0864   8.3471  135.857   33.025  107.902   39.160 27.95504 51.22647 
1 1 1    5   25   34 o  226.994   15.580   39.993   5.3806   45.288   7.7158   34.981   7.5070  240.256   21.199  210.224   23.746 30.03194 31.83203 
1 1 1    5   25   35 o  275.323   10.070   58.264   4.2437   56.689   4.9148   62.879   8.4125  271.353   11.833  283.707   19.491 -12.35385 22.80161 
1 1 1    5   25   36 o  230.532   11.692   41.033   4.1120   38.700   4.5014   52.799   10.108  223.589   13.212  257.478   26.004 -33.88924 29.16754 
1 1 1    5   25   37 f  711.848   8.4167  389.185   9.1706  377.629   14.382  397.104   11.905  699.284   13.437  718.220   10.829 -18.93616 17.25725 
1 1 1    5   25   38 o  264.700   10.587   53.945   4.2894   36.057   8.7083   59.676   4.9287  211.223   27.595  278.242   11.573 -67.01846 29.92326 
1 1 1    5   25   39 o  218.783   9.4034   36.816   3.1490   34.466   4.3371   39.436   4.5794  210.707   13.519  225.488   13.328 -14.78027 18.98400 
1 1 1    5   25   40 o  137.293   13.987   14.740   2.8983   11.554   4.2194   17.587   3.9880  118.863   24.018  149.182   17.817 -30.31824 29.90518 
1 1 1    5   25   41 f   75.549   22.521   4.5767   2.8004   6.5415   3.9224   2.5341   3.9993   89.647   26.638   68.532   26.615 21.11444 37.65532 
1 1 1    5   25   42 o  237.633   9.6132   43.486   3.4966   43.066   5.0188   43.882   4.8742  235.267   14.000  237.643   13.455 -2.375839 19.41790 
1 1 1    5   25   43 o  419.776   7.6508  135.421   4.9158  136.708   6.9491  134.131   6.9548  420.902   10.786  416.881   10.899 4.020874 15.33442 
1 1 1    5   25   44 o  230.137   15.395   41.438   5.3917   42.607   5.6296   28.489   18.743  233.216   15.865  170.001   58.973 63.21492 61.06987 
1 1 1    5   25   45 f  171.296   13.503   22.921   3.5117   22.361   4.8403   23.543   5.1028  167.456   19.233  171.681   19.780 -4.224899 27.58956 
1 1 1    5   25   46 o  158.076   15.474   19.690   3.6961   19.056   5.0987   20.391   5.3657  153.135   22.416  158.350   22.795 -5.214462 31.97043 
1 1 1    5   25   47 o  164.794   15.073   21.385   3.7599   17.801   5.3093   24.991   5.3254  146.848   24.483  176.438   20.077 -29.59059 31.66242 
1 1 1    5   25   48 o  195.607   12.938   29.897   3.8516   26.630   5.4132   33.247   5.4815  182.074   19.740  204.556   17.681 -22.48215 26.50083 
1 1 1    5   25   49 o  182.244   14.532   26.161   4.0200   28.199   5.4293   23.687   5.9811  187.335   19.206  169.446   23.710 17.88916 30.51316 
1 1 1    5   25   50 o  176.954   16.353   24.930   4.3790   27.528   5.8906   21.720   6.5471  183.611   21.359  159.414   27.845 24.19719 35.09372 
1 1 1    5   25   51 o  202.569   16.142   32.658   4.9634   20.963   10.016   36.465   5.7145  146.169   42.330  213.328   17.660 -67.15854 45.86619 
1 1 1    5   25   52 o   95.436   29.237   7.9894   4.6736  -5.1725   9.4628   12.236   5.3748   73.147   34.169  117.018   29.898 -43.87141 45.40288 
1 1 1    5   25   53 o  143.469   19.837   17.009   4.2397   18.988   5.9844   15.015   6.0074  147.005   27.610  128.248   30.956 18.75650 41.47973 
1 1 1    5   25   54 o  126.096   22.552   13.584   4.1929   17.874   6.1893   9.9449   5.7003  140.100   29.780  103.067   32.408 37.03243 44.01299 
1 1 1    5   25   55 o  126.686   26.261   14.324   4.9250   27.219   6.1337  -9.0755   8.2625  178.408   22.997   60.549   29.276 117.8593 37.22791 
1 1 1    5   26    0 o  499.710   14.125  191.714   10.784  191.714   10.784  191.714   10.784  499.710   14.125  499.710   14.125 0.000000 0.000000 
1 1 1    5   26    1 o  1323.50   13.446  1342.49   27.238  1324.21   37.974  1361.86   39.091  1313.55   18.887  1332.04   19.173 -18.48364 26.91352 
1 1 1    5   26    2 o  444.719   14.733  151.621   10.029   0.0000   0.0000  151.621   10.029  ?   ?   444.719   14.733 0.000000 14.73342 
1 1 1    5   26    3 o  355.196   15.937   96.751   8.6643   0.0000   0.0000   96.751   8.6643  ?   ?   355.196   15.937 0.000000 15.93654 
1 1 1    5   26    4 o  261.622   14.215   52.622   5.6711   46.004   8.2508   58.549   7.8079  243.670   22.372  275.584   18.619 -31.91417 29.10628 
1 1 1    5   26    5 o  897.513   11.187  617.112   15.368  641.870   22.608  595.848   20.953  914.834   16.146  881.497   15.529 33.33704 22.40164 
1 1 1    5   26    6 o  999.648   11.663  765.638   17.846  771.374   25.664  760.268   24.831  1002.79   16.720  995.602   16.295 7.186951 23.34710 
1 1 1    5   26    7 o  476.680   10.786  174.068   7.8695  181.173   11.642  168.091   10.679  486.046   15.649  468.215   14.901 17.83179 21.60816 
1 1 1    5   26    8 o  200.557   18.706   31.143   5.6762   24.583   7.9360   38.013   8.1219  176.041   30.561  220.973   24.421 -44.93205 39.11992 
1 1 1    5   26    9 o  731.381   8.9876  409.674   10.061  391.874   12.085  449.874   18.162  715.186   11.040  765.885   15.493 -50.69946 19.02378 
1 1 1    5   26   10 o  971.888   11.587  723.777   17.237  716.128   23.990  731.939   24.781  966.171   16.222  976.727   16.576 -10.55627 23.19332 
1 1 1    5   26   11 o  348.482   12.453   93.076   6.6422   83.970   8.9946  103.998   9.8507  330.263   17.860  368.100   17.484 -37.83658 24.99285 
1 1 1    5   26   12 o  103.190   30.471   8.3473   5.1450   9.2196   7.0376   7.3457   7.5407  110.957   36.126  104.824   37.321 6.132652 51.94218 
1 1 1    5   26   13 o  741.409   8.9439  421.031   10.150  409.228   12.197  447.615   18.304  730.797   10.904  763.807   15.656 -33.01068 19.07906 
1 1 1    5   26   15 o  1341.93   11.390  1380.21   23.394  1394.47   28.951  1353.39   39.712  1348.32   14.028  1326.90   19.553 21.41931 24.06459 
1 1 1    5   26   16 o  465.414   9.3523  165.952   6.6624  171.579   8.2737  155.574   11.236  473.115   11.425  450.137   16.308 22.97791 19.91187 
1 1 1    5   26   17 o  565.721   11.066  245.322   9.5823  245.322   9.5823   0.0000   0.0000  565.721   11.066  ?   ?  0.000000 11.06620 
1 1 1    5   26   18 o  221.142   14.704   37.704   4.9486   30.790   6.0707   51.397   8.5433  199.005   20.210  257.377   21.894 -58.37184 29.79614 
1 1 1    5   26   19 o  612.950   11.191  288.070   10.499  288.070   10.499   0.0000   0.0000  612.950   11.191  ?   ?  0.000000 11.19078 
1 1 1    5   26   20 o  405.985   8.8674  126.300   5.5103  126.754   7.7045  125.825   7.8840  406.472   12.384  404.951   12.720 1.520477 17.75222 
1 1 1    5   26   21 o  376.746   9.3685  108.790   5.4024  108.435   7.4910  109.175   7.7985  375.868   13.021  377.106   13.511 -1.237152 18.76383 
1 1 1    5   26   22 f  272.375   11.442   56.914   4.7700   71.690   7.0244   44.269   6.4980  305.429   15.026  239.150   17.881 66.27988 23.35597 
1 1 1    5   26   23 o  309.097   10.544   73.280   4.9883   74.151   7.1420   72.449   6.9703  310.580   15.024  307.013   14.833 3.566986 21.11212 
1 1 1    5   26   24 o  135.847   20.952   14.579   4.2165   14.998   5.8937   14.139   6.0349  136.260   29.140  132.067   30.474 4.192871 42.16413 
1 1 1    5   26   25 o  361.730   11.549  100.446   6.3946  105.329   7.6893   89.495   11.515  370.206   13.570  339.336   22.293 30.86981 26.09843 
1 1 1    5   26   26 o  119.898   28.324   11.657   5.1153   12.424   6.1264   9.8916   9.2954  123.579   32.100  117.645   41.484 5.934227 52.45351 
1 1 1    5   26   27 o  374.334   11.635  107.620   6.6665  112.563   12.014  105.421   8.0133  380.841   20.687  370.178   14.143 10.66299 25.05944 
1 1 1    5   26   28 f  396.818   11.505  120.956   6.9881  116.327   12.643  122.993   8.3855  386.817   21.437  399.836   13.702 -13.01843 25.44175 
1 1 1    5   26   29 o  241.950   15.905   45.333   5.8575   60.724   10.984   39.216   6.9244  277.687   26.150  224.073   20.413 53.61426 33.17379 
1 1 1    5   26   30 o  611.152   8.7121  286.552   8.1497  287.130   11.544  285.977   11.507  611.015   12.343  609.790   12.329 1.225098 17.44569 
1 1 1    5   26   31 o  174.674   18.458   23.880   4.8602   24.886   6.9260   22.905   6.8219  176.383   26.471  168.836   27.332 7.546677 38.04933 
1 1 1    5   26   32 o   83.243   29.901   4.7191   4.8505   8.8027   6.8504   0.6135   6.8689  106.957   35.683   77.997   33.098 28.96073 48.66935 
1 1 1    5   26   33 o  311.990   12.226   74.945   5.8382   68.263   8.0388   82.402   8.4928  296.246   17.811  325.779   17.091 -29.53317 24.68503 
1 1 1    5   26   34 o  377.370   20.294  111.245   11.679  111.245   11.679   0.0000   0.0000  377.370   20.294  ?   ?  0.000000 20.29356 
1 1 1    5   26   35 o  369.465   12.861  105.284   7.2731  104.640   9.2091  106.351   11.857  367.451   16.374  368.355   21.118 -0.9037476 26.72195 
1 1 1    5   26   36 o  277.477   14.417   59.702   6.1020   68.194   8.6501   51.289   8.6090  295.147   19.253  254.778   22.301 40.36920 29.46180 
1 1 1    5   26   37 o  363.134   8.8266  101.343   4.9060   98.340   5.6690  110.300   9.7913  357.431   10.362  376.722   16.981 -19.29034 19.89249 
1 1 1    5   26   38 o  146.917   12.332   16.775   2.7474   19.306   3.8205   14.065   3.9538  156.886   16.140  132.667   20.100 24.21861 25.77832 
1 1 1    5   26   39 o   63.633   21.635   2.9726   2.5187   3.0148   3.5583   2.9303   3.5656   68.710   25.464   68.307   25.455 0.4026413 36.00494 
1 1 1    5   26   40 o  327.924   7.8485   82.619   3.9394   80.511   5.4984   84.841   5.6469  323.083   11.119  331.656   11.124 -8.573364 15.72780 
1 1 1    5   26   41 o  236.354   9.6889   43.023   3.5051   44.087   5.0996   42.070   4.8258  238.036   14.059  232.631   13.612 5.405487 19.56899 
1 1 1    5   26   42 o  178.932   12.230   24.875   3.3295   25.464   4.5057   24.167   4.9419  179.949   16.544  174.592   18.788 5.356979 25.03395 
1 1 1    5   26   43 o   90.505   42.774 -12.3668   15.605   0.0000   0.0000 -12.3668   15.605  ?   ?    90.505   42.774 0.000000 42.77447 
1 1 1    5   26   44 o  181.046   12.680   25.527   3.4918   27.735   4.8225   23.094   5.0624  187.499   16.988  170.018   19.826 17.48116 26.10844 
1 1 1    5   26   45 f  119.081   18.799   11.423   3.3129   8.4855   4.5434   14.758   4.8409  100.395   28.332  133.665   24.566 -33.27055 37.49916 
1 1 1    5   26   46 o   69.709   24.886   3.4866   3.3550   1.1389   4.5199   6.3672   5.0067   65.063   27.181   89.497   30.503 -24.43421 40.85636 
1 1 1    5   26   47 o  126.535   18.180   12.885   3.4199   10.965   4.7901   14.881   4.8843  113.318   27.821  133.630   24.793 -20.31141 37.26530 
1 1 1    5   26   48 o   92.127   24.779   7.1676   3.5702   7.2349   5.0004   7.0976   5.0991   93.079   30.459   92.522   30.782 0.5569000 43.30436 
1 1 1    5   26   49 o   71.361   26.056   3.6596   3.7034  -2.3158   5.1069   10.287   5.3784   57.672   26.268  108.141   30.933 -50.46835 40.58137 
1 1 1    5   26   50 o   83.146   26.011   5.7999   3.6772   9.5021   5.2602   2.2614   5.1425  103.772   30.851   71.310   29.317 32.46246 42.55918 
1 1 1    5   26   51 o  192.086   24.500   30.981   7.0392   20.456   10.162   40.688   9.7598  142.741   42.982  215.658   30.411 -72.91692 52.65276 
1 1 1    5   26   52 o   75.604   26.927   4.5268   3.9258   2.7453   5.6623   6.1757   5.4476   74.185   30.659   86.700   31.610 -12.51546 44.03589 
1 1 1    5   26   53 o  147.156   18.701   17.827   4.1171   23.867   5.9627   12.325   5.6916  167.050   24.010  114.985   31.437 52.06495 39.55732 
1 1 1    5   26   54 o   50.954   23.077  -1.3149   3.8722   0.1434   5.5574  -2.6909   5.3983   64.728   28.588   56.942   26.326 7.785587 38.86338 
1 1 1    5   27    0 o  291.691   17.960   65.947   7.9491   65.947   7.9491   65.947   7.9491  291.691   17.960  291.691   17.960 0.000000 0.000000 
1 1 1    5   27    1 o  476.534   10.581  173.968   7.7177  184.655   11.207  164.326   10.644  490.707   14.921  462.902   15.023 27.80524 21.17315 
1 1 1    5   27    2 o  481.377   14.689  177.691   10.823   0.0000   0.0000  177.691   10.823  ?   ?   481.377   14.689 0.000000 14.68935 
1 1 1    5   27    3 o  886.931   15.573  603.377   21.142   0.0000   0.0000  603.377   21.142  ?   ?   886.931   15.573 0.000000 15.57323 
1 1 1    5   27    4 o  465.664   15.047  166.303   10.725   0.0000   0.0000  166.303   10.725  ?   ?   465.664   15.047 0.000000 15.04703 
1 1 1    5   27    5 o  1019.68   16.657  797.820   25.997   0.0000   0.0000  797.820   25.997  ?   ?   1019.68   16.657 0.000000 16.65707 
1 1 1    5   27    6 o  315.238   18.808   76.582   9.0337   0.0000   0.0000   76.582   9.0337  ?   ?   315.238   18.808 0.000000 18.80795 
1 1 1    5   27    7 o  496.205   15.633  188.891   11.873   0.0000   0.0000  188.891   11.873  ?   ?   496.205   15.633 0.000000 15.63308 
1 1 1    5   27    8 o  409.909   11.777  128.773   7.3893  119.433   10.385  138.350   10.516  394.448   17.201  424.613   16.180 -30.16443 23.61528 
1 1 1    5   27    9 o  678.040   10.757  352.271   11.164  339.758   15.456  365.922   16.144  665.490   15.173  690.628   15.272 -25.13812 21.52785 
1 1 1    5   27   10 o  892.828   9.2740  610.634   12.674  611.016   15.525  609.871   21.943  892.898   11.360  891.433   16.082 1.464844 19.68926 
1 1 1    5   27   11 o  501.158   9.0587  192.394   6.9488  190.502   8.4252  196.420   12.288  498.575   11.040  505.887   15.870 -7.312408 19.33238 
1 1 1    5   27   12 o  449.734   9.3505  154.953   6.4367  158.476   7.9856  148.421   10.875  454.698   11.474  439.700   16.159 14.99774 19.81818 
1 1 1    5   27   13 o  852.876   9.2655  557.282   12.095  562.718   14.932  546.907   20.628  856.792   11.386  844.014   15.967 12.77863 19.61115 
1 1 1    5   27   14 o  467.726   9.3286  167.617   6.6785  165.772   8.1512  171.385   11.649  465.010   11.452  472.420   16.109 -7.409485 19.76507 
1 1 1    5   27   15 o  295.938   14.374   67.218   6.5109   67.218   6.5109   0.0000   0.0000  295.938   14.374  ?   ?  0.000000 14.37375 
1 1 1    5   27   16 o  455.735   9.4590  159.160   6.5982  157.575   7.9974  162.538   11.677  453.317   11.526  459.921   16.587 -6.604553 20.19867 
1 1 1    5   27   17 o  1362.65   11.603  1424.03   24.201  1409.73   29.256  1455.03   43.073  1355.12   14.105  1374.37   20.475 -19.25403 24.86333 
1 1 1    5   27   18 o  364.660   10.412  101.951   5.8114  108.149   7.1982   90.351   9.8482  375.430   12.526  342.077   18.882 33.35306 22.65931 
1 1 1    5   27   19 o  864.567   8.2665  572.742   10.939  581.404   15.558  564.273   15.384  870.561   11.676  857.631   11.719 12.92932 16.54311 
1 1 1    5   27   20 o  556.228   8.0616  237.069   6.8635  236.413   9.6947  237.728   9.7183  555.120   11.410  556.662   11.406 -1.542053 16.13308 
1 1 1    5   27   21 o   71.473   26.979   2.8980   4.0314   6.5196   5.5931  -1.0181   5.8160   94.783   32.240   68.055   29.674 26.72848 43.81747 
1 1 1    5   27   22 o  277.923   11.070   59.268   4.7091   57.976   6.5817   60.624   6.7405  274.064   15.756  280.270   15.777 -6.206116 22.29703 
1 1 1    5   27   23 o  591.299   9.5923  268.141   8.6816  263.761   10.371  278.395   15.869  586.173   11.559  601.098   17.248 -14.92505 20.76298 
1 1 1    5   27   24 o  466.250   10.263  166.797   7.3241  169.605   8.9317  161.032   12.797  469.881   12.419  456.854   18.300 13.02625 22.11580 
1 1 1    5   27   25 o  721.446   8.2899  399.039   9.1542  401.203   13.006  396.915   12.886  722.753   11.757  718.890   11.711 3.863281 16.59455 
1 1 1    5   27   26 o  138.743   25.721   15.455   5.2611   24.602   10.400   12.309   6.0990  172.272   40.179  122.850   32.085 49.42146 51.41836 
1 1 1    5   27   27 o  496.247   10.690  189.100   8.1200  201.596   14.720  183.634   9.7353  510.587   18.835  488.628   13.017 21.95938 22.89513 
1 1 1    5   27   28 o  433.044   9.5118  143.926   6.3047  143.531   8.8522  144.333   8.9815  431.848   13.392  433.023   13.551 -1.175659 19.05202 
1 1 1    5   27   29 o  231.726   17.484   41.746   6.1558   42.427   10.779   41.416   7.4990  229.739   31.481  229.874   21.565 -0.1345062 38.15885 
1 1 1    5   27   30 o  167.553   22.960   22.275   5.7334   27.623   10.734   20.140   6.7819  181.730   39.700  157.509   29.206 24.22119 49.28535 
1 1 1    5   27   31 o  131.633   29.353   14.209   5.7635  -6.1561   10.959   21.995   6.7764   83.616   38.237  165.010   27.819 -81.39352 47.28614 
1 1 1    5   27   32 o  255.254   24.688   51.566   9.5250   51.566   9.5250   0.0000   0.0000  255.254   24.688  ?   ?  0.000000 24.68776 
1 1 1    5   27   33 o  529.896   10.716  215.998   8.6918  228.702   14.203  208.392   10.990  543.116   17.085  519.601   13.818 23.51422 21.97384 
1 1 1    5   27   34 o  386.593   12.582  115.255   7.4451  123.929   9.5660  101.927   11.857  400.055   15.622  360.300   21.600 39.75565 26.65717 
1 1 1    5   27   35 o  192.626   19.163   29.202   5.5749   24.148   7.8035   34.471   7.9672  171.186   30.920  207.330   25.653 -36.14394 40.17619 
1 1 1    5   27   36 o  313.597   13.496   76.006   6.4778   79.967   9.3986   72.421   8.9406  319.488   19.310  303.986   19.315 15.50223 27.31248 
1 1 1    5   27   37 o  157.348   14.648   19.338   3.4872   21.586   3.8932   10.216   7.8430  166.124   15.490  113.084   38.179 53.04050 41.20131 
1 1 1    5   27   38 o   75.217   24.389   4.3813   3.2089   4.6300   3.5339   3.2126   7.6602   77.643   25.616   88.054   35.942 -10.41119 44.13639 
1 1 1    5   27   39 o  132.141   13.507   13.654   2.6935   11.182   3.6896   16.474   3.9411  117.525   21.295  144.120   18.277 -26.59488 28.06239 
1 1 1    5   27   40 o  135.992   13.708   14.472   2.8145   13.652   3.8422   15.420   4.1343  130.478   19.866  138.773   20.045 -8.295959 28.22130 
1 1 1    5   27   41 o  196.945   11.403   30.057   3.4228   25.611   4.3689   37.123   5.5077  180.634   15.966  217.497   16.671 -36.86362 23.08345 
1 1 1    5   27   42 o  199.933   14.466   31.229   4.3969   32.632   5.0423   26.779   8.9823  203.844   16.297  176.938   34.405 26.90598 38.06990 
1 1 1    5   27   43 f   58.880   22.759   1.8972   2.9139   5.2347   4.2111  -1.1688   4.0362   82.335   27.975   54.325   24.160 28.01036 36.96309 
1 1 1    5   27   44 o  158.502   14.140   19.699   3.3944   27.056   4.8373   12.562   4.7644  184.953   17.288  122.541   26.195 62.41235 31.38568 
1 1 1    5   27   45 o   99.171   22.769   8.1715   3.3832   7.9267   4.5103   8.4863   5.1158   97.045   28.494  100.264   30.565 -3.219505 41.78657 
1 1 1    5   27   46 o  150.805   15.277   17.974   3.4776   17.233   4.8461   18.762   4.9934  145.000   22.569  151.574   22.179 -6.574112 31.64302 
1 1 1    5   27   47 o   80.237   25.472   5.2624   3.5143   3.7301   4.8767   6.9178   5.0688   76.531   29.482   91.630   30.694 -15.09911 42.55923 
1 1 1    5   27   48 f  142.156   18.576   16.333   3.9453   18.029   5.5034   14.540   5.6589  146.281   25.507  129.252   29.282 17.02808 38.83362 
1 1 1    5   27   49 o  112.015   21.971   10.488   3.6324   4.8148   5.2012   15.890   5.0752   81.544   30.674  136.986   25.131 -55.44134 39.65427 
1 1 1    5   27   50 o  133.934   23.521   15.118   4.6460   13.647   9.6904   15.557   5.2941  119.381   42.329  134.234   26.706 -14.85336 50.04945 
1 1 1    5   27   51 o  215.988   16.909   37.504   5.5456   51.800   6.8819   11.032   9.3649  253.337   17.862  109.036   41.129 144.3010 44.84025 
1 1 1    5   27   52 o   73.238   31.628   1.5491   6.4788   3.6484   9.4357  -0.3235   8.9116   87.917   38.068   77.988   35.192 9.929100 51.84252 
1 1 1    5   27   53 o  156.093   17.470   19.937   4.1024   12.227   5.6697   28.410   5.9434  113.816   31.484  183.737   21.542 -69.92077 38.14852 
1 1 1    5   28    0 o  799.969   15.194  490.908   18.590  490.908   18.590  490.908   18.590  799.969   15.194  799.969   15.194 0.000000 0.000000 
1 1 1    5   28    1 o  221.636   15.875   37.889   5.3498   40.065   7.6362   35.792   7.4971  227.120   22.252  214.396   23.217 12.72392 32.15844 
1 1 1    5   28    2 f  505.590   15.355  196.137   11.883   0.0000   0.0000  196.137   11.883  ?   ?   505.590   15.355 0.000000 15.35469 
1 1 1    5   28    3 o   98.181   36.508   5.7759   7.3266   0.0000   0.0000   5.7759   7.3266  ?   ?    98.181   36.508 0.000000 36.50827 
1 1 1    5   28    4 o  575.247   10.781  253.580   9.4922  258.348   13.733  249.219   13.135  580.229   15.463  569.925   15.057 10.30432 21.58299 
1 1 1    5   28    5 o  550.484   10.719  232.220   9.0319  226.349   12.813  238.019   12.734  543.100   15.413  556.971   14.937 -13.87091 21.46330 
1 1 1    5   28    6 o  307.246   13.257   72.394   6.2343   66.248   8.7801   78.643   8.8536  292.900   19.699  319.432   18.183 -26.53210 26.80827 
1 1 1    5   28    7 o  186.617   19.900   27.079   5.5966   30.221   8.1846   24.320   7.6701  195.854   28.108  174.990   29.698 20.86342 40.89042 
1 1 1    5   28    8 o  382.053   12.000  111.907   7.0171  110.116   10.222  113.504   9.6502  378.593   17.640  384.473   16.398 -5.880249 24.08458 
1 1 1    5   28    9 o  391.999   12.294  117.827   7.3767  119.527   10.450  116.139   10.415  394.443   17.308  388.796   17.501 5.647339 24.61404 
1 1 1    5   28   10 o  900.535   11.593  621.748   15.980  607.894   22.285  636.412   22.927  889.660   16.365  910.270   16.455 -20.61066 23.20790 
1 1 1    5   28   11 o  424.551   9.7666  138.124   6.3466  135.671   7.6960  143.339   11.221  420.627   11.954  431.918   16.973 -11.29129 20.75945 
1 1 1    5   28   12 o  365.483   12.668  102.465   7.0869  102.465   7.0869   0.0000   0.0000  365.483   12.668  ?   ?  0.000000 12.66826 
1 1 1    5   28   13 o  594.614   10.950  271.076   9.9659  271.076   9.9659   0.0000   0.0000  594.614   10.950  ?   ?  0.000000 10.94998 
1 1 1    5   28   14 o  240.984   16.173   44.826   5.9309   44.826   5.9309   0.0000   0.0000  240.984   16.173  ?   ?  0.000000 16.17285 
1 1 1    5   28   15 o  513.034   9.2436  201.718   7.2586  203.123   8.8692  198.867   12.632  514.642   11.259  508.649   16.225 5.993195 19.74866 
1 1 1    5   28   16 o  626.381   7.8702  300.598   7.5456  287.700   10.357  315.186   11.015  612.475   11.048  641.043   11.226 -28.56836 15.75096 
1 1 1    5   28   17 o  293.870   10.478   66.225   4.7129   76.377   6.5777   55.515   6.7560  315.372   13.626  268.155   16.541 47.21680 21.43085 
1 1 1    5   28   18 o  499.699   8.4791  191.365   6.4853  187.204   8.8714  196.140   9.5045  493.923   11.734  505.509   12.284 -11.58569 16.98783 
1 1 1    5   28   19 o  540.351   9.3131  223.854   7.7027  214.247   9.2281  245.925   13.987  528.393   11.410  565.352   16.163 -36.95886 19.78496 
1 1 1    5   28   20 o  607.831   11.422  283.555   10.627  283.555   10.627   0.0000   0.0000  607.831   11.422  ?   ?  0.000000 11.42194 
1 1 1    5   28   21 o  641.625   9.4075  315.711   9.2390  332.994   11.445  283.383   15.653  658.648   11.353  606.523   16.861 52.12567 20.32682 
1 1 1    5   28   22 o  475.369   9.9338  173.359   7.2280  177.536   8.8658  165.079   12.481  480.791   12.047  462.688   17.624 18.10321 21.34827 
1 1 1    5   28   23 o  502.606   8.5971  193.696   6.6137  197.184   9.2298  190.015   9.4818  506.670   11.901  497.287   12.457 9.382874 17.22845 
1 1 1    5   28   24 o  757.729   8.2909  440.234   9.6158  432.199   13.375  448.830   13.834  750.098   11.649  764.350   11.825 -14.25214 16.59922 
1 1 1    5   28   25 f  385.516   11.402  114.173   6.7280  117.927   11.908  112.413   8.1543  389.780   20.027  382.177   13.940 7.603424 24.40053 
1 1 1    5   28   26 o  185.099   16.470   26.645   4.6174   26.743   6.4775   26.543   6.5837  183.940   23.548  183.111   24.074 0.8289490 33.67539 
1 1 1    5   28   27 o  170.203   17.925   22.645   4.5996   30.174   6.4986   15.086   6.5111  195.818   22.066  135.542   31.913 60.27667 38.79882 
1 1 1    5   28   28 o  151.507   20.055   18.111   4.5364   16.299   6.2591   20.117   6.5842  141.236   29.886  157.715   28.315 -16.47913 41.16929 
1 1 1    5   28   29 o  108.256   27.899   9.5745   4.6518   9.8819   6.3118   9.2089   6.8825  110.837   33.981  108.733   35.742 2.104553 49.31707 
1 1 1    5   28   30 o  434.767   11.226  145.397   7.4705  135.433   11.947  151.795   9.5728  417.737   18.685  443.581   14.099 -25.84424 23.40750 
1 1 1    5   28   31 o  251.504   19.720   49.506   7.5304   0.0000   0.0000   49.506   7.5304  ?   ?   251.504   19.720 0.000000 19.71964 
1 1 1    5   28   32 o   88.765   34.640   4.2747   6.8002  -5.4531   11.596   9.3730   8.3951   87.046   39.622  111.787   39.424 -24.74055 55.89371 
1 1 1    5   28   33 o  186.580   26.392   28.042   7.3269   30.719   12.623   26.682   8.9979  187.982   44.550  179.100   34.068 8.881943 56.08316 
1 1 1    5   28   34 o   49.151   23.490  -6.4626   4.9738  -7.3121   6.9711  -5.5816   7.0988   60.617   28.631   64.431   29.928 -3.813606 41.41766 
1 1 1    5   28   35 o  227.592   16.553   40.437   5.7269   45.555   8.0181   35.107   8.1824  239.870   22.087  208.870   26.168 31.00076 34.24336 
1 1 1    5   28   36 o  316.841   13.423   77.627   6.5098   67.492   8.9766   88.871   9.4546  292.912   20.144  337.021   18.398 -44.10913 27.28127 
1 1 1    5   28   37 o  304.961   14.021   72.025   6.5446   77.189   9.4164   67.199   9.1026  313.322   19.735  291.956   20.499 21.36646 28.45546 
1 1 1    5   28   38 o  200.629   13.284   31.285   4.0563   32.553   4.6786   27.447   8.1399  204.228   15.073  182.099   30.266 22.12961 33.81220 
1 1 1    5   28   39 o  112.777   20.801   10.308   3.4583   12.832   3.8334  -0.7252   8.0160  126.213   20.550   78.877   34.603 47.33582 40.24579 
1 1 1    5   28   40 o  364.170   10.441  102.288   5.8198  104.709   6.1726   82.907   17.465  368.312   10.949  312.437   37.254 55.87515 38.82987 
1 1 1    5   28   41 o  320.296   20.437   81.284   9.9673   0.0000   0.0000   81.284   9.9673  ?   ?   320.296   20.437 0.000000 20.43745 
1 1 1    5   28   42 o   82.045   22.484   5.5329   2.9074   3.7392   3.7884   8.1030   4.5348   73.060   26.402   98.455   28.475 -25.39428 38.83163 
1 1 1    5   28   43 o  200.127   14.150   31.319   4.3066   36.052   4.8370   13.220   9.4585  214.571   14.819  123.473   41.926 91.09775 44.46753 
1 1 1    5   28   44 o  127.582   17.426   13.017   3.3140   13.567   4.6188   12.433   4.7577  127.841   24.496  121.603   26.325 6.237915 35.95885 
1 1 1    5   28   45 o   68.685   24.080   3.4859   3.1287   0.5173   4.4081   6.4996   4.4414   62.014   26.420   88.913   28.679 -26.89882 38.99372 
1 1 1    5   28   46 o  163.410   15.956   21.179   3.9399   17.806   5.4532   24.863   5.6987  145.866   25.345  174.685   21.787 -28.81927 33.42166 
1 1 1    5   28   47 o  161.691   16.177   20.810   3.9498   20.105   5.4181   21.610   5.7703  155.716   23.461  161.193   24.129 -5.477203 33.65464 
1 1 1    5   28   48 o  146.019   17.468   17.157   3.8267   14.400   5.4535   19.831   5.3708  128.663   28.448  154.299   23.482 -25.63672 36.88730 
1 1 1    5   28   49 o  163.808   19.562   21.876   4.8078   12.480   9.9321   24.752   5.4945  115.700   42.605  173.517   21.124 -57.81718 47.55428 
1 1 1    5   28   50 o  129.802   21.133   14.069   4.0541   23.465   6.4716   7.9999   5.2012  164.844   26.551   95.004   31.063 69.84013 40.86407 
1 1 1    5   28   51 o  182.180   25.828   28.688   7.0003   41.856   10.138   16.688   9.6780  214.634   31.823  126.248   42.412 88.38579 53.02311 
1 1 1    5   28   52 o   83.287   26.748   6.0856   3.8668   0.2935   5.3919   12.219   5.5483   64.499   28.336  114.216   30.961 -49.71700 41.97020 
1 1 1    5   29    0 f  283.431   19.510   62.502   8.3718   62.502   8.3718   62.502   8.3718  283.431   19.510  283.431   19.510 0.000000 0.000000 
1 1 1    5   29    1 o  360.021   11.896   99.384   6.5556  107.763   9.4180   91.509   9.1308  374.569   16.427  344.663   17.364 29.90616 23.90278 
1 1 1    5   29    2 o  176.080   20.397   24.175   5.3954   18.014   7.4274   31.058   7.8508  149.445   33.320  198.820   26.455 -49.37515 42.54481 
1 1 1    5   29    3 o  985.335   11.965  744.475   18.045  709.728   24.894  782.950   26.195  961.133   16.921  1009.49   16.953 -48.35577 23.95267 
1 1 1    5   29    4 o  561.915   10.851  242.037   9.3325  243.007   13.405  241.125   13.001  562.559   15.568  560.424   15.156 2.134521 21.72677 
1 1 1    5   29    5 o  835.547   11.238  535.238   14.373  539.378   20.565  531.284   20.096  838.010   16.033  831.744   15.785 6.265869 22.49948 
1 1 1    5   29    6 o  543.766   11.082  226.685   9.2235  206.867   12.897  247.431   13.196  518.934   16.237  567.669   15.187 -48.73511 22.23276 
1 1 1    5   29    7 o  370.188   12.373  105.112   7.0106   97.033   10.121  112.563   9.7200  354.684   18.709  382.743   16.592 -28.05927 25.00645 
1 1 1    5   29    8 o  662.549   11.139  336.575   11.296  368.558   16.707  309.641   15.331  692.671   15.758  634.895   15.776 57.77631 22.29814 
1 1 1    5   29    9 o  685.432   15.753  360.934   16.527  360.934   16.527   0.0000   0.0000  685.432   15.753  ?   ?  0.000000 15.75260 
1 1 1    5   29   10 o  186.835   28.912   27.679   8.0010   27.679   8.0010   0.0000   0.0000  186.835   28.912  ?   ?  0.000000 28.91157 
1 1 1    5   29   11 o  1191.22   13.121  1089.07   23.924  1089.07   23.924   0.0000   0.0000  1191.22   13.121  ?   ?  0.000000 13.12139 
1 1 1    5   29   12 o  398.480   10.096  121.734   6.1579  119.447   7.4251  126.774   11.021  394.552   12.295  405.906   17.739 -11.35364 21.58317 
1 1 1    5   29   13 o  803.269   9.2153  494.561   11.330  492.146   13.754  499.661   19.988  801.013   11.218  806.127   16.199 -5.113037 19.70390 
1 1 1    5   29   14 o  823.949   9.2751  520.399   11.697  519.721   14.285  521.778   20.377  823.086   11.339  823.700   16.162 -0.6131592 19.74335 
1 1 1    5   29   15 o  477.635   9.5870  174.908   7.0089  172.132   8.4809  180.891   12.449  473.622   11.699  484.842   16.774 -11.21988 20.45102 
1 1 1    5   29   16 o  101.821   28.893   8.2785   4.7118   6.3675   5.6488   12.649   8.5427   94.231   32.393  126.776   39.643 -32.54498 51.19479 
1 1 1    5   29   17 o  263.779   13.169   53.448   5.3169   52.224   6.4056   56.159   9.5338  260.003   16.176  268.322   23.449 -8.318756 28.48713 
1 1 1    5   29   18 o  302.047   12.225   70.057   5.6520   71.106   6.7534   67.603   10.327  304.091   14.509  294.573   23.088 9.518402 27.26843 
1 1 1    5   29   19 o  471.200   9.7767  170.307   7.0513  170.873   8.5759  169.126   12.389  471.729   11.877  468.441   17.278 3.287781 20.96692 
1 1 1    5   29   20 o  280.406   11.254   60.364   4.8301   60.152   6.6879   60.596   6.9832  279.062   15.721  279.985   16.366 -0.9236145 22.69390 
1 1 1    5   29   21 o  248.128   14.242   47.522   5.3862   47.989   6.5630   46.559   9.4270  248.842   17.339  243.274   25.706 5.567734 31.00724 
1 1 1    5   29   22 o  449.141   10.111  154.821   6.9509  146.962   8.3811  172.138   12.441  437.264   12.522  472.334   17.208 -35.06952 21.28229 
1 1 1    5   29   23 o  347.649   11.915   92.879   6.3401  108.516   11.491   86.035   7.6019  373.818   20.157  334.213   14.860 39.60541 25.04285 
1 1 1    5   29   24 o   97.163   27.019   7.6083   4.1641   7.9854   5.9126   7.2371   5.8655  101.796   33.112   98.265   33.017 3.530708 46.76036 
1 1 1    5   29   25 o  313.315   10.677   75.409   5.1201   72.554   7.0554   78.585   7.4420  306.767   15.026  319.230   15.231 -12.46298 21.39504 
1 1 1    5   29   26 o  457.844   9.1134  160.889   6.3866  160.233   8.9787  161.561   9.0862  456.259   12.857  458.125   12.958 -1.865692 18.25380 
1 1 1    5   29   27 o  471.488   9.1653  170.660   6.6143  169.523   9.3172  171.814   9.3915  469.185   12.974  472.341   12.990 -3.155487 18.35922 
1 1 1    5   29   28 o  172.272   20.622   23.405   5.3295   31.830   9.0448   18.925   6.5962  198.177   30.819  152.323   29.356 45.85344 42.56308 
1 1 1    5   29   29 o  522.422   10.338  209.812   8.2667  209.314   13.554  210.107   10.432  519.811   17.035  522.095   13.054 -2.284546 21.46123 
1 1 1    5   29   30 o   88.159   29.295   5.9265   4.6190   7.0465   6.4225   4.7265   6.6478   98.131   34.495   89.842   34.469 8.288841 48.76435 
1 1 1    5   29   31 o  496.537   10.705  189.726   8.1359  191.622   10.219  186.444   13.445  498.240   13.400  489.808   17.934 8.431702 22.38728 
1 1 1    5   29   32 o   64.525   27.722  -0.0419   4.9271  -1.1635   6.8839   1.1362   7.0551   72.822   32.004   79.826   33.690 -7.003227 46.46778 
1 1 1    5   29   33 o   98.704   42.883   0.3158   12.054   0.3158   12.054   0.0000   0.0000   98.704   42.883  ?   ?  0.000000 42.88301 
1 1 1    5   29   34 o  123.071   33.993   12.733   6.6152   40.018   13.875   4.7057   7.5256  214.574   43.730   92.470   36.337 122.1034 56.85739 
1 1 1    5   29   35 o  178.429   25.576   25.745   6.7852   7.3062   13.132   32.460   7.9250  116.389   47.231  200.354   26.492 -83.96473 54.15306 
1 1 1    5   29   36 o  218.578   18.006   37.527   5.9706   38.566   8.3289   36.429   8.5634  218.937   25.322  212.014   27.001 6.923141 37.01673 
1 1 1    5   29   37 o  260.311   15.705   52.868   6.2281   51.130   8.8016   54.611   8.8142  253.262   22.954  262.144   22.175 -8.881409 31.91619 
1 1 1    5   29   38 o  171.345   30.997   24.531   7.8303   26.535   8.9366   17.910   16.247  176.845   34.252  145.371   54.305 31.47394 64.20464 
1 1 1    5   29   39 o  165.867   15.809   21.617   3.9650   21.203   4.4865   23.096   8.4739  163.561   18.231  164.130   34.810 -0.5690002 39.29496 
1 1 1    5   29   40 o  145.673   18.052   16.874   3.9389   20.127   4.4843   5.8899   8.2405  159.043   18.784   97.320   38.089 61.72392 42.46899 
1 1 1    5   29   41 o  327.894   8.5615   82.765   4.2969   76.296   5.8333   90.438   6.3533  313.896   12.141  341.751   12.146 -27.85489 17.17335 
1 1 1    5   29   42 o  229.271   10.275   40.592   3.6059   40.966   4.9651   40.175   5.2454  228.966   14.238  226.402   15.225 2.563828 20.84521 
1 1 1    5   29   43 o  114.967   18.375   10.662   3.1245   12.291   4.3474   8.9205   4.4937  121.633   24.203  102.590   27.886 19.04311 36.92439 
1 1 1    5   29   44 o  171.452   13.271   23.021   3.4557   22.873   4.7999   23.181   4.9791  168.966   18.882  169.864   19.504 -0.8980255 27.14687 
1 1 1    5   29   45 o  171.914   15.261   23.358   3.9740   27.621   5.6189   19.092   5.6214  184.980   20.172  151.206   25.174 33.77428 32.25909 
1 1 1    5   29   46 o   79.311   25.481   5.1505   3.5087   5.3951   5.0367   4.9198   4.8907   83.998   30.429   81.441   29.911 2.556725 42.66847 
1 1 1    5   29   48 o  146.608   21.996   17.856   4.7837   15.657   10.027   18.505   5.4430  126.098   43.167  147.698   24.966 -21.59956 49.86655 
1 1 1    5   29   49 o  206.652   23.371   35.795   7.2625   25.231   10.773   44.595   9.8326  156.553   43.433  225.767   29.134 -69.21312 52.29871 
1 1 1    5   29   50 o  229.467   16.444   42.361   5.7375   28.025   9.9154   49.577   7.0348  168.027   39.260  246.537   18.784 -78.50980 43.52250 
1 1 1    5   29   51 o   78.952   26.624   5.3216   3.8139   6.2852   5.5264   4.4453   5.2699   86.104   31.769   78.027   30.482 8.077705 44.02708 
1 1 1    5   30    0 o  500.055   15.404  192.279   11.765  192.279   11.765  192.279   11.765  500.055   15.404  500.055   15.404 0.000000 0.000000 
1 1 1    5   30    1 o   73.699   29.465   2.1095   5.0291   2.3774   7.1017   1.8400   7.1227   85.417   34.707   83.874   34.496 1.542427 48.93388 
1 1 1    5   30    2 o  279.164   14.046   59.984   5.9828   63.594   8.4623   56.375   8.4596  286.744   19.395  269.704   20.649 17.04068 28.32936 
1 1 1    5   30    3 o  732.906   15.911  412.792   17.849  412.792   17.849   0.0000   0.0000  732.906   15.911  ?   ?  0.000000 15.91086 
1 1 1    5   30    4 o  698.004   15.712  374.393   16.786  374.393   16.786   0.0000   0.0000  698.004   15.712  ?   ?  0.000000 15.71180 
1 1 1    5   30    5 o  586.219   15.679  264.089   14.069  264.089   14.069   0.0000   0.0000  586.219   15.679  ?   ?  0.000000 15.67914 
1 1 1    5   30    6 o  940.207   16.804  679.799   24.183  679.799   24.183   0.0000   0.0000  940.207   16.804  ?   ?  0.000000 16.80448 
1 1 1    5   30    7 o  897.969   16.482  620.035   22.654  620.035   22.654   0.0000   0.0000  897.969   16.482  ?   ?  0.000000 16.48220 
1 1 1    5   30    8 o  377.077   12.451  109.119   7.1861  109.457   10.292  108.798   10.038  377.112   17.830  376.021   17.441 1.090790 24.94198 
1 1 1    5   30    9 o  352.839   12.893   95.569   6.9630   77.241   9.5855  116.045   10.132  315.927   19.925  388.363   17.044 -72.43576 26.21987 
1 1 1    5   30   10 o  424.427   11.964  138.236   7.7722  125.833   10.863  151.244   11.125  404.310   17.553  443.423   16.391 -39.11282 24.01637 
1 1 1    5   30   11 o  650.282   11.120  324.408   11.068  327.241   15.815  321.688   15.494  652.307   15.840  646.786   15.651 5.520691 22.26803 
1 1 1    5   30   12 o  678.612   9.1273  353.033   9.4806  341.772   11.443  377.687   16.931  667.417   11.201  700.734   15.786 -33.31714 19.35588 
1 1 1    5   30   13 o  286.215   11.880   62.880   5.2046   56.077   6.3511   76.789   9.0813  269.577   15.457  315.022   18.922 -45.44501 24.43217 
1 1 1    5   30   14 o  652.015   9.1820  325.952   9.1636  340.506   11.474  300.324   15.226  666.106   11.254  624.708   15.924 41.39795 19.49912 
1 1 1    5   30   15 o  372.788   10.634  106.630   6.0677  106.866   7.4464  106.163   10.467  372.959   13.044  371.018   18.432 1.941345 22.58091 
1 1 1    5   30   16 f  294.766   12.331   66.735   5.5636   66.592   6.8483   67.011   9.5416  293.779   15.282  293.570   21.381 0.2089844 26.28137 
1 1 1    5   30   17 o  620.896   9.3885  295.678   8.9225  289.275   10.764  309.735   15.950  613.813   11.457  634.070   16.435 -20.25781 20.03409 
1 1 1    5   30   18 o  108.425   24.838   9.4959   4.0335   11.467   5.6158   7.3952   5.7970  118.770   30.676   99.084   32.814 19.68674 44.91940 
1 1 1    5   30   19 o  675.732   8.1649  350.080   8.4449  364.466   12.067  336.273   11.822  688.880   11.445  661.654   11.673 27.22668 16.34773 
1 1 1    5   30   20 o  392.522   9.4482  118.212   5.6765  106.127   7.9648  130.688   8.0923  371.357   14.013  412.278   12.824 -40.92169 18.99469 
1 1 1    5   30   21 o  188.718   18.493   27.789   5.2731   26.936   9.3167   28.191   6.3962  181.604   34.784  189.229   22.526 -7.624619 41.44057 
1 1 1    5   30   22 o  581.182   8.4946  259.086   7.5566  253.076   10.548  265.422   10.831  573.755   12.011  587.577   12.043 -13.82159 17.00853 
1 1 1    5   30   23 o  225.789   15.289   39.493   5.2528   37.511   6.5425   43.086   8.8111  219.140   19.716  233.622   25.030 -14.48239 31.86275 
1 1 1    5   30   24 o  299.537   12.623   69.048   5.7874   79.200   7.3820   52.855   9.3228  320.430   15.051  259.238   23.759 61.19241 28.12560 
1 1 1    5   30   25 o   92.600   27.925   6.8240   4.2871   6.8411   5.9837   6.8061   6.1452   96.502   33.330   96.799   33.757 -0.2973785 47.43924 
1 1 1    5   30   26 o  160.337   21.167   20.347   5.0678   14.870   8.2660   23.645   6.4149  133.754   38.375  171.993   25.107 -38.23837 45.85861 
1 1 1    5   30   27 o   63.422   27.398  -0.3366   4.8651  -3.1105   7.7553   1.4634   6.2472   73.415   33.007   77.135   32.067 -3.719353 46.01914 
1 1 1    5   30   28 o  372.472   10.559  106.701   6.0198  126.834   8.8815   89.592   8.1873  405.260   14.318  340.290   15.719 64.96924 21.26239 
1 1 1    5   30   29 o  385.700   19.782  116.233   11.639   0.0000   0.0000  116.233   11.639  ?   ?   385.700   19.782 0.000000 19.78240 
1 1 1    5   30   30 f  244.807   15.581   46.598   5.8080   46.195   7.3740   47.256   9.4262  242.504   20.046  243.322   25.698 -0.8174744 32.59219 
1 1 1    5   30   31 o  107.880   28.940   9.6121   4.8776   7.9690   6.9653   11.193   6.8326  102.867   35.936  116.382   35.289 -13.51484 50.36556 
1 1 1    5   30   32 o  131.879   26.607   14.265   5.1856   19.461   7.1582   8.5269   7.5224  152.911   31.628  106.163   37.331 46.74828 48.92741 
1 1 1    5   30   33 o  285.882   14.084   63.253   6.1627   66.994   8.8342   59.707   8.6012  291.972   19.886  275.313   20.559 16.65884 28.60305 
1 1 1    5   30   34 o  165.499   22.626   21.956   5.5814   29.777   7.8532   13.974   7.9341  191.279   27.624  128.200   37.834 63.07835 46.84533 
1 1 1    5   30   35 o  261.485   15.753   53.322   6.2753   60.139   9.4436   47.931   8.3975  275.119   22.626  245.433   22.608 29.68559 31.98534 
1 1 1    5   30   36 o  323.867   23.691   83.613   11.663   75.067   15.913   93.532   17.143  299.592   35.385  335.943   33.798 -36.35074 48.93232 
1 1 1    5   30   37 o  294.691   25.646   69.929   11.453   56.253   15.688   85.533   16.757  254.033   41.802  319.782   34.797 -65.74907 54.38987 
1 1 1    5   30   38 o  239.184   21.312   45.546   7.7204   29.675   15.184   51.081   8.9660  176.722   52.387  252.386   23.479 -75.66376 57.40769 
1 1 1    5   30   39 o  280.502   15.981   61.579   6.8329   63.866   9.9577   59.544   9.3935  282.258   23.255  272.773   22.705 9.484711 32.50108 
1 1 1    5   30   40 o  320.400   14.744   79.942   7.2305   78.273   10.358   81.527   10.098  313.222   21.740  320.294   20.708 -7.071747 30.02406 
1 1 1    5   30   41 o  149.467   17.924   17.800   4.0188   21.332   4.5147   4.3191   8.8200  163.660   18.338   93.814   38.462 69.84673 42.60969 
1 1 1    5   30   42 o  228.343   10.638   40.323   3.7181   45.143   5.2225   35.370   5.2947  240.210   14.268  211.739   16.466 28.47104 21.78831 
1 1 1    5   30   43 o  151.226   15.293   18.082   3.4912   15.351   5.0503   20.582   4.8316  135.518   25.277  159.630   20.229 -24.11240 32.37466 
1 1 1    5   30   44 o  193.303   13.375   29.289   3.9329   30.872   5.5220   27.660   5.6028  196.370   18.593  185.105   20.098 11.26500 27.37961 
1 1 1    5   30   45 o  184.386   13.334   26.694   3.7377   29.569   5.3604   23.973   5.2145  191.958   18.472  171.892   20.205 20.06645 27.37624 
1 1 1    5   30   46 o  321.919   12.109   80.785   5.9666   53.527   10.687   93.128   7.1917  250.915   28.323  344.801   13.627 -93.88618 31.43049 
1 1 1    5   30   47 o   56.046   24.710  -0.5056   4.1337   2.2365   9.5110  -1.1442   4.5899   87.263   38.002   57.080   25.547 30.18322 45.79068 
1 1 1    5   30   48 o  146.057   31.539   19.365   6.8446   20.246   10.019   18.594   9.3730  140.326   42.772  135.589   41.381 4.736893 59.51331 
1 1 1    5   30   49 o  313.144   12.904   77.200   6.1849   89.453   7.8537   57.194   10.036  335.178   15.308  258.181   25.738 76.99692 29.94681 
1 1 1    5   30   50 o   93.742   34.171   7.8856   6.3660   4.9343   9.3179   10.469   8.7177   89.862   38.352  104.444   39.614 -14.58199 55.13703 
1 1 1    5   31    1 o  461.721   16.845  164.044   11.905   0.0000   0.0000  164.044   11.905  ?   ?   461.721   16.845 0.000000 16.84497 
1 1 1    5   31    2 o  423.560   17.024  138.068   11.037   0.0000   0.0000  138.068   11.037  ?   ?   423.560   17.024 0.000000 17.02432 
1 1 1    5   31    3 o  160.231   22.915   20.238   5.4600   16.931   7.5528   23.858   7.9023  144.255   34.642  172.449   31.081 -28.19402 46.54200 
1 1 1    5   31    4 o  374.116   12.585  107.449   7.2064  113.692   10.426  101.739   9.9717  384.244   17.728  363.460   17.924 20.78391 25.21013 
1 1 1    5   31    5 o  352.346   12.924   95.329   6.9703   94.869   9.7457   95.810   9.9732  350.455   18.231  352.133   18.569 -1.678070 26.02298 
1 1 1    5   31    6 o  923.798   11.797  654.964   16.681  622.106   22.883  692.222   24.367  899.080   16.628  948.343   16.787 -49.26367 23.62794 
1 1 1    5   31    7 o  718.357   11.166  395.947   12.278  385.593   17.445  406.110   17.283  707.921   16.100  726.643   15.539 -18.72247 22.37577 
1 1 1    5   31    8 o  249.168   15.763   47.951   5.9806   44.677   8.5584   51.077   8.3608  239.069   23.701  256.213   21.519 -17.14383 32.01217 
1 1 1    5   31    9 o  865.929   11.661  575.544   15.455  562.342   21.688  589.165   22.030  854.662   16.579  874.847   16.452 -20.18518 23.35640 
1 1 1    5   31   10 o  455.371   11.969  159.202   8.3422  150.585   11.677  168.185   11.922  442.120   17.255  467.345   16.667 -25.22559 23.99001 
1 1 1    5   31   11 o  707.659   11.375  384.386   12.321  389.640   17.815  379.569   17.059  711.360   16.362  702.234   15.871 9.126892 22.79440 
1 1 1    5   31   12 o  574.874   11.309  253.680   9.9506  246.772   14.015  260.701   14.130  566.109   16.174  581.934   15.863 -15.82538 22.65534 
1 1 1    5   31   13 o  509.672   9.5968  199.245   7.4867  196.947   9.1646  203.855   12.980  506.432   11.823  514.420   16.485 -7.987976 20.28661 
1 1 1    5   31   14 o  635.937   9.3219  310.177   9.0738  299.672   10.904  333.829   16.362  624.739   11.403  658.286   16.238 -33.54749 19.84228 
1 1 1    5   31   15 o  429.791   10.113  141.744   6.6531  134.329   7.9915  158.491   12.010  418.108   12.487  453.316   17.309 -35.20856 21.34295 
1 1 1    5   31   16 o  502.504   9.8197  193.753   7.5528  193.314   9.2510  194.632   13.080  501.605   12.049  502.338   17.011 -0.7330933 20.84631 
1 1 1    5   31   17 o  807.851   9.6057  500.756   11.878  492.697   14.337  518.390   21.207  800.824   11.697  819.733   16.902 -18.90930 20.55467 
1 1 1    5   31   18 f  147.014   22.724   17.166   4.9485   10.259   8.7791   20.382   5.9909  117.309   40.380  159.848   25.330 -42.53883 47.66738 
1 1 1    5   31   19 o  370.559   11.082  105.484   6.2858  100.610   10.965  107.871   7.6715  359.843   19.986  374.405   13.387 -14.56137 24.05517 
1 1 1    5   31   20 o  455.319   8.8817  159.063   6.1899  154.220   8.7268  163.967   8.7811  447.736   12.734  461.726   12.425 -13.98944 17.79128 
1 1 1    5   31   21 o  644.237   8.3109  318.376   8.1952  335.884   11.817  302.152   11.375  660.966   11.680  626.855   11.856 34.11072 16.64294 
1 1 1    5   31   22 o  274.708   11.551   58.027   4.8569   52.682   6.7837   63.649   6.9570  260.477   17.110  286.671   15.918 -26.19434 23.36935 
1 1 1    5   31   23 o  193.472   17.038   29.174   4.9942   23.331   8.2782   32.518   6.2621  168.494   33.279  203.587   20.369 -35.09258 39.01774 
1 1 1    5   31   24 o  131.859   25.668   14.088   4.9942   8.7255   7.9707   17.554   6.4080  109.008   38.417  146.517   29.593 -37.50907 48.49340 
1 1 1    5   31   25 o  147.794   23.345   17.482   5.1056   16.470   6.5050   19.106   8.2394  141.364   30.924  151.111   36.115 -9.746140 47.54530 
1 1 1    5   31   26 o  373.725   11.826  107.552   6.7650  103.241   8.3223  115.951   11.615  365.504   14.876  385.450   19.753 -19.94656 24.72821 
1 1 1    5   31   27 o  142.441   24.410   16.369   5.1305   21.416   6.4356   7.5679   8.4985  162.661   26.781  105.721   39.318 56.94005 47.57235 
1 1 1    5   31   28 o  320.493   13.104   79.269   6.4283   80.551   8.0957   77.081   10.575  321.891   16.487  312.878   22.227 9.013489 27.67397 
1 1 1    5   31   29 o  217.267   15.685   36.760   5.1810   39.501   7.4111   34.141   7.2459  223.476   21.950  207.199   23.248 16.27672 31.97282 
1 1 1    5   31   30 o  495.587   9.8337  188.924   7.4594  201.752   10.714  176.858   10.391  510.917   13.701  478.186   14.197 32.73148 19.73019 
1 1 1    5   31   31 o  351.983   11.922   95.565   6.4233   97.331   8.9699   93.705   9.2023  353.937   16.557  347.035   17.324 6.902344 23.96405 
1 1 1    5   31   32 o  286.418   13.772   63.471   6.0378   65.363   8.3860   61.436   8.7001  288.626   19.090  279.260   20.497 9.366028 28.01005 
1 1 1    5   31   33 o   91.868   31.390   6.4557   5.3025   7.9897   7.5386   4.9537   7.4597  103.688   37.273   92.740   36.256 10.94849 51.99780 
1 1 1    5   31   34 o  231.410   16.974   41.943   5.9701   44.014   8.4997   39.925   8.3876  234.470   24.023  222.788   25.030 11.68140 34.69254 
1 1 1    5   31   35 o   71.328   31.348  -0.9184   6.6047  -3.2086   7.5698   6.3848   13.518   71.210   32.256  114.273   47.311 -43.06307 57.26081 
1 1 1    5   31   36 o  306.230   14.493   72.827   6.7932   72.550   9.6710   73.097   9.5443  302.578   21.012  303.901   20.641 -1.323700 29.45399 
1 1 1    5   31   37 o  283.611   18.688   63.390   8.0672   44.903   15.109   70.762   9.5411  222.861   45.823  298.599   21.010 -75.73828 50.40998 
1 1 1    5   31   38 o  209.527   24.785   35.602   7.7947   24.009   14.970   39.914   9.1300  159.183   52.732  220.546   27.654 -61.36273 59.54282 
1 1 1    5   31   39 o  409.232   15.678  130.756   9.8205  138.633   19.328  128.015   11.402  408.747   31.128  403.376   18.467 5.370300 36.19362 
1 1 1    5   31   40 o   79.272   32.869   2.3190   6.5390  -7.5617   9.7674   10.344   8.8027   73.372   34.415  112.423   40.292 -39.05100 52.98875 
1 1 1    5   31   41 o  222.409   13.627   38.659   4.6167   44.110   5.2931   21.323   9.4390  237.253   14.647  152.963   39.899 84.29039 42.50225 
1 1 1    5   31   42 o  276.425   12.587   59.427   5.3257   67.831   6.4618   41.630   9.4036  294.629   14.329  223.020   28.176 71.60913 31.61029 
1 1 1    5   31   43 o   53.938   22.786   0.5004   3.2322  -1.6541   4.4987   2.7992   4.6469   55.611   25.058   71.613   28.422 -16.00143 37.89067 
1 1 1    5   31   44 o  111.737   19.961   10.264   3.2886   12.726   4.6792   7.8615   4.6228  122.272   25.812   95.690   29.029 26.58186 38.84571 
1 1 1    5   31   45 o  115.415   25.395   11.395   4.3645   0.8997   9.7553   14.021   4.8802   86.008   37.938  128.157   25.772 -42.14865 45.86325 
1 1 1    5   31   46 o   53.470   22.850   0.3502   3.3157   3.0555   4.7503  -2.2200   4.6301   72.170   28.707   54.409   24.870 17.76136 37.98201 
1 1 1    5   31   47 o   93.275   24.233   7.5374   3.4910   10.851   5.0248   4.4453   4.8536  109.791   29.340   77.839   29.550 31.95168 41.64144 
1 1 1    5   31   48 o  140.945   22.392   16.813   4.6692  -5.4812   9.3627   24.193   5.3869   70.978   33.419  170.363   21.110 -99.38418 39.52829 
1 1 1    5   31   49 o  153.720   17.378   19.297   4.0170   15.055   5.4797   24.224   5.9059  128.953   28.519  168.308   23.572 -39.35536 36.99957 
1 1 1    5   32    0 f   39.678   28.210 -10.0704   7.3716 -10.0704   7.3716 -10.0704   7.3716   39.678   28.210   39.678   28.210 0.000000 0.000000 
1 1 1    5   32    1 o  381.884   12.529  112.004   7.3235  127.433   10.896   99.292   9.8906  406.656   17.506  358.430   18.086 48.22580 25.17077 
1 1 1    5   32    2 o  470.861   11.582  170.192   8.3475  169.032   11.723  171.385   11.889  468.552   16.346  471.781   16.464 -3.229279 23.20039 
1 1 1    5   32    3 o  196.581   19.760   30.129   5.8652   43.623   8.9193   19.849   7.7853  235.789   25.099  156.218   33.560 79.57161 41.90758 
1 1 1    5   32    4 o  282.037   15.158   61.371   6.5197   60.008   9.1379   62.785   9.3050  277.711   21.669  284.121   21.557 -6.410492 30.56545 
1 1 1    5   32    5 o  135.807   27.118   14.844   5.4397   13.844   7.7548   15.811   7.6326  130.659   37.063  139.089   35.678 -8.430008 51.44532 
1 1 1    5   32    6 o  790.674   11.474  479.928   13.886  478.203   19.823  481.591   19.458  787.974   16.435  790.869   16.074 -2.895203 22.98869 
1 1 1    5   32    7 o  648.965   11.437  323.323   11.361  339.194   16.728  309.735   15.478  663.593   16.469  634.251   15.943 29.34204 22.92165 
1 1 1    5   32    8 o  658.464   11.295  332.851   11.384  328.370   16.388  337.029   15.825  652.898   16.399  661.648   15.626 -8.750000 22.65191 
1 1 1    5   32    9 o  339.224   13.584   88.471   7.0533   88.431   10.282   88.507   9.6935  337.679   19.982  338.076   18.807 -0.3973083 27.44081 
1 1 1    5   32   10 o  157.129   25.343   19.665   5.8877   27.661   8.4892   12.254   8.1729  185.543   30.984  124.256   38.763 61.28732 49.62433 
1 1 1    5   32   11 o  189.955   21.013   28.262   6.0072   31.971   8.8209   25.054   8.2036  200.075   29.706  176.171   31.583 23.90433 43.35806 
1 1 1    5   32   12 o  306.587   14.675   72.353   6.8864   68.385   9.9460   76.008   9.5442  296.191   22.097  312.837   20.037 -16.64612 29.82935 
1 1 1    5   32   13 f  199.848   20.187   31.215   6.0903   35.322   8.8494   27.519   8.3945  210.797   28.129  184.946   30.733 25.85146 41.66209 
1 1 1    5   32   14 o  326.270   11.402   81.774   5.6941   77.113   6.8753   91.951   10.160  316.513   14.192  344.249   19.361 -27.73538 24.00486 
1 1 1    5   32   15 o  209.572   19.810   34.296   6.2794   38.785   9.2723   30.494   8.5344  220.911   28.055  195.089   29.502 25.82257 40.71118 
1 1 1    5   32   16 o  620.710   11.811  296.130   11.221  283.195   15.781  309.359   15.959  605.606   17.024  633.144   16.468 -27.53827 23.68567 
1 1 1    5   32   17 o  333.599   14.558   85.749   7.4338   88.102   10.634   83.500   10.396  336.364   20.756  327.403   20.853 8.961731 29.42240 
1 1 1    5   32   18 o  110.459   28.845   9.9464   4.9298   0.8719   5.7999   33.571   9.3581   73.154   30.692  204.140   30.917 -130.9861 43.56489 
1 1 1    5   32   19 o  288.212   11.211   63.850   4.9457   68.084   6.9548   59.519   7.0343  296.657   15.369  277.049   16.666 19.60822 22.67065 
1 1 1    5   32   20 o  191.657   17.689   28.666   5.1306   24.592   8.6426   30.883   6.3755  172.990   33.852  198.146   21.359 -25.15652 40.02730 
1 1 1    5   32   21 o  414.358   10.769  131.982   6.8299  124.515   11.153  136.462   8.6392  400.832   18.179  420.820   13.412 -19.98865 22.59118 
1 1 1    5   32   22 o  305.972   12.765   72.116   5.9784   71.001   9.6797   72.803   7.6015  301.203   21.130  306.390   16.267 -5.186584 26.66613 
1 1 1    5   32   23 o  272.865   12.245   57.343   5.1140   61.804   7.2314   52.880   7.2333  282.007   16.830  260.418   18.262 21.58960 24.83438 
1 1 1    5   32   24 o   83.528   28.545   5.1552   4.3848   6.9821   6.2686   3.4050   6.1355   97.482   34.089   82.989   32.747 14.49330 47.26975 
1 1 1    5   32   25 o  269.809   14.419   56.409   5.9333   49.283   7.2852   70.446   10.225  250.941   19.111  299.093   22.500 -48.15208 29.52063 
1 1 1    5   32   26 o   59.265   26.553  -1.9498   4.9728   0.2579   6.2771  -5.6705   8.1489   73.404   31.406   70.227   32.425 3.176949 45.14146 
1 1 1    5   32   27 o  235.038   16.245   43.034   5.8085   39.743   7.2608   48.884   9.6802  224.367   21.402  247.369   25.953 -23.00197 33.63936 
1 1 1    5   32   28 o  319.343   13.534   78.792   6.6152   78.009   8.4438   80.036   10.644  316.287   17.510  318.708   21.954 -2.420776 28.08177 
1 1 1    5   32   29 o   90.335   32.403   5.8149   5.6941   8.4240   7.5453   2.3633   8.6785  105.760   37.367   90.167   37.667 15.59323 53.05704 
1 1 1    5   32   30 o  105.455   30.869   9.1730   5.3008   14.948   7.6673   3.8853   7.3365  132.580   36.587   89.027   35.590 43.55250 51.04215 
1 1 1    5   32   31 o   64.170   27.865  -0.4039   5.0847  -1.9105   7.1172   1.1668   7.2669   71.947   32.034   80.515   34.098 -8.568314 46.78489 
1 1 1    5   32   32 o   91.857   31.747   6.3980   5.4293   1.7587   7.4058   11.788   7.9828   82.669   34.683  119.050   38.454 -36.38096 51.78420 
1 1 1    5   32   33 o  378.818   14.202  111.264   8.2344  112.862   9.6578  107.010   15.759  380.637   16.577  363.483   28.555 17.15372 33.01775 
1 1 1    5   32   34 f   94.094   32.526   6.8082   5.6990   3.6302   8.2292   9.7370   7.9000   91.023   37.215  110.450   38.289 -19.42791 53.39470 
1 1 1    5   32   35 o  168.641   29.020   23.600   7.2206   33.675   14.300   20.153   8.3653  190.751   48.784  152.521   36.348 38.23047 60.83673 
1 1 1    5   32   36 o  180.576   22.697   26.268   6.1346   30.696   8.7930   22.070   8.5629  191.569   31.051  159.625   35.916 31.94406 47.47701 
1 1 1    5   32   37 o  171.355   24.530   23.935   6.2502   26.328   9.0862   21.787   8.6112  174.703   35.196  158.013   36.359 16.69037 50.60380 
1 1 1    5   32   38 o  249.073   17.699   48.951   6.7034   44.272   9.5337   53.526   9.4274  232.037   27.370  257.228   24.230 -25.19109 36.55405 
1 1 1    5   32   39 o  179.557   24.877   26.445   6.6535   31.405   9.8745   22.321   9.0045  190.092   35.235  158.256   37.709 31.83611 51.60921 
1 1 1    5   32   40 o  163.567   36.570   23.810   8.9259   0.0000   0.0000   23.810   8.9259  ?   ?   163.567   36.570 0.000000 36.57034 
1 1 1    5   32   41 o   84.925   36.669   1.4595   8.7051   0.0000   0.0000   1.4595   8.7051  ?   ?    84.925   36.669 0.000000 36.66865 
1 1 1    5   32   42 o   44.142   21.242  -5.8085   4.2277  -7.7454   4.6096   4.4489   10.608   43.629   21.271   97.524   41.243 -53.89507 46.40532 
1 1 1    5   32   43 f   69.678   26.734   3.0768   3.9992   4.9179   4.4901  -3.9891   8.7963   80.223   28.774   73.379   33.813 6.843750 44.39849 
1 1 1    5   32   44 o  230.696   15.127   42.112   5.3118   9.6582   10.014   54.818   6.2659  108.027   42.070  263.039   15.633 -155.0120 44.88042 
1 1 1    5   32   45 o  113.049   20.735   10.660   3.4558   5.9246   4.8318   15.619   4.9445   84.960   29.914  135.302   24.789 -50.34200 38.85061 
1 1 1    5   32   46 o   97.015   27.921   8.3571   4.3698  -3.2366   9.0861   11.846   4.9840   74.043   34.205  115.107   28.451 -41.06361 44.49129 
1 1 1    5   32   47 o  158.399   15.317   20.146   3.6671   20.788   5.2022   19.513   5.1701  157.029   22.268  151.615   23.001 5.413879 32.01392 
1 1 1    5   32   48 o   73.231   32.277   0.8339   7.0487  -3.6265   8.9438   8.1457   11.451   71.726   33.409  100.992   42.788 -29.26674 54.28598 
1 1 1    5   33    0 f  1429.84   20.962  1574.56   45.854  1574.56   45.854  1574.56   45.854  1429.84   20.962  1429.84   20.962 0.000000 0.000000 
1 1 1    5   33    1 o  1023.76   12.287  805.253   19.254  812.126   27.426  798.573   27.037  1026.07   17.463  1017.52   17.360 8.550598 24.62325 
1 1 1    5   33    2 o  787.301   11.407  475.983   13.746  461.356   19.111  491.661   19.786  773.802   16.136  798.797   16.183 -24.99463 22.85291 
1 1 1    5   33    3 o  235.536   16.800   42.984   6.0171   32.865   8.7805   51.943   8.2621  203.074   29.079  258.189   21.091 -55.11571 35.92198 
1 1 1    5   33    4 o  244.373   16.930   46.264   6.2936   46.559   9.0203   45.985   8.7854  243.549   24.531  242.151   24.020 1.397537 34.33287 
1 1 1    5   33    5 o  412.350   12.481  130.670   7.8776  127.245   11.202  134.021   11.080  405.997   18.027  416.796   17.368 -10.79916 25.03207 
1 1 1    5   33    6 o  538.101   11.695  222.420   9.6320  229.643   13.783  215.525   13.466  545.773   16.499  528.698   16.640 17.07507 23.43337 
1 1 1    5   33    7 o  400.126   12.649  123.067   7.7468  111.245   11.121  134.209   10.797  378.861   19.241  417.128   16.911 -38.26746 25.61649 
1 1 1    5   33    8 o  587.654   11.519  265.276   10.361  266.066   15.025  264.560   14.307  587.326   16.713  585.864   15.955 1.462402 23.10563 
1 1 1    5   33    9 o  287.752   15.120   63.956   6.6360   60.197   9.7065   67.255   9.0929  277.438   23.067  294.033   20.329 -16.59503 30.74606 
1 1 1    5   33   10 o  689.470   11.632  365.248   12.276  363.946   17.581  366.487   17.149  686.795   16.724  689.344   16.253 -2.548889 23.32063 
1 1 1    5   33   11 o  189.616   21.330   28.228   6.0833   21.825   8.5491   34.795   8.6579  162.932   35.301  209.129   27.732 -46.19658 44.89078 
1 1 1    5   33   12 o  468.773   12.159  168.944   8.7244  160.656   12.308  177.314   12.369  455.990   17.634  479.243   16.862 -23.25290 24.39841 
1 1 1    5   33   13 f  588.024   11.755  265.786   10.580  275.854   15.513  257.030   14.466  597.649   16.958  577.073   16.378 20.57526 23.57575 
1 1 1    5   33   14 o  446.670   12.678  153.495   8.6675  149.833   12.324  157.079   12.192  440.062   18.297  450.743   17.672 -10.68073 25.43766 
1 1 1    5   33   15 o  163.557   20.842   21.093   5.0991   20.439   6.2325   22.418   8.8678  159.571   26.444  164.579   36.187 -5.008453 44.81957 
1 1 1    5   33   16 o  336.986   12.186   87.363   6.2856   87.466   7.7833   87.170   10.658  336.715   15.102  334.297   20.934 2.418396 25.81290 
1 1 1    5   33   17 o  381.674   13.990  112.286   8.1727  111.433   11.302  113.221   11.832  378.448   19.578  381.231   20.350 -2.782990 28.23913 
1 1 1    5   33   18 o  496.931   12.296  190.074   9.3528  181.644   12.777  199.808   13.728  484.453   17.230  507.956   17.657 -23.50330 24.67109 
1 1 1    5   33   19 o  304.991   13.495   71.703   6.2999   73.482   7.7449   68.225   10.831  307.779   16.500  294.230   24.266 13.54892 29.34412 
1 1 1    5   33   20 o  404.637   9.7544  125.800   6.0413  135.310   8.7221  117.030   8.3759  418.874   13.604  389.456   14.051 29.41876 19.55754 
1 1 1    5   33   21 o  299.261   11.610   68.940   5.3179   78.200   7.7320   60.628   7.3256  317.920   15.889  279.156   17.229 38.76346 23.43717 
1 1 1    5   33   22 o  243.594   13.342   45.912   4.9557   39.890   6.9982   51.969   7.0188  225.287   20.520  258.135   17.874 -32.84819 27.21289 
1 1 1    5   33   23 o   85.545   30.417   5.1679   5.0074   10.332   6.3656  -3.2150   8.1102  112.407   34.057   74.837   33.689 37.57079 47.90432 
1 1 1    5   33   24 o  383.642   11.680  113.386   6.8589  112.691   8.5599  114.633   11.464  381.745   14.650  382.984   19.622 -1.239380 24.48750 
1 1 1    5   33   25 o  264.741   13.341   54.251   5.3885   61.607   7.8448   47.679   7.4144  280.796   18.354  246.439   19.824 34.35664 27.01538 
1 1 1    5   33   26 o  167.628   19.591   22.212   4.9317   14.173   6.8222   31.012   7.1374  129.866   33.943  196.988   24.179 -67.12209 41.67413 
1 1 1    5   33   27 o  187.203   18.797   27.591   5.3133   37.935   7.4978   17.157   7.5307  218.511   22.751  142.443   34.831 76.06787 41.60266 
1 1 1    5   33   28 o  364.466   11.588  102.428   6.4644   91.305   8.7950  115.498   9.5339  342.707   16.767  385.663   16.151 -42.95593 23.28002 
1 1 1    5   33   29 o  274.539   15.969   58.734   6.6813   68.503   8.5452   43.369   10.717  295.500   18.993  229.817   31.278 65.68323 36.59359 
1 1 1    5   33   30 f  257.567   21.167   52.480   8.2710   52.480   8.2710   0.0000   0.0000  257.567   21.167  ?   ?  0.000000 21.16681 
1 1 1    5   33   31 o  202.185   26.692   33.184   8.0585   33.184   8.0585   0.0000   0.0000  202.185   26.692  ?   ?  0.000000 26.69228 
1 1 1    5   33   32 o  265.844   15.821   55.174   6.4087   55.076   9.1453   55.269   8.9835  262.782   22.968  263.461   22.493 -0.6792603 32.14696 
1 1 1    5   33   33 o  151.553   32.207   19.443   7.2408   2.3971   14.486   25.121   8.3602  108.684   47.114  172.483   32.867 -63.79842 57.44513 
1 1 1    5   33   34 o  220.143   23.000   38.881   7.6357   33.995   15.017   40.585   8.8675  190.133   50.680  223.353   26.452 -33.21964 57.16795 
1 1 1    5   33   35 o  218.465   19.155   37.808   6.3405   30.660   8.9191   45.112   9.0154  191.045   31.606  235.915   25.365 -44.87003 40.52586 
1 1 1    5   33   36 o   61.800   28.188  -3.0366   5.9079  -4.4941   8.3886  -1.6022   8.3218   72.271   33.197   77.684   34.610 -5.412880 47.95742 
1 1 1    5   33   37 f  243.977   17.732   47.014   6.5764   50.946   9.5263   43.434   9.0899  250.188   25.221  230.267   26.260 19.92094 36.40961 
1 1 1    5   33   38 o  312.917   16.806   77.100   8.0198   86.173   13.193   71.783   10.100  324.028   26.842  298.775   22.246 25.25269 34.86190 
1 1 1    5   33   39 o  219.656   23.197   39.260   7.6811   52.658   12.703   31.538   9.6440  246.458   34.628  190.071   34.416 56.38686 48.82205 
1 1 1    5   33   40 o  179.572   27.102   27.063   7.2174   30.554   9.6299   22.588   10.902  185.806   35.148  153.462   44.084 32.34383 56.38028 
1 1 1    5   33   41 o   86.171   33.699   4.8669   6.4467   6.0353   9.3582   3.8116   8.8935   98.016   39.836   90.805   38.047 7.211067 55.08608 
1 1 1    5   33   42 o  184.617   30.249   29.497   8.2517   13.035   15.177   36.405   9.8317  123.391   50.505  203.626   32.648 -80.23475 60.13861 
1 1 1    5   33   43 o  138.533   23.591   16.129   4.8230   15.644   5.7049   17.342   9.0298  133.676   28.737  133.732   40.572 -0.5590820E-01 49.71835 
1 1 1    5   33   44 o  244.521   26.916   51.114   9.9071   0.0000   0.0000   51.114   9.9071  ?   ?   244.521   26.916 0.000000 26.91605 
1 1 1    5   33   45 o  217.535   11.817   37.140   3.9200   34.985   5.4083   39.527   5.6900  208.294   17.115  221.610   16.902 -13.31616 24.05390 
1 1 1    5   33   46 o  293.177   13.356   67.840   5.9936   48.430   9.8625   79.207   7.5471  234.969   27.972  315.006   15.653 -80.03665 32.05376 
1 1 1    5   34    0 o  611.406   15.741  287.712   14.709  287.712   14.709  287.712   14.709  611.406   15.741  611.406   15.741 0.000000 0.000000 
1 1 1    5   34    1 o  329.604   13.253   83.580   6.6863   82.013   9.4707   85.137   9.4410  325.039   19.120  331.295   18.694 -6.256683 26.74071 
1 1 1    5   34    2 o  490.964   9.7199  184.999   7.3044  184.793   8.9538  185.408   12.630  490.340   11.930  490.123   16.835 0.2175293 20.63366 
1 1 1    5   34    3 o  102.824   26.517   8.5711   4.2005   8.1779   5.0712   9.4304   7.4969  101.309   30.331  111.376   37.328 -10.06647 48.09761 
1 1 1    5   34    4 o  471.731   12.092  171.062   8.7308  173.267   12.610  169.032   12.101  473.642   17.393  467.938   16.895 5.703949 24.24780 
1 1 1    5   34    5 o  276.656   15.754   59.209   6.6437   49.270   9.2629   69.740   9.5341  250.305   24.491  299.157   20.954 -48.85130 32.23150 
1 1 1    5   34    6 o  571.647   11.732  251.161   10.265  243.760   14.395  258.819   14.643  561.923   16.736  579.084   16.520 -17.16083 23.51622 
1 1 1    5   34    7 o  441.785   12.569  150.115   8.4990  171.009   13.085  134.868   11.178  470.256   18.179  417.781   17.480 52.47433 25.21946 
1 1 1    5   34    8 o  349.869   13.577   94.236   7.2706   93.212   10.585   95.151   10.004  346.202   20.060  350.150   18.735 -3.947906 27.44825 
1 1 1    5   34    9 o  463.104   12.348  164.955   8.7531  158.303   12.486  171.385   12.275  452.396   18.031  470.987   17.027 -18.59134 24.79957 
1 1 1    5   34   10 o  529.498   12.130  215.630   9.8313  211.290   14.079  219.761   13.734  522.726   17.596  533.336   16.824 -10.61041 24.34543 
1 1 1    5   34   11 o  597.103   11.954  274.202   10.925  249.219   15.254  300.512   15.654  567.646   17.557  623.749   16.397 -56.10272 24.02277 
1 1 1    5   34   12 f  136.689   39.021   15.482   8.5674   0.0000   0.0000   15.482   8.5674  ?   ?   136.689   39.021 0.000000 39.02092 
1 1 1    5   34   13 o  145.475   38.540   17.675   8.7187   0.0000   0.0000   17.675   8.7187  ?   ?   145.475   38.540 0.000000 38.54037 
1 1 1    5   34   14 o  546.058   17.331  230.772   14.486   0.0000   0.0000  230.772   14.486  ?   ?   546.058   17.331 0.000000 17.33147 
1 1 1    5   34   15 o   96.773   30.772   7.3460   5.1272   3.2579   6.1708   16.461   9.2142   82.882   32.797  140.393   40.585 -57.51162 52.18079 
1 1 1    5   34   16 o  256.627   14.640   50.996   5.7268   54.248   7.1058   44.969   9.6734  264.017   17.686  237.529   27.091 26.48816 32.35332 
1 1 1    5   34   17 o  248.687   15.207   47.961   5.7609   45.291   7.0770   53.204   9.9184  240.651   19.377  259.084   25.335 -18.43338 31.89576 
1 1 1    5   34   18 o  203.600   17.977   32.406   5.5449   37.295   6.8892   23.416   9.3431  217.754   20.928  166.953   37.481 50.80112 42.92734 
1 1 1    5   34   19 o  235.659   16.225   43.199   5.8166   41.363   7.0834   47.001   10.192  229.501   20.376  242.159   28.015 -12.65833 34.64170 
1 1 1    5   34   20 o  253.036   15.515   49.725   5.9798   49.497   7.2065   50.230   10.715  251.585   18.851  250.111   28.498 1.473755 34.16868 
1 1 1    5   34   21 o  182.168   19.361   26.123   5.3156   26.392   6.5796   25.618   9.0197  181.712   24.262  175.308   34.842 6.404572 42.45700 
1 1 1    5   34   22 o  323.906   12.941   80.950   6.4160   84.607   7.9748   74.239   10.803  330.495   15.765  306.652   23.187 23.84268 28.03874 
1 1 1    5   34   23 o  510.317   9.5127  200.215   7.4304  204.100   10.489  196.302   10.527  514.120   13.329  504.096   13.644 10.02460 19.07406 
1 1 1    5   34   24 o  134.634   24.273   14.698   4.8180   15.608   6.7307   13.743   6.8996  136.478   32.657  127.842   34.472 8.635674 47.48505 
1 1 1    5   34   25 o  689.616   9.2005  365.631   9.7116  379.822   13.823  351.798   13.648  701.338   12.876  674.810   13.213 26.52783 18.44954 
1 1 1    5   34   26 o   65.932   27.970   0.4764   4.9033   1.0183   6.9921  -0.0479   6.8781   78.935   33.438   75.449   32.586 3.485275 46.69007 
1 1 1    5   34   27 o  310.663   12.880   74.576   6.1246   68.492   8.4037   81.469   8.9445  295.613   18.669  322.689   18.183 -27.07556 26.06063 
1 1 1    5   34   28 o  298.055   15.868   69.210   7.2132   70.617   8.4052   65.279   14.051  300.179   18.382  281.224   33.288 18.95502 38.02649 
1 1 1    5   34   29 f  336.164   14.820   87.685   7.6253   85.502   8.9805   93.325   14.436  330.498   17.818  339.912   27.995 -9.413483 33.18455 
1 1 1    5   34   30 o   98.435   31.838   7.8128   5.4709   8.1142   7.7227   7.5092   7.7514  104.211   37.690  102.084   37.631 2.126228 53.26044 
1 1 1    5   34   31 o   96.078   33.922   6.9849   6.2171   6.8362   7.8977   7.2272   10.081   99.944   37.753  107.100   42.067 -7.155876 56.52334 
1 1 1    5   34   32 o  165.938   35.185   23.628   8.6593   38.569   14.373   15.115   10.849  205.906   46.680  132.402   44.903 73.50452 64.77131 
1 1 1    5   34   33 o  371.244   14.586  107.150   8.2884  121.355   10.685   85.692   13.133  393.619   17.735  325.229   26.615 68.38956 31.98255 
1 1 1    5   34   34 o  112.016   33.148   10.685   6.0833   12.951   8.8737   8.6759   8.3557  122.697   40.596  106.587   39.104 16.11021 56.36653 
1 1 1    5   34   35 o  301.319   15.480   71.052   7.1154   64.796   10.154   77.088   9.9739  283.600   23.606  311.017   21.076 -27.41705 31.64524 
1 1 1    5   34   36 o  242.085   18.305   46.433   6.7327   45.543   9.6883   47.265   9.3629  234.877   27.467  240.290   25.864 -5.412827 37.72832 
1 1 1    5   34   37 o   98.606   35.281   7.6966   6.7468   4.5656   10.991   9.5899   8.5466  100.310   42.176  108.743   39.601 -8.433548 57.85379 
1 1 1    5   34   38 f   78.618   32.125   2.8727   6.1278   6.4617   8.9294  -0.3220   8.4247   98.948   39.359   79.803   35.225 19.14581 52.81953 
1 1 1    5   34   39 o  240.160   20.964   46.564   7.6291   51.063   10.213   40.884   11.475  247.146   27.463  214.428   36.255 32.71831 45.48201 
1 1 1    5   34   40 o  123.478   33.704   13.673   6.5483   16.659   9.3763   10.830   9.1492  132.674   41.540  111.921   40.940 20.75334 58.32360 
1 1 1    5   34   41 o  158.285   28.220   21.554   6.5863   10.560   9.5717   31.441   9.0769  110.534   41.605  188.659   32.613 -78.12431 52.86380 
1 1 1    5   34   42 o  214.893   20.944   37.800   6.8015   30.699   9.8293   44.323   9.4211  182.015   36.551  227.666   27.599 -45.65079 45.80071 
1 1 1    5   34   43 o  277.186   16.583   61.472   7.0035   66.557   10.212   56.955   9.6233  282.068   23.877  260.294   24.440 21.77411 34.16774 
1 1 1    5   34   44 o  321.150   14.952   81.860   7.3500   81.860   7.3500   0.0000   0.0000  321.150   14.952  ?   ?  0.000000 14.95237 
1 1 1    5   34   45 f  121.300   46.718   15.934   12.244   0.0000   0.0000   15.934   12.244  ?   ?   121.300   46.718 0.000000 46.71829 
1 1 1    5   35    0 o  716.864   16.198  395.663   17.752  395.663   17.752  395.663   17.752  716.864   16.198  716.864   16.198 0.000000 0.000000 
1 1 1    5   35    1 o  707.352   11.588  384.693   12.546  375.616   17.355  394.628   18.157  697.404   16.258  714.700   16.598 -17.29523 23.23418 
1 1 1    5   35    2 f  314.165   12.085   75.917   5.8114   72.384   7.0067   83.707   10.402  306.360   14.942  327.634   20.852 -21.27444 25.65264 
1 1 1    5   35    3 o  204.624   16.646   32.560   5.1684   31.790   6.3007   34.145   9.0366  201.290   20.748  206.250   29.462 -4.960236 36.03410 
1 1 1    5   35    4 o  438.585   16.985  148.703   11.402   0.0000   0.0000  148.703   11.402  ?   ?   438.585   16.985 0.000000 16.98499 
1 1 1    5   35    5 o  100.163   37.604   6.3114   7.8096   0.0000   0.0000   6.3114   7.8096  ?   ?   100.163   37.604 0.000000 37.60405 
1 1 1    5   35    6 o  666.679   16.400  343.429   16.736   0.0000   0.0000  343.429   16.736  ?   ?   666.679   16.400 0.000000 16.40040 
1 1 1    5   35    7 o  117.560   38.471   10.880   7.9771   0.0000   0.0000   10.880   7.9771  ?   ?   117.560   38.471 0.000000 38.47132 
1 1 1    5   35    8 o  733.485   16.908  416.086   18.983   0.0000   0.0000  416.086   18.983  ?   ?   733.485   16.908 0.000000 16.90827 
1 1 1    5   35    9 o  565.379   17.432  247.431   15.085   0.0000   0.0000  247.431   15.085  ?   ?   565.379   17.432 0.000000 17.43190 
1 1 1    5   35   11 o  353.570   14.758   96.495   7.9870  102.304   11.671   91.377   10.954  361.850   21.164  341.961   21.029 19.88940 29.83557 
1 1 1    5   35   12 o   77.704   31.779   2.0135   6.0027   3.9613   8.6851   0.2322   8.3057   95.558   38.538   83.948   36.028 11.61098 52.75608 
1 1 1    5   35   13 o  130.166   31.478   14.012   6.2029   6.1966   8.6309   22.362   8.9207  102.022   39.243  163.529   36.558 -61.50713 53.63314 
1 1 1    5   35   14 o  401.454   13.798  124.345   8.4786  113.504   11.899  135.527   12.084  381.194   20.468  417.641   18.904 -36.44711 27.86217 
1 1 1    5   35   15 o  515.656   13.052  205.021   10.301  188.608   14.309  222.678   14.842  492.549   18.980  535.566   18.105 -43.01724 26.23060 
1 1 1    5   35   16 o  554.523   10.252  236.445   8.7012  245.716   10.886  220.043   14.479  564.612   12.597  532.438   17.767 32.17474 21.77924 
1 1 1    5   35   17 o  221.382   17.136   38.233   5.7615   37.128   7.1721   40.244   9.6744  216.842   21.909  223.394   28.976 -6.551636 36.32645 
1 1 1    5   35   18 o  121.425   33.022   12.259   6.2994   12.259   6.2994   0.0000   0.0000  121.425   33.022  ?   ?  0.000000 33.02156 
1 1 1    5   35   19 o  506.758   13.122  198.169   10.178  198.169   10.178   0.0000   0.0000  506.758   13.122  ?   ?  0.000000 13.12191 
1 1 1    5   35   20 o  220.006   18.350   37.911   6.1229   36.191   7.2745   42.089   11.340  213.668   22.585  226.121   33.801 -12.45305 40.65224 
1 1 1    5   35   21 o  303.996   14.237   71.464   6.6247   72.096   8.0957   70.182   11.525  304.068   17.468  296.861   25.616 7.206970 31.00487 
1 1 1    5   35   22 o  396.233   10.675  120.880   6.4744  114.226   9.0799  127.762   9.2346  383.915   15.452  406.219   14.852 -22.30325 21.43219 
1 1 1    5   35   23 o  155.095   22.286   19.258   5.1385   17.144   7.0930   21.593   7.4543  142.851   33.089  161.318   31.319 -18.46753 45.56043 
1 1 1    5   35   24 o  197.135   17.446   30.477   5.2099   26.338   7.1819   35.073   7.5692  180.152   26.867  209.447   24.046 -29.29507 36.05646 
1 1 1    5   35   25 o  376.538   15.657  110.062   9.0238  110.062   9.0238   0.0000   0.0000  376.538   15.657  ?   ?  0.000000 15.65717 
1 1 1    5   35   26 f  233.762   19.382   43.042   6.8722   37.782   7.9869   58.041   13.487  217.071   24.465  264.532   34.102 -47.46103 41.97054 
1 1 1    5   35   27 o  192.520   23.414   29.726   6.7576   36.907   8.0177   12.113   12.557  214.181   24.923  126.601   47.652 87.57928 53.77652 
1 1 1    5   35   28 o  120.482   30.014   12.198   5.5144   11.848   7.8156   12.546   7.7817  118.877   38.012  121.716   37.800 -2.838287 53.60734 
1 1 1    5   35   29 o  236.337   17.194   43.819   6.1771   44.858   8.7691   42.797   8.7026  236.176   24.620  230.427   25.079 5.748856 35.14410 
1 1 1    5   35   30 o  202.840   23.875   33.142   7.2706   33.261   13.742   33.097   8.5679  190.612   47.321  200.533   28.735 -9.920624 55.36236 
1 1 1    5   35   31 o  101.813   38.820   7.0991   8.3999   7.0991   8.3999   0.0000   0.0000  101.813   38.820  ?   ?  0.000000 38.82047 
1 1 1    5   35   32 o  114.464   32.160   11.170   5.8678   7.1534   8.5729   14.711   8.0486  102.121   39.151  129.650   38.062 -27.52837 54.60371 
1 1 1    5   35   33 o  195.887   23.830   31.113   6.9978   28.416   8.9755   35.293   11.175  182.373   33.384  201.052   37.698 -18.67896 50.35467 
1 1 1    5   35   34 o  200.387   23.854   32.637   7.1726   36.262   9.3713   27.510   11.145  207.820   30.356  173.498   42.340 34.32289 52.09753 
1 1 1    5   35   35 o  412.678   15.817  133.374   9.9911  130.256   13.950  136.656   14.316  402.421   22.741  412.180   22.780 -9.758911 32.18823 
1 1 1    5   35   36 o   66.286   29.557  -1.3518   6.0828  -2.9400   8.6055   0.2340   8.5993   75.350   34.234   81.941   35.897 -6.591080 49.60353 
1 1 1    5   35   37 o  127.395   34.651   14.491   6.9357   18.568   9.1923   9.1029   10.568  141.332   40.444  109.743   43.081 31.58956 59.09068 
1 1 1    5   35   38 o   54.260   25.958  -7.2105   6.1077 -10.6772   8.5858  -3.6589   8.6903   62.580   30.154   73.844   33.872 -11.26414 45.34938 
1 1 1    5   35   39 o  160.397   27.772   21.963   6.5712   15.656   9.6539   27.409   8.9700  128.327   42.338  174.860   34.739 -46.53394 54.76582 
1 1 1    5   35   40 f  245.129   18.107   48.220   6.7456   51.211   9.6426   45.353   9.4401  246.885   25.903  231.189   27.197 15.69579 37.55856 
1 1 1    5   35   41 o  122.797   33.676   13.926   6.5194   18.493   9.4183   9.7249   9.0333  136.332   41.453  105.657   40.264 30.67510 57.78867 
1 1 1    5   35   42 o   94.378   33.583   7.7333   6.1049   14.960   8.9894   1.5471   8.3170  122.518   40.876   80.818   35.356 41.69916 54.04505 
1 1 1    5   35   43 o   72.251   31.978   0.2537   6.9893   0.8847   8.6055  -0.9694   11.981   79.749   35.381   86.664   39.759 -6.915314 53.22163 
1 1 1    5   36    0 o  907.556   17.397  634.812   24.147  634.812   24.147  634.812   24.147  907.556   17.397  907.556   17.397 0.000000 0.000000 
1 1 1    5   36    1 o  210.847   19.519   34.816   6.2280   29.590   8.4228   41.119   9.2507  191.301   29.731  227.038   27.159 -35.73672 40.26826 
1 1 1    5   36    2 o  684.574   9.6525  359.984   10.114  358.279   12.453  363.287   17.336  682.291   11.925  685.275   16.527 -2.983948 20.38025 
1 1 1    5   36    3 o  131.669   25.024   14.019   4.8589   13.153   5.9437   15.764   8.4365  126.281   30.983  137.389   38.549 -11.10826 49.45683 
1 1 1    5   36    4 o  167.798   25.353   22.558   6.3084   29.119   9.3935   17.167   8.5141  188.272   33.841  143.090   38.170 45.18156 51.01089 
1 1 1    5   36    5 f  446.823   13.230  153.881   9.0485  151.150   12.801  156.609   12.792  441.204   18.955  449.219   18.604 -8.014832 26.55980 
1 1 1    5   36    6 o  222.119   19.738   38.649   6.6407   30.738   9.5958   45.919   9.1995  193.555   33.609  240.567   25.366 -47.01170 42.10696 
1 1 1    5   36    7 o  345.791   14.462   92.305   7.6544   98.633   11.374   87.067   10.349  355.163   21.016  333.841   20.350 21.32205 29.25341 
1 1 1    5   36    8 o  548.667   12.299  231.857   10.329  251.666   15.845  217.219   13.621  569.490   18.178  529.612   16.802 39.87720 24.75388 
1 1 1    5   36    9 o  262.620   17.284   53.681   6.9091   41.825   9.8112   65.345   9.7310  228.171   28.730  288.364   22.218 -60.19250 36.31849 
1 1 1    5   36   10 f  524.146   12.550  211.698   10.068  202.820   14.341  220.325   14.138  511.065   18.334  533.075   17.327 -22.01007 25.22603 
1 1 1    5   36   11 o  225.829   20.092   40.023   6.8724   41.307   9.7551   38.757   9.6833  226.604   28.774  219.071   29.639 7.532166 41.30871 
1 1 1    5   36   12 o  344.276   15.424   91.680   8.1279   89.372   11.852   93.730   11.168  336.965   23.118  345.871   21.198 -8.905945 31.36571 
1 1 1    5   36   13 o  389.497   14.638  117.243   8.7271  111.998   12.607  122.068   12.093  377.834   21.893  395.275   20.053 -17.44049 29.68911 
1 1 1    5   36   14 o  274.035   17.785   58.551   7.4196   83.038   11.674   41.957   9.6101  324.396   23.675  228.473   28.071 95.92328 36.72184 
1 1 1    5   36   15 o  412.709   21.510  133.550   13.541  133.550   13.541   0.0000   0.0000  412.709   21.510  ?   ?  0.000000 21.51044 
1 1 1    5   36   16 o  153.555   42.464   20.273   10.316   20.273   10.316   0.0000   0.0000  153.555   42.464  ?   ?  0.000000 42.46366 
1 1 1    5   36   17 o  197.759   19.384   30.765   5.7920   32.330   7.1631   27.811   9.8438  201.469   23.681  181.876   36.627 19.59273 43.61555 
1 1 1    5   36   18 o  216.408   17.807   36.657   5.8461   44.136   7.2836   23.115   9.8012  236.847   20.287  164.350   39.460 72.49757 44.37000 
1 1 1    5   36   19 o  194.124   20.727   29.799   6.0635   24.978   7.1799   41.787   11.322  175.299   27.677  224.930   33.943 -49.63063 43.79692 
1 1 1    5   36   20 f  179.059   21.709   25.497   5.8283   31.871   7.1437   12.809   10.079  199.752   23.836  126.002   43.273 73.74974 49.40308 
1 1 1    5   36   21 o  270.588   15.724   56.988   6.4841   52.578   7.7910   66.926   11.696  258.587   19.835  288.940   26.750 -30.35318 33.30135 
1 1 1    5   36   22 o  193.788   20.639   29.746   6.0278   24.012   7.1723   43.538   11.123  171.275   28.350  229.812   32.529 -58.53731 43.14980 
1 1 1    5   36   23 o  221.574   18.580   38.589   6.2430   34.325   7.3694   49.430   11.749  207.176   23.664  245.114   32.087 -37.93811 39.86930 
1 1 1    5   36   24 o   99.163   33.034   7.7723   5.8719   5.9766   6.8096   12.979   11.595   94.138   35.159  127.798   46.188 -33.65945 58.04726 
1 1 1    5   36   25 o  206.418   17.581   33.472   5.5017   36.046   7.5725   30.593   8.0068  212.104   23.732  193.577   27.823 18.52730 36.56902 
1 1 1    5   36   26 o  274.170   14.778   58.510   6.1788   57.009   8.4446   60.240   9.0645  268.464   20.711  275.591   21.663 -7.127228 29.97036 
1 1 1    5   36   27 o   58.344   26.704  -3.1807   5.3611  -4.3248   7.3316  -1.8659   7.8595   67.649   31.060   75.523   33.642 -7.874428 45.78743 
1 1 1    5   36   28 o   74.566   32.142   0.2401   6.6658 -18.8514   12.127   8.5045   7.9791   70.967   34.578  105.880   38.308 -34.91248 51.60570 
1 1 1    5   36   29 f  226.361   18.086   40.391   6.2142   37.664   8.8925   42.995   8.6874  214.396   27.749  230.623   25.011 -16.22717 37.35723 
1 1 1    5   36   30 o   64.488   28.855  -1.8127   5.8515   0.2743   8.5051  -3.6885   8.0630   82.908   36.021   72.351   32.974 10.55697 48.83385 
1 1 1    5   36   31 o  127.359   30.629   13.838   5.8976   9.2755   8.3142   18.459   8.3671  108.429   39.124  144.601   37.491 -36.17223 54.18703 
1 1 1    5   36   32 o   99.768   34.739   7.9570   6.5065   12.282   10.324   5.1074   8.3801  120.937   43.604   94.646   37.966 26.29111 57.81611 
1 1 1    5   36   33 o  104.981   35.044   9.2304   6.6071   6.5345   10.368   11.074   8.5737  103.815   42.023  114.384   39.875 -10.56909 57.92987 
1 1 1    5   36   34 o   85.509   32.940   4.8007   6.0876   6.6379   8.5497   2.9116   8.6699   98.894   38.772   88.780   37.401 10.11445 53.87117 
1 1 1    5   36   35 o  298.355   16.819   70.326   7.6493   66.572   9.6894   76.535   12.462  286.934   22.236  303.957   27.069 -17.02209 35.03066 
1 1 1    5   36   36 o  104.379   35.200   9.3286   6.6669   7.6883   8.5532   11.868   10.642  101.360   39.045  117.467   43.937 -16.10696 58.77902 
1 1 1    5   36   37 o  206.431   23.280   35.027   7.2273   32.379   9.2778   39.115   11.526  192.273   32.696  207.661   37.649 -15.38824 49.86464 
1 1 1    5   36   38 o   89.536   33.539   6.1306   6.2056   9.6345   8.6809   2.4686   8.8745  106.425   39.707   86.525   37.190 19.89929 54.40363 
1 1 1    5   36   39 o   84.619   32.657   5.1391   5.9921   2.7168   8.6314   7.3926   8.3251   85.610   36.734   97.724   38.274 -12.11381 53.04982 
1 1 1    5   36   40 o  186.880   21.992   28.979   6.1703   26.948   8.8819   30.873   8.5782  170.412   35.216  186.128   31.216 -15.71535 47.05915 
1 1 1    5   36   41 o  132.833   30.843   16.053   6.1507   26.626   8.8427   6.1426   8.5610  168.237   35.457   92.991   37.982 75.24622 51.95994 
1 1 1    5   36   42 o   82.501   34.051   4.1047   6.9713   4.5306   8.6380   3.3091   11.806   88.256   37.264   93.224   41.396 -4.968262 55.69807 
1 1 1    5   37    0 o  109.859   46.829   13.581   8.0162   13.581   8.0162   13.581   8.0162  109.859   46.829  109.859   46.829 0.000000 0.000000 
1 1 1    5   37    1 o  528.130   12.211  214.866   9.8708  194.632   13.487  238.207   14.485  500.892   17.591  554.352   17.072 -53.45938 24.51324 
1 1 1    5   37    2 o  526.870   10.039  213.391   8.0962  218.010   10.058  204.890   13.645  531.937   12.354  514.013   17.343 17.92297 21.29270 
1 1 1    5   37    3 o  759.210   9.8533  443.025   11.450  439.035   14.024  451.003   19.830  754.947   12.137  762.800   16.984 -7.853210 20.87502 
1 1 1    5   37    4 o  367.435   14.045  104.232   7.8991  105.975   11.703  102.774   10.706  368.009   20.862  362.954   19.340 5.055267 28.44762 
1 1 1    5   37    5 o  551.859   12.548  234.719   10.600  230.584   15.348  238.490   14.656  544.783   18.406  554.541   17.267 -9.757996 25.23724 
1 1 1    5   37    6 o  383.091   14.067  113.319   8.2484  125.362   12.384  103.716   11.058  400.551   20.265  364.376   19.903 36.17526 28.40405 
1 1 1    5   37    7 o  370.274   14.658  105.952   8.3076  103.057   12.009  108.610   11.505  362.472   21.746  372.739   20.241 -10.26691 29.70832 
1 1 1    5   37    8 o  160.773   26.660   20.912   6.3306   31.698   9.7922   13.167   8.2980  196.051   33.856  126.232   39.006 69.81892 51.64927 
1 1 1    5   37    9 o  225.018   19.494   39.712   6.6478   45.900   10.095   34.973   8.8337  239.092   28.122  208.189   28.467 30.90329 40.01519 
1 1 1    5   37   10 o  647.232   12.546  322.974   12.429  399.804   19.746  272.560   15.995  717.334   17.984  592.451   17.639 124.8830 25.19072 
1 1 1    5   37   11 o  248.275   28.524   49.571   10.643   49.571   10.643   0.0000   0.0000  248.275   28.524  ?   ?  0.000000 28.52367 
1 1 1    5   37   12 o  429.618   20.273  144.091   13.331  144.091   13.331   0.0000   0.0000  429.618   20.273  ?   ?  0.000000 20.27295 
1 1 1    5   37   13 o  141.947   41.816   17.176   9.6996   17.176   9.6996   0.0000   0.0000  141.947   41.816  ?   ?  0.000000 41.81588 
1 1 1    5   37   14 o  441.854   14.038  150.908   9.4941  155.385   13.663  146.727   13.202  446.092   20.010  433.534   19.895 12.55771 28.21762 
1 1 1    5   37   15 o  153.939   30.127   19.557   6.8444   13.948   9.7761   24.950   9.5855  129.889   42.593  171.527   37.552 -41.63733 56.78278 
1 1 1    5   37   16 o  282.564   17.964   62.382   7.7291   63.764   11.161   61.109   10.714  282.538   26.103  276.780   25.579 5.757843 36.54666 
1 1 1    5   37   17 o  214.900   22.302   36.649   7.2292   35.256   10.296   38.004   10.152  206.159   33.802  215.113   31.792 -8.954300 46.40314 
1 1 1    5   37   18 o  225.097   17.266   39.637   5.9035   38.976   7.3229   40.865   9.9776  221.767   21.857  223.943   29.852 -2.176544 36.99836 
1 1 1    5   37   19 o  316.689   14.060   77.617   6.8154   79.714   8.2396   73.072   12.128  319.729   16.897  302.011   26.503 17.71835 31.43101 
1 1 1    5   37   20 o  346.718   13.495   92.980   7.1618  101.744   8.6916   74.446   12.640  362.022   15.685  304.193   27.442 57.82870 31.60864 
1 1 1    5   37   21 o  180.296   23.302   26.070   6.2800   21.718   7.3899   37.383   11.914  161.517   31.019  209.269   38.619 -47.75156 49.53378 
1 1 1    5   37   22 o  155.814   25.928   19.803   5.9663   21.246   7.1645   16.536   10.777  159.832   30.396  138.358   44.678 21.47345 54.03732 
1 1 1    5   37   23 o  288.110   13.512   64.267   5.9587   59.891   8.2177   69.119   8.6527  275.739   19.598  296.491   19.169 -20.75223 27.41449 
1 1 1    5   37   24 o  221.407   17.103   38.453   5.7512   38.719   7.8727   38.149   8.4218  219.729   23.788  217.218   25.837 2.511017 35.11995 
1 1 1    5   37   25 o  220.364   18.220   38.244   6.0903   34.512   8.5869   42.021   8.6393  205.345   28.054  228.262   25.144 -22.91705 37.67303 
1 1 1    5   37   26 o  249.729   19.596   49.296   7.4302   35.218   12.930   56.237   9.0790  198.560   43.725  265.498   22.555 -66.93835 49.19993 
1 1 1    5   37   27 o  207.353   19.342   34.081   6.0680   30.177   8.4407   38.256   8.7294  190.528   29.930  216.466   26.929 -25.93765 40.26120 
1 1 1    5   37   28 o  162.163   24.888   21.498   5.9801   27.614   8.4978   15.497   8.4172  180.904   31.853  132.759   38.909 48.14508 50.28452 
1 1 1    5   37   29 o  255.218   16.779   51.195   6.5181   56.780   9.4385   46.102   9.0122  265.606   23.458  238.303   25.084 27.30208 34.34341 
1 1 1    5   37   30 o  119.128   34.665   12.323   6.7025   8.6163   10.484   14.885   8.7162  110.257   43.016  129.381   39.976 -19.12363 58.72332 
1 1 1    5   37   31 o  264.952   18.101   55.564   7.2966   42.889   11.502   64.102   9.4392  222.904   34.852  282.489   22.004 -59.58533 41.21741 
1 1 1    5   37   32 o  207.284   20.423   34.505   6.3955   30.993   9.0784   37.964   9.0111  189.877   32.400  213.134   28.323 -23.25697 43.03422 
1 1 1    5   37   33 o  117.615   40.361   12.180   8.7676   0.0000   0.0000   12.180   8.7676  ?   ?   117.615   40.361 0.000000 40.36132 
1 1 1    5   37   34 o  201.307   23.156   33.146   7.0050   28.109   8.7804   41.966   11.618  179.331   33.211  217.661   36.140 -38.32898 49.08277 
1 1 1    5   37   35 o  212.443   20.370   36.463   6.5426   39.605   9.1973   33.243   9.3090  216.327   28.468  195.394   32.251 20.93268 43.01818 
1 1 1    5   37   36 o   88.075   32.924   5.8626   5.9742   9.1474   8.1471   2.0418   8.7866  104.326   38.557   85.416   36.860 18.91032 53.34139 
1 1 1    5   37   37 o   92.879   33.692   7.0792   6.1780   7.1673   8.7710   6.9925   8.7033   98.228   39.028   97.570   38.842 0.6585312 55.06299 
1 1 1    5   37   38 o  134.702   33.808   16.749   6.9597   22.704   8.6917   6.1091   11.618  154.839   37.149  100.563   42.870 54.27586 56.72628 
1 1 1    5   37   39 o  120.860   35.374   13.845   6.9611   8.3953   8.7392   23.303   11.514  100.298   39.233  147.608   46.002 -47.30997 60.45982 
1 1 1    5   37   40 f  172.087   29.413   26.326   7.4692   29.050   9.0864   20.649   13.116  176.115   34.941  135.055   49.077 41.06071 60.24449 
1 1 1    5   38    0 o  239.557   27.869   46.437   9.8578   46.437   9.8578   46.437   9.8578  239.557   27.869  239.557   27.869 0.000000 0.000000 
1 1 1    5   38    1 o  794.166   10.111  485.054   12.291  488.817   15.190  477.921   20.916  796.231   12.464  784.543   17.417 11.68781 21.41749 
1 1 1    5   38    2 o  508.895   10.428  199.234   8.1225  200.253   10.092  197.361   13.685  509.478   12.942  504.016   17.739 5.461578 21.95842 
1 1 1    5   38    3 o  650.901   10.115  325.847   10.077  323.780   12.445  329.782   17.173  647.974   12.548  651.783   17.214 -3.809509 21.30174 
1 1 1    5   38    4 o   80.540   29.959   4.1376   4.9347   11.003   6.1511  -8.2605   8.2660  115.326   33.108   66.488   31.334 48.83873 45.58480 
1 1 1    5   38    5 o  238.340   28.591   45.769   10.222   45.769   10.222   0.0000   0.0000  238.340   28.591  ?   ?  0.000000 28.59073 
1 1 1    5   38    6 o  265.007   26.553   56.102   10.626   56.102   10.626   0.0000   0.0000  265.007   26.553  ?   ?  0.000000 26.55277 
1 1 1    5   38    7 o  184.252   36.729   28.527   9.9949   28.527   9.9949   0.0000   0.0000  184.252   36.729  ?   ?  0.000000 36.72920 
1 1 1    5   38    8 o  663.489   18.036  342.394   18.317  342.394   18.317   0.0000   0.0000  663.489   18.036  ?   ?  0.000000 18.03597 
1 1 1    5   38    9 o  127.865   33.443   13.696   6.6198   12.715   9.2226   14.739   9.5075  124.948   41.389  132.656   41.873 -7.709045 58.87621 
1 1 1    5   38   10 o  261.477   18.019   53.435   7.1677   53.731   10.382   53.166   9.9082  259.114   26.551  258.211   25.398 0.9031677 36.74277 
1 1 1    5   38   11 o  161.167   27.458   21.164   6.5308   20.244   9.2944   22.061   9.1785  153.705   39.341  160.940   37.888 -7.234741 54.61849 
1 1 1    5   38   12 f  165.062   28.677   22.302   6.9824   12.564   10.308   30.559   9.4919  125.605   43.725  191.856   33.544 -66.25119 55.10975 
1 1 1    5   38   13 o  444.507   14.071  152.833   9.5738  155.668   13.942  150.303   13.170  446.008   20.422  438.629   19.617 7.378754 28.31746 
1 1 1    5   38   14 o  108.641   35.043   9.5403   6.6314   21.825   10.004  -0.0894   8.8570  158.792   40.908   84.873   36.816 73.91845 55.03521 
1 1 1    5   38   15 o  269.770   18.517   57.016   7.5999   48.686   10.620   65.759   10.880  245.123   28.860  287.169   25.002 -42.04637 38.18344 
1 1 1    5   38   16 o  108.212   35.602   9.4110   6.8282   11.849   10.296   7.4963   9.1235  122.753   43.619  106.322   40.477 16.43058 59.50653 
1 1 1    5   38   17 o  222.844   22.874   39.542   7.6915   32.357   10.859   46.776   10.896  194.971   37.753  239.191   30.451 -44.21996 48.50289 
1 1 1    5   38   18 o  180.658   28.078   26.683   7.5121   20.894   10.656   32.404   10.592  154.110   43.352  195.438   36.758 -41.32829 56.83770 
1 1 1    5   38   19 o  154.673   26.347   19.553   6.0140   20.265   7.1189   17.778   11.240  155.829   30.938  142.793   45.576 13.03525 55.08509 
1 1 1    5   38   20 o  342.534   13.900   90.893   7.2879   95.850   8.8582   80.507   12.821  350.888   16.493  316.284   26.734 34.60403 31.41261 
1 1 1    5   38   21 o  100.474   33.548   8.0346   6.0550   12.307   7.2574  -1.7496   10.983  120.527   36.330   89.656   39.864 30.87098 53.93530 
1 1 1    5   38   22 o   78.754   32.247   2.3754   6.1901   8.8735   7.5297 -11.1715   10.872  106.583   37.356   74.303   35.288 32.28046 51.38828 
1 1 1    5   38   23 o   98.268   37.571   6.3672   7.8813   7.4182   10.920   5.2244   11.387  109.751   43.566  105.521   43.532 4.229904 61.58767 
1 1 1    5   38   24 o  205.846   21.777   33.866   6.7572   23.670   12.510   38.067   8.0293  160.573   47.539  217.145   24.591 -56.57266 53.52303 
1 1 1    5   38   25 o  140.753   27.721   16.507   5.7596   18.342   8.1233   14.652   8.1675  145.030   36.594  129.613   38.422 15.41704 53.06035 
1 1 1    5   38   26 o  164.012   25.051   22.012   6.0894   22.376   8.7509   21.670   8.4790  160.139   36.512  157.823   35.908 2.315948 51.21083 
1 1 1    5   38   27 o  164.385   28.586   22.578   6.9315   43.180   11.690   11.408   8.6078  224.469   35.181  116.435   39.990 108.0337 53.26229 
1 1 1    5   38   28 o  116.903   35.069   11.845   6.7744   14.249   11.468   10.556   8.3959  128.127   45.981  112.712   39.450 15.41514 60.58487 
1 1 1    5   38   29 o  204.928   21.713   33.854   6.7071   36.832   9.3715   30.728   9.6032  209.217   30.134  188.146   34.622 21.07011 45.89923 
1 1 1    5   38   30 o   67.539   29.869  -0.9066   6.0864   8.9871   8.6116 -10.7811   8.6032  106.695   39.599   63.005   30.315 43.68959 49.87082 
1 1 1    5   38   31 f   77.537   31.892   2.5711   6.0890   10.403   8.5998  -5.3021   8.6227  111.160   39.826   71.100   33.012 40.06084 51.72950 
1 1 1    5   38   32 o   97.176   34.838   7.5723   6.5816   20.465   8.5333 -11.3598   10.341  150.121   37.302   69.918   33.535 80.20332 50.15984 
1 1 1    5   38   33 o  351.080   13.773   96.364   7.4013   90.343   10.247  102.930   10.702  335.488   20.047  358.548   19.574 -23.06021 28.01839 
1 1 1    5   38   34 f  136.866   29.558   16.352   6.0110   15.465   8.4632   17.254   8.5390  128.268   39.352  135.359   39.053 -7.090256 55.44085 
1 1 1    5   38   35 o  100.350   33.080   8.8455   5.8940   13.050   8.4133   4.7929   8.2596  117.975   39.544   90.291   37.142 27.68427 54.25171 
1 1 1    5   38   36 o   54.836   26.039  -5.8299   5.9155  -3.4888   8.2940  -8.2537   8.4394   71.085   32.783   64.156   30.643 6.929153 44.87442 
1 1 1    5   38   37 o  160.602   26.330   22.208   6.2482   37.645   9.0765   8.3035   8.6144  207.245   29.441  100.127   39.011 107.1185 48.87356 
1 1 1    5   38   38 o  139.110   32.383   17.823   6.7661   10.372   8.3382   32.188   11.578  105.942   39.033  177.628   43.036 -71.68521 58.10091 
1 1 1    5   39    1 o  402.595   20.449  127.056   12.560  127.056   12.560   0.0000   0.0000  402.595   20.449  ?   ?  0.000000 20.44875 
1 1 1    5   39    2 o  657.282   18.507  336.558   18.619  336.558   18.619   0.0000   0.0000  657.282   18.507  ?   ?  0.000000 18.50667 
1 1 1    5   39    3 o  103.702   35.187   8.3447   6.6622  -6.1062   9.1389   24.734   9.7325   74.371   34.338  170.399   38.253 -96.02728 51.40457 
1 1 1    5   39    4 o  362.711   15.236  101.918   8.4585   95.622   11.998  108.139   11.927  348.120   22.640  371.012   21.089 -22.89136 30.94041 
1 1 1    5   39    5 o  128.661   32.892   13.888   6.5025   17.139   9.1683   10.597   9.2237  141.486   40.358  117.167   41.323 24.31905 57.76112 
1 1 1    5   39    6 o  157.810   29.149   20.473   6.7816   23.153   10.307   18.428   9.0052  163.640   41.184  146.606   39.320 17.03343 56.93987 
1 1 1    5   39    7 o  117.890   33.559   11.601   6.3460   9.6563   9.4864   13.176   8.5376  114.449   41.715  125.705   39.680 -11.25645 57.57270 
1 1 1    5   39    8 o  436.374   13.737  147.231   9.1755  137.127   13.125  156.891   12.833  418.535   20.487  448.523   18.692 -29.98798 27.73302 
1 1 1    5   39    9 o  372.760   14.811  107.627   8.4503  107.480   12.174  107.763   11.739  369.437   21.622  370.313   20.795 -0.8757629 29.99964 
1 1 1    5   39   10 o  506.872   13.408  198.602   10.402  202.820   15.032  194.726   14.410  509.528   19.274  499.479   18.849 10.04849 26.95818 
1 1 1    5   39   11 f  197.205   24.126   31.153   7.1306   41.853   10.460   21.863   9.7464  225.989   31.060  158.977   40.067 67.01146 50.69613 
1 1 1    5   39   12 o  406.676   14.466  128.103   9.0048  127.904   13.147  128.280   12.359  402.989   21.391  404.780   19.947 -1.791534 29.24839 
1 1 1    5   39   13 o  318.860   17.359   79.410   8.4403   85.175   12.285   74.257   11.616  326.946   24.733  304.976   25.106 21.97031 35.24237 
1 1 1    5   39   14 o  205.722   24.109   33.919   7.4475   31.670   11.033   35.802   10.094  192.169   38.846  207.638   32.854 -15.46837 50.87588 
1 1 1    5   39   15 o  124.189   36.452   13.074   7.3828  -4.5505   10.880   28.112   10.051   84.522   38.437  181.337   37.451 -96.81501 53.66496 
1 1 1    5   39   16 o  280.720   19.941   62.088   8.5124   66.389   12.317   58.154   11.778  286.187   28.497  267.291   29.267 18.89584 40.84830 
1 1 1    5   39   17 o   97.362   36.308   6.5269   7.2569   1.4522   10.674   10.889   9.8960   95.068   40.822  118.283   42.683 -23.21436 59.06156 
1 1 1    5   39   18 o  137.950   36.547   16.389   7.8401   15.821   11.425   16.894   10.778  135.930   46.079  139.197   44.653 -3.267136 64.16505 
1 1 1    5   39   19 o  137.530   29.512   15.826   6.0266   8.8342   7.2006   32.178   11.012  105.834   36.562  193.029   38.621 -87.19426 53.18248 
1 1 1    5   39   20 o   70.085   32.074  -4.1465   7.7315   6.3396   10.976 -14.4750   10.893  107.115   43.280   70.291   33.894 36.82349 54.97198 
1 1 1    5   39   21 o   83.638   35.910   0.8890   8.2579  -0.2552   11.543   2.0884   11.818   94.107   41.399   99.709   42.889 -5.602783 59.60985 
1 1 1    5   39   22 o   94.161   34.520   6.3995   6.5100   10.622   7.7133  -4.0564   12.138  113.171   37.863   89.410   40.635 23.76073 55.54143 
1 1 1    5   39   23 o  321.189   15.373   80.389   7.5577   77.651   9.0143   86.869   13.867  313.742   18.859  326.183   28.047 -12.44122 33.79770 
1 1 1    5   39   24 o  145.129   36.863   18.517   8.2044   19.877   10.880   16.724   12.492  147.527   44.485  137.119   48.113 10.40793 65.52696 
1 1 1    5   39   25 o  295.800   16.787   68.758   7.5690   73.090   12.816   66.437   9.3797  297.957   28.446  288.416   21.400 9.541138 35.59674 
1 1 1    5   39   26 o   99.209   35.070   7.7931   6.6472  -3.5322   10.552   15.244   8.5589   83.124   37.821  130.587   39.474 -47.46301 54.66790 
1 1 1    5   39   27 o  228.828   18.851   41.656   6.5437   46.225   9.4251   37.403   9.0924  236.960   26.437  211.516   28.836 25.44409 39.12033 
1 1 1    5   39   28 o   69.441   30.193   0.0124   5.9848   0.2733   8.3280  -0.2661   8.6064   81.065   35.424   81.001   35.686 0.6406403E-01 50.28269 
1 1 1    5   39   29 o  181.344   24.237   27.046   6.5593   31.486   9.1682   22.390   9.3881  190.965   32.532  156.427   39.269 34.53789 50.99410 
1 1 1    5   39   30 o  249.421   20.629   50.069   7.8049   49.962   9.8571   50.248   12.779  245.208   26.694  238.537   36.131 6.671051 44.92261 
1 1 1    5   39   31 o   68.849   29.984   0.1175   5.9213   4.3943   8.4564  -3.9964   8.2938   90.972   37.521   71.335   32.857 19.63700 49.87352 
1 1 1    5   39   32 o  145.025   28.379   18.148   6.0739   22.855   9.1155   14.389   8.1457  156.510   38.351  124.246   38.688 32.26424 54.47551 
1 1 1    5   39   33 o   80.712   31.630   4.2727   5.6884   1.0950   8.3133   7.0704   7.8003   81.045   35.405   96.136   37.215 -15.09126 51.36588 
1 1 1    5   39   34 o  396.015   18.263  125.697   11.070  125.697   11.070   0.0000   0.0000  396.015   18.263  ?   ?  0.000000 18.26283 
1 1 1    5   39   35 o  109.452   32.820   10.975   5.9343   13.475   8.7321   8.8293   8.0894  117.940   40.282  101.279   38.220 16.66167 55.52874 
1 1 1    5   39   36 o  125.533   35.150   14.941   7.0218   23.614   8.6895  -1.3807   11.920  157.330   36.748   86.626   39.711 70.70365 54.10527 
1 1 1    5   40    0 o  107.262   51.313   13.797   9.6810   13.797   9.6810   13.797   9.6810  107.262   51.313  107.262   51.313 0.000000 0.000000 
1 1 1    5   40    1 o  363.797   12.649  102.212   7.0432   96.302   8.4960  115.198   12.594  352.246   15.758  382.356   21.608 -30.10999 26.74360 
1 1 1    5   40    2 o   92.318   32.374   6.3192   5.6556   0.9549   6.8681   17.618   9.9680   78.101   33.116  142.731   42.477 -64.62926 53.86081 
1 1 1    5   40    3 o  496.838   11.152  190.263   8.4806  197.642   10.507  176.467   14.366  505.519   13.579  474.903   19.763 30.61563 23.97858 
1 1 1    5   40    4 o  581.543   10.676  260.523   9.5028  253.303   11.684  274.630   16.333  572.382   13.336  593.537   17.978 -21.15509 22.38441 
1 1 1    5   40    5 o  212.175   22.714   35.846   7.2619   32.865   10.455   38.625   10.094  197.534   35.901  216.730   31.339 -19.19600 47.65537 
1 1 1    5   40    6 o  259.257   19.401   52.843   7.6430   47.453   10.782   58.286   10.836  241.285   29.830  269.300   26.637 -28.01468 39.99208 
1 1 1    5   40    7 o  203.394   23.683   33.097   7.2349   29.891   10.460   36.037   10.018  187.185   37.810  208.642   32.422 -21.45735 49.80714 
1 1 1    5   40    8 o  208.863   22.879   34.791   7.1947   23.868   10.188   45.656   10.161  165.694   40.511  237.113   28.573 -71.41946 49.57417 
1 1 1    5   40    9 o  272.283   19.696   58.339   8.1533   54.098   11.495   62.634   11.567  257.719   29.682  278.670   27.475 -20.95126 40.44587 
1 1 1    5   40   10 o  243.665   21.351   47.023   7.8826   43.802   11.072   50.333   11.225  230.237   32.307  248.162   30.172 -17.92450 44.20546 
1 1 1    5   40   11 o  401.146   15.701  125.026   9.6408  125.174   14.004  124.892   13.292  397.315   23.128  397.563   21.927 -0.2488403 31.87057 
1 1 1    5   40   12 o  206.938   25.318   34.526   7.8520   38.155   11.361   31.209   10.864  212.443   36.240  190.530   38.576 21.91255 52.92872 
1 1 1    5   40   13 o  365.747   16.283  104.105   9.1154   94.775   13.510  111.904   12.351  343.811   25.861  376.309   21.532 -32.49869 33.65119 
1 1 1    5   40   14 o   69.833   31.514  -2.8364   7.1474   7.6319   10.311 -12.5174   9.9161  109.205   42.644   68.299   32.780 40.90596 53.78724 
1 1 1    5   40   15 o  336.836   17.361   88.787   8.9204   99.104   13.576   80.949   11.833  351.610   25.397  318.128   24.490 33.48178 35.28097 
1 1 1    5   40   16 o  323.704   18.025   82.204   8.8954   81.156   13.046   83.114   12.160  316.785   27.169  321.995   24.866 -5.209137 36.83048 
1 1 1    5   40   17 o  321.883   18.319   81.400   8.9882   83.443   13.609   79.820   11.970  320.476   28.026  315.254   25.012 5.222260 37.56425 
1 1 1    5   40   18 o  164.148   34.470   23.059   8.3849   55.500   13.121   0.6672   10.901  257.003   34.205   93.555   40.713 163.4473 53.17477 
1 1 1    5   40   19 o  146.194   37.023   18.666   8.2933   37.223   12.110   2.2757   11.381  206.207   39.810   98.387   42.198 107.8201 58.01247 
1 1 1    5   40   20 o  187.728   24.384   28.607   6.8410   31.573   8.0832   21.120   12.843  195.791   27.749  151.217   48.767 44.57443 56.10930 
1 1 1    5   40   21 o  138.796   37.161   16.952   8.0517   10.202   10.089   28.790   13.362  114.733   42.806  174.869   48.317 -60.13635 64.55149 
1 1 1    5   40   22 o  325.294   18.998   83.683   9.4179   76.272   12.227   94.492   14.767  305.987   26.364  338.908   28.738 -32.92010 38.99945 
1 1 1    5   40   23 o  301.332   18.273   71.762   8.3882   71.966   10.287   71.359   14.491  299.270   22.624  290.307   33.210 8.962433 40.18382 
1 1 1    5   40   24 o   73.738   32.421  -0.5310   7.0715   0.5439   8.3775  -3.1952   13.189   82.207   35.733   93.007   42.304 -10.80040 55.37551 
1 1 1    5   40   25 o  206.776   24.991   35.066   7.7492   34.426   9.0396   36.837   15.050  201.902   30.177  193.755   50.304 8.146301 58.66125 
1 1 1    5   40   26 f  288.621   15.424   65.422   6.7892   65.935   9.6539   64.920   9.5496  285.883   22.237  283.709   22.167 2.174316 31.39849 
1 1 1    5   40   27 o  109.811   35.594   10.482   6.8352   6.9363   8.6093   16.527   11.242   99.610   38.947  132.998   45.699 -33.38763 60.04433 
1 1 1    5   40   28 o   77.682   33.323   1.2409   7.0991   12.935   9.1358 -16.5832   11.279  119.865   41.196   67.992   33.176 51.87312 52.89402 
1 1 1    5   40   29 o  106.439   33.471   9.9604   6.0800   19.811   8.8538   1.1693   8.3640  145.718   38.948   82.257   35.729 63.46107 52.85397 
1 1 1    5   40   30 o   65.486   29.011  -0.7039   5.7658   6.4518   8.4185  -7.0263   7.9131   96.076   38.216   64.031   30.321 32.04528 48.78375 
1 1 1    5   40   31 o  238.224   17.926   45.517   6.4886   45.731   9.5123   45.330   8.8735  232.051   27.304  232.585   25.335 -0.5339966 37.24726 
1 1 1    5   40   32 o   80.587   31.968   4.1616   5.8758   6.3012   8.9847   2.5627   7.7670   95.791   38.993   82.236   35.054 13.55491 52.43327 
1 1 1    5   40   33 o   87.565   34.870   5.3159   7.0158   2.1495   9.0699   10.033   11.070   85.133   37.091  108.584   43.608 -23.45111 57.24892 
1 1 1    5   40   34 o  229.642   21.460   43.548   7.4557   54.548   9.6406   27.181   11.760  253.862   25.141  160.281   45.704 93.58072 52.16283 
1 1 1    5   41    0 o  604.388   13.320  281.494   12.308  281.494   12.308  281.494   12.308  604.388   13.320  604.388   13.320 0.000000 0.000000 
1 1 1    5   41    1 o  527.064   11.031  214.202   8.8990  207.947   10.770  227.666   15.800  518.316   13.575  539.341   19.140 -21.02496 23.46477 
1 1 1    5   41    2 o  207.417   18.951   33.918   5.9501   33.123   7.0947   35.802   10.925  203.493   23.192  205.860   35.981 -2.366516 42.80771 
1 1 1    5   41    3 o  384.768   12.785  114.454   7.5297  114.635   9.1250  114.068   13.330  384.157   15.519  379.206   23.075 4.951599 27.80799 
1 1 1    5   41    4 o  428.524   12.040  141.809   7.8974  138.339   9.5983  149.080   13.895  422.263   14.851  435.488   20.846 -13.22418 25.59486 
1 1 1    5   41    5 o  344.184   13.618   91.717   7.1745   98.652   8.9235   79.039   12.065  356.048   16.374  314.219   25.301 41.82938 30.13682 
1 1 1    5   41    6 o  381.831   16.048  113.396   9.3792  102.022   13.202  124.986   13.327  357.789   24.251  397.537   21.988 -39.74789 32.73452 
1 1 1    5   41    7 o  235.573   21.547   44.059   7.6831   39.237   11.420   48.046   10.385  215.549   35.875  242.957   28.465 -27.40865 45.79565 
1 1 1    5   41    8 o  464.764   14.356  167.519   10.213  161.032   14.836  173.361   14.080  452.028   21.443  470.152   19.566 -18.12448 29.02785 
1 1 1    5   41    9 o  233.442   22.336   43.422   7.8835   27.030   11.021   60.601   11.282  175.135   41.709  273.622   27.302 -98.48637 49.85004 
1 1 1    5   41   10 o  427.695   14.995  142.097   9.8164  127.056   13.896  157.079   13.869  399.988   22.791  446.948   20.273 -46.95926 30.50339 
1 1 1    5   41   11 o  274.457   20.123   59.524   8.3948   67.039   12.677   53.655   11.203  286.479   29.323  256.158   29.090 30.32114 41.30433 
1 1 1    5   41   12 o  226.005   23.178   40.917   7.9045   45.242   11.922   37.524   10.559  231.773   34.670  211.214   33.802 20.55931 48.42073 
1 1 1    5   41   13 o  151.349   33.521   19.546   7.5607   20.376   11.085   18.823   10.339  150.536   44.792  145.370   43.260 5.166046 62.27177 
1 1 1    5   41   14 o  228.430   24.180   42.022   8.3259   33.806   12.017   49.608   11.547  195.576   41.430  244.339   31.616 -48.76314 52.11559 
1 1 1    5   41   15 o  152.717   35.475   20.178   8.1338   35.472   12.098   7.5622   10.988  200.578   40.796  109.757   43.659 90.82084 59.75286 
1 1 1    5   41   16 o  221.836   26.280   40.110   8.7498   32.254   12.479   47.707   12.271  188.689   44.016  237.062   34.860 -48.37346 56.14837 
1 1 1    5   41   17 o  278.715   32.614   65.081   13.650   0.0000   0.0000   65.081   13.650  ?   ?   278.715   32.614 0.000000 32.61430 
1 1 1    5   41   18 o  181.473   43.839   30.089   12.040   0.0000   0.0000   30.089   12.040  ?   ?   181.473   43.839 0.000000 43.83868 
1 1 1    5   41   19 o  209.227   42.866   39.623   13.266   0.0000   0.0000   39.623   13.266  ?   ?   209.227   42.866 0.000000 42.86575 
1 1 1    5   41   20 o  239.894   27.002   47.345   9.7424   57.928   13.837   36.940   13.719  259.197   35.836  198.911   45.981 60.28654 58.29666 
1 1 1    5   41   21 o   60.235   28.417  -6.4524   6.8309 -10.8064   7.9709   5.5877   13.255   59.926   28.921  108.929   46.086 -49.00299 54.40921 
1 1 1    5   41   22 o  156.524   31.879   21.112   7.3781   20.274   8.7405   23.190   13.762  150.140   38.000  154.094   50.535 -3.953491 63.22808 
1 1 1    5   41   23 o  205.970   24.479   34.748   7.5663   29.171   8.8880   49.430   14.421  183.875   32.782  232.955   41.988 -49.08055 53.26979 
1 1 1    5   41   24 o  129.350   35.841   14.968   7.3410   13.252   8.7202   19.143   13.601  121.643   40.244  141.036   50.132 -19.39399 64.28669 
1 1 1    5   41   25 o  175.301   34.114   27.046   8.8241   27.046   8.8241   0.0000   0.0000  175.301   34.114  ?   ?  0.000000 34.11395 
1 1 1    5   41   26 o  282.554   23.197   65.187   9.9437   65.187   9.9437   0.0000   0.0000  282.554   23.197  ?   ?  0.000000 23.19659 
1 1 1    5   41   27 o   89.329   32.837   6.1743   5.8963  -3.6224   8.6120   14.819   8.0899   73.177   33.622  126.273   38.423 -53.09589 51.05669 
1 1 1    5   41   28 o  456.850   11.799  162.587   8.2508  171.646   12.055  154.602   11.317  465.096   16.934  441.576   16.743 23.51971 23.81371 
1 1 1    5   41   29 o  200.389   21.123   32.876   6.3811   44.499   9.6720   23.917   8.4914  227.885   28.341  161.423   35.347 66.46201 45.30555 
1 1 1    5   41   30 o   68.750   30.018   0.3162   5.9695   13.022   8.8620 -10.2374   8.0767  116.981   40.553   59.797   28.920 57.18376 49.80869 
1 1 1    5   41   31 o  171.325   28.891   25.687   7.3066   51.519   9.7279  -7.7495   11.068  246.170   26.221   75.330   35.726 170.8401 44.31602 
1 1 1    5   42    0 o  380.290   15.895  112.213   9.2153  112.213   9.2153  112.213   9.2153  380.290   15.895  380.290   15.895 0.000000 0.000000 
1 1 1    5   42    1 o  380.315   12.769  111.937   7.4329  111.761   9.1372  112.280   12.780  378.919   15.754  376.051   22.303 2.868073 27.30605 
1 1 1    5   42    2 o  475.380   11.592  174.554   8.4346  181.746   10.465  161.221   14.250  483.997   14.126  452.414   20.578 31.58267 24.95972 
1 1 1    5   42    3 o  233.840   18.488   43.085   6.5631   42.583   8.0435   44.084   11.353  230.640   23.095  229.542   33.283 1.098495 40.51088 
1 1 1    5   42    4 o  284.483   15.175   63.100   6.5839   66.825   8.1631   56.168   11.137  291.543   18.387  262.508   28.157 29.03491 33.62864 
1 1 1    5   42    5 o   78.156   31.599   2.6980   5.8547   1.6641   7.3351   4.5129   9.7186   81.688   34.407   98.502   40.377 -16.81345 53.04887 
1 1 1    5   42    6 o  454.129   14.905  160.322   10.360  151.150   15.200  168.279   14.158  435.865   22.864  462.396   20.004 -26.53101 30.37971 
1 1 1    5   42    7 o  347.320   16.794   94.191   8.9280   90.982   13.027   97.033   12.260  336.195   25.506  348.778   23.096 -12.58371 34.40860 
1 1 1    5   42    8 o  120.306   36.206   12.390   7.2121   25.364   11.215   3.2395   9.4179  167.846   43.349   93.998   39.250 73.84792 58.47794 
1 1 1    5   42    9 o  325.312   18.057   83.183   8.9558   75.933   13.247   89.288   12.155  304.697   28.743  333.797   23.949 -29.10019 37.41254 
1 1 1    5   42   10 o  239.117   22.710   45.817   8.2120   51.312   12.591   41.750   10.833  246.503   34.302  222.952   32.717 23.55026 47.40285 
1 1 1    5   42   11 o  368.058   23.875  108.610   13.378   0.0000   0.0000  108.610   13.378  ?   ?   368.058   23.875 0.000000 23.87532 
1 1 1    5   42   12 o  347.583   25.213   97.504   13.322   0.0000   0.0000   97.504   13.322  ?   ?   347.583   25.213 0.000000 25.21256 
1 1 1    5   42   13 o  238.914   32.324   47.971   11.517   0.0000   0.0000   47.971   11.517  ?   ?   238.914   32.324 0.000000 32.32373 
1 1 1    5   42   14 o  218.960   38.472   41.957   12.423   0.0000   0.0000   41.957   12.423  ?   ?   218.960   38.472 0.000000 38.47200 
1 1 1    5   42   15 o  159.989   35.524   22.367   8.4726   30.503   12.363   15.162   11.635  181.582   44.765  131.229   46.397 50.35303 64.47138 
1 1 1    5   42   16 o  144.440   38.272   18.650   8.5970   28.414   12.028   8.4516   12.292  174.774   44.764  113.513   45.824 61.26063 64.06004 
1 1 1    5   42   17 o  250.339   25.028   51.070   9.4618   58.822   13.234   42.964   13.533  262.692   33.691  217.922   42.095 44.76945 53.91677 
1 1 1    5   42   18 o  288.166   21.792   66.659   9.5410   82.606   13.917   52.517   13.106  315.368   29.161  246.130   35.840 69.23831 46.20456 
1 1 1    5   42   19 o  193.337   31.010   31.762   8.8665   48.545   13.073   17.468   12.065  234.790   37.650  137.150   47.331 97.64096 60.47951 
1 1 1    5   42   20 o  176.764   34.718   27.374   9.0581   37.063   13.284   18.955   12.383  198.680   44.757  141.242   47.972 57.43834 65.60867 
1 1 1    5   42   21 o  122.792   41.773   13.535   9.3898   8.5570   12.937   19.077   13.650  113.321   46.534  140.763   50.203 -27.44245 68.45254 
1 1 1    5   42   22 o   65.649   31.029  -7.3227   8.2135  -7.3227   8.2135   0.0000   0.0000   65.649   31.029  ?   ?  0.000000 31.02883 
1 1 1    5   42   23 o   86.722   37.211   2.1951   8.8567   2.1951   8.8567   0.0000   0.0000   86.722   37.211  ?   ?  0.000000 37.21061 
1 1 1    5   42   24 o  363.951   16.106  104.520   8.9720  108.545   10.906   96.092   15.781  367.937   19.435  334.464   31.185 33.47266 36.74502 
1 1 1    5   42   25 o  200.523   24.835   33.536   7.4595   31.080   8.9994   38.926   13.335  187.718   32.498  199.278   44.805 -11.56044 55.35003 
1 1 1    5   42   26 o  154.641   30.835   21.095   7.0425   23.380   8.4537   15.915   12.731  159.707   35.502  127.282   47.968 32.42557 59.67676 
1 1 1    5   42   27 o   89.092   35.243   5.5128   7.1234   11.038   8.9217  -4.2032   11.831  110.475   40.425   83.473   38.727 27.00156 55.98182 
1 1 1    5   42   28 o   93.040   35.788   6.7426   7.1778   7.3617   8.8408   5.5453   12.295   98.304   39.144  100.973   43.588 -2.669189 58.58465 
1 1 1    5   42   29 o  186.591   26.538   29.833   7.3656   31.006   9.2582   27.811   12.157  184.256   34.083  162.223   46.538 22.03342 57.68394 
1 1 1    5   43    0 o   77.490   46.781   5.6874   10.147   5.6874   10.147   5.6874   10.147   77.490   46.781   77.490   46.781 0.000000 0.000000 
1 1 1    5   43    1 o  450.099   15.051  157.803   10.369  156.044   14.546  159.620   14.786  443.623   21.421  448.596   21.534 -4.972504 30.37443 
1 1 1    5   43    2 f  146.123   33.686   18.402   7.3799   32.508   10.524   4.7557   10.351  193.635   36.855  100.389   41.469 93.24590 55.47933 
1 1 1    5   43    3 f  215.783   24.548   37.738   7.9634   38.569   11.213   36.893   11.312  211.888   35.851  206.314   37.189 5.573898 51.65602 
1 1 1    5   43    4 o  217.207   22.877   37.971   7.4914   35.133   10.510   40.903   10.681  202.364   35.209  220.223   32.678 -17.85881 48.03732 
1 1 1    5   43    5 o   78.591   33.467   1.1622   7.0668   10.701   9.9757  -8.4469   10.012  116.065   42.705   73.505   34.594 42.55984 54.95831 
1 1 1    5   43    6 o  191.107   24.193   29.673   6.9183   40.592   9.6126   17.938   9.9646  221.312   29.081  140.988   42.586 80.32384 51.56861 
1 1 1    5   43    7 o  318.750   24.357   81.966   11.794   0.0000   0.0000   81.966   11.794  ?   ?   318.750   24.357 0.000000 24.35725 
1 1 1    5   43    8 o  130.207   43.940   14.993   10.389   0.0000   0.0000   14.993   10.389  ?   ?   130.207   43.940 0.000000 43.94006 
1 1 1    5   43    9 o  219.776   25.027   39.347   8.2689   33.402   12.404   44.103   11.093  191.275   43.368  228.236   32.688 -36.96094 54.30717 
1 1 1    5   43   10 o  207.993   26.589   35.578   8.2712   33.929   12.299   36.940   11.176  193.095   42.742  205.857   36.821 -12.76215 56.41493 
1 1 1    5   43   11 o  184.804   31.225   28.939   8.5177   23.858   12.435   33.430   11.691  158.636   47.497  192.732   40.895 -34.09589 62.67694 
1 1 1    5   43   12 o  459.048   15.760  164.843   11.074  153.691   15.796  175.620   15.528  436.759   23.718  469.357   21.614 -32.59760 32.08898 
1 1 1    5   43   13 o  142.745   37.030   18.154   8.1595   23.068   12.135   14.099   11.024  155.817   46.981  126.800   45.126 29.01705 65.14264 
1 1 1    5   43   14 o  384.686   17.905  116.619   10.543  137.409   15.437   98.445   14.433  411.718   24.609  345.884   27.489 65.83356 36.89497 
1 1 1    5   43   15 o  220.423   27.642   40.348   9.1208   40.724   12.589   39.933   13.233  212.825   40.117  208.510   42.893 4.314575 58.72968 
1 1 1    5   43   16 o  180.598   33.962   28.398   9.0434   39.585   12.633   16.640   12.951  208.644   41.020  134.453   48.781 74.19086 63.73615 
1 1 1    5   43   17 o   86.037   36.568   2.2789   8.4084 -12.6586   11.752   17.948   12.036   74.441   35.716  137.696   47.288 -63.25546 59.26022 
1 1 1    5   43   18 o   63.747   30.628 -10.3937   8.7088  -5.8700   12.943 -14.1362   11.772   87.120   40.449   72.648   35.082 14.47163 53.54304 
1 1 1    5   43   19 o  182.486   48.548   33.261   13.797   33.261   13.797   0.0000   0.0000  182.486   48.548  ?   ?  0.000000 48.54783 
1 1 1    5   43   20 o  221.262   41.949   45.797   13.687   45.797   13.687   0.0000   0.0000  221.262   41.949  ?   ?  0.000000 41.94856 
1 1 1    5   43   21 o  248.486   26.637   51.732   9.9732   38.249   13.806   66.446   14.422  196.380   46.627  273.545   35.267 -77.16502 58.46255 
1 1 1    5   43   22 o  120.295   41.481   13.522   9.2664   5.6178   12.708   22.494   13.540  103.845   44.566  146.433   50.161 -42.58826 67.09860 
1 1 1    5   43   23 o  248.656   20.499   50.208   7.7323   49.874   9.2041   51.011   14.254  244.525   24.941  231.516   41.761 13.00822 48.64210 
1 1 1    5   43   24 o  138.716   35.043   17.775   7.4430   20.242   8.8004   11.576   13.950  145.568   38.795  116.951   48.208 28.61622 61.87906 
1 1 1    5   43   25 f  235.307   22.548   45.745   8.0216   41.251   9.6500   55.792   14.430  217.677   29.741  242.321   40.323 -24.64406 50.10459 
1 1 1    5   43   26 o  217.680   23.472   39.516   7.6967   39.436   9.1733   39.707   14.146  213.179   28.855  194.627   47.828 18.55142 55.85777 
1 1 1    5   44    0 o  466.649   15.051  168.844   10.725  168.844   10.725  168.844   10.725  466.649   15.051  466.649   15.051 0.000000 0.000000 
1 1 1    5   44    1 o   79.359   30.023   4.1327   4.9994   8.8613   6.9203  -1.0290   7.2303  104.021   35.849   73.437   32.513 30.58366 48.39630 
1 1 1    5   44    2 o  322.354   14.357   80.985   7.0837   79.226   8.8463   84.130   11.826  316.558   18.336  322.535   24.130 -5.976288 30.30604 
1 1 1    5   44    3 o  169.696   25.268   23.706   6.3630   34.611   7.8523   2.8489   10.859  205.478   25.516   96.634   41.326 108.8442 48.56843 
1 1 1    5   44    4 o  414.784   12.749  133.592   8.0941  147.689   10.287  110.680   13.115  434.649   15.463  370.787   23.225 63.86179 27.90158 
1 1 1    5   44    5 o  192.652   21.543   29.912   6.2439   38.166   7.9128   16.291   10.164  216.475   24.301  133.886   43.406 82.58902 49.74555 
1 1 1    5   44    6 o  104.845   33.175   9.3188   5.9650   12.952   7.2771   1.8795   10.414  121.375   36.333   92.917   40.113 28.45795 54.12147 
1 1 1    5   44    7 o  317.027   18.556   79.602   8.9648   73.439   13.110   85.015   12.286  297.228   29.194  323.294   25.023 -26.06598 38.45071 
1 1 1    5   44    8 o   86.104   35.199   3.5593   7.3605  -3.4098   10.997   9.2149   9.9068   84.768   38.585  110.103   42.117 -25.33492 57.11909 
1 1 1    5   44    9 o  241.599   22.813   47.229   8.3362   63.622   12.560   34.324   11.145  275.331   30.306  196.116   38.500 79.21443 48.99738 
1 1 1    5   44   10 o   84.966   35.116   3.1539   7.4287   8.8554   11.398  -1.0560   9.7945  111.631   44.448   84.182   37.523 27.44929 58.16875 
1 1 1    5   44   11 o  130.187   37.319   15.242   7.8203   12.772   11.028   17.741   11.092  121.727   44.883  137.546   45.381 -15.81975 63.82751 
1 1 1    5   44   12 o  147.298   36.726   19.532   8.2517   37.035   11.804   2.8037   11.540  202.228   39.551   97.522   42.163 104.7066 57.81036 
1 1 1    5   44   13 o  137.376   38.066   17.227   8.2805   22.531   11.502   11.520   11.930  152.598   45.678  118.511   45.983 34.08759 64.81449 
1 1 1    5   44   14 o  210.302   28.177   37.232   8.8421   34.456   12.133   40.376   12.913  191.658   42.476  208.443   41.925 -16.78448 59.68162 
1 1 1    5   44   15 o  315.924   28.618   83.895   13.688   83.895   13.688   0.0000   0.0000  315.924   28.618  ?   ?  0.000000 28.61795 
1 1 1    5   44   16 o  107.611   44.054   7.9613   11.550   7.9613   11.550   0.0000   0.0000  107.611   44.054  ?   ?  0.000000 44.05353 
1 1 1    5   44   17 o  206.719   41.711   40.272   12.743   40.272   12.743   0.0000   0.0000  206.719   41.711  ?   ?  0.000000 41.71129 
1 1 1    5   44   18 o  101.576   38.433   8.3042   8.1936   5.5867   11.872   10.776   11.323  102.115   43.428  113.516   44.583 -11.40097 62.23870 
1 1 1    5   44   19 o   99.575   38.886   7.5630   8.5740   5.0230   11.768   10.437   12.518  100.279   42.956  113.721   46.125 -13.44218 63.02988 
1 1 1    5   44   20 o  101.735   39.459   8.2419   8.7824   34.343   12.466 -17.4773   12.375  186.166   44.376   70.328   34.409 115.8374 56.15357 
1 1 1    5   44   21 o  130.751   40.497   16.581   8.9388   18.051   12.001   14.748   13.397  132.849   47.105  123.768   48.531 9.081192 67.63219 
1 1 1    5   44   22 o  109.487   40.371   10.810   8.9219   11.492   12.743   10.155   12.496  114.955   46.568  111.573   45.766 3.382195 65.29240 
1 1 1    5   45    0 o   50.956   34.076  -1.7801   7.3401  -1.7801   7.3401  -1.7801   7.3401   50.956   34.076   50.956   34.076 0.000000 0.000000 
1 1 1    5   45    1 o  269.745   15.140   57.174   6.2259   58.009   8.6627   56.282   8.9539  268.376   21.262  263.612   22.403 4.763885 30.88674 
1 1 1    5   45    2 o   75.746   31.493   2.1312   6.0261   3.7267   7.2404  -1.4654   10.871   85.616   34.945   86.960   39.089 -1.343430 52.43164 
1 1 1    5   45    3 o  205.120   21.349   34.041   6.6045   39.955   8.2334   23.369   11.061  220.363   24.844  156.361   44.233 64.00136 50.73229 
1 1 1    5   45    4 o  113.976   33.377   11.428   6.1960   15.769   7.7422   3.6959   10.334  131.985   36.892   95.573   40.578 36.41227 54.84129 
1 1 1    5   45    5 o  126.580   32.745   14.145   6.3922   17.162   8.1555   9.3401   10.293  137.180   37.684  109.897   42.692 27.28326 56.94429 
1 1 1    5   45    6 o   57.754   26.970  -4.5793   5.8880  -7.8721   7.3405   1.3619   9.8599   60.299   28.739   88.677   38.653 -28.37859 48.16613 
1 1 1    5   45    7 o  133.551   35.584   16.089   7.4051   26.927   11.506   8.4262   9.6753  167.312   44.249  105.853   41.316 61.45931 60.53886 
1 1 1    5   45    8 o  159.259   34.217   22.545   8.0924   19.858   11.444   25.232   11.444  142.686   46.037  161.206   44.780 -18.52017 64.22383 
1 1 1    5   45    9 o   97.304   37.842   6.8293   8.0940   0.5954   11.334   13.317   11.563   91.604   40.624  122.034   45.768 -30.43037 61.19633 
1 1 1    5   45   10 o   90.217   40.007   0.5292   10.991   0.5292   10.991   0.0000   0.0000   90.217   40.007  ?   ?  0.000000 40.00663 
1 1 1    5   45   11 o  131.391   44.643   16.593   10.725   16.593   10.725   0.0000   0.0000  131.391   44.643  ?   ?  0.000000 44.64341 
1 1 1    5   45   12 o  197.669   39.938   36.357   11.668   36.357   11.668   0.0000   0.0000  197.669   39.938  ?   ?  0.000000 39.93840 
1 1 1    5   45   13 o   95.509   41.930   2.3792   11.789   2.3792   11.789   0.0000   0.0000   95.509   41.930  ?   ?  0.000000 41.93019 
1 1 1    5   45   14 o  149.580   35.123   20.400   7.9042   16.715   11.289   23.943   11.071  130.505   45.740  155.265   44.368 -24.75954 63.72372 
1 1 1    5   45   15 o   70.791   32.405  -2.9943   7.8980  -1.7374   10.908  -4.3792   11.450   84.883   38.556   82.518   38.218 2.365067 54.28829 
1 1 1    5   45   16 o  220.839   26.381   41.170   8.7407   28.724   11.950   55.491   12.819  168.746   45.310  249.014   34.563 -80.26755 56.98783 
1 1 1    5   45   17 o  163.094   34.313   24.180   8.2945   38.719   12.252   11.877   11.270  201.015   41.204  115.156   44.689 85.85939 60.78595 
1 1 1    5   45   18 o  199.229   29.760   34.553   8.7971   36.404   12.703   32.846   12.195  191.173   44.281  181.127   44.343 10.04578 62.66697 
1 1 1    5   46    0 o  260.023   22.849   54.517   8.9323   54.517   8.9323   54.517   8.9323  260.023   22.849  260.023   22.849 0.000000 0.000000 
1 1 1    5   46    1 o  200.260   19.732   32.406   5.9696   27.898   8.3858   37.037   8.5000  178.428   31.875  209.542   27.140 -31.11411 41.86370 
1 1 1    5   46    2 o  462.542   11.131  166.209   7.8808  173.557   11.193  158.985   11.098  469.317   15.581  448.696   16.159 20.62054 22.44779 
1 1 1    5   46    3 f  135.469   37.185   17.005   7.9446   17.005   7.9446   0.0000   0.0000  135.469   37.185  ?   ?  0.000000 37.18489 
1 1 1    5   46    4 o  213.262   26.383   38.200   8.4284   38.200   8.4284   0.0000   0.0000  213.262   26.383  ?   ?  0.000000 26.38336 
1 1 1    5   46    5 o  203.856   27.034   35.109   8.2274   35.109   8.2274   0.0000   0.0000  203.856   27.034  ?   ?  0.000000 27.03425 
1 1 1    5   46    6 f  151.475   34.596   20.785   7.8451   20.785   7.8451   0.0000   0.0000  151.475   34.596  ?   ?  0.000000 34.59554 
1 1 1    5   46    7 o  120.867   37.575   13.534   7.6874   13.534   7.6874   0.0000   0.0000  120.867   37.575  ?   ?  0.000000 37.57534 
1 1 1    5   46    8 o  193.711   28.528   32.153   8.2052   28.856   11.686   35.359   11.523  170.736   44.327  193.753   40.174 -23.01706 59.82375 
1 1 1    5   46    9 o  187.278   28.857   30.187   8.0064   36.771   11.678   24.348   10.998  197.682   39.969  156.442   44.056 41.24004 59.48428 
1 1 1    5   46   10 o  104.047   37.257   9.4018   7.5252   14.974   10.697   3.9435   10.588  124.537   44.440   94.778   40.676 29.75908 60.24516 
1 1 1    5   46   11 o  101.532   37.046   8.7700   7.4848   14.691   10.347   2.2701   10.841  123.456   43.743   91.839   40.266 31.61694 59.45436 
1 1 1    5   46   12 o   70.546   32.008  -2.0787   7.4909  -3.2545   10.472  -0.8465   10.720   80.498   37.019   85.456   38.576 -4.957100 53.46530 
1 1 1    6    0    2 o   54.897   16.966   2.8809   1.2478   2.8809   1.2478   2.8809   1.2478   54.897   16.966   54.897   16.966 0.000000 0.000000 
1 1 1    6    0    3 o  663.488   7.5522  337.079   7.6674  337.079   7.6674  337.079   7.6674  663.488   7.5522  663.488   7.5522 0.000000 0.000000 
1 1 1    6    0    4 o  666.898   6.1733  340.494   6.3003  340.494   6.3003  340.494   6.3003  666.898   6.1733  666.898   6.1733 0.000000 0.000000 
1 1 1    6    0    5 o  212.196   4.1594   34.501   1.3498   34.501   1.3498   34.501   1.3498  212.196   4.1594  212.196   4.1594 0.000000 0.000000 
1 1 1    6    0    6 o  1033.17   7.1717  817.139   11.340  817.139   11.340  817.139   11.340  1033.17   7.1717  1033.17   7.1717 0.000000 0.000000 
1 1 1    6    0    7 o   37.610   15.668   1.5244   0.9008   1.5244   0.9008   1.5244   0.9008   37.610   15.668   37.610   15.668 0.000000 0.000000 
1 1 1    6    0    8 o  1344.87   8.9059  1384.66   18.331  1384.66   18.331  1384.66   18.331  1344.87   8.9059  1344.87   8.9059 0.000000 0.000000 
1 1 1    6    0    9 o  1047.46   7.3435  839.926   11.772  839.926   11.772  839.926   11.772  1047.46   7.3435  1047.46   7.3435 0.000000 0.000000 
1 1 1    6    0   10 o  2072.21   13.075  3288.19   41.469  3288.19   41.469  3288.19   41.469  2072.21   13.075  2072.21   13.075 0.000000 0.000000 
1 1 1    6    0   11 o  2300.66   16.661  4054.60   58.663  4054.60   58.663  4054.60   58.663  2300.66   16.661  2300.66   16.661 0.000000 0.000000 
1 1 1    6    0   12 o  937.169   7.9955  672.440   11.467  672.440   11.467  672.440   11.467  937.169   7.9955  937.169   7.9955 0.000000 0.000000 
1 1 1    6    0   13 o  521.906   7.4639  208.626   5.9598  208.626   5.9598  208.626   5.9598  521.906   7.4639  521.906   7.4639 0.000000 0.000000 
1 1 1    6    0   14 o  1402.71   10.825  1506.73   23.238  1506.73   23.238  1506.73   23.238  1402.71   10.825  1402.71   10.825 0.000000 0.000000 
1 1 1    6    0   15 o  501.330   5.4672  192.439   4.1942  192.439   4.1942  192.439   4.1942  501.330   5.4672  501.330   5.4672 0.000000 0.000000 
1 1 1    6    0   16 o  536.186   5.5959  220.127   4.5915  220.127   4.5915  220.127   4.5915  536.186   5.5959  536.186   5.5959 0.000000 0.000000 
1 1 1    6    0   17 o  537.437   5.6588  221.159   4.6539  221.159   4.6539  221.159   4.6539  537.437   5.6588  537.437   5.6588 0.000000 0.000000 
1 1 1    6    0   18 o  599.049   6.7702  274.808   6.2060  274.808   6.2060  274.808   6.2060  599.049   6.7702  599.049   6.7702 0.000000 0.000000 
1 1 1    6    0   19 o  256.374   6.5394   50.411   2.5624   50.411   2.5624   50.411   2.5624  256.374   6.5394  256.374   6.5394 0.000000 0.000000 
1 1 1    6    0   20 o  790.320   7.6140  478.284   9.2087  478.284   9.2087  478.284   9.2087  790.320   7.6140  790.320   7.6140 0.000000 0.000000 
1 1 1    6    0   21 f  833.920   6.8343  532.433   8.7221  532.433   8.7221  532.433   8.7221  833.920   6.8343  833.920   6.8343 0.000000 0.000000 
1 1 1    6    0   22 o   36.018   21.495   1.0419   2.0931   1.0419   2.0931   1.0419   2.0931   36.018   21.495   36.018   21.495 0.000000 0.000000 
1 1 1    6    0   23 o  1090.88   8.0532  911.091   13.445  911.091   13.445  911.091   13.445  1090.88   8.0532  1090.88   8.0532 0.000000 0.000000 
1 1 1    6    0   24 o  255.680   8.6948   50.216   3.3938   50.216   3.3938   50.216   3.3938  255.680   8.6948  255.680   8.6948 0.000000 0.000000 
1 1 1    6    0   25 o  257.034   8.9445   50.757   3.5093   50.757   3.5093   50.757   3.5093  257.034   8.9445  257.034   8.9445 0.000000 0.000000 
1 1 1    6    0   26 o  1413.49   13.806  1530.28   29.863  1530.28   29.863  1530.28   29.863  1413.49   13.806  1413.49   13.806 0.000000 0.000000 
1 1 1    6    0   27 o  870.001   7.4030  579.477   9.8566  579.477   9.8566  579.477   9.8566  870.001   7.4030  870.001   7.4030 0.000000 0.000000 
1 1 1    6    0   28 o  197.547   11.552   30.182   3.4656   30.182   3.4656   30.182   3.4656  197.547   11.552  197.547   11.552 0.000000 0.000000 
1 1 1    6    0   29 o  806.338   7.4116  497.795   9.1457  497.795   9.1457  497.795   9.1457  806.338   7.4116  806.338   7.4116 0.000000 0.000000 
1 1 1    6    0   30 o  234.264   12.793   42.395   4.5559   42.395   4.5559   42.395   4.5559  234.264   12.793  234.264   12.793 0.000000 0.000000 
1 1 1    6    0   31 o  125.869   21.871   13.185   3.8324   13.185   3.8324   13.185   3.8324  125.869   21.871  125.869   21.871 0.000000 0.000000 
1 1 1    6    0   32 f  254.608   13.290   50.046   5.1471   50.046   5.1471   50.046   5.1471  254.608   13.290  254.608   13.290 0.000000 0.000000 
1 1 1    6    0   33 o  195.354   15.218   29.760   4.4870   29.760   4.4870   29.760   4.4870  195.354   15.218  195.354   15.218 0.000000 0.000000 
1 1 1    6    0   34 o  187.840   16.481   27.650   4.6547   27.650   4.6547   27.650   4.6547  187.840   16.481  187.840   16.481 0.000000 0.000000 
1 1 1    6    0   35 o  715.849   8.0455  392.437   8.8130  392.437   8.8130  392.437   8.8130  715.849   8.0455  715.849   8.0455 0.000000 0.000000 
1 1 1    6    0   36 f  213.456   15.992   35.496   5.1575   35.496   5.1575   35.496   5.1575  213.456   15.992  213.456   15.992 0.000000 0.000000 
1 1 1    6    0   37 o  725.826   9.5224  403.586   10.575  403.586   10.575  403.586   10.575  725.826   9.5224  725.826   9.5224 0.000000 0.000000 
1 1 1    6    0   38 o  258.126   17.359   51.771   6.7871   51.771   6.7871   51.771   6.7871  258.126   17.359  258.126   17.359 0.000000 0.000000 
1 1 1    6    0   39 o  349.238   11.281   93.717   6.0162   93.717   6.0162   93.717   6.0162  349.238   11.281  349.238   11.281 0.000000 0.000000 
1 1 1    6    0   40 o  235.201   15.683   42.981   5.5884   42.981   5.5884   42.981   5.5884  235.201   15.683  235.201   15.683 0.000000 0.000000 
1 1 1    6    0   41 o  399.336   10.497  122.422   6.4058  122.422   6.4058  122.422   6.4058  399.336   10.497  399.336   10.497 0.000000 0.000000 
1 1 1    6    0   42 o  664.413   9.8820  338.424   10.045  338.424   10.045  338.424   10.045  664.413   9.8820  664.413   9.8820 0.000000 0.000000 
1 1 1    6    0   43 o   79.589   36.976   7.1793   4.9945   7.1793   4.9945   7.1793   4.9945   79.589   36.976   79.589   36.976 0.000000 0.000000 
1 1 1    6    0   44 o  210.988   19.149   35.073   6.0669   35.073   6.0669   35.073   6.0669  210.988   19.149  210.988   19.149 0.000000 0.000000 
1 1 1    6    0   45 o  258.558   13.954   51.764   5.4856   51.764   5.4856   51.764   5.4856  258.558   13.954  258.558   13.954 0.000000 0.000000 
1 1 1    6    0   46 o  493.410   9.3891  186.812   7.0852  186.812   7.0852  186.812   7.0852  493.410   9.3891  493.410   9.3891 0.000000 0.000000 
1 1 1    6    0   47 o  114.355   31.267   12.148   4.7317   12.148   4.7317   12.148   4.7317  114.355   31.267  114.355   31.267 0.000000 0.000000 
1 1 1    6    0   48 o   52.480   31.986   1.9876   4.8402   1.9876   4.8402   1.9876   4.8402   52.480   31.986   52.480   31.986 0.000000 0.000000 
1 1 1    6    0   49 o  440.566   13.775  149.683   9.2684  149.683   9.2684  149.683   9.2684  440.566   13.775  440.566   13.775 0.000000 0.000000 
1 1 1    6    0   50 o  251.260   14.753   49.102   5.6291   49.102   5.6291   49.102   5.6291  251.260   14.753  251.260   14.753 0.000000 0.000000 
1 1 1    6    0   51 o   40.657   27.533  -2.3595   5.0817  -2.3595   5.0817  -2.3595   5.0817   40.657   27.533   40.657   27.533 0.000000 0.000000 
1 1 1    6    0   52 o  175.625   20.573   24.874   5.3318   24.874   5.3318   24.874   5.3318  175.625   20.573  175.625   20.573 0.000000 0.000000 
1 1 1    6    0   53 o   83.420   38.304   8.0923   5.3530   8.0923   5.3530   8.0923   5.3530   83.420   38.304   83.420   38.304 0.000000 0.000000 
1 1 1    6    0   54 o  112.445   40.678   13.369   6.4236   13.369   6.4236   13.369   6.4236  112.445   40.678  112.445   40.678 0.000000 0.000000 
1 1 1    6    0   55 f   52.524   33.558   0.8400   6.0202   0.8400   6.0202   0.8400   6.0202   52.524   33.558   52.524   33.558 0.000000 0.000000 
1 1 1    6    0   56 f  302.012   14.092   70.888   6.4822   70.888   6.4822   70.888   6.4822  302.012   14.092  302.012   14.092 0.000000 0.000000 
1 1 1    6    0   57 o  157.808   26.679   21.176   5.8912   21.176   5.8912   21.176   5.8912  157.808   26.679  157.808   26.679 0.000000 0.000000 
1 1 1    6    0   58 o   84.540   40.471   8.6630   6.0232   8.6630   6.0232   8.6630   6.0232   84.540   40.471   84.540   40.471 0.000000 0.000000 
1 1 1    6    0   59 o   62.334   36.637   4.0659   5.9183   4.0659   5.9183   4.0659   5.9183   62.334   36.637   62.334   36.637 0.000000 0.000000 
1 1 1    6    0   60 o  223.257   25.546   41.153   8.4341   41.153   8.4341   41.153   8.4341  223.257   25.546  223.257   25.546 0.000000 0.000000 
1 1 1    6    0   61 o   69.682   37.152   6.0203   5.3843   6.0203   5.3843   6.0203   5.3843   69.682   37.152   69.682   37.152 0.000000 0.000000 
1 1 1    6    0   62 o  222.596   16.564   39.370   5.5716   39.370   5.5716   39.370   5.5716  222.596   16.564  222.596   16.564 0.000000 0.000000 
1 1 1    6    0   63 o   53.256   32.537   2.5886   5.0360   2.5886   5.0360   2.5886   5.0360   53.256   32.537   53.256   32.537 0.000000 0.000000 
1 1 1    6    0   64 o  203.456   20.345   33.963   6.1903   33.963   6.1903   33.963   6.1903  203.456   20.345  203.456   20.345 0.000000 0.000000 
1 1 1    6    0   65 o   46.161   29.479   1.1223   4.6393   1.1223   4.6393   1.1223   4.6393   46.161   29.479   46.161   29.479 0.000000 0.000000 
1 1 1    6    1    0 o   58.546   11.568   2.9110   0.9216   2.9110   0.9216   2.9110   0.9216   58.546   11.568   58.546   11.568 0.000000 0.000000 
1 1 1    6    1    1 o  1122.04   10.688  964.026   18.356  987.276   26.650  943.041   25.319  1135.18   15.338  1109.49   14.909 25.68884 21.39028 
1 1 1    6    1    2 o  1022.16   9.9801  799.974   15.614  778.997   21.453  823.608   22.771  1008.45   13.898  1036.89   14.347 -28.44324 19.97499 
1 1 1    6    1    3 o  592.086   10.044  268.418   9.1029   0.0000   0.0000  268.418   9.1029  ?   ?   592.086   10.044 0.000000 10.04444 
1 1 1    6    1    4 o  333.822   3.7596   85.290   1.9210   90.127   3.1071   82.297   2.4441  343.140   5.9159  327.905   4.8697 15.23456 7.662342 
1 1 1    6    1    5 o  1041.90   5.8978  830.927   9.4056  837.942   13.426  824.167   13.181  1046.20   8.3841  1037.57   8.2995 8.631226 11.79719 
1 1 1    6    1    6 o  557.523   3.7231  237.899   3.1771  235.385   4.1859  241.316   4.8798  554.555   4.9314  561.488   5.6779 -6.932495 7.520461 
1 1 1    6    1    7 o  538.147   3.9923  221.653   3.2885  220.838   4.6435  222.474   4.6578  537.136   5.6479  539.122   5.6445 -1.986267 7.984958 
1 1 1    6    1    8 o  762.959   4.1857  445.533   4.8881  444.976   6.9139  446.089   6.9118  762.450   5.9244  763.403   5.9152 -0.9529419 8.371856 
1 1 1    6    1    9 o  512.356   3.5225  200.915   2.7624  203.504   3.9464  198.427   3.8681  515.631   5.0003  509.159   4.9633 6.472076 7.045355 
1 1 1    6    1   10 o  217.757   3.5785   36.292   1.1927   36.184   1.7057   36.395   1.6685  217.425   5.1254  218.059   4.9989 -0.6345215 7.159519 
1 1 1    6    1   11 o  277.450   3.7956   58.918   1.6119   60.523   2.1302   56.767   2.4656  281.197   4.9492  272.323   5.9151 8.874908 7.712507 
1 1 1    6    1   12 f  600.847   4.4888  276.325   4.1282  274.145   5.8237  278.527   5.8528  598.436   6.3579  603.200   6.3392 -4.764038 8.978193 
1 1 1    6    1   13 o  949.678   6.2433  690.403   9.0753  688.346   11.684  693.533   14.408  948.181   8.0509  951.644   9.8916 -3.462952 12.75385 
1 1 1    6    1   14 o  658.092   4.3677  331.492   4.3996  341.158   6.8938  324.849   5.7146  667.555   6.7468  651.433   5.7313 16.12164 8.852516 
1 1 1    6    1   15 o  670.102   4.4468  343.709   4.5609  344.412   6.9983  343.190   6.0134  670.716   6.8169  669.557   5.8676 1.159058 8.994383 
1 1 1    6    1   16 o  850.398   5.0414  553.583   6.5622  556.427   10.083  551.494   8.6428  852.448   7.7281  848.720   6.6530 3.728027 10.19738 
1 1 1    6    1   17 o  597.317   4.3780  273.104   4.0027  271.936   6.1079  273.983   5.2992  595.967   6.6958  598.237   5.7872 -2.270142 8.850156 
1 1 1    6    1   18 o  764.552   4.8577  447.461   5.6846  456.414   7.6297  436.290   8.5229  772.093   6.4561  754.833   7.3767 17.25995 9.802917 
1 1 1    6    1   19 o  652.156   4.3098  325.552   4.3021  325.913   6.0974  325.195   6.0707  652.458   6.1055  651.740   6.0855 0.7183228 8.620394 
1 1 1    6    1   20 o  162.372   7.2310   20.187   1.7971   17.411   2.5062   23.125   2.5783  150.348   10.966  173.478   9.7497 -23.12935 14.67366 
1 1 1    6    1   21 o  621.414   4.3659  295.579   4.1526  296.290   5.8963  294.880   5.8494  622.109   6.1922  620.628   6.1576 1.480713 8.732666 
1 1 1    6    1   22 o  712.069   4.5967  388.112   5.0100  384.541   7.0521  391.750   7.1188  708.727   6.5008  715.339   6.5017 -6.612732 9.194141 
1 1 1    6    1   23 o  998.266   5.7827  762.842   8.8358  766.256   13.577  760.333   11.638  1000.34   8.8671  996.536   7.6296 3.802185 11.69772 
1 1 1    6    1   24 o  1224.30   7.1350  1147.51   13.371  1156.69   19.108  1138.70   18.716  1228.99   10.158  1219.40   10.027 9.588257 14.27341 
1 1 1    6    1   25 o  692.910   5.4318  367.508   5.7609  376.089   10.147  363.427   6.9982  700.832   9.4592  689.023   6.6356 11.80890 11.55455 
1 1 1    6    1   26 o  751.078   6.1473  431.815   7.0671  431.589   9.1977  432.140   11.042  750.828   8.0033  751.250   9.6025 -0.4224243 12.50047 
1 1 1    6    1   27 o  824.711   5.4505  520.609   6.8803  523.041   9.1741  517.483   10.402  826.586   7.2511  822.148   8.2657 4.437561 10.99550 
1 1 1    6    1   28 o  1008.27   5.6738  778.161   8.7563  808.833   12.793  751.130   12.010  1027.86   8.1318  990.524   7.9216 37.33319 11.35242 
1 1 1    6    1   29 o  776.824   5.1771  461.902   6.1557  451.375   8.5622  473.165   8.8563  767.865   7.2850  786.179   7.3597 -18.31384 10.35550 
1 1 1    6    1   30 o  639.963   5.9433  313.501   5.8218  319.886   8.3156  307.364   8.1532  646.378   8.4050  633.601   8.4071 12.77734 11.88793 
1 1 1    6    1   31 o  263.488   8.0835   53.155   3.2601   48.235   4.3130   59.712   4.9794  250.950   11.228  279.204   11.651 -28.25446 16.18134 
1 1 1    6    1   32 o  1046.12   6.9247  837.813   11.088  835.026   15.645  840.625   15.716  1044.21   9.7889  1047.70   9.8004 -3.494507 13.85170 
1 1 1    6    1   33 o  233.066   9.3836   41.599   3.3475   40.950   4.7609   42.233   4.7076  230.764   13.538  234.391   13.175 -3.626617 18.89085 
1 1 1    6    1   34 o  482.718   6.1667  178.385   4.5564  175.852   6.4259  180.947   6.4616  479.203   8.7608  486.098   8.6846 -6.894867 12.33586 
1 1 1    6    1   35 o  879.236   5.8993  591.812   7.9391  595.008   11.237  588.625   11.218  881.474   8.3286  876.732   8.3596 4.742676 11.80040 
1 1 1    6    1   36 o  1055.50   6.2820  852.939   10.149  852.873   14.352  853.005   14.354  1055.26   8.8858  1055.34   8.8858 -0.8203125E-01 12.56639 
1 1 1    6    1   37 f  569.168   6.9885  248.053   6.0883  245.098   8.6424  250.965   8.5782  565.615   9.9826  572.355   9.7917 -6.740540 13.98324 
1 1 1    6    1   38 o  478.102   7.9117  175.068   5.7898  173.647   8.2854  176.425   8.0940  475.967   11.373  479.782   11.022 -3.815277 15.83717 
1 1 1    6    1   39 o  434.273   6.9819  144.430   4.6410  135.167   6.4530  154.355   6.6794  419.964   10.039  448.802   9.7233 -28.83795 13.97570 
1 1 1    6    1   40 o  965.771   6.2036  714.263   9.1704  713.758   13.025  714.760   12.913  965.122   8.8173  965.811   8.7353 -0.6885986 12.41170 
1 1 1    6    1   41 o  502.528   6.5408  193.423   5.0311  198.419   7.1867  188.622   7.0455  508.773   9.2286  496.050   9.2793 12.72278 13.08712 
1 1 1    6    1   42 o  769.494   6.9666  453.636   8.2054  458.048   11.619  449.246   11.589  772.826   9.8226  765.353   9.8928 7.472961 13.94094 
1 1 1    6    1   43 o  593.944   6.5832  270.270   5.9848  268.175   7.8810  273.125   9.1986  591.399   8.7062  596.643   10.073 -5.243835 13.31368 
1 1 1    6    1   44 o   68.752   26.379   2.5261   3.8936   10.627   5.4910  -5.6660   5.5220  114.357   30.718   54.916   25.796 59.44027 40.11263 
1 1 1    6    1   45 o  224.023   10.719   38.548   3.6756   40.760   5.2421   36.409   5.1551  229.481   15.007  216.725   15.645 12.75581 21.67917 
1 1 1    6    1   46 o   99.577   22.907   8.0303   3.4187   3.8853   4.8405   12.156   4.8292   79.471   29.650  122.251   26.567 -42.77938 39.81114 
1 1 1    6    1   47 o  616.740   6.2187  291.551   5.8705  293.246   8.3603  289.902   8.2450  618.046   8.8376  614.528   8.7656 3.518188 12.44741 
1 1 1    6    1   48 o  291.834   9.2468   65.428   4.1305   67.968   5.6182   62.441   6.0934  297.001   12.359  284.398   13.998 12.60336 18.67289 
1 1 1    6    1   49 o  317.372   11.372   77.586   5.5244   90.617   8.8631   69.307   7.0646  341.650   16.949  298.750   15.503 42.89984 22.96921 
1 1 1    6    1   50 f  272.563   9.7218   57.156   4.0558   54.561   5.7954   59.647   5.6780  265.112   14.335  277.792   13.354 -12.68015 19.59142 
1 1 1    6    1   51 o  295.497   9.2765   67.184   4.1957   68.573   5.9719   65.830   5.8961  297.747   13.104  291.707   13.205 6.039764 18.60358 
1 1 1    6    1   52 o  293.416   9.4153   66.282   4.2285   71.337   6.1122   61.641   5.8561  303.545   13.155  282.060   13.564 21.48508 18.89579 
1 1 1    6    1   53 o   81.636   26.250   5.2810   3.7232   5.5992   5.3771   4.9879   5.1603   87.649   31.482   84.260   30.758 3.389236 44.01359 
1 1 1    6    1   54 o  282.708   11.959   61.851   5.1751   65.289   7.2838   58.346   7.3541  288.555   16.561  272.245   17.745 16.30975 24.27252 
1 1 1    6    1   55 o   66.279   26.821   1.8490   4.2223   11.691   5.9223  -8.3248   6.0213  116.613   32.145   52.497   25.285 64.11543 40.89771 
1 1 1    6    1   56 o  113.586   23.891   10.733   4.0219   11.508   5.6873   9.9567   5.6885  115.493   31.363  107.784   32.091 7.708412 44.87165 
1 1 1    6    1   57 o  212.925   13.170   35.418   4.2711   34.995   6.0986   35.826   5.9834  209.255   19.257  212.031   18.625 -2.775406 26.79063 
1 1 1    6    1   58 o  117.590   24.464   11.613   4.2598   15.020   6.0228   8.2029   6.0257  131.423   30.525   98.960   33.464 32.46330 45.29481 
1 1 1    6    1   59 o   57.947   25.296  -0.2544   4.2371   5.4403   5.9940  -5.9422   5.9904   86.782   32.864   55.600   26.344 31.18245 42.11939 
1 1 1    6    1   60 f  157.121   25.219   20.852   5.8598   17.150   8.2346   24.650   8.3405  134.669   38.190  165.143   34.124 -30.47469 51.21497 
1 1 1    6    1   61 o   58.019   24.454   0.8665   3.7093   5.0976   5.2951  -3.2103   5.1976   82.211   30.944   55.568   25.741 26.64311 40.25098 
1 1 1    6    1   62 o  139.833   18.120   15.978   3.7872   19.137   5.3311   12.759   5.3810  149.882   24.051  118.766   29.683 31.11601 38.20374 
1 1 1    6    1   63 o  134.768   18.553   15.009   3.7256   11.469   5.3116   18.438   5.2269  111.112   30.366  146.090   24.224 -34.97761 38.84463 
1 1 1    6    1   64 o   81.665   26.520   5.9290   3.7934   9.6241   5.9048   3.3323   4.9500   99.686   33.122   71.848   29.053 27.83848 44.05849 
1 1 1    6    1   65 o   54.131   23.863  -0.0322   3.8540   0.1044   5.4219  -0.1718   5.4793   62.798   27.960   62.346   27.907 0.4526024 39.50442 
1 1 1    6    2    1 o  593.589   6.9799  269.717   6.3416  268.324   8.9093  271.148   9.0287  591.989   9.8325  595.093   9.9122 -3.104370 13.96173 
1 1 1    6    2    2 o  561.411   6.8472  241.266   5.8839  241.596   8.3243  240.937   8.3178  561.734   9.6816  560.967   9.6873 0.7665405 13.69588 
1 1 1    6    2    3 f  575.402   7.0277  253.443   6.1895  248.184   8.6331  259.007   8.8787  569.336   9.9066  581.616   9.9734 -12.28015 14.05741 
1 1 1    6    2    5 o  652.270   5.3406  325.651   5.3320  327.676   7.5856  323.672   7.4963  654.252   7.5749  650.244   7.5319 4.007935 10.68216 
1 1 1    6    2    6 o  1229.01   8.2433  1156.34   15.507  1138.38   21.543  1175.66   22.339  1219.24   11.544  1239.03   11.779 -19.78748 16.49258 
1 1 1    6    2    7 o   54.149   7.4245   2.2866   0.5992   2.2170   0.8992   2.3422   0.8035   52.787   11.458   54.450   10.010 -1.663326 15.21465 
1 1 1    6    2    8 o  1208.55   6.1640  1118.03   11.402  1100.89   17.098  1131.76   15.302  1199.11   9.3159  1215.86   8.2222 -16.75403 12.42543 
1 1 1    6    2    9 o  1442.79   6.6961  1593.48   14.788  1594.86   20.929  1592.11   20.896  1443.25   9.4741  1442.01   9.4675 1.240601 13.39375 
1 1 1    6    2   10 o  930.872   5.5662  663.272   7.9308  670.529   9.7809  649.344   13.551  935.910   6.8277  920.893   9.6137 15.01697 11.79151 
1 1 1    6    2   11 o  614.186   4.1269  288.724   3.8797  287.302   5.0990  290.678   5.9788  612.650   5.4375  616.221   6.3388 -3.570923 8.351493 
1 1 1    6    2   12 o  1440.10   7.7768  1587.76   17.142  1591.65   29.823  1585.84   20.948  1441.32   13.518  1439.09   9.5103 2.224487 16.52833 
1 1 1    6    2   13 o   70.357   9.1202   3.8540   0.9590   3.1942   1.3027   4.6348   1.4171   63.337   13.826   76.797   12.484 -13.46037 18.62808 
1 1 1    6    2   14 o  403.647   3.6647  124.705   2.2641  124.608   3.2126  124.802   3.1915  403.468   5.2021  403.784   5.1638 -0.3150635 7.329869 
1 1 1    6    2   15 o  1162.72   5.7431  1034.93   10.221  1026.88   14.332  1043.26   14.581  1158.04   8.0856  1167.24   8.1611 -9.194336 11.48824 
1 1 1    6    2   16 o  145.095   5.7753   16.117   1.2826   16.105   1.8814   16.127   1.7532  144.767   8.5284  144.904   7.9346 -0.1367950 11.64867 
1 1 1    6    2   17 o  711.256   4.6551  387.241   5.0679  375.171   7.5515  397.132   6.8359  699.991   7.0481  720.225   6.2010 -20.23389 9.387608 
1 1 1    6    2   18 o  429.725   4.5845  141.355   3.0155  135.699   4.1768  147.512   4.3580  420.997   6.4818  438.939   6.4865 -17.94211 9.170014 
1 1 1    6    2   19 o  490.151   4.0875  183.895   3.0666  179.902   4.2794  188.110   4.3966  484.761   5.7674  495.697   5.7947 -10.93542 8.175719 
1 1 1    6    2   20 f  434.895   4.7637  144.777   3.1710  141.122   4.4166  148.667   4.5557  429.326   6.7210  440.651   6.7544 -11.32513 9.528589 
1 1 1    6    2   21 o  382.155   4.6303  111.789   2.7085  111.517   4.2205  111.979   3.5316  381.640   7.2250  382.455   6.0328 -0.8148804 9.412505 
1 1 1    6    2   22 o  486.245   4.6168  180.976   3.4361  186.213   5.3777  177.363   4.4668  493.173   7.1240  481.338   6.0628 11.83578 9.354672 
1 1 1    6    2   23 o  537.200   4.4057  220.887   3.6226  215.690   5.0953  226.199   5.1514  530.805   6.2714  543.585   6.1914 -12.77972 8.812723 
1 1 1    6    2   24 o  1020.88   5.8798  797.771   9.1876  796.887   12.173  798.942   14.006  1020.22   7.7950  1021.48   8.9581 -1.252563 11.87474 
1 1 1    6    2   25 o  1310.43   7.5219  1314.64   15.087  1328.39   26.486  1308.03   18.357  1316.83   13.140  1307.03   9.1757 9.797363 16.02703 
1 1 1    6    2   26 o  902.520   5.5960  623.486   7.7304  624.454   10.286  622.229   11.719  903.163   7.4405  901.512   8.4926 1.650269 11.29092 
1 1 1    6    2   27 o  418.519   5.0437  134.069   3.2310  136.211   4.6532  132.075   4.4897  421.820   7.2071  415.368   7.0618 6.451141 10.09010 
1 1 1    6    2   28 o  826.734   5.5356  523.170   7.0049  526.483   9.3777  518.988   10.536  829.295   7.3878  823.337   8.3603 5.957764 11.15684 
1 1 1    6    2   29 o  1304.88   7.0858  1303.47   14.152  1298.84   18.702  1309.68   21.650  1302.42   9.3812  1307.74   10.816 -5.314331 14.31740 
1 1 1    6    2   30 o  693.376   5.4772  368.006   5.8130  381.444   9.0689  358.636   7.5733  705.836   8.3943  684.446   7.2290 21.39032 11.07797 
1 1 1    6    2   31 o  644.187   5.6067  317.652   5.5283  318.541   7.3791  316.515   8.3464  645.037   7.4739  642.950   8.4811 2.087219 11.30435 
1 1 1    6    2   32 o  499.795   6.4500  191.227   4.9343  191.656   6.9649  190.794   6.9914  500.284   9.0956  499.156   9.1508 1.127960 12.90218 
1 1 1    6    2   33 o  259.216   8.3629   51.451   3.3181   54.675   4.7590   48.401   4.6287  267.148   11.638  251.346   12.031 15.80225 16.73940 
1 1 1    6    2   34 o  847.662   5.7247  550.048   7.4275  552.160   10.596  548.007   10.415  849.172   8.1521  845.978   8.0430 3.193542 11.45196 
1 1 1    6    2   35 o  279.003   8.9234   59.616   3.8108   60.786   5.4180   58.471   5.3609  281.630   12.569  276.212   12.680 5.417694 17.85384 
1 1 1    6    2   36 o  579.847   6.3616  257.417   5.6461  262.445   7.6672  251.459   8.3453  585.391   8.5570  572.960   9.5159 12.43170 12.79745 
1 1 1    6    2   37 o  686.771   6.2677  361.115   6.5886  355.148   9.9075  365.846   8.8220  680.887   9.5065  691.143   8.3393 -10.25555 12.64583 
1 1 1    6    2   38 o  710.268   6.9544  386.313   7.5605  391.802   10.959  381.327   10.444  715.072   10.013  705.477   9.6717 9.594849 13.92123 
1 1 1    6    2   39 o  1010.91   6.2683  782.538   9.6991  786.592   13.791  778.570   13.644  1013.24   8.8921  1008.07   8.8423 5.173828 12.54018 
1 1 1    6    2   40 o  358.126   7.8671   98.254   4.3124  100.885   6.1694   95.741   6.0303  362.706   11.113  353.336   11.150 9.370239 15.74222 
1 1 1    6    2   41 o  584.153   6.1907  261.342   5.5353  261.301   7.8278  261.383   7.8284  583.894   8.7586  583.986   8.7579 -0.9136963E-01 12.38600 
1 1 1    6    2   42 o  354.666   8.2772   96.412   4.4934   97.140   6.8272   95.855   5.9683  355.659   12.541  353.435   11.032 2.223938 16.70318 
1 1 1    6    2   43 o   65.276   25.693   1.9239   3.7680   0.3702   4.9829   3.9988   5.7583   66.906   28.279   84.393   32.150 -17.48741 42.81780 
1 1 1    6    2   44 o  186.286   14.477   26.875   4.0954   36.551   5.7106   16.628   5.8766  216.938   17.343  143.531   27.753 73.40709 32.72643 
1 1 1    6    2   45 o  252.607   9.8046   48.985   3.7909   47.184   5.4714   50.647   5.2574  247.049   14.533  256.165   13.456 -9.115463 19.80578 
1 1 1    6    2   46 o  396.344   7.2040  120.446   4.3704  124.586   6.2456  116.473   6.1176  402.733   10.132  389.381   10.264 13.35233 14.42269 
1 1 1    6    2   47 o   79.268   24.715   4.9069   3.3231  -5.5172   4.6701   15.599   4.7297   48.908   23.199  139.590   22.933 -90.68179 32.62091 
1 1 1    6    2   48 o  233.965   10.856   42.114   3.8877   48.723   5.4435   35.234   5.5543  250.786   14.240  212.487   17.226 38.29915 22.34959 
1 1 1    6    2   49 o  129.409   24.404   13.597   4.6566   21.031   7.8484   9.5587   5.7849  158.745   33.360  108.048   32.406 50.69705 46.50846 
1 1 1    6    2   50 o  169.008   14.302   22.264   3.6651   17.220   5.1158   27.583   5.2534  146.020   23.702  187.168   18.583 -41.14716 30.11840 
1 1 1    6    2   51 o  336.904   8.4287   87.253   4.3465   84.541   6.1369   89.983   6.1569  330.845   12.119  341.414   11.782 -10.56863 16.90181 
1 1 1    6    2   52 o   91.436   25.905   6.8755   3.7907   4.5060   5.1556   9.6640   5.5928   82.326   30.623  107.552   31.772 -25.22607 44.12718 
1 1 1    6    2   53 o  149.333   17.751   17.685   3.9780   20.986   6.1426   15.301   5.2206  159.958   25.980  136.091   26.010 23.86694 36.76275 
1 1 1    6    2   54 o  236.612   12.505   43.489   4.5126   44.913   5.8477   41.391   7.0954  239.336   16.056  227.977   20.555 11.35905 26.08229 
1 1 1    6    2   55 o  372.802   9.2233  107.132   5.2630  108.272   7.5036  106.027   7.3839  373.412   13.128  369.551   13.054 3.861633 18.51372 
1 1 1    6    2   56 o  224.873   12.106   39.330   4.1516   37.985   5.8547   40.690   5.8879  219.039   17.612  226.972   17.073 -7.932877 24.52874 
1 1 1    6    2   57 o   59.059   24.988   0.5929   3.8971   0.1421   5.4926   1.0499   5.5302   67.121   29.054   70.086   29.717 -2.965523 41.55988 
1 1 1    6    2   58 o  142.142   19.586   16.359   4.1481   6.2626   5.8328   26.691   5.9004   90.186   32.734  181.127   21.716 -90.94142 39.28236 
1 1 1    6    2   59 o  210.783   14.170   34.957   4.5452   29.916   6.0497   41.490   6.8871  191.828   20.944  226.737   20.051 -34.90855 28.99529 
1 1 1    6    2   60 o   50.436   23.782  -4.4529   4.7736  -1.6759   7.4533  -6.3842   6.2158   71.311   32.181   55.846   26.569 15.46508 41.73188 
1 1 1    6    2   61 f  179.132   14.359   25.457   3.9039   27.910   5.5032   22.973   5.5388  184.803   19.762  166.036   22.363 18.76633 29.84350 
1 1 1    6    2   62 o  175.669   14.516   24.578   3.8682   23.452   5.4005   25.764   5.5432  167.766   21.528  176.298   20.952 -8.532135 30.04044 
1 1 1    6    2   63 f  144.856   17.330   17.160   3.7662   13.439   5.3806   20.734   5.2734  121.029   29.348  156.034   22.749 -35.00587 37.13268 
1 1 1    6    2   64 o  120.317   21.956   12.497   3.8945   10.762   5.8100   13.913   5.2480  105.077   32.666  122.611   28.504 -17.53371 43.35439 
1 1 1    6    2   65 o   83.190   27.829   6.3304   4.1668   9.1639   5.8169   3.3442   5.9717   96.347   32.878   74.276   31.152 22.07070 45.29266 
1 1 1    6    3    0 o  851.676   12.270  555.660   15.988  555.660   15.988  555.660   15.988  851.676   12.270  851.676   12.270 0.000000 0.000000 
1 1 1    6    3    1 o  1540.85   14.006  1818.67   33.032  1809.85   46.402  1827.73   47.034  1536.43   19.731  1543.97   19.902 -7.547485 28.02525 
1 1 1    6    3    2 o  358.715   6.0138   98.494   3.3019   96.375   4.6220  100.704   4.7188  354.804   8.5108  362.686   8.5002 -7.881866 12.02857 
1 1 1    6    3    3 o  672.107   7.6559  345.807   7.8759  347.946   11.195  343.711   11.082  674.091   10.850  669.977   10.807 4.113708 15.31392 
1 1 1    6    3    4 o  787.818   6.8992  475.103   8.3195  479.073   10.258  467.474   14.220  791.059   8.4723  781.299   11.891 9.760742 14.60046 
1 1 1    6    3    5 o  413.398   4.5712  130.803   2.8925  130.384   4.0890  131.223   4.0922  412.714   6.4729  414.041   6.4572 -1.326691 9.142961 
1 1 1    6    3    6 o  1459.06   7.7574  1629.70   17.324  1636.31   24.621  1623.22   24.382  1461.80   11.004  1455.95   10.941 5.852417 15.51733 
1 1 1    6    3    7 o  372.276   3.6120  106.071   2.0582  103.065   3.4278  107.766   2.5737  366.941   6.1031  375.231   4.4812 -8.289795 7.571633 
1 1 1    6    3    8 o  443.920   4.8672  150.835   3.3072  140.076   4.4889  163.607   4.8910  427.770   6.8559  462.305   6.9119 -34.53528 9.735368 
1 1 1    6    3    9 o  880.915   5.8561  593.999   7.8961  609.032   10.375  573.306   12.173  891.937   7.5996  865.320   9.1904 26.61725 11.92550 
1 1 1    6    3   10 o  270.309   3.4029   55.923   1.4079   56.131   2.0108   55.722   1.9719  270.802   4.8513  269.816   4.7747 0.9864807 6.806840 
1 1 1    6    3   11 o  1011.03   5.1096  782.417   7.9072  774.526   11.076  790.619   11.292  1005.85   7.1941  1016.24   7.2596 -10.39270 10.22040 
1 1 1    6    3   12 o  853.166   5.3249  557.166   6.9536  564.681   12.273  553.613   8.4387  858.740   9.3375  850.404   6.4830 8.335938 11.36743 
1 1 1    6    3   13 o  801.888   4.7588  492.192   5.8410  493.654   7.7905  490.315   8.8269  803.029   6.3382  800.276   7.2061 2.753113 9.596902 
1 1 1    6    3   14 o  568.016   3.8815  246.951   3.3746  254.660   4.8705  239.833   4.6801  576.781   5.5169  559.739   5.4627 17.04144 7.763786 
1 1 1    6    3   15 o  558.714   3.9158  238.932   3.3488  241.680   4.7784  236.280   4.6944  561.881   5.5561  555.568   5.5205 6.312134 7.832368 
1 1 1    6    3   16 o  476.215   4.1139  173.585   2.9986  177.526   4.6259  170.729   3.9381  481.541   6.2762  472.253   5.4480 9.288391 8.310914 
1 1 1    6    3   17 o  829.017   4.6857  526.088   5.9458  520.572   8.3412  531.785   8.4778  824.574   6.6089  833.405   6.6459 -8.831360 9.372621 
1 1 1    6    3   18 o  745.570   5.1898  425.531   5.9225  425.761   8.3393  425.298   8.4126  745.675   7.3065  745.265   7.3748 0.4095459 10.38133 
1 1 1    6    3   19 o  610.204   4.8705  285.028   4.5491  286.905   6.5078  283.235   6.3614  612.137   6.9457  608.214   6.8332 3.923035 9.743495 
1 1 1    6    3   20 o  699.786   5.1772  374.867   5.5454  376.136   9.8141  374.271   6.7211  700.789   9.1494  699.190   6.2803 1.598145 11.09747 
1 1 1    6    3   21 o  755.334   4.9841  436.725   5.7623  435.410   8.8407  437.697   7.5980  754.088   7.6594  756.115   6.5651 -2.026794 10.08794 
1 1 1    6    3   22 o  534.189   4.3129  218.419   3.5264  221.094   5.0572  215.888   4.9198  537.411   6.1479  531.048   6.0527 6.362488 8.627406 
1 1 1    6    3   23 o  512.065   4.6650  200.703   3.6563  199.363   4.8591  202.451   5.5514  510.324   6.2207  514.241   7.0529 -3.916901 9.404264 
1 1 1    6    3   24 o  452.697   4.7708  156.861   3.3057  158.261   4.4584  155.152   4.9266  454.687   6.4061  450.185   7.1496 4.501923 9.599779 
1 1 1    6    3   25 o  847.158   6.3879  549.374   8.2831  537.636   13.128  557.138   10.676  837.908   10.236  853.061   8.1767 -15.15259 13.10103 
1 1 1    6    3   26 o  754.066   5.2279  435.233   6.0341  431.535   8.0042  440.100   9.1838  750.814   6.9650  758.200   7.9135 -7.386047 10.54199 
1 1 1    6    3   27 o  924.593   6.1585  654.375   8.7156  666.307   12.548  643.253   12.115  932.888   8.7877  916.613   8.6350 16.27496 12.32014 
1 1 1    6    3   28 o  211.984   7.6399   34.402   2.4789   33.189   3.6254   35.467   3.3972  207.859   11.439  215.213   10.313 -7.353470 15.40152 
1 1 1    6    3   29 o  953.554   6.4010  696.034   9.3424  703.847   13.376  688.593   13.054  958.776   9.1146  948.336   8.9934 10.44031 12.80455 
1 1 1    6    3   30 o  548.875   5.5575  230.604   4.6690  227.176   6.2957  234.793   6.9600  544.737   7.5507  553.777   8.2112 -9.039368 11.15508 
1 1 1    6    3   31 o  982.289   6.6481  738.658   9.9955  740.972   12.305  734.169   17.138  983.755   8.1721  979.024   11.436 4.730286 14.05608 
1 1 1    6    3   32 o  488.790   6.6222  182.902   4.9544  189.245   7.0267  176.630   6.9867  497.122   9.2346  480.259   9.5045 16.86328 13.25187 
1 1 1    6    3   33 o  203.725   10.289   31.870   3.1981   35.454   4.7081   28.800   4.3578  214.584   14.418  193.260   14.845 21.32428 20.69457 
1 1 1    6    3   34 o  680.914   5.6676  354.927   5.9069  361.657   8.4639  348.537   8.2476  687.247   8.0462  674.669   7.9867 12.57831 11.33703 
1 1 1    6    3   35 o  934.899   5.9993  669.127   8.5849  675.982   12.323  662.663   11.967  939.518   8.5689  930.229   8.4048 9.289917 12.00282 
1 1 1    6    3   36 o  563.890   6.3660  243.444   5.4945  241.917   7.4723  245.241   8.1072  562.023   8.6863  565.837   9.3607 -3.814270 12.77007 
1 1 1    6    3   37 o  372.736   8.7407  106.415   4.9868  113.342   9.4393  103.733   5.8733  384.299   16.047  367.945   10.429 16.35403 19.13825 
1 1 1    6    3   38 o  909.195   7.0454  633.023   9.8047  633.076   14.129  632.974   13.617  908.933   10.156  908.901   9.7879 0.3198242E-01 14.10477 
1 1 1    6    3   39 o  573.686   6.2445  252.017   5.4833  246.338   7.7330  257.760   7.7762  567.022   8.9101  580.029   8.7589 -13.00726 12.49432 
1 1 1    6    3   40 o  542.008   6.2946  224.977   5.2221  225.741   7.4384  224.234   7.3329  542.744   8.9539  540.937   8.8565 1.806763 12.59407 
1 1 1    6    3   41 o  211.960   11.570   34.574   3.7394   32.528   5.3130   36.582   5.2640  204.886   17.098  217.528   15.921 -12.64203 23.36255 
1 1 1    6    3   42 o  257.466   10.089   50.846   3.9759   51.286   6.0863   50.519   5.2511  257.723   15.501  256.062   13.445 1.660675 20.51932 
1 1 1    6    3   43 o   55.451   23.911  -0.3296   3.6916   2.0764   4.8804  -3.5474   5.6440   72.453   29.005   60.341   27.534 12.11238 39.99279 
1 1 1    6    3   44 o  527.244   7.2858  213.072   5.8798  214.203   8.3110  211.939   8.3195  528.242   10.279  525.432   10.345 2.809143 14.58311 
1 1 1    6    3   45 o  463.716   6.6547  164.803   4.7233  164.675   6.7362  164.926   6.6249  463.194   9.5012  463.569   9.3367 -0.3752136 13.32093 
1 1 1    6    3   46 f  141.438   15.954   15.641   3.3936   14.366   4.9333   16.787   4.6756  133.451   25.072  145.365   21.677 -11.91399 33.14336 
1 1 1    6    3   47 o  152.966   14.608   18.222   3.3785   23.564   4.9708   13.635   4.6060  173.202   19.066  130.031   24.027 43.17041 30.67283 
1 1 1    6    3   48 o  472.631   6.9098  171.326   4.9987  172.549   6.8450  169.928   7.3170  473.873   9.4372  470.108   10.169 3.765045 13.87318 
1 1 1    6    3   49 f  136.727   22.311   15.017   4.5081   19.858   8.0267   12.787   5.4487  153.623   34.927  124.253   29.152 29.37023 45.49379 
1 1 1    6    3   50 o  177.686   13.414   24.544   3.6214   26.837   5.1320   22.270   5.1108  184.631   18.405  167.483   20.355 17.14780 27.44217 
1 1 1    6    3   51 o  352.778   8.2607   95.655   4.4605  100.028   6.2996   91.258   6.3167  360.046   11.431  343.756   12.005 16.29022 16.57699 
1 1 1    6    3   52 o  144.098   17.068   16.416   3.6915   27.029   5.3188   6.5539   5.1275  184.752   19.084   91.629   30.870 93.12308 36.29238 
1 1 1    6    3   53 o   42.828   20.481  -4.9512   3.7935  -4.2484   5.7031  -5.5089   5.0803   58.059   26.919   51.363   24.315 6.696316 36.27432 
1 1 1    6    3   54 f  299.606   10.587   69.306   4.8551   69.579   6.3377   68.918   7.5537  299.267   13.836  296.392   16.719 2.875397 21.70111 
1 1 1    6    3   55 o   69.142   27.262   2.5000   4.2493   3.5823   5.6840   1.1288   6.3979   80.008   31.535   75.143   31.917 4.865753 44.86856 
1 1 1    6    3   56 o  158.999   17.149   20.083   4.1074   23.571   5.8581   16.710   5.7605  170.033   23.107  140.815   27.713 29.21815 36.08285 
1 1 1    6    3   57 o  185.460   15.274   27.103   4.2973   30.119   6.0931   24.117   6.0615  193.233   20.936  171.436   23.737 21.79645 31.65019 
1 1 1    6    3   58 o  145.798   19.646   17.209   4.2727   15.504   6.1303   18.819   5.9584  133.438   30.659  149.180   27.093 -15.74149 40.91412 
1 1 1    6    3   59 f  282.341   11.229   61.928   4.8529   53.517   6.4131   73.197   7.4231  259.936   16.199  304.261   15.995 -44.32474 22.76559 
1 1 1    6    3   60 o   63.554   27.646   0.1350   5.0227  -5.2496   8.3550   3.1823   6.2853   68.688   32.093   79.016   32.440 -10.32793 45.63254 
1 1 1    6    3   61 o   72.061   25.991   3.9485   3.6687   3.6152   5.2238   4.2729   5.1535   75.984   30.142   78.341   30.271 -2.356789 42.71833 
1 1 1    6    3   62 o  154.065   16.276   19.138   3.7800   22.268   5.2977   15.891   5.3951  163.251   21.742  134.391   27.162 28.85976 34.79203 
1 1 1    6    3   63 o  219.064   12.063   37.846   4.0291   41.699   5.8510   34.372   5.5564  226.760   16.981  205.152   17.873 21.60782 24.65379 
1 1 1    6    3   64 o  182.042   14.202   26.612   3.9259   24.494   6.0135   28.185   5.1828  167.530   24.149  184.351   18.623 -16.82115 30.49554 
1 1 1    6    3   65 o   81.398   27.728   6.0046   4.1372   15.496   6.0068  -2.5616   5.7065  126.031   31.285   57.844   26.857 68.18712 41.23133 
1 1 1    6    4    0 o  1180.69   11.140  1067.47   20.127  1067.47   20.127  1067.47   20.127  1180.69   11.140  1180.69   11.140 0.000000 0.000000 
1 1 1    6    4    1 o  1089.12   8.5274  908.108   14.215  915.936   24.873  904.311   17.323  1093.43   14.862  1086.75   10.414 6.679565 18.14756 
1 1 1    6    4    2 o  524.433   6.7554  210.528   5.4226  209.878   7.6173  211.196   7.7212  523.569   9.5052  525.207   9.6047 -1.638611 13.51290 
1 1 1    6    4    3 o  1875.82   16.796  2696.41   48.225  2719.95   68.927  2673.83   67.498  1882.73   23.918  1866.76   23.623 15.96912 33.61726 
1 1 1    6    4    4 o  551.255   5.7899  232.602   4.8853  230.270   5.9260  237.548   8.6307  548.464   7.0591  556.996   10.123 -8.532471 12.34148 
1 1 1    6    4    5 o  641.847   5.3908  315.329   5.2961  322.842   7.6278  308.335   7.3590  649.403   7.6738  634.647   7.5756 14.75592 10.78318 
1 1 1    6    4    6 o  1452.68   10.947  1615.97   24.341  1645.85   30.373  1562.32   40.697  1465.82   13.537  1427.57   18.625 38.25061 23.02498 
1 1 1    6    4    7 o  811.500   7.0607  504.111   8.7701  512.161   10.782  488.367   15.078  817.903   8.6121  798.522   12.336 19.38116 15.04505 
1 1 1    6    4    8 o  1427.73   8.3945  1560.60   18.345  1581.17   24.006  1531.73   28.441  1436.92   10.915  1414.08   13.140 22.84009 17.08206 
1 1 1    6    4    9 o  306.959   3.5307   72.116   1.6589   70.984   2.5337   72.965   2.1946  304.527   5.4358  308.753   4.6438 -4.226044 7.149360 
1 1 1    6    4   10 o  332.273   3.5903   84.501   1.8260   84.173   2.8227   84.737   2.3945  331.610   5.5611  332.728   4.7017 -1.117493 7.282284 
1 1 1    6    4   11 o  1591.38   7.8207  1938.86   19.050  1924.58   28.841  1949.92   25.372  1585.11   11.887  1595.68   10.388 -10.56775 15.78668 
1 1 1    6    4   12 o  1113.66   6.3858  949.434   10.885  979.817   15.951  922.956   14.891  1131.18   9.2129  1097.89   8.8614 33.28979 12.78291 
1 1 1    6    4   13 o  473.237   3.8931  171.413   2.8200  171.536   3.7750  171.258   4.2418  473.387   5.2100  472.990   5.8591 0.3966370 7.840460 
1 1 1    6    4   14 o  941.123   4.9544  677.981   7.1369  667.971   9.9512  688.583   10.241  934.061   6.9604  948.358   7.0553 -14.29694 9.910770 
1 1 1    6    4   15 o  535.343   4.1344  219.367   3.3878  215.380   5.1173  222.477   4.5201  530.404   6.3032  539.094   5.4779 -8.690491 8.350942 
1 1 1    6    4   16 o  616.620   4.0945  291.034   3.8644  293.150   5.5160  288.993   5.4157  618.809   5.8237  614.408   5.7587 4.401245 8.190097 
1 1 1    6    4   17 o   67.889   11.233   3.6254   1.1264   1.1882   1.6282   5.8624   1.5599   45.819   17.177   86.626   12.095 -40.80641 21.00756 
1 1 1    6    4   18 o  840.755   5.5359  541.137   7.1241  550.153   10.267  532.765   9.8935  847.598   7.9137  834.107   7.7492 13.49194 11.07596 
1 1 1    6    4   19 f   98.664   10.346   7.5393   1.5391   8.1047   2.2753   7.0623   2.0898  101.703   15.073   94.825   14.889 6.877602 21.18635 
1 1 1    6    4   20 o  900.036   5.7314  620.133   7.8956  592.545   13.016  636.195   9.9315  879.552   9.6685  911.545   7.1182 -31.99286 12.00613 
1 1 1    6    4   21 o  647.827   4.6935  321.245   4.6540  320.415   7.1154  321.866   6.1526  646.911   7.1860  648.409   6.1993 -1.497864 9.490478 
1 1 1    6    4   22 o  448.723   4.6037  154.121   3.1620  153.319   4.2273  155.140   4.7641  447.526   6.1712  450.160   6.9142 -2.633942 9.267718 
1 1 1    6    4   23 o  661.881   4.8624  335.326   4.9261  337.107   6.5966  333.080   7.4065  663.596   6.4946  659.596   7.3361 3.999817 9.797857 
1 1 1    6    4   24 o  382.082   4.6468  111.740   2.7176  112.231   3.9242  111.288   3.7670  382.894   6.6958  381.285   6.4548 1.609039 9.300411 
1 1 1    6    4   25 o  896.356   6.5643  615.041   9.0061  612.314   14.534  616.741   11.474  894.196   10.619  897.528   8.3525 -3.332581 13.51049 
1 1 1    6    4   26 f  828.778   5.0924  525.745   6.4600  533.072   9.3113  518.946   8.9699  834.473   7.2900  823.348   7.1176 11.12500 10.18844 
1 1 1    6    4   27 f  524.717   4.7770  210.738   3.8366  210.662   5.4883  210.809   5.3655  524.591   6.8351  524.777   6.6798 -0.1857910 9.557132 
1 1 1    6    4   28 o  671.827   4.9615  345.471   5.1020  351.186   7.4011  340.297   7.0430  677.312   7.1390  666.735   6.9013 10.57721 9.929440 
1 1 1    6    4   29 o  1556.61   8.0315  1855.06   19.136  1860.33   29.319  1851.15   25.257  1558.43   12.291  1554.75   10.613 3.680298 16.23938 
1 1 1    6    4   30 o  1119.35   6.0912  959.110   10.436  975.948   15.046  943.499   14.488  1129.00   8.7067  1110.08   8.5267 18.91699 12.18649 
1 1 1    6    4   31 o  1161.11   7.2281  1032.13   12.846  1036.25   15.828  1024.18   21.989  1163.32   8.8891  1156.24   12.425 7.080811 15.27702 
1 1 1    6    4   32 o  982.672   7.3023  739.302   10.983  746.753   14.342  728.735   17.080  987.483   9.4887  975.355   11.441 12.12787 14.86378 
1 1 1    6    4   33 o  718.040   5.5441  394.675   6.0933  399.002   8.8206  390.726   8.4273  721.874   7.9831  714.360   7.7072 7.513794 11.09644 
1 1 1    6    4   34 o  519.205   5.9137  206.368   4.6997  204.485   6.8103  208.081   6.4937  516.745   8.6103  521.286   8.1386 -4.541077 11.84797 
1 1 1    6    4   35 o  336.480   7.6579   86.694   3.9440   88.307   5.6756   85.188   5.4847  339.503   10.922  333.458   10.746 6.044739 15.32199 
1 1 1    6    4   36 o  811.770   6.2614  504.516   7.7799  499.020   10.423  511.429   11.690  807.208   8.4364  817.118   9.3468 -9.909424 12.59109 
1 1 1    6    4   37 o  711.339   7.5814  387.498   8.2546  380.492   14.050  391.191   10.201  704.442   13.030  714.604   9.3261 -10.16235 16.02386 
1 1 1    6    4   38 o  705.107   6.0714  380.672   6.5526  376.800   9.3164  384.463   9.2178  701.341   8.6786  708.450   8.5006 -7.108582 12.14817 
1 1 1    6    4   39 o  690.060   6.3674  364.646   6.7254  353.429   10.038  373.782   9.0594  679.102   9.6569  698.492   8.4736 -19.38940 12.84748 
1 1 1    6    4   40 o  125.403   19.081   12.381   3.5471   8.1379   5.1155   16.311   4.9227  101.742   30.464  143.558   23.194 -41.81585 38.28841 
1 1 1    6    4   41 o  426.408   7.3693  139.302   4.8097  144.325   7.3934  135.616   6.3330  433.731   11.137  420.553   9.8383 13.17801 14.85986 
1 1 1    6    4   42 o  611.261   6.0873  286.192   5.6953  285.990   8.1380  286.385   7.9734  610.778   8.7049  611.222   8.5226 -0.4439697 12.18235 
1 1 1    6    4   43 o  415.024   7.5786  132.017   4.8143  128.291   6.2445  137.478   7.5591  408.902   9.9772  423.090   11.673 -14.18738 15.35561 
1 1 1    6    4   44 o  288.543   9.9330   63.902   4.3870   61.420   5.9128   66.943   6.5432  282.518   13.673  294.847   14.499 -12.32892 19.92909 
1 1 1    6    4   45 o  455.353   6.7594  158.922   4.7111  166.241   6.7994  152.165   6.5336  465.373   9.5456  445.230   9.5873 20.14301 13.52901 
1 1 1    6    4   46 o  207.067   11.069   33.055   3.4954   31.056   4.9603   35.026   4.9263  199.814   16.362  212.493   15.248 -12.67940 22.36530 
1 1 1    6    4   47 o  403.161   7.1007  124.651   4.3818  125.661   6.2622  123.682   6.1333  404.359   10.118  401.185   9.9880 3.174438 14.21730 
1 1 1    6    4   48 o  320.655   8.4495   78.948   4.1471   74.524   5.6273   84.206   6.1353  311.055   11.819  330.589   12.125 -19.53336 16.93242 
1 1 1    6    4   49 o  400.895   9.6320  123.586   5.9104  128.292   10.280  121.263   7.2237  406.583   16.518  396.612   11.899 9.971710 20.35808 
1 1 1    6    4   50 o  128.612   18.483   13.155   3.5340   16.728   5.0937   9.8381   4.9072  143.735   23.999  108.845   28.951 34.88981 37.60484 
1 1 1    6    4   51 o  192.331   12.683   28.720   3.7127   30.067   5.3109   27.433   5.1921  195.439   17.954  186.473   18.432 8.966812 25.73149 
1 1 1    6    4   52 o  135.180   17.831   14.518   3.5993   6.9153   5.1664   21.687   5.0172   93.444   30.979  164.898   20.307 -71.45388 37.04177 
1 1 1    6    4   53 o  165.840   15.857   21.624   3.9762   16.345   6.0279   25.690   5.2903  139.551   29.160  179.721   19.547 -40.17027 35.10532 
1 1 1    6    4   54 o   60.325   25.430   0.6301   4.0121   6.8385   5.1765  -8.7111   6.3496   92.608   31.018   54.021   26.005 38.58636 40.47721 
1 1 1    6    4   55 o  123.086   23.359   12.486   4.2398   21.013   5.7146   2.0441   6.3236  160.273   24.036   77.535   32.251 82.73793 40.22231 
1 1 1    6    4   56 o  168.897   15.922   22.529   4.0675   24.116   5.8009   20.995   5.7050  172.237   22.545  159.895   24.056 12.34152 32.96905 
1 1 1    6    4   57 o   77.335   26.928   4.5635   3.9096   9.1307   5.5940   0.2029   5.4661  103.283   32.045   67.118   29.018 36.16486 43.23098 
1 1 1    6    4   58 o  141.025   20.306   16.182   4.2569   15.941   6.2953   16.385   5.7782  135.073   31.093  138.377   28.237 -3.304596 42.00136 
1 1 1    6    4   59 o  109.365   25.671   10.228   4.2235   8.4323   5.7272   12.370   6.2533   98.998   32.607  117.471   33.269 -18.47305 46.58370 
1 1 1    6    4   60 o  180.103   19.040   26.284   5.1692   23.090   8.6184   28.079   6.4602  157.721   36.434  183.642   23.524 -25.92081 43.36802 
1 1 1    6    4   61 o  135.504   18.977   15.051   3.8279   17.411   5.3211   12.518   5.5108  142.522   25.320  117.787   30.371 24.73443 39.54108 
1 1 1    6    4   62 o   78.648   26.471   5.1786   3.7701   2.1374   5.3306   8.2224   5.3329   70.549   29.500   95.661   31.463 -25.11218 43.12957 
1 1 1    6    4   63 o   82.888   25.939   6.0381   3.6566   8.6243   5.3315   3.7410   5.0246   96.440   31.446   74.361   29.542 22.07819 43.14578 
1 1 1    6    4   64 o   69.690   26.112   3.7504   3.7622   6.4905   5.7110   1.6496   5.0005   85.857   32.172   65.989   28.127 19.86799 42.73383 
1 1 1    6    4   65 o  152.506   20.480   19.853   4.6599   23.112   5.8446   14.167   7.7204  161.391   24.423  114.094   37.872 47.29720 45.06416 
1 1 1    6    5    0 o  1602.23   14.503  1966.11   35.560  1966.11   35.560  1966.11   35.560  1602.23   14.503  1602.23   14.503 0.000000 0.000000 
1 1 1    6    5    1 o  1510.94   9.7347  1747.94   22.513  1731.99   31.481  1764.64   32.209  1503.70   13.678  1517.79   13.864 -14.08777 19.47559 
1 1 1    6    5    2 o  804.953   6.8904  495.996   8.4896  507.232   10.578  475.662   14.231  813.972   8.4905  788.109   11.797 25.86285 14.53457 
1 1 1    6    5    3 o  1174.31   11.225  1056.00   20.176  1077.63   29.189  1036.22   27.919  1185.90   16.081  1162.92   15.685 22.97400 22.46324 
1 1 1    6    5    4 o  1262.84   9.7624  1221.06   18.870  1216.21   23.009  1231.04   32.979  1260.18   11.929  1267.39   17.000 -7.208618 20.76772 
1 1 1    6    5    5 o  1300.85   12.275  1296.04   24.440  1296.04   24.440   0.0000   0.0000  1300.85   12.275  ?   ?  0.000000 12.27452 
1 1 1    6    5    6 o  922.435   7.7548  651.394   10.949  636.412   18.481  659.497   13.591  911.498   13.246  928.081   9.5674 -16.58282 16.34024 
1 1 1    6    5    7 o  559.674   5.2265  239.758   4.4773  237.656   6.3000  241.902   6.3642  557.176   7.3872  562.132   7.3967 -4.955444 10.45382 
1 1 1    6    5    8 o  393.511   4.7555  118.524   2.8643  123.627   4.0319  113.325   4.0699  401.870   6.5548  384.757   6.9108 17.11362 9.524881 
1 1 1    6    5    9 o  836.944   5.6946  536.183   7.2951  540.641   9.4463  529.596   11.483  840.365   7.3438  831.670   9.0206 8.694214 11.63200 
1 1 1    6    5   10 o  330.351   4.3946   83.530   2.2221   79.276   2.7743   91.142   3.7115  321.818   5.6322  345.045   7.0276 -23.22675 9.005990 
1 1 1    6    5   11 o  1235.92   6.3604  1169.32   12.032  1151.26   18.052  1183.76   16.140  1226.13   9.6188  1243.40   8.4806 -17.26880 12.82351 
1 1 1    6    5   12 o  434.503   4.5193  144.507   3.0056  140.725   4.9235  146.753   3.7948  428.725   7.5028  437.850   5.6623 -9.124268 9.399672 
1 1 1    6    5   13 o  412.981   3.9035  130.542   2.4675  133.113   3.8114  128.687   3.2375  416.996   5.9714  410.018   5.1587 6.977356 7.891155 
1 1 1    6    5   14 o  1069.77   6.2295  876.120   10.200  873.997   17.613  877.192   12.512  1068.12   10.773  1070.33   7.6374 -2.212769 13.20554 
1 1 1    6    5   15 o  465.694   3.8057  165.996   2.7127  165.647   3.8557  166.338   3.8174  465.173   5.4153  466.143   5.3503 -0.9706726 7.612536 
1 1 1    6    5   16 o  424.798   4.4757  138.130   2.9102  142.515   4.2719  134.333   3.9753  431.444   6.4689  418.882   6.2002 12.56158 8.960413 
1 1 1    6    5   17 o  767.510   4.8538  450.929   5.7021  456.457   8.8797  447.050   7.4383  772.076   7.5139  764.139   6.3596 7.936951 9.843966 
1 1 1    6    5   18 o  472.630   4.6713  170.991   3.3793  171.673   4.1133  169.573   5.9273  473.548   5.6749  470.564   8.2294 2.984863 9.996382 
1 1 1    6    5   19 o  488.641   4.2974  182.765   3.2141  181.994   4.8575  183.366   4.2868  487.555   6.5091  489.411   5.7225 -1.856140 8.666911 
1 1 1    6    5   20 o  574.526   4.2526  252.654   3.7397  251.519   5.3524  253.737   5.2273  573.187   6.1007  575.714   5.9320 -2.526794 8.509260 
1 1 1    6    5   21 o  200.184   5.5447   30.676   1.6989   28.783   2.4221   32.510   2.3837  193.881   8.1617  206.061   7.5577 -12.17989 11.12351 
1 1 1    6    5   22 o  1055.16   6.4166  852.320   10.363  846.193   14.564  858.603   14.749  1051.21   9.0517  1058.89   9.0999 -7.676880 12.83516 
1 1 1    6    5   23 o  274.404   5.2305   57.636   2.1969   59.516   3.4094   56.302   2.8728  278.810   7.9892  271.192   6.9207 7.618439 10.56993 
1 1 1    6    5   24 o  722.448   5.0655  399.500   5.6014  396.840   8.6763  401.400   7.3348  719.964   7.8733  724.127   6.6176 -4.162842 10.28498 
1 1 1    6    5   25 o  943.820   6.7584  681.906   9.7634  691.862   16.074  676.085   12.290  950.490   11.048  939.714   8.5448 10.77673 13.96714 
1 1 1    6    5   26 o  809.086   5.0431  501.056   6.2454  498.117   8.8602  503.959   8.8049  806.654   7.1760  811.373   7.0898 -4.719360 10.08765 
1 1 1    6    5   27 o  454.380   4.8777  158.028   3.3924  159.544   4.8620  156.589   4.7356  456.525   6.9579  452.280   6.8406 4.244965 9.757382 
1 1 1    6    5   28 o  742.485   5.3796  421.973   6.1137  419.191   9.2842  424.102   8.1237  739.957   8.1973  744.312   7.1307 -4.354858 10.86469 
1 1 1    6    5   29 o  546.131   5.0750  228.296   4.2423  230.275   6.1328  226.480   5.8747  548.449   7.3056  543.916   7.0564 4.532227 10.15697 
1 1 1    6    5   30 o  939.398   6.0412  675.519   8.6864  676.700   11.539  673.974   13.196  940.137   8.0187  938.183   9.1893 1.953796 12.19606 
1 1 1    6    5   31 o  876.297   6.5115  587.850   8.7337  586.063   10.626  591.571   15.332  874.904   7.9351  878.808   11.398 -3.904175 13.88839 
1 1 1    6    5   32 o  266.516   9.1014   54.394   3.7128   51.656   5.1097   57.455   5.4041  259.646   12.857  273.832   12.893 -14.18567 18.20842 
1 1 1    6    5   33 o  733.405   5.8947  411.762   6.6172  411.727   8.9401  411.804   9.8408  733.292   7.9652  733.322   8.7673 -0.3002930E-01 11.84528 
1 1 1    6    5   34 o  375.725   7.0935  108.085   4.0794  116.104   5.6941   99.629   5.8473  389.345   9.5548  360.634   10.593 28.71179 14.26553 
1 1 1    6    5   35 o  450.869   6.6942  155.640   4.6197  159.945   6.3187  150.697   6.7713  456.984   9.0336  443.539   9.9740 13.44498 13.45683 
1 1 1    6    5   36 o  218.309   10.708   36.517   3.5781   35.044   5.2166   37.824   4.9169  213.104   16.112  221.598   14.578 -8.494141 21.72799 
1 1 1    6    5   37 o  521.659   8.2225  208.424   6.5654  190.532   11.716  216.616   7.9271  498.290   15.361  531.730   9.7399 -33.43973 18.18842 
1 1 1    6    5   38 o  344.494   7.7667   90.896   4.0953   93.529   5.8560   88.375   5.7294  349.312   10.953  339.549   11.024 9.763702 15.53982 
1 1 1    6    5   39 o  626.288   6.0464  300.350   5.7962  295.217   8.2963  305.245   8.1012  620.727   8.7320  631.210   8.3851 -10.48248 12.10610 
1 1 1    6    5   40 o  242.493   10.060   45.083   3.7341   41.897   5.3478   48.113   5.2162  233.031   15.074  249.952   13.686 -16.92090 20.36019 
1 1 1    6    5   41 f  205.743   11.847   32.595   3.7151   29.538   5.3941   35.354   5.1241  194.958   18.290  213.820   15.768 -18.86218 24.14843 
1 1 1    6    5   42 o  139.603   16.217   15.205   3.4007   14.937   4.9622   15.442   4.6697  136.738   24.614  139.494   22.647 -2.755814 33.44805 
1 1 1    6    5   43 o  153.174   15.951   18.269   3.6848   20.174   4.8774   15.736   5.6241  160.242   20.344  139.732   27.275 20.50967 34.02666 
1 1 1    6    5   44 o  580.793   7.1457  258.551   6.3524  259.269   8.8400  257.785   9.1345  581.184   9.9374  579.455   10.299 1.728943 14.31153 
1 1 1    6    5   45 o  425.233   6.8537  138.604   4.4609  138.479   6.5107  138.714   6.1244  424.664   10.016  425.108   9.4122 -0.4440613 13.74480 
1 1 1    6    5   46 o  174.315   12.714   23.518   3.3689   20.474   4.7743   26.535   4.7545  161.238   19.759  184.447   17.033 -23.20909 26.08708 
1 1 1    6    5   47 o  130.777   17.521   13.483   3.4191   9.8824   4.6926   17.558   4.9919  109.782   27.875  148.277   22.719 -38.49490 35.96080 
1 1 1    6    5   48 o  155.770   14.058   18.890   3.3157   22.886   4.7998   15.242   4.5857  170.571   18.690  137.838   22.513 32.73369 29.26021 
1 1 1    6    5   49 o   76.505   28.392   3.7483   4.4266   5.4274   8.6319   3.1492   5.1562   98.831   38.891   77.232   30.157 21.59928 49.21325 
1 1 1    6    5   50 o   63.266   24.491   2.1348   3.3783   6.0285   4.9031  -1.3845   4.6614   88.901   30.186   58.498   25.992 30.40257 39.83438 
1 1 1    6    5   51 o  281.811   9.3275   61.120   4.0234   59.801   5.8051   62.339   5.5814  277.873   13.649  283.900   12.844 -6.027466 18.74205 
1 1 1    6    5   52 o  191.821   13.408   28.642   3.9119   30.062   5.9594   27.567   5.1855  194.481   20.320  186.794   18.374 7.686737 27.39533 
1 1 1    6    5   53 o   59.604   24.406   1.1881   3.5458   3.6398   5.2055  -0.9341   4.8430   78.634   30.412   60.676   26.749 17.95807 40.50195 
1 1 1    6    5   54 o  136.789   20.265   15.077   4.1145   13.519   5.1951   17.700   6.7396  126.920   27.534  144.058   31.447 -17.13832 41.79757 
1 1 1    6    5   55 o  269.965   11.433   56.410   4.7243   54.625   6.3709   58.590   7.0416  263.857   15.848  272.822   16.946 -8.965057 23.20212 
1 1 1    6    5   56 o  150.313   17.153   17.978   3.8757   21.872   5.5798   14.347   5.3874  163.735   22.890  130.117   27.889 33.61789 36.07954 
1 1 1    6    5   57 o  146.442   17.705   17.152   3.8880   11.840   5.5744   22.183   5.4256  116.784   30.758  165.018   22.031 -48.23367 37.83410 
1 1 1    6    5   58 o  194.838   14.501   29.881   4.2936   27.779   6.1870   31.834   5.9634  184.352   22.385  198.794   19.865 -14.44109 29.92827 
1 1 1    6    5   59 o   94.416   27.005   7.6516   4.0992   11.702   5.6099   3.0112   6.0047  114.929   31.123   77.816   31.800 37.11312 44.49557 
1 1 1    6    5   60 o  135.946   24.919   15.713   4.9942   20.541   8.3317   13.005   6.2394  147.979   36.908  119.498   33.016 28.48029 49.52079 
1 1 1    6    5   61 o   68.436   25.869   3.2298   3.7097  -1.3006   5.1428   8.1440   5.3562   59.745   26.868   95.922   31.531 -36.17662 41.42546 
1 1 1    6    5   62 o  126.947   20.034   13.419   3.7637   16.690   5.2915   10.070   5.3544  138.411   25.930  104.692   31.126 33.71863 40.51164 
1 1 1    6    5   63 o   51.321   23.148  -1.1380   3.8506   4.6191   5.8437  -5.5557   5.1190   79.931   31.826   49.596   23.737 30.33438 39.70276 
1 1 1    6    5   64 o   74.161   25.890   4.6720   3.6150   10.717   5.1607  -1.1521   5.0654  105.900   30.303   58.158   26.361 47.74243 40.16487 
1 1 1    6    5   65 o   79.399   28.923   5.5640   4.5595   14.968   5.6426 -12.1291   7.7397  124.820   29.923   53.555   26.402 71.26498 39.90582 
1 1 1    6    6    0 o  1269.48   11.898  1234.12   23.115  1234.12   23.115  1234.12   23.115  1269.48   11.898  1269.48   11.898 0.000000 0.000000 
1 1 1    6    6    1 o  1491.26   11.148  1702.99   25.446  1723.70   31.616  1664.91   42.873  1500.06   13.770  1473.64   19.007 26.42212 23.47119 
1 1 1    6    6    2 o  1060.96   8.4388  861.765   13.704  880.097   17.138  829.255   22.821  1072.08   10.444  1040.41   14.331 31.67493 17.73256 
1 1 1    6    6    3 o  679.153   7.8105  353.108   8.1192  384.746   12.310  328.747   10.802  708.806   11.346  655.216   10.771 53.58911 15.64449 
1 1 1    6    6    4 o  2142.89   15.555  3518.61   51.018  3598.51   64.273  3382.52   83.883  2166.34   19.383  2098.69   26.113 67.64966 32.52067 
1 1 1    6    6    5 o  1320.85   12.462  1336.28   25.195  1345.86   35.945  1327.03   35.325  1325.03   17.723  1315.75   17.540 9.276611 24.93537 
1 1 1    6    6    6 o  1176.24   9.2916  1059.33   16.728  1055.98   28.875  1061.02   20.524  1173.84   16.071  1177.04   11.392 -3.201416 19.69892 
1 1 1    6    6    7 o  449.469   4.9561  154.632   3.4096  150.819   4.7542  158.669   4.8926  443.863   6.9978  455.268   7.0211 -11.40469 9.912886 
1 1 1    6    6    8 o  584.374   5.3860  261.393   4.8175  257.705   6.7238  265.283   6.9059  580.190   7.5714  588.656   7.6646 -8.466125 10.77364 
1 1 1    6    6    9 o  1081.76   6.7871  895.828   11.238  889.396   14.351  906.025   18.070  1077.77   8.6991  1087.66   10.854 -9.888916 13.91006 
1 1 1    6    6   10 o  250.226   4.6153   47.925   1.7677   48.542   2.2215   46.861   2.9185  251.820   5.7636  247.402   7.7070 4.418564 9.623781 
1 1 1    6    6   11 o  499.475   5.3203  190.964   4.0675  187.613   5.6865  194.475   5.8203  495.024   7.5050  503.995   7.5449 -8.970642 10.64189 
1 1 1    6    6   12 o  567.380   10.727  246.584   9.3160   0.0000   0.0000  246.584   9.3160  ?   ?   567.380   10.727 0.000000 10.72716 
1 1 1    6    6   13 o  346.951   4.1891   92.138   2.2246   92.527   3.8580   91.945   2.7229  347.631   7.2505  346.574   5.1329 1.057251 8.883554 
1 1 1    6    6   14 o  1080.71   6.3149  894.151   10.446  883.700   17.984  899.472   12.832  1073.99   10.940  1083.82   7.7354 -9.832397 13.39857 
1 1 1    6    6   15 o  241.820   4.9103   44.763   1.8175   44.668   3.4797   44.799   2.1313  241.491   9.4138  241.906   5.7562 -0.4154358 11.03421 
1 1 1    6    6   16 o  1331.62   7.4239  1357.80   15.131  1344.65   26.033  1364.51   18.595  1324.44   12.842  1334.72   9.1020 -10.28125 15.74016 
1 1 1    6    6   17 o  182.747   5.9561   25.568   1.6660   25.758   2.4543   25.404   2.2688  183.392   8.7434  182.136   8.1383 1.255676 11.94486 
1 1 1    6    6   18 o  551.764   4.7765  233.045   4.0339  232.884   4.9122  233.377   7.0694  551.545   5.8187  552.035   8.3666 -0.4899292 10.19100 
1 1 1    6    6   19 o  692.522   4.6781  367.105   4.9587  363.334   7.4905  370.048   6.6160  688.870   7.1040  695.241   6.2171 -6.371338 9.440331 
1 1 1    6    6   20 o  948.766   5.1665  689.054   7.5028  680.144   10.501  698.344   10.723  942.511   7.2793  955.035   7.3357 -12.52338 10.33443 
1 1 1    6    6   21 o  1025.38   5.8338  804.849   9.1560  810.329   12.217  797.828   13.829  1028.76   7.7586  1020.73   8.8515 8.033447 11.77049 
1 1 1    6    6   22 o  231.619   5.2375   41.065   1.8568   41.245   2.7120   40.905   2.5476  232.105   7.6336  231.150   7.2005 0.9546814 10.49373 
1 1 1    6    6   23 o  654.393   4.8130  327.776   4.8209  332.532   7.4551  324.358   6.3201  659.061   7.3902  650.939   6.3433 8.122314 9.739229 
1 1 1    6    6   24 o  940.858   6.6514  677.632   9.5786  682.106   15.349  674.779   12.258  943.779   10.626  938.801   8.5308 4.977966 13.62636 
1 1 1    6    6   25 o  1185.49   7.7567  1075.91   14.075  1021.73   21.566  1116.10   18.577  1154.99   12.199  1207.31   10.053 -52.31738 15.80728 
1 1 1    6    6   26 o  367.990   5.0124  103.650   2.8233  102.362   4.0207  104.902   3.9653  365.671   7.1835  370.184   6.9982 -4.512543 10.02887 
1 1 1    6    6   27 o  513.399   5.1209  201.749   4.0241  210.413   6.2435  195.592   5.2632  524.259   7.7806  505.478   6.8026 18.78152 10.33500 
1 1 1    6    6   28 o  359.969   5.7907   99.186   3.1906   99.634   4.8188   98.837   4.2574  360.737   8.7273  359.307   7.7412 1.429932 11.66585 
1 1 1    6    6   29 o  482.057   5.1793  177.872   3.8216  178.098   5.5339  177.665   5.2837  482.322   7.4960  481.742   7.1657 0.5800476 10.36997 
1 1 1    6    6   30 o  1015.87   6.2491  789.989   9.7169  785.380   12.816  796.221   14.903  1012.80   8.2670  1019.70   9.5483 -6.891663 12.62986 
1 1 1    6    6   31 o  807.335   6.3722  498.963   7.8743  493.477   9.4818  511.154   14.135  802.832   7.7160  816.893   11.305 -14.06085 13.68710 
1 1 1    6    6   32 o  529.134   5.8816  214.330   4.7636  217.767   7.3320  211.819   6.2663  533.269   8.9827  525.975   7.7835 7.294189 11.88576 
1 1 1    6    6   33 o  355.436   6.7336   96.721   3.6634   95.788   5.2500   97.605   5.1142  353.649   9.6988  356.997   9.3593 -3.347687 13.47826 
1 1 1    6    6   34 o  594.619   6.0519  270.680   5.5081  273.768   7.5130  267.091   8.0992  597.922   8.2091  590.552   8.9601 7.369690 12.15211 
1 1 1    6    6   35 o  463.303   6.6213  164.342   4.6954  167.397   6.4365  160.868   6.8648  467.506   8.9949  458.267   9.7868 9.239685 13.29242 
1 1 1    6    6   36 o  442.407   6.6205  149.859   4.4832  149.245   6.4588  150.430   6.2278  441.390   9.5601  443.155   9.1814 -1.765076 13.25492 
1 1 1    6    6   37 o  391.885   9.1714  117.649   5.5013  111.604   10.512  119.928   6.4559  381.147   18.019  395.595   10.662 -14.44803 20.93734 
1 1 1    6    6   38 o  216.835   10.796   36.040   3.5831   35.452   5.1986   36.572   4.9455  214.271   15.965  217.766   14.927 -3.495209 21.85661 
1 1 1    6    6   39 o  574.210   6.1248  252.486   5.3831  267.255   7.8886  239.617   7.3641  590.586   8.7266  559.224   8.6033 31.36163 12.25446 
1 1 1    6    6   40 o  104.697   22.254   8.7815   3.4564   8.3287   4.9843   9.2010   4.7971  102.501   29.913  107.016   28.697 -4.514954 41.45240 
1 1 1    6    6   41 f  318.396   7.9673   77.688   3.8828   72.163   5.4952   83.197   5.4871  306.629   11.709  329.301   10.886 -22.67258 15.98758 
1 1 1    6    6   42 o  285.078   8.7343   62.310   3.8112   61.050   5.4494   63.517   5.3321  281.900   12.630  287.582   12.113 -5.681763 17.49976 
1 1 1    6    6   43 o  284.867   10.486   62.291   4.5720   64.027   5.3812   57.784   8.6689  288.659   12.179  272.377   20.954 16.28268 24.23667 
1 1 1    6    6   44 o  267.303   9.3636   54.829   3.8310   54.131   5.7767   55.377   5.1186  264.743   14.309  268.358   12.462 -3.615143 18.97439 
1 1 1    6    6   45 o  430.722   6.7798  142.206   4.4697  141.586   6.3930  142.799   6.2517  429.425   9.7262  431.297   9.4701 -1.871399 13.57505 
1 1 1    6    6   46 o  183.223   11.953   25.941   3.3339   20.694   4.7326   31.110   4.6972  162.156   19.456  200.122   15.455 -37.96654 24.84715 
1 1 1    6    6   47 o   84.007   23.941   5.6749   3.2279   5.3994   4.5188   5.9619   4.6126   85.255   28.979   88.408   29.270 -3.153152 41.18850 
1 1 1    6    6   48 o   59.474   23.503   1.6047   3.1649   0.2992   4.5633   2.8147   4.3934   63.397   26.942   72.236   27.939 -8.839630 38.81330 
1 1 1    6    6   49 o  215.105   14.473   35.963   4.7374   30.230   9.6402   37.789   5.4395  190.422   34.338  220.084   16.263 -29.66179 37.99443 
1 1 1    6    6   50 o  217.306   10.958   36.489   3.6330   37.168   5.2326   35.858   5.0479  218.215   15.772  214.393   15.487 3.821945 22.10456 
1 1 1    6    6   51 o  250.011   10.050   48.151   3.8457   53.139   5.6352   43.803   5.2614  261.440   14.135  237.177   14.564 24.26308 20.29484 
1 1 1    6    6   52 o  260.122   10.257   52.164   4.0837   46.055   6.0597   57.246   5.5275  242.518   16.421  271.830   13.285 -29.31259 21.12222 
1 1 1    6    6   53 o  286.314   9.4376   63.159   4.1359   65.130   5.8196   61.148   5.8791  289.845   13.118  280.686   13.684 9.159088 18.95601 
1 1 1    6    6   54 o  125.550   21.639   12.836   4.0083   11.412   4.9957   15.411   6.7157  116.194   28.342  133.627   33.024 -17.43362 43.51866 
1 1 1    6    6   55 o  101.775   26.236   8.7134   4.1130   9.6185   5.4004   7.4633   6.3467  106.267   31.172   97.307   34.282 8.960030 46.33565 
1 1 1    6    6   56 o  105.344   23.672   9.2616   3.7240   7.7584   5.2761   10.754   5.2570   96.581   31.269  111.846   30.062 -15.26591 43.37538 
1 1 1    6    6   57 o  284.923   10.273   62.799   4.4801   64.165   6.5209   61.577   6.1655  285.944   14.951  280.346   14.417 5.598053 20.76979 
1 1 1    6    6   58 o   51.757   23.549  -2.0090   4.0910   2.2771   5.7201  -6.4972   5.8533   74.537   30.811   53.911   25.686 20.62554 40.11333 
1 1 1    6    6   59 o  210.291   13.937   34.805   4.4606   43.156   5.9976   24.467   6.6728  232.775   16.950  170.014   26.506 62.76167 31.46248 
1 1 1    6    6   60 o  226.208   14.614   40.485   5.0330   21.185   9.2393   48.629   6.0017  147.793   39.908  247.246   15.944 -99.45285 42.97482 
1 1 1    6    6   61 o   47.817   21.931  -2.0193   3.6421  -1.0197   4.9262  -3.2245   5.4089   59.187   26.480   56.685   26.258 2.501720 37.29189 
1 1 1    6    6   62 o  192.779   13.332   29.439   3.9096   32.205   5.4965   26.606   5.5621  198.804   18.267  179.054   20.675 19.75011 27.58909 
1 1 1    6    6   63 o   96.284   26.179   8.3506   3.9596  -3.4937   5.6494   19.788   5.5514   56.541   26.408  150.374   24.997 -93.83324 36.36246 
1 1 1    6    6   64 o   62.601   24.703   2.5277   3.4917   0.1965   4.8275   5.0850   5.0563   60.504   26.688   78.743   30.096 -18.23919 40.22456 
1 1 1    6    6   65 o   54.696   24.783  -1.0217   4.4719  -3.6486   5.4823   4.2016   7.7305   54.351   25.585   80.930   34.746 -26.57878 43.14924 
1 1 1    6    7    0 o  1382.22   12.829  1463.16   27.137  1463.16   27.137  1463.16   27.137  1382.22   12.829  1382.22   12.829 0.000000 0.000000 
1 1 1    6    7    2 o  420.053   5.2474  135.055   3.3738  137.673   4.1531  129.974   5.7853  424.091   6.3980  412.015   9.1737 12.07581 11.18437 
1 1 1    6    7    3 o  1099.82   10.720  926.300   18.047  949.629   26.220  905.301   24.877  1113.23   15.388  1086.97   14.952 26.25525 21.45570 
1 1 1    6    7    4 o  1042.00   10.388  831.430   16.568  867.184   24.606  801.773   22.410  1063.82   15.111  1022.98   14.312 40.84277 20.81287 
1 1 1    6    7    5 f  630.696   7.7413  304.526   7.4731  311.429   10.789  298.159   10.361  637.695   11.054  623.968   10.848 13.72656 15.48781 
1 1 1    6    7    6 o  414.434   4.9127  131.465   3.1164  131.754   4.3862  131.171   4.4285  414.861   6.9074  413.941   6.9896 0.9200439 9.826812 
1 1 1    6    7    7 o  287.724   5.0034   63.366   2.2035   65.565   3.1525   61.266   3.0812  292.651   7.0378  282.894   7.1158 9.756927 10.00822 
1 1 1    6    7    8 f  1200.58   8.2447  1103.59   15.151  1107.00   21.493  1100.23   21.361  1202.18   11.680  1198.50   11.644 3.681396 16.49293 
1 1 1    6    7    9 o  2185.78   13.778  3660.99   46.096  3667.89   65.371  3654.16   65.009  2186.46   19.533  2182.38   19.461 4.077637 27.57328 
1 1 1    6    7   10 o  389.966   6.0252  116.414   3.5964  112.563   6.2698  118.302   4.3905  383.356   10.685  393.093   7.2971 -9.736816 12.93909 
1 1 1    6    7   11 o  584.489   6.2432  261.529   5.5854  262.573   6.8608  259.478   9.6179  585.610   7.6542  582.020   10.796 3.590515 13.23428 
1 1 1    6    7   12 o   46.730   14.409   1.6682   1.1330   1.4588   1.3613   2.1404   2.0442   45.991   15.897   55.955   19.472 -9.964153 25.13703 
1 1 1    6    7   13 o  732.928   6.1912  411.254   6.9455  413.245   9.8445  409.282   9.8005  734.573   8.7557  731.043   8.7586 3.530640 12.38444 
1 1 1    6    7   14 o  824.655   5.9253  520.626   7.4791  519.596   11.810  521.316   9.6643  823.638   9.3675  825.112   7.6522 -1.473755 12.09576 
1 1 1    6    7   15 o  706.861   5.0205  382.485   5.4318  373.859   7.4993  392.004   7.8783  698.764   7.0116  715.512   7.1936 -16.74750 10.04543 
1 1 1    6    7   16 o  247.859   4.5686   47.026   1.7332   47.401   2.7262   46.771   2.2455  248.810   7.1584  247.169   5.9353 1.640884 9.298917 
1 1 1    6    7   17 o  246.599   5.8742   46.555   2.2172   47.434   2.7853   45.034   3.6634  248.895   7.3113  242.465   9.8710 6.429581 12.28377 
1 1 1    6    7   18 o  468.396   4.3191  167.934   3.0965  169.654   4.8502  166.751   4.0232  470.733   6.7315  466.716   5.6318 4.017059 8.776701 
1 1 1    6    7   19 o  485.475   4.6801  180.407   3.4777  190.223   6.1706  175.838   4.2100  498.418   8.0885  479.266   5.7390 19.15195 9.917624 
1 1 1    6    7   20 o  422.672   4.4524  136.745   2.8805  139.070   3.8799  133.890   4.2996  426.225   5.9472  418.195   6.7170 8.029449 8.971439 
1 1 1    6    7   21 o  473.083   4.2585  171.304   3.0837  175.421   4.4867  167.618   4.2453  478.702   6.1234  467.938   5.9272 10.76422 8.522141 
1 1 1    6    7   22 o  675.827   4.5454  349.596   4.7019  360.262   6.8312  339.994   6.4815  686.013   6.5058  666.441   6.3540 19.57196 9.093837 
1 1 1    6    7   23 o  275.211   5.7055   57.976   2.4034   66.427   3.7317   51.987   3.1418  294.556   8.2770  260.585   7.8769 33.97079 11.42606 
1 1 1    6    7   24 o  508.461   5.5330  197.891   4.3061  204.400   7.2823  194.392   5.3397  516.681   9.2083  503.922   6.9228 12.75873 11.52029 
1 1 1    6    7   25 o  1115.86   6.2938  953.121   10.750  927.506   15.954  974.416   14.547  1100.62   9.4706  1128.16   8.4243 -27.54407 12.67522 
1 1 1    6    7   26 o  1218.95   6.6661  1137.40   12.437  1140.65   19.024  1134.97   16.437  1220.50   10.183  1217.54   8.8198 2.957153 13.47168 
1 1 1    6    7   27 o  1245.23   6.8089  1186.99   12.978  1195.14   19.931  1181.00   17.099  1249.29   10.423  1241.97   8.9947 7.322021 13.76769 
1 1 1    6    7   28 o  1366.68   6.8376  1429.85   14.304  1417.99   20.050  1442.14   20.411  1360.82   9.6260  1372.36   9.7170 -11.53503 13.67771 
1 1 1    6    7   29 o  596.137   5.0820  272.019   4.6372  265.856   6.5394  278.253   6.5767  589.296   7.2499  602.883   7.1270 -13.58661 10.16635 
1 1 1    6    7   30 o  367.027   6.5236  103.123   3.6648  100.682   4.7836  106.592   5.7023  362.619   8.6185  373.079   9.9858 -10.46017 13.19071 
1 1 1    6    7   31 f  707.854   6.1380  383.568   6.6503  387.831   9.4254  379.342   9.3846  711.683   8.6525  703.848   8.7110 7.834351 12.27791 
1 1 1    6    7   32 f  931.764   5.7630  664.601   8.2191  666.470   11.770  662.823   11.483  932.950   8.2422  930.404   8.0631 2.546021 11.53027 
1 1 1    6    7   33 o  607.278   5.6132  282.311   5.2175  286.484   7.5852  278.563   7.1882  611.664   8.1019  603.161   7.7861 8.502319 11.23670 
1 1 1    6    7   34 o  348.758   7.3109   93.131   3.9027   94.329   5.4085   91.831   5.6371  350.918   10.069  346.222   10.637 4.696411 14.64724 
1 1 1    6    7   35 o  309.642   7.8375   73.421   3.7146   76.651   5.3797   70.477   5.1352  316.285   11.112  303.281   11.062 13.00433 15.67994 
1 1 1    6    7   36 f  1003.51   7.0809  771.111   10.876  773.206   15.825  769.236   14.973  1004.57   10.292  1002.04   9.7625 2.524414 14.18545 
1 1 1    6    7   37 o  437.967   8.0063  146.914   5.3671  146.645   7.6629  147.173   7.5197  437.386   11.446  438.187   11.212 -0.8009033 16.02237 
1 1 1    6    7   38 o  407.390   6.8995  127.103   4.3023  128.840   6.1965  125.486   5.9781  410.020   9.8735  404.660   9.6517 5.359833 13.80730 
1 1 1    6    7   39 f  625.047   5.9782  299.172   5.7195  290.204   8.0356  308.380   8.1426  615.420   8.5305  634.411   8.3853 -18.99176 11.96176 
1 1 1    6    7   40 o  275.263   9.0101   58.077   3.7962   57.997   5.5868   58.146   5.1741  274.825   13.281  275.243   12.282 -0.4178162 18.08934 
1 1 1    6    7   41 o  792.050   5.9909  480.491   7.2629  481.796   10.358  479.228   10.187  792.805   8.5357  790.707   8.4168 2.098755 11.98758 
1 1 1    6    7   42 o  523.899   6.8561  210.301   5.4978  208.580   7.1663  212.764   8.5712  521.532   8.9773  526.525   10.635 -4.992676 13.91767 
1 1 1    6    7   43 f  400.875   8.1230  123.215   4.9842  125.354   6.7040  120.572   7.4528  404.047   10.840  396.078   12.293 7.969360 16.39008 
1 1 1    6    7   44 o  419.483   6.7690  134.864   4.3462  128.672   6.1678  140.970   6.1252  409.412   9.8424  428.595   9.3369 -19.18375 13.56655 
1 1 1    6    7   45 o  252.158   9.1299   48.805   3.5238   50.813   5.0965   46.965   4.8775  256.581   13.020  246.658   12.965 9.922958 18.37372 
1 1 1    6    7   46 o  384.671   7.3459  113.486   4.3252  119.325   6.0705  107.465   6.1641  394.076   10.064  373.872   10.772 20.20456 14.74148 
1 1 1    6    7   47 o  215.457   10.404   35.696   3.4311   38.328   4.9151   33.194   4.7917  222.300   14.525  206.663   15.256 15.63695 21.06477 
1 1 1    6    7   48 o  303.816   10.619   71.034   4.9382   75.779   8.8537   68.892   5.9497  311.479   18.657  298.786   13.010 12.69293 22.74462 
1 1 1    6    7   49 o  123.746   19.310   12.225   3.5381   13.896   5.5053   11.049   4.6180  129.558   28.533  115.748   26.621 13.81001 39.02335 
1 1 1    6    7   50 f  309.613   8.4600   73.684   4.0092   68.723   5.7116   78.502   5.6291  298.240   12.512  318.981   11.529 -20.74155 17.01390 
1 1 1    6    7   51 o  289.626   9.0427   64.544   4.0087   68.933   5.7352   60.352   5.6054  298.570   12.550  279.236   13.115 19.33435 18.15202 
1 1 1    6    7   52 o  416.971   7.7136  133.624   4.9230  150.180   7.6447  121.892   6.4350  440.978   11.326  397.512   10.576 43.46698 15.49614 
1 1 1    6    7   53 o  301.757   8.9168   70.111   4.1184   73.490   5.9597   67.022   5.6978  308.005   12.641  294.134   12.656 13.87085 17.88797 
1 1 1    6    7   54 f  148.175   18.347   17.508   4.0722   17.518   5.1901   17.493   6.5683  146.204   24.027  143.317   30.855 2.887146 39.10696 
1 1 1    6    7   55 o  156.952   17.693   19.602   4.1763   13.559   5.5642   27.399   6.3201  126.066   29.380  183.707   22.979 -57.64066 37.29894 
1 1 1    6    7   56 f  282.927   10.201   61.875   4.4177   67.340   6.4791   57.126   6.0392  293.713   14.412  270.058   14.665 23.65485 20.56130 
1 1 1    6    7   57 o  141.347   18.695   16.085   3.9455   19.714   5.8769   13.107   5.3235  153.552   25.928  123.516   28.705 30.03620 38.68088 
1 1 1    6    7   58 f   60.219   25.355   0.8356   3.9811   7.3888   5.6251  -5.7409   5.6350   94.390   32.331   53.860   25.529 40.52962 41.19472 
1 1 1    6    7   59 o  292.286   11.964   66.574   5.3524   63.106   8.3211   69.022   6.9905  279.837   19.550  295.448   15.512 -15.61047 24.95651 
1 1 1    6    7   60 o   44.727   21.227  -4.1868   3.9197  -3.8096   6.0098  -4.4660   5.1709   59.183   27.506   52.835   24.864 6.348232 37.07874 
1 1 1    6    7   61 o   58.832   24.601   1.1152   3.7071   2.0002   5.1061   0.1287   5.3909   69.385   28.930   64.908   28.429 4.476898 40.56047 
1 1 1    6    7   62 o   83.025   26.254   5.9907   3.7363   9.3136   5.2256   2.5153   5.3442  100.624   30.930   71.551   29.696 29.07346 42.87794 
1 1 1    6    7   63 o  156.133   16.944   19.942   3.9844   16.447   5.8326   23.000   5.4557  133.437   29.355  164.156   22.290 -30.71936 36.85833 
1 1 1    6    7   64 o   89.861   25.116   7.3222   3.5885   10.519   5.0655   4.1018   5.0842  104.755   30.037   74.708   29.705 30.04655 42.24424 
1 1 1    6    8    0 o  778.132   11.892  463.897   14.156  463.897   14.156  463.897   14.156  778.132   11.892  778.132   11.892 0.000000 0.000000 
1 1 1    6    8    1 o  248.590   6.4028   47.305   2.4363   48.150   3.4311   46.446   3.4599  250.772   8.9388  246.293   9.1779 4.478989 12.81159 
1 1 1    6    8    2 o  1556.83   14.260  1857.04   33.979  1905.85   49.522  1813.61   46.709  1576.18   20.527  1537.69   19.846 38.49329 28.55180 
1 1 1    6    8    3 o  1663.08   21.429  2122.31   54.548   0.0000   0.0000  2122.31   54.548  ?   ?   1663.08   21.429 0.000000 21.42884 
1 1 1    6    8    4 o  329.071   5.4985   82.889   2.7695   81.437   3.3896   85.805   4.8037  326.161   6.7896  334.754   9.3752 -8.593262 11.57555 
1 1 1    6    8    5 o  814.262   7.2552  507.582   9.0423  514.697   11.219  494.391   15.276  819.882   8.9399  803.365   12.423 16.51642 15.30535 
1 1 1    6    8    6 o  577.470   5.3709  255.256   4.7473  250.306   6.6072  260.539   6.8255  571.792   7.5494  583.360   7.6441 -11.56805 10.74365 
1 1 1    6    8    7 f  1205.13   9.5341  1112.16   17.587  1135.98   31.135  1100.99   21.312  1217.22   16.711  1198.90   11.614 18.32507 20.35076 
1 1 1    6    8    8 o  872.546   7.6651  582.897   10.237  577.307   17.576  585.767   12.594  868.005   13.229  874.602   9.4073 -6.597168 16.23309 
1 1 1    6    8    9 o  492.018   6.1112  185.319   4.6023  177.973   7.8720  189.134   5.6728  482.034   10.669  497.024   7.4568 -14.99005 13.01690 
1 1 1    6    8   10 o  441.971   5.9866  149.537   4.0499  149.629   5.0008  149.362   6.9035  442.074   7.3904  441.594   10.214 0.4801331 12.60698 
1 1 1    6    8   11 o  502.750   6.1557  193.501   4.7369  192.386   5.8305  195.667   8.1244  501.257   7.5994  505.401   10.502 -4.143829 12.96334 
1 1 1    6    8   12 o  850.789   6.6469  554.186   8.6559  553.891   12.216  554.483   12.267  850.396   9.3850  850.848   9.4192 -0.4517822 13.29661 
1 1 1    6    8   13 o  449.775   5.5213  154.865   3.8011  154.999   5.3552  154.729   5.3960  449.907   7.7765  449.512   7.8426 0.3949585 11.04450 
1 1 1    6    8   14 o  426.406   4.8454  139.183   3.1625  135.214   3.9414  146.357   5.2988  420.254   6.1273  437.174   7.9187 -16.92038 10.01247 
1 1 1    6    8   15 o  516.989   5.0456  204.601   3.9927  204.241   5.0603  205.196   6.4988  516.495   6.4009  517.636   8.2023 -1.140381 10.40431 
1 1 1    6    8   16 o  686.109   5.4927  360.371   5.7684  359.972   7.3750  361.000   9.2577  685.667   7.0272  686.555   8.8096 -0.8876953 11.26900 
1 1 1    6    8   17 o  660.988   4.9926  334.445   5.0511  337.491   7.1402  331.394   7.1465  663.918   7.0263  657.891   7.0969 6.027527 9.986773 
1 1 1    6    8   18 o  640.357   5.4346  313.901   5.3267  316.316   8.3057  312.213   6.9426  642.703   8.4430  638.578   7.1029 4.125305 11.03337 
1 1 1    6    8   19 o  339.885   5.1645   88.429   2.6868   92.580   3.7076   83.839   3.8989  347.741   6.9658  330.905   7.6978 16.83630 10.38163 
1 1 1    6    8   20 o  1196.41   6.4330  1095.79   11.781  1103.29   18.164  1090.35   15.477  1200.26   9.8869  1193.31   8.4737 6.953491 13.02133 
1 1 1    6    8   21 o  663.831   4.8051  337.302   4.8824  336.269   7.5460  338.045   6.4034  662.746   7.4388  664.527   6.2954 -1.781067 9.745121 
1 1 1    6    8   22 o  952.741   5.6289  694.815   8.2086  712.216   12.884  682.924   10.650  964.473   8.7272  944.491   7.3670 19.98175 11.42092 
1 1 1    6    8   23 o  317.096   5.1499   76.963   2.4995   81.039   4.0483   74.452   3.1776  325.348   8.1292  311.866   6.6567 13.48288 10.50696 
1 1 1    6    8   24 o  1069.65   6.5821  875.833   10.777  901.515   15.893  853.976   14.662  1085.08   9.5692  1056.11   9.0700 28.97131 13.18466 
1 1 1    6    8   25 o  1255.43   6.7889  1206.51   13.046  1234.30   20.405  1187.29   16.966  1269.60   10.500  1245.29   8.9010 24.31531 13.76531 
1 1 1    6    8   26 o  1340.89   7.1303  1376.40   14.634  1371.45   22.244  1380.17   19.432  1338.24   10.860  1342.59   9.4557 -4.351318 14.39941 
1 1 1    6    8   27 o  1156.57   6.5047  1023.96   11.515  1020.32   17.522  1026.73   15.278  1154.33   9.9170  1158.03   8.6192 -3.695190 13.13913 
1 1 1    6    8   28 o  781.254   5.4440  467.197   6.5100  467.922   9.9223  466.649   8.6262  781.770   8.2921  780.744   7.2184 1.025452 10.99384 
1 1 1    6    8   29 o  695.626   5.1120  370.393   5.4430  374.204   7.8365  366.841   7.5657  699.135   7.3230  692.227   7.1406 6.907104 10.22810 
1 1 1    6    8   30 o  300.760   8.1194   69.259   3.7378   67.591   4.3399   74.048   7.3555  297.093   9.5436  310.802   15.462 -13.70981 18.16990 
1 1 1    6    8   31 o  477.432   5.7910  174.489   4.2319  173.825   6.3421  175.022   5.6817  476.449   8.6966  478.114   7.7639 -1.664856 11.65798 
1 1 1    6    8   32 o  516.339   5.6207  204.088   4.4422  205.275   6.3582  202.957   6.2087  517.771   8.0229  514.845   7.8787 2.926208 11.24458 
1 1 1    6    8   33 f  691.067   5.9319  365.603   6.2746  357.108   8.3737  376.480   9.4753  682.907   8.0110  701.144   8.8291 -18.23773 11.92176 
1 1 1    6    8   34 o  178.942   11.848   24.645   3.2267   28.015   4.7246   21.698   4.4175  190.395   16.371  167.236   17.517 23.15894 23.97667 
1 1 1    6    8   35 o  441.518   6.4432  149.252   4.3543  151.853   6.4590  147.085   5.8954  445.241   9.4777  438.222   8.7892 7.018707 12.92577 
1 1 1    6    8   36 o  357.912   8.4261   98.116   4.6161   92.433   7.5242  101.546   5.8454  347.138   14.161  364.034   10.491 -16.89655 17.62330 
1 1 1    6    8   37 o  465.150   7.2540  165.699   5.1646  165.570   7.9500  165.794   6.7934  464.751   11.176  465.167   9.5413 -0.4162292 14.69465 
1 1 1    6    8   38 o  511.150   6.4233  200.080   5.0255  199.788   6.9327  200.404   7.2953  510.633   8.8700  511.390   9.3201 -0.7564087 12.86630 
1 1 1    6    8   39 o  268.876   8.8337   55.403   3.6355   59.583   5.4098   51.960   4.9094  278.636   12.684  260.223   12.326 18.41281 17.68666 
1 1 1    6    8   40 o  379.713   7.0227  110.453   4.0816  106.884   5.9062  113.716   5.6470  373.314   10.336  385.118   9.5797 -11.80441 14.09284 
1 1 1    6    8   41 o  778.334   5.8672  463.993   6.9899  458.176   9.9311  469.703   9.8398  773.123   8.3923  782.815   8.2122 -9.691711 11.74182 
1 1 1    6    8   42 f   71.228   25.078   3.4803   3.3956   0.4594   4.2372   8.9022   5.6767   62.302   26.191  106.005   32.171 -43.70284 41.48434 
1 1 1    6    8   43 o  409.847   7.6445  128.773   4.7956  126.964   6.4004  131.089   7.2410  406.677   10.282  413.077   11.452 -6.399841 15.39101 
1 1 1    6    8   44 o  254.553   8.7252   49.713   3.3996   53.711   4.9043   46.016   4.7167  264.285   12.124  244.247   12.660 20.03806 17.52864 
1 1 1    6    8   45 o   95.893   21.076   7.4224   3.0091   9.1661   4.2217   5.6217   4.2902  106.072   26.165   85.986   28.217 20.08650 38.48134 
1 1 1    6    8   46 o  402.832   7.1324  124.447   4.3978  126.394   6.1282  122.380   6.3147  405.588   9.8714  399.019   10.339 6.568939 14.29495 
1 1 1    6    8   47 o  113.553   18.189   10.255   3.0546   10.707   4.4127   9.8386   4.2326  114.410   25.812  109.646   25.673 4.764198 36.40546 
1 1 1    6    8   48 o   89.342   25.773   6.4640   3.7194   5.5111   6.6187   6.9038   4.4965   92.343   34.628   92.889   28.715 -0.5462494 44.98480 
1 1 1    6    8   49 o  205.859   11.692   32.786   3.6690   39.175   5.9022   28.762   4.6840  223.708   17.373  191.812   16.103 31.89548 23.68844 
1 1 1    6    8   50 o  302.307   8.4055   70.251   3.8894   69.828   5.5388   70.661   5.4628  300.703   12.034  302.545   11.797 -1.841522 16.85162 
1 1 1    6    8   51 o  426.527   7.3904  139.740   4.8248  151.307   7.3626  131.033   6.3875  442.894   10.861  412.368   10.120 30.52576 14.84484 
1 1 1    6    8   52 o  170.944   13.355   22.785   3.4666   23.638   4.9137   21.940   4.8915  172.574   18.912  165.954   19.637 6.619781 27.26349 
1 1 1    6    8   53 o  210.272   11.346   34.273   3.6382   38.279   5.2348   30.531   5.0601  221.052   15.571  196.862   16.958 24.18942 23.02268 
1 1 1    6    8   54 o  273.048   12.499   57.806   5.2238   57.332   6.0176   59.255   10.523  270.931   14.564  269.804   25.796 1.127655 29.62389 
1 1 1    6    8   55 o  282.360   9.5156   61.518   4.1125   61.841   6.0205   61.236   5.6311  281.779   13.959  280.687   13.107 1.091736 19.14787 
1 1 1    6    8   56 o   47.519   21.736  -2.0950   3.5446   0.3085   5.1708  -4.2258   4.8686   65.856   28.348   52.121   24.399 13.73585 37.40263 
1 1 1    6    8   57 o   70.652   26.272   3.3881   3.7942   5.0404   5.4469   1.8307   5.2883   84.086   31.437   71.217   29.547 12.86921 43.14259 
1 1 1    6    8   58 o  251.874   11.101   49.250   4.2796   52.515   6.3312   46.504   5.8071  257.607   16.138  242.563   15.726 15.04378 22.53329 
1 1 1    6    8   59 o   65.128   27.288   1.3352   4.5744   4.5842   7.4181  -0.6584   5.8108   87.406   35.488   65.704   29.115 21.70190 45.90292 
1 1 1    6    8   60 f  135.440   19.436   15.058   3.9138   21.332   5.8533   9.9852   5.2635  158.501   24.952  105.454   30.729 53.04726 39.58360 
1 1 1    6    8   61 o   64.661   25.600   2.4211   3.7615  -2.7156   5.2878   7.6832   5.3519   56.988   26.244   93.394   31.538 -36.40617 41.02890 
1 1 1    6    8   62 o   66.831   26.018   2.9377   3.8293   7.6417   5.5123  -1.4495   5.3235   92.253   31.983   59.689   27.043 32.56342 41.88358 
1 1 1    6    8   63 o  133.221   18.405   14.759   3.6528   13.111   5.0507   16.565   5.2892  119.425   28.099  135.999   26.360 -16.57375 38.52829 
1 1 1    6    8   64 o   81.953   25.817   6.0652   3.6156   5.1434   5.0873   7.0059   5.1395   78.745   30.167   86.976   30.828 -8.230865 43.13216 
1 1 1    6    9    0 o  1776.28   22.731  2419.72   61.778  2419.72   61.778  2419.72   61.778  1776.28   22.731  1776.28   22.731 0.000000 0.000000 
1 1 1    6    9    1 o  1232.90   11.759  1164.31   22.191  1204.68   32.584  1129.39   30.306  1253.51   16.983  1213.79   16.312 39.72046 23.54803 
1 1 1    6    9    2 o  854.246   12.776  559.048   16.706   0.0000   0.0000  559.048   16.706  ?   ?   854.246   12.776 0.000000 12.77645 
1 1 1    6    9    3 o  361.285   9.4600   99.951   5.2313   0.0000   0.0000   99.951   5.2313  ?   ?   361.285   9.4600 0.000000 9.459986 
1 1 1    6    9    4 o  614.320   7.6572  288.931   7.2001  278.583   9.8703  300.700   10.526  603.109   10.692  626.580   10.975 -23.47131 15.32265 
1 1 1    6    9    5 o  809.280   8.8465  501.494   10.958  505.779   15.589  497.308   15.407  812.515   12.535  805.685   12.493 6.829651 17.69769 
1 1 1    6    9    6 f  1245.09   9.8349  1187.22   18.743  1169.80   22.619  1225.39   33.482  1235.72   11.959  1264.05   17.305 -28.33093 21.03519 
1 1 1    6    9    7 o  883.274   6.6810  597.272   9.0325  603.608   12.897  591.174   12.654  887.799   9.4911  878.613   9.4092 9.186584 13.36467 
1 1 1    6    9    8 o  410.612   5.1524  129.060   3.2382  131.479   4.6112  126.707   4.5485  414.400   7.2699  406.810   7.3048 7.590149 10.30588 
1 1 1    6    9    9 o  352.233   5.9521   94.979   3.2090   97.016   3.9949   91.274   5.3877  355.964   7.3321  345.197   10.197 10.76685 12.55935 
1 1 1    6    9   10 o  583.146   6.4224  260.346   5.7325  263.825   7.0998  253.831   9.7164  586.974   7.9023  575.599   11.028 11.37506 13.56741 
1 1 1    6    9   11 f  1034.57   7.5004  819.558   11.877  817.407   16.749  821.733   16.845  1032.95   10.594  1035.68   10.626 -2.726685 15.00463 
1 1 1    6    9   12 o  625.283   5.8399  299.317   5.5892  298.938   7.8966  299.698   7.9121  624.787   8.2573  625.581   8.2630 -0.7943726 11.68161 
1 1 1    6    9   13 o  828.087   6.6222  525.020   8.3936  523.110   11.825  526.959   11.916  826.405   9.3484  829.438   9.3861 -3.032410 13.24731 
1 1 1    6    9   14 o  522.536   5.0116  209.014   4.0084  209.092   5.0951  208.887   6.4931  522.595   6.3697  522.276   8.1223 0.3194580 10.32207 
1 1 1    6    9   15 f  309.041   6.0945   73.118   2.8828   69.291   4.0570   77.021   4.0973  300.787   8.8120  317.133   8.4408 -16.34540 12.20234 
1 1 1    6    9   16 o  306.697   5.3343   72.006   2.5041   71.859   3.1329   72.267   4.1672  306.361   6.6810  307.183   8.8629 -0.8218994 11.09899 
1 1 1    6    9   17 o  138.762   8.4841   14.800   1.7933   14.063   2.3828   15.762   2.7234  134.981   11.647  142.867   12.583 -7.886078 17.14567 
1 1 1    6    9   18 o  679.816   5.6491  353.777   5.8782  346.718   7.4345  365.549   9.6009  672.947   7.2177  690.898   9.0788 -17.95123 11.59828 
1 1 1    6    9   19 o  862.872   5.7100  569.944   7.5414  556.596   10.418  584.636   10.930  852.614   7.9831  873.818   8.1723 -21.20325 11.42437 
1 1 1    6    9   20 o  729.776   5.3608  407.661   5.9881  411.908   8.5137  403.503   8.4239  733.499   7.5831  725.978   7.5808 7.521179 10.72255 
1 1 1    6    9   21 o  657.020   5.2514  330.421   5.2811  339.512   7.5969  321.918   7.3467  665.943   7.4529  648.460   7.4018 17.48297 10.50395 
1 1 1    6    9   22 o  451.286   5.1725  155.886   3.5729  155.993   5.0658  155.781   5.0400  451.407   7.3318  451.101   7.2994 0.3052673 10.34585 
1 1 1    6    9   23 o  651.889   5.7873  325.284   5.7746  330.104   9.7810  322.705   7.1546  656.597   9.7323  649.269   7.1993 7.328186 12.10571 
1 1 1    6    9   24 o  412.364   5.8261  130.160   3.6773  131.748   6.6012  129.445   4.4280  414.793   10.397  411.214   7.0351 3.578735 12.55367 
1 1 1    6    9   25 o  162.830   8.7237   20.358   2.1663   18.443   3.8224   21.264   2.6294  154.257   16.442  166.315   10.381 -12.05836 19.44500 
1 1 1    6    9   26 o  802.774   5.4443  493.283   6.6897  493.753   10.380  492.949   8.7492  803.067   8.4443  802.457   7.1233 0.6097412 11.04751 
1 1 1    6    9   27 o  444.473   5.8519  151.222   3.9812  140.327   5.7314  161.380   5.5342  428.110   8.7466  459.122   7.8751 -31.01248 11.76945 
1 1 1    6    9   28 o  1334.32   7.1818  1363.00   14.668  1369.19   22.467  1358.41   19.364  1337.06   10.978  1331.91   9.4983 5.149780 14.51656 
1 1 1    6    9   29 o  608.505   5.3909  283.433   5.0210  291.857   7.6500  277.057   6.6551  617.408   8.0951  601.576   7.2276 15.83252 10.85216 
1 1 1    6    9   30 o  642.032   6.7425  315.568   6.6259  306.779   8.1247  333.020   11.449  632.973   8.3860  659.355   11.344 -26.38116 14.10749 
1 1 1    6    9   31 o  1032.62   6.3203  816.310   9.9897  808.922   15.101  822.058   13.321  1027.74   9.5998  1036.13   8.3993 -8.395264 12.75556 
1 1 1    6    9   32 o  548.520   5.8640  230.327   4.9233  225.228   7.4052  234.367   6.5910  542.314   8.9210  553.250   7.7832 -10.93640 11.83907 
1 1 1    6    9   33 o  586.283   5.9617  263.142   5.3499  267.509   7.3995  258.358   7.7440  591.047   8.1792  580.826   8.7107 10.22058 11.94884 
1 1 1    6    9   34 o  358.217   6.7460   98.248   3.6988   97.982   5.3833   98.485   5.0908  357.645   9.8339  358.581   9.2754 -0.9359436 13.51812 
1 1 1    6    9   35 o  439.196   6.9008  147.699   4.6390  144.515   7.7204  149.498   5.8036  434.236   11.616  441.802   8.5822 -7.566406 14.44222 
1 1 1    6    9   36 o  232.991   12.343   41.737   4.3863   39.567   10.312   42.216   4.8465  224.068   30.890  234.217   13.577 -10.14854 33.74194 
1 1 1    6    9   37 o  774.906   6.3447  459.809   7.5254  462.639   12.076  458.012   9.6224  776.952   10.154  773.253   8.1300 3.698792 13.00800 
1 1 1    6    9   38 o  457.056   6.4000  159.979   4.4773  160.831   6.4222  159.173   6.2453  458.116   9.1588  455.762   8.9525 2.354309 12.80748 
1 1 1    6    9   39 o   79.571   23.771   4.9508   3.1172   7.8277   4.4376   2.1484   4.3798   99.111   28.010   70.090   27.664 29.02109 39.36868 
1 1 1    6    9   40 o  348.548   7.5236   93.085   4.0138   94.380   5.5868   91.703   5.7705  350.775   10.406  345.725   10.905 5.049591 15.07274 
1 1 1    6    9   41 o  504.927   6.1670  195.295   4.7662  190.124   6.7699  200.376   6.7113  497.955   8.8823  511.236   8.5766 -13.28088 12.34717 
1 1 1    6    9   42 o  551.924   7.3536  233.471   6.2122  232.709   7.3121  235.449   11.778  550.865   8.6722  553.215   13.909 -2.350708 16.39106 
1 1 1    6    9   43 f  200.604   10.756   30.994   3.2907   25.484   4.7947   35.899   4.5244  180.813   17.546  215.529   13.787 -34.71599 22.31430 
1 1 1    6    9   44 o  605.941   5.9802  281.336   5.5465  275.371   7.8010  287.434   7.8875  599.113   8.5069  612.110   8.4186 -12.99768 11.96831 
1 1 1    6    9   45 o  235.203   9.5688   42.484   3.4448   41.871   4.7554   43.160   4.9971  232.737   13.406  236.220   13.882 -3.482864 19.29816 
1 1 1    6    9   46 o   61.367   22.998   2.2357   2.9184   6.1456   4.2245  -1.3338   4.0364   88.514   27.909   54.441   24.188 34.07286 36.93225 
1 1 1    6    9   47 o  359.949   7.2193   99.400   3.9775   94.861   5.7125  103.671   5.5414  351.135   10.629  367.213   9.8589 -16.07813 14.49716 
1 1 1    6    9   48 o   75.238   26.329   4.0532   3.7399   6.0621   6.6906   3.1403   4.5103   94.581   34.943   74.124   28.403 20.45729 45.03045 
1 1 1    6    9   49 o  169.441   13.337   22.334   3.4310   24.922   5.4646   20.649   4.4081  177.194   20.528  161.767   18.114 15.42688 27.37763 
1 1 1    6    9   50 o   40.716   19.090  -2.9565   3.0004  -3.9389   4.2753  -2.0030   4.2117   48.966   22.904   53.423   24.142 -4.456665 33.27806 
1 1 1    6    9   51 o  358.591   7.8139   98.819   4.2888  102.955   6.4047   95.457   5.7747  365.149   11.459  351.793   10.724 13.35556 15.69482 
1 1 1    6    9   52 o  107.793   20.354   9.4394   3.2351   9.5432   4.5822   9.3363   4.5681  106.706   27.783  105.558   27.865 1.147713 39.34862 
1 1 1    6    9   53 o  124.957   17.987   12.486   3.3412   9.9649   4.7300   14.997   4.7203  108.721   28.188  135.288   23.657 -26.56702 36.79965 
1 1 1    6    9   54 o  287.268   12.009   63.935   5.2802   67.373   6.0735   53.293   10.685  294.425   13.477  254.338   27.906 40.08711 30.99030 
1 1 1    6    9   55 o   78.023   25.199   4.8633   3.4281   8.6531   5.0406   1.6020   4.6761  101.056   30.236   67.620   27.897 33.43662 41.13917 
1 1 1    6    9   56 o   73.276   25.565   4.0391   3.5246   6.0479   5.2116   2.3459   4.7847   88.130   31.064   70.811   28.588 17.31848 42.21667 
1 1 1    6    9   57 o  181.169   14.620   25.856   4.0195   26.681   5.7162   25.049   5.6532  181.406   20.973  175.463   21.499 5.942245 30.03503 
1 1 1    6    9   58 o  227.960   12.187   40.586   4.2368   35.550   6.0499   45.434   5.9352  210.279   19.002  239.372   16.296 -29.09320 25.03296 
1 1 1    6    9   59 o  250.636   13.069   49.301   4.9962   46.300   7.7589   51.427   6.5303  237.876   21.544  253.906   16.900 -16.03052 27.38108 
1 1 1    6    9   60 o  250.489   11.353   48.942   4.3530   46.763   6.5109   50.704   5.8535  241.015   17.775  252.667   15.206 -11.65166 23.39176 
1 1 1    6    9   61 o  165.809   15.637   22.054   3.9216   19.739   5.4311   24.576   5.6685  152.147   24.127  171.367   22.128 -19.21980 32.73716 
1 1 1    6    9   62 o  139.258   18.907   16.070   3.9259   23.460   5.6030   8.9440   5.5024  166.132   22.622   98.032   31.945 68.10006 39.14415 
1 1 1    6    9   63 o  167.888   14.795   22.738   3.7630   19.978   5.2137   25.741   5.4368  151.877   23.160  174.578   20.753 -22.70029 31.09793 
1 1 1    6    9   64 o  122.645   21.123   12.984   3.8222   15.661   5.4978   10.480   5.3176  129.275   28.548  103.524   31.074 25.75092 42.19656 
1 1 1    6   10    0 o  158.303   11.538   19.491   2.7616   19.491   2.7616   19.491   2.7616  158.303   11.538  158.303   11.538 0.000000 0.000000 
1 1 1    6   10    1 o  1006.64   8.2883  775.881   12.771  778.320   15.689  771.091   21.983  1008.10   10.168  1003.05   14.319 5.048889 17.56170 
1 1 1    6   10    2 o  748.370   8.4397  428.836   9.6675  427.851   13.654  429.827   13.690  747.322   11.937  749.046   11.940 -1.723877 16.88372 
1 1 1    6   10    3 o  288.097   9.9081   63.566   4.3692   0.0000   0.0000   63.566   4.3692  ?   ?   288.097   9.9081 0.000000 9.908106 
1 1 1    6   10    4 o  543.842   10.516  226.537   8.7537   0.0000   0.0000  226.537   8.7537  ?   ?   543.842   10.516 0.000000 10.51594 
1 1 1    6   10    5 o  803.360   8.9520  494.226   11.008  498.438   15.796  490.250   15.349  806.519   12.795  799.887   12.536 6.631958 17.91326 
1 1 1    6   10    6 f  551.794   6.2325  233.092   5.2639  227.336   6.3501  245.737   9.4113  544.897   7.6137  566.385   10.856 -21.48798 13.25966 
1 1 1    6   10    7 o  388.549   5.1754  115.566   3.0779  118.739   4.4091  112.549   4.2988  393.803   7.3147  383.401   7.3252 10.40240 10.35199 
1 1 1    6   10    8 o  192.456   6.9992   28.359   2.0618   30.240   2.5951   25.138   3.3952  198.717   8.5320  180.697   12.350 18.02019 15.01038 
1 1 1    6   10    9 o  541.690   5.5258  224.626   4.5816  229.003   6.5005  220.306   6.4584  546.869   7.7659  536.381   7.8665 10.48859 11.05398 
1 1 1    6   10   10 o  1059.58   7.6249  859.694   12.366  868.708   17.677  851.054   17.306  1064.83   10.846  1053.97   10.727 10.86304 15.25473 
1 1 1    6   10   11 o  616.950   5.8149  291.393   5.4911  292.627   7.7740  290.164   7.7572  618.156   8.2163  615.547   8.2333 2.608765 11.63164 
1 1 1    6   10   12 o  157.875   8.0128   19.136   1.9299   22.807   2.7364   15.502   2.7224  172.225   10.430  141.650   12.691 30.57558 16.42654 
1 1 1    6   10   13 o  384.378   5.6280  113.106   3.3112  112.610   4.6753  113.605   4.6901  383.477   7.9652  385.168   7.9555 -1.691223 11.25761 
1 1 1    6   10   14 o  247.651   6.5075   46.956   2.4667   43.706   3.4166   50.494   3.5651  238.878   9.3444  256.765   9.0712 -17.88747 13.02322 
1 1 1    6   10   15 o  795.125   6.6128  484.035   8.0481  488.650   11.462  479.548   11.303  798.751   9.3753  791.281   9.3323 7.470520 13.22832 
1 1 1    6   10   16 o  1223.20   9.8754  1146.00   18.489  1153.33   22.627  1131.27   32.076  1226.86   12.049  1214.31   17.257 12.55554 21.04767 
1 1 1    6   10   17 o  580.038   6.8483  257.578   6.0801  255.963   7.1873  261.642   11.402  578.175   8.1215  584.337   12.748 -6.162354 15.11500 
1 1 1    6   10   18 o  1194.10   7.6012  1091.68   13.893  1083.38   17.711  1104.96   22.399  1189.40   9.7288  1200.96   12.185 -11.56482 15.59234 
1 1 1    6   10   19 o  473.249   4.8705  171.429   3.5281  176.112   4.9864  166.734   4.9925  479.635   6.7921  466.686   6.9891 12.94876 9.745813 
1 1 1    6   10   20 o  640.516   5.1735  314.028   5.0721  319.177   7.2031  308.965   7.1432  645.696   7.2882  635.281   7.3461 10.41553 10.34814 
1 1 1    6   10   21 o  716.738   5.4032  393.215   5.9276  396.368   8.3933  390.078   8.3726  719.548   7.6208  713.815   7.6631 5.733093 10.80740 
1 1 1    6   10   22 o  626.597   5.2640  300.524   5.0486  302.420   7.1225  298.610   7.1574  628.526   7.4035  624.552   7.4871 3.974426 10.52944 
1 1 1    6   10   23 o  428.320   6.5819  140.434   4.3151  132.558   6.4893  146.677   5.7775  416.071   10.190  437.701   8.6236 -21.63000 13.34904 
1 1 1    6   10   24 o  1056.34   7.2218  854.211   11.677  858.942   18.427  851.037   15.094  1059.05   11.368  1054.28   9.3533 4.771240 14.72117 
1 1 1    6   10   25 o  612.779   5.0862  287.414   4.7706  285.569   7.4230  288.712   6.2268  610.749   7.9405  614.133   6.6242 -3.383728 10.34074 
1 1 1    6   10   26 f  1550.09   7.9915  1839.53   18.961  1842.12   29.108  1837.62   24.989  1550.80   12.263  1549.08   10.539 1.723145 16.16952 
1 1 1    6   10   27 o  116.012   12.533   10.430   2.1902   11.546   3.5839   9.7649   2.7669  121.089   20.037  111.639   16.706 9.450417 26.08801 
1 1 1    6   10   28 o  198.335   8.5921   30.119   2.6084   28.147   4.3342   31.239   3.2660  191.060   14.939  201.684   10.617 -10.62387 18.32788 
1 1 1    6   10   29 o  1259.38   9.3105  1214.54   17.947  1212.92   25.063  1216.25   25.712  1258.19   13.014  1259.88   13.333 -1.693359 18.63190 
1 1 1    6   10   30 o  569.412   5.7553  248.198   5.0161  252.528   8.2721  245.680   6.3082  574.242   9.4114  566.476   7.2753 7.765686 11.89553 
1 1 1    6   10   31 o  360.765   6.3926   99.639   3.5300  102.613   5.3545   97.353   4.6946  366.037   9.5571  356.557   8.6020 9.480042 12.85818 
1 1 1    6   10   32 o  546.549   5.8545  228.678   4.8976  222.896   6.5620  235.949   7.3588  539.530   7.9461  555.074   8.6614 -15.54419 11.75413 
1 1 1    6   10   33 o  559.765   5.6494  239.871   4.8403  235.895   6.8611  243.811   6.8295  555.021   8.0764  564.264   7.9075 -9.242920 11.30293 
1 1 1    6   10   34 o  857.761   5.7918  563.273   7.6041  555.088   10.739  571.505   10.769  851.359   8.2408  863.864   8.1444 -12.50476 11.58629 
1 1 1    6   10   35 o  357.496   7.5547   97.872   4.1339  104.430   7.0278   94.403   5.1118  369.076   12.440  351.036   9.5137 18.04001 15.66123 
1 1 1    6   10   36 o  227.128   10.328   39.534   3.5904   42.381   5.7346   37.699   4.6046  234.389   16.082  221.261   13.663 13.12825 21.10207 
1 1 1    6   10   37 o  534.289   5.8913  218.581   4.8179  220.124   6.9490  217.154   6.6857  536.025   8.4696  532.414   8.2040 3.610718 11.79155 
1 1 1    6   10   38 o  208.409   10.027   33.298   3.1984   30.418   4.7459   35.694   4.3293  198.327   15.764  215.242   13.205 -16.91519 20.56366 
1 1 1    6   10   39 o  340.981   7.0755   89.068   3.6928   87.736   5.2769   90.346   5.1696  338.245   10.192  343.263   9.8393 -5.017731 14.16678 
1 1 1    6   10   40 o  400.476   6.8647  122.870   4.2079  115.635   5.7156  131.432   6.2179  388.311   9.6164  413.969   9.8131 -25.65781 13.73947 
1 1 1    6   10   41 o  290.206   8.0041   64.558   3.5554   66.790   4.9328   62.145   5.1291  294.974   10.925  284.464   11.780 10.51056 16.06660 
1 1 1    6   10   42 o   48.051   22.312  -3.4113   3.9402  -0.8204   4.1692 -25.0725   12.055   57.315   25.054   66.822   32.944 -9.506077 41.38917 
1 1 1    6   10   43 o  412.683   6.4561  130.510   4.0781  128.280   5.7753  132.728   5.7592  408.861   9.2285  415.911   9.0468 -7.049561 12.92324 
1 1 1    6   10   44 f  158.377   12.374   19.416   2.9759   19.122   4.3110   19.683   4.1131  156.101   18.396  158.643   17.215 -2.541641 25.19453 
1 1 1    6   10   45 o  482.775   6.5642  178.675   4.8506  181.179   6.7754  176.043   6.9473  485.766   9.1126  478.766   9.4804 6.999481 13.14976 
1 1 1    6   10   46 o  104.753   18.998   8.7825   2.9339   6.7281   4.2252   10.695   4.0771   91.739   27.735  114.755   23.984 -23.01560 36.66721 
1 1 1    6   10   47 o  295.309   9.5012   67.036   4.2946   62.383   6.9171   69.954   5.4784  283.298   16.018  301.297   11.879 -17.99854 19.94189 
1 1 1    6   10   48 o  237.918   10.233   43.567   3.7265   48.163   6.1342   40.879   4.6915  248.587   16.210  229.617   13.407 18.97002 21.03612 
1 1 1    6   10   49 o  186.853   11.152   27.014   3.1750   26.583   4.5181   27.435   4.4627  184.248   16.185  187.318   15.710 -3.070618 22.55569 
1 1 1    6   10   50 o  200.436   10.985   31.078   3.3571   27.883   4.8809   33.947   4.6249  188.356   17.116  208.688   14.570 -20.33218 22.47817 
1 1 1    6   10   51 o  461.295   6.8408  163.386   4.8301  158.087   6.9298  168.392   6.7359  452.917   9.9961  467.629   9.4107 -14.71265 13.72893 
1 1 1    6   10   52 o  337.489   7.9610   87.583   4.1124   91.653   5.9987   83.975   5.6488  344.391   11.380  329.700   11.193 14.69012 15.96227 
1 1 1    6   10   53 o  102.169   24.349   8.6849   3.7538   6.9862   4.7098   11.643   6.2155   92.521   29.500  116.447   33.234 -23.92646 44.43811 
1 1 1    6   10   54 o   58.643   24.593   0.7318   3.7213  -3.7303   4.8973   6.8281   5.7242   53.577   24.877   93.321   32.579 -39.74404 40.99096 
1 1 1    6   10   55 f  138.303   16.902   15.235   3.5035   14.413   5.1779   15.929   4.7581  130.866   26.753  139.227   23.140 -8.360596 35.37162 
1 1 1    6   10   56 o  348.119   8.8516   93.481   4.7165   97.507   6.6798   89.479   6.6605  354.233   12.320  339.121   12.832 15.11252 17.78852 
1 1 1    6   10   57 f  227.125   12.254   40.249   4.2443   36.369   5.9442   44.285   6.0621  213.318   18.385  236.294   16.872 -22.97597 24.95327 
1 1 1    6   10   58 o  275.801   12.277   59.300   5.1825   48.464   8.1208   66.746   6.7316  243.633   22.015  290.842   15.174 -47.21001 26.73742 
1 1 1    6   10   59 o  252.085   12.807   49.859   4.9253   33.393   7.3946   62.988   6.6032  199.454   24.754  281.930   15.360 -82.47565 29.13191 
1 1 1    6   10   60 o  211.062   13.448   35.162   4.3218   35.787   6.5822   34.688   5.7300  208.574   20.899  207.010   18.271 1.563583 27.75986 
1 1 1    6   10   61 o  220.195   12.596   38.221   4.2277   31.405   5.9577   45.135   6.0003  195.061   20.249  236.824   16.659 -41.76343 26.22140 
1 1 1    6   10   62 o  169.420   17.183   23.436   4.3942   9.4134   6.8616   33.186   5.7214   99.461   35.581  200.632   18.852 -101.1713 40.26637 
1 1 1    6   10   63 o  136.409   17.846   15.445   3.6368   12.244   5.0563   18.876   5.2347  114.295   28.889  146.606   24.170 -32.31193 37.66609 
1 1 1    6   10   64 o   63.007   26.736   1.6248   4.4821   1.6994   5.3017   1.4379   8.3918   66.739   28.717   76.527   34.376 -9.787102 44.79257 
1 1 1    6   11    0 o  160.477   12.292   20.066   2.9787   20.066   2.9787   20.066   2.9787  160.477   12.292  160.477   12.292 0.000000 0.000000 
1 1 1    6   11    1 o  484.273   5.8526  179.531   4.3382  181.973   5.3547  174.867   7.4006  487.521   7.1759  477.809   10.119 9.712067 12.40520 
1 1 1    6   11    2 o  1227.94   11.853  1155.30   22.277  1140.68   31.051  1170.80   31.980  1219.47   16.635  1235.42   16.912 -15.94690 23.72240 
1 1 1    6   11    3 o  127.441   10.658   12.528   2.0598   11.821   2.8616   13.289   2.9674  123.189   15.521  130.784   15.101 -7.594315 21.65503 
1 1 1    6   11    4 o  887.760   9.4481  603.621   12.838  593.871   17.874  614.012   18.452  880.232   13.266  895.013   13.469 -14.78082 18.90569 
1 1 1    6   11    5 o  119.568   11.471   11.055   2.0735   10.485   2.9856   11.586   2.8819  115.614   17.412  121.891   15.820 -6.277145 23.52534 
1 1 1    6   11    6 o  1086.39   15.587  905.206   25.919  905.206   25.919   0.0000   0.0000  1086.39   15.587  ?   ?  0.000000 15.58670 
1 1 1    6   11    7 o  593.639   11.395  270.018   10.354  270.018   10.354   0.0000   0.0000  593.639   11.395  ?   ?  0.000000 11.39491 
1 1 1    6   11    8 o  409.772   5.3057  128.540   3.3278  129.354   4.7028  127.723   4.7096  411.016   7.4752  408.414   7.5337 2.601410 10.61302 
1 1 1    6   11    9 o  806.452   6.4718  497.931   7.9886  502.490   11.380  493.501   11.217  809.973   9.1788  802.700   9.1299 7.273315 12.94627 
1 1 1    6   11   10 f  463.195   5.4989  164.245   3.8986  159.965   5.4258  168.813   5.6054  457.055   7.7558  469.524   7.7998 -12.46857 10.99947 
1 1 1    6   11   11 o  388.059   5.5140  115.281   3.2751  117.311   4.6073  113.207   4.6566  391.408   7.6903  384.495   7.9125 6.913055 11.03397 
1 1 1    6   11   12 o  402.051   5.6211  123.745   3.4591  122.679   4.8515  124.848   4.9334  400.257   7.9190  403.778   7.9825 -3.521057 11.24413 
1 1 1    6   11   13 o  309.348   5.9988   73.261   2.8404   71.140   3.9701   75.486   4.0656  304.787   8.5100  313.960   8.4602 -9.172668 11.99983 
1 1 1    6   11   14 o  690.924   7.2230  365.505   7.6386  367.738   9.3518  361.029   13.241  692.956   8.8170  686.369   12.603 6.586914 15.38111 
1 1 1    6   11   15 f  219.524   8.6995   36.904   2.9231   38.583   3.4854   32.922   5.3673  224.438   10.146  206.455   17.140 17.98322 19.91748 
1 1 1    6   11   16 o  639.732   7.1608  313.330   7.0118  319.335   12.237  310.395   8.5554  645.589   12.384  636.668   8.7793 8.920837 15.18022 
1 1 1    6   11   17 o  761.667   5.8548  444.091   6.8256  444.883   8.7650  442.871   10.880  762.288   7.5122  760.482   9.3470 1.805969 11.99164 
1 1 1    6   11   18 o  342.205   5.5253   89.639   2.8941   94.314   3.7035   82.307   4.6382  350.996   6.8935  327.854   9.2427 23.14218 11.53030 
1 1 1    6   11   19 o  559.994   5.4791  240.040   4.6963  235.152   5.8718  248.717   7.8239  554.235   6.9217  569.942   8.9686 -15.70667 11.32892 
1 1 1    6   11   20 o  387.782   5.0578  115.100   3.0020  116.332   4.1862  113.796   4.3074  389.827   7.0158  385.549   7.2991 4.278137 10.12418 
1 1 1    6   11   21 o  727.053   6.0618  404.627   6.7458  409.491   10.847  401.560   8.6143  731.302   9.6906  724.248   7.7707 7.053589 12.42143 
1 1 1    6   11   22 o  1518.46   11.863  1765.86   27.571  1771.26   48.242  1763.24   33.600  1519.66   20.740  1517.07   14.470 2.593384 25.28867 
1 1 1    6   11   23 o  268.192   6.7141   55.059   2.7562   51.336   4.0742   58.201   3.7425  258.926   10.280  275.713   8.8682 -16.78711 13.57660 
1 1 1    6   11   24 o  667.221   5.5746  340.760   5.6931  342.938   8.0259  338.556   8.0769  669.295   7.8345  665.003   7.9351 4.292542 11.15097 
1 1 1    6   11   25 f  1252.59   7.4191  1201.13   14.224  1214.60   20.298  1188.13   19.939  1259.41   10.530  1245.61   10.458 13.79602 14.84076 
1 1 1    6   11   26 o  1094.93   6.8785  917.766   11.528  911.561   16.197  924.135   16.411  1091.07   9.6986  1098.57   9.7598 -7.495605 13.75922 
1 1 1    6   11   27 o  1023.88   6.6935  802.531   10.490  801.324   14.811  803.745   14.859  1022.97   9.4594  1024.52   9.4754 -1.543457 13.38898 
1 1 1    6   11   28 o  556.037   6.0737  236.676   5.1693  238.153   7.3962  235.265   7.2276  557.698   8.6645  554.312   8.5186 3.386475 12.15071 
1 1 1    6   11   29 o  426.716   7.1429  139.404   4.6653  147.967   7.3547  133.638   6.0349  439.520   10.932  417.742   9.4383 21.77774 14.44295 
1 1 1    6   11   30 o  1009.54   6.3268  780.225   9.7763  774.739   15.122  784.164   12.815  1005.77   9.8228  1011.98   8.2730 -6.207153 12.84250 
1 1 1    6   11   31 o  422.510   7.0511  136.676   4.5600  141.974   7.4487  133.500   5.7669  430.484   11.305  417.518   9.0240 12.96515 14.46467 
1 1 1    6   11   32 o  180.551   11.280   25.074   3.1018   28.310   5.6292   23.662   3.7170  191.024   19.527  175.128   13.983 15.89542 24.01732 
1 1 1    6   11   33 o  1069.10   6.6814  875.112   10.933  883.892   17.291  869.264   14.113  1074.11   10.517  1065.37   8.6544 8.741943 13.62043 
1 1 1    6   11   34 o  516.434   6.4218  204.202   5.0762  201.076   8.3931  206.005   6.3741  512.266   10.704  518.645   8.0294 -6.378784 13.38107 
1 1 1    6   11   35 o  804.610   6.0733  495.682   7.4797  493.055   10.152  498.801   11.062  802.324   8.2668  806.929   8.9563 -4.604370 12.18834 
1 1 1    6   11   36 o  307.921   8.0440   72.628   3.7912   87.873   6.4066   64.412   4.7032  338.496   12.365  289.887   10.600 48.60849 16.28661 
1 1 1    6   11   37 o   53.702   21.875   0.8377   2.8301   6.2206   4.1209  -3.9676   3.8935   89.563   27.457   46.463   21.773 43.10008 35.04156 
1 1 1    6   11   38 o  500.725   5.9831  192.009   4.5856  189.014   6.5243  194.932   6.4465  496.634   8.5827  504.367   8.3504 -7.732727 11.97468 
1 1 1    6   11   39 o   55.717   21.938   1.3645   2.7480   0.3589   3.8752   2.3817   3.8974   59.488   25.030   68.268   26.340 -8.779938 36.33572 
1 1 1    6   11   40 o  244.144   8.5314   45.696   3.1881   40.504   4.4429   51.207   4.5775  229.268   12.710  258.263   11.580 -28.99443 17.19416 
1 1 1    6   11   41 o  476.202   7.4670  173.807   5.4426  176.831   6.2253  163.999   11.212  480.225   8.4693  461.370   15.876 18.85519 17.99401 
1 1 1    6   11   42 o  108.518   20.663   9.4208   3.3068   6.2964   3.9902   16.272   5.9088   89.318   26.942  141.788   28.219 -52.47060 39.01505 
1 1 1    6   11   43 o  315.810   7.5896   76.475   3.6687   73.606   5.0789   79.605   5.3052  309.536   10.720  321.899   10.767 -12.36270 15.19378 
1 1 1    6   11   44 o  368.470   6.9684  104.093   3.9301  105.310   5.4082  102.731   5.7210  370.329   9.5411  365.675   10.221 4.653229 13.98242 
1 1 1    6   11   45 o  355.234   6.9405   96.767   3.7738   92.077   5.3512  101.407   5.3228  346.138   10.100  363.328   9.5713 -17.19055 13.91486 
1 1 1    6   11   46 o  511.485   6.2271  200.573   4.8751  191.164   6.9059  209.920   6.8831  498.854   9.0443  522.848   8.6008 -23.99316 12.48091 
1 1 1    6   11   47 o  233.904   10.699   42.115   3.8305   43.441   6.5481   41.425   4.7229  235.577   18.304  231.223   13.402 4.353851 22.68559 
1 1 1    6   11   48 o  427.643   7.2001  140.370   4.7129  131.273   7.4119  146.545   6.1064  412.552   11.738  436.557   9.1384 -24.00522 14.87561 
1 1 1    6   11   49 o  208.194   10.035   33.380   3.1979   36.865   4.6561   30.268   4.3998  217.709   14.047  197.028   14.695 20.68112 20.32900 
1 1 1    6   11   50 o  269.200   8.7493   55.743   3.6051   53.750   5.2599   57.509   4.9509  263.532   13.040  272.854   11.854 -9.321869 17.62295 
1 1 1    6   11   51 o   83.329   22.481   5.6936   2.9334   9.8438   4.3194   2.1409   3.9964  108.691   26.257   66.557   26.376 42.13400 37.21755 
1 1 1    6   11   52 o  222.162   10.347   38.084   3.5186   34.206   5.0502   41.742   4.9050  208.814   15.921  231.428   13.912 -22.61320 21.14238 
1 1 1    6   11   53 o  413.915   9.8581  132.173   6.2456  136.068   7.3054  121.593   12.040  419.414   11.380  391.601   20.155 27.81320 23.14536 
1 1 1    6   11   54 o  221.962   10.808   38.099   3.6720   39.824   5.4048   36.621   5.0042  225.100   15.787  216.013   15.233 9.087769 21.93751 
1 1 1    6   11   55 o  193.550   12.227   29.192   3.6036   26.981   5.3395   31.042   4.8835  183.609   19.288  198.289   16.232 -14.68063 25.20930 
1 1 1    6   11   56 o   80.645   25.798   5.2913   3.5996   1.5300   5.1371   8.9196   5.0454   69.477   28.998  101.932   30.194 -32.45502 41.86367 
1 1 1    6   11   57 o   59.842   24.481   1.3807   3.5637  -3.7896   5.1151   6.2574   4.9678   54.418   25.320   87.994   30.371 -33.57591 39.54086 
1 1 1    6   11   58 o  112.124   25.926   10.803   4.3606   5.0109   7.1650   14.210   5.4955   88.140   35.194  127.553   28.826 -39.41215 45.49284 
1 1 1    6   11   59 o  192.288   14.280   29.267   4.1730   31.380   6.3840   27.691   5.5141  195.041   21.755  184.203   19.872 10.83797 29.46485 
1 1 1    6   11   60 o  128.751   19.406   13.672   3.7056   13.968   5.2031   13.368   5.2787  125.781   27.769  122.484   28.664 3.296402 39.90918 
1 1 1    6   11   61 o   84.860   26.148   6.3013   3.7320   2.4935   5.3182   9.9956   5.2383   71.354   29.619  104.063   30.751 -32.70830 42.69563 
1 1 1    6   11   62 o   86.712   25.558   6.7145   3.6227   16.739   5.2003  -2.7374   5.0495  137.459   25.660   54.655   25.337 82.80402 36.06083 
1 1 1    6   11   63 o   67.283   25.240   3.4614   3.5170   4.8680   4.9102   1.9794   5.0400   77.453   29.645   66.995   28.386 10.45796 41.04359 
1 1 1    6   12    0 o  182.739   12.304   25.920   3.4057   25.920   3.4057   25.920   3.4057  182.739   12.304  182.739   12.304 0.000000 0.000000 
1 1 1    6   12    1 o  1582.76   14.628  1920.87   35.438  1941.61   50.761  1901.14   49.497  1589.71   20.861  1573.15   20.556 16.56641 29.28723 
1 1 1    6   12    2 o  246.540   7.5508   46.541   2.8494   42.427   3.9566   50.973   4.1068  235.325   10.985  257.953   10.401 -22.62752 15.12786 
1 1 1    6   12    3 o  1338.69   12.748  1373.54   26.121  1414.56   38.165  1337.39   35.826  1357.47   18.368  1320.06   17.731 37.41248 25.53012 
1 1 1    6   12    4 o  1151.63   16.048  1017.39   28.288  1017.39   28.288   0.0000   0.0000  1151.63   16.048  ?   ?  0.000000 16.04812 
1 1 1    6   12    5 o  803.570   9.0908  494.561   11.181  494.561   11.181   0.0000   0.0000  803.570   9.0908  ?   ?  0.000000 9.090816 
1 1 1    6   12    6 o  631.543   6.6510  305.370   6.4293  302.902   7.8512  310.394   11.202  628.920   8.1558  636.453   11.499 -7.533447 14.09764 
1 1 1    6   12    7 o  351.457   7.7148   94.586   4.1502   90.455   5.8331   98.822   5.9060  343.592   11.091  359.145   10.744 -15.55228 15.44175 
1 1 1    6   12    8 o  535.328   6.4541  219.406   5.2884  221.172   9.2844  218.558   6.4342  537.262   11.290  534.241   7.8684 3.021179 13.76153 
1 1 1    6   12    9 o   99.378   10.813   7.6558   1.6182   7.9275   2.3151   7.3961   2.2628  100.492   15.554   96.953   15.792 3.539375 22.16546 
1 1 1    6   12   10 o  328.724   5.6282   82.724   2.8318   79.821   3.9908   85.668   4.0190  322.855   8.0758  334.477   7.8502 -11.62192 11.26252 
1 1 1    6   12   11 f  805.579   7.5760  496.912   9.3415  505.857   11.595  480.367   15.769  812.690   9.3215  791.658   13.013 21.03235 16.00745 
1 1 1    6   12   12 o  373.001   6.6480  106.518   3.7955  107.967   4.6243  103.527   6.6441  375.496   8.0458  367.578   11.809 7.918243 14.28948 
1 1 1    6   12   13 o  241.230   7.8193   44.557   2.8871   45.376   3.5001   42.813   5.1072  243.410   9.3945  235.900   14.211 7.509521 17.03520 
1 1 1    6   12   14 o  1478.89   11.489  1675.54   26.006  1698.79   45.730  1664.42   31.617  1487.57   20.084  1473.62   14.017 13.95483 24.49209 
1 1 1    6   12   15 o  408.763   6.8636  127.917   4.2943  121.410   7.2611  131.418   5.3255  398.095   11.916  414.284   8.3983 -16.18857 14.57848 
1 1 1    6   12   16 o  265.499   6.9127   53.964   2.8092   54.448   3.9746   53.481   3.9710  266.646   9.7384  264.266   9.8172 2.379913 13.82803 
1 1 1    6   12   17 o  1041.71   7.8249  830.804   12.477  837.602   17.810  824.253   17.484  1045.77   11.127  1037.41   11.011 8.359131 15.65355 
1 1 1    6   12   18 o  694.637   6.5690  369.370   6.9843  361.441   9.6981  377.913   10.067  687.059   9.2220  702.535   9.3617 -15.47626 13.14103 
1 1 1    6   12   19 o  666.052   5.7303  339.573   5.8419  339.975   7.4596  338.934   9.3945  666.410   7.3132  665.332   9.2250 1.077637 11.77209 
1 1 1    6   12   20 o  167.910   8.1813   21.584   2.1027   20.783   2.5125   23.458   3.8411  164.442   10.030  174.380   14.523 -9.938889 17.65008 
1 1 1    6   12   21 o  1062.52   11.355  864.561   18.467  868.596   26.389  860.690   25.851  1064.64   16.194  1059.80   15.936 4.833862 22.72013 
1 1 1    6   12   22 o  551.346   5.7631  232.681   4.8635  224.191   7.2152  239.750   6.5842  541.136   8.7111  559.622   7.6867 -18.48615 11.61758 
1 1 1    6   12   23 o  1115.89   6.8288  953.215   11.664  965.877   16.615  940.911   16.378  1123.14   9.6646  1108.53   9.6526 14.61011 13.65929 
1 1 1    6   12   24 o  509.610   5.5024  198.787   4.2920  199.581   6.0013  197.956   6.1408  510.587   7.6790  508.500   7.8897 2.086700 11.00975 
1 1 1    6   12   25 o  1331.83   7.7636  1357.96   15.826  1366.66   22.507  1349.44   22.259  1335.86   11.007  1327.42   10.955 8.440430 15.53009 
1 1 1    6   12   26 f  749.535   5.9181  430.047   6.7896  435.669   9.6759  424.595   9.5298  754.336   8.3802  744.688   8.3606 9.648254 11.83758 
1 1 1    6   12   27 o  667.656   6.6145  341.247   6.7596  345.078   8.5846  334.999   10.966  671.335   8.3543  661.356   10.832 9.979431 13.67979 
1 1 1    6   12   28 o  506.786   6.9754  196.624   5.4108  200.277   6.8173  190.405   8.8945  511.424   8.7089  498.556   11.656 12.86853 14.54989 
1 1 1    6   12   29 o  1132.28   7.8773  981.622   13.652  1009.63   22.012  964.115   17.403  1147.91   12.528  1121.96   10.134 25.94678 16.11387 
1 1 1    6   12   30 o  782.143   7.0602  468.366   8.4522  465.514   10.912  472.642   13.363  779.653   9.1443  785.474   11.115 -5.821411 14.39291 
1 1 1    6   12   31 o  265.466   9.1691   53.972   3.7257   49.511   5.2190   58.608   5.3203  253.795   13.483  276.544   12.569 -22.74881 18.43311 
1 1 1    6   12   32 o  710.120   6.0329  386.056   6.5573  374.915   10.372  393.474   8.4633  699.611   9.6859  716.832   7.7135 -17.22131 12.38200 
1 1 1    6   12   33 o  280.942   8.8027   60.453   3.7853   65.286   6.6919   58.179   4.5903  291.348   15.058  275.550   10.884 15.79776 18.57911 
1 1 1    6   12   34 o  548.138   8.3984  230.128   7.0462   0.0000   0.0000  230.128   7.0462  ?   ?   548.138   8.3984 0.000000 8.398369 
1 1 1    6   12   35 o  643.597   7.3138  317.226   7.2049  313.988   13.853  318.426   8.4356  639.695   14.148  644.731   8.5480 -5.035828 16.52997 
1 1 1    6   12   36 o  215.397   10.445   35.565   3.4435   28.826   6.2093   38.558   4.1381  192.246   21.468  223.889   12.120 -31.64236 24.65351 
1 1 1    6   12   37 o  305.710   8.2667   71.609   3.8682   75.046   6.7661   69.940   4.7148  312.609   14.141  302.035   10.198 10.57425 17.43451 
1 1 1    6   12   38 o  222.087   9.0664   37.808   3.0819   33.744   4.4030   41.711   4.3154  209.138   13.833  232.806   12.152 -23.66754 18.41262 
1 1 1    6   12   39 o  486.552   5.9568  181.317   4.4362  185.518   6.3577  177.331   6.1931  491.961   8.4430  480.986   8.4121 10.97537 11.91836 
1 1 1    6   12   40 o  109.614   16.780   9.4695   2.7258   18.456   3.9651   1.4181   3.7532  153.795   17.135   62.913   25.348 90.88193 30.59618 
1 1 1    6   12   41 o  386.492   8.6422  114.561   5.1125  113.676   5.8559  117.397   10.484  384.866   9.9407  389.966   17.565 -5.100586 20.18280 
1 1 1    6   12   42 o  735.338   5.8306  414.262   6.5625  413.967   9.4071  414.541   9.1593  734.664   8.3656  735.215   8.1392 -0.5515137 11.67171 
1 1 1    6   12   43 f  404.647   6.6702  125.506   4.1313  126.723   5.6504  124.109   6.0557  406.335   9.0851  402.023   9.8411 4.312347 13.39350 
1 1 1    6   12   44 o  348.536   7.1585   93.153   3.8189   91.128   5.2285   95.468   5.5912  344.414   9.9181  352.459   10.364 -8.045105 14.34506 
1 1 1    6   12   45 o   65.511   22.679   3.0505   2.7712  -0.7614   3.7341   7.7236   4.1345   53.976   23.650   97.424   26.859 -43.44767 35.78747 
1 1 1    6   12   46 o  223.920   10.397   38.572   3.5634   42.335   6.1749   36.693   4.3632  232.878   17.450  217.673   13.158 15.20543 21.85482 
1 1 1    6   12   47 o  566.688   6.3845  246.301   5.5379  245.428   7.7441  247.215   7.9224  565.093   8.9533  567.099   9.1270 -2.005798 12.78524 
1 1 1    6   12   48 o   49.818   21.294   0.0134   2.8805  -5.9693   4.4387   4.3663   3.7861   46.042   22.054   76.956   26.516 -30.91423 34.48883 
1 1 1    6   12   49 o  549.496   6.4494  231.696   5.4244  228.232   7.9458  234.719   7.4233  544.521   9.5335  552.446   8.7789 -7.925232 12.95980 
1 1 1    6   12   50 o   42.968   19.522  -1.5729   2.7990  -1.1050   3.8788  -2.0811   4.0429   53.550   23.756   51.859   23.524 1.691483 33.43222 
1 1 1    6   12   51 o  345.752   7.5710   91.874   4.0067   88.537   5.6883   95.160   5.6446  338.634   10.974  351.202   10.500 -12.56778 15.18871 
1 1 1    6   12   52 f  319.626   8.3357   78.615   4.0781   73.416   5.5711   84.616   5.9858  308.029   11.816  330.688   11.826 -22.65933 16.71746 
1 1 1    6   12   53 o  188.292   15.922   27.902   4.5458   31.677   5.0637   12.231   10.318  200.452   16.655  120.904   43.590 79.54842 46.66325 
1 1 1    6   12   54 o   91.797   22.637   7.0049   3.1607   10.610   4.5499   3.6428   4.3939  112.019   26.880   74.720   28.175 37.29913 38.94062 
1 1 1    6   12   55 o   80.096   24.863   5.2379   3.3673   5.1003   4.6419   5.3907   4.8920   82.239   29.281   84.314   30.056 -2.075264 41.96140 
1 1 1    6   12   56 o  200.933   12.093   31.493   3.7018   33.940   5.3677   29.273   5.1119  206.715   17.119  191.673   17.622 15.04242 24.56779 
1 1 1    6   12   57 o  126.974   19.244   13.129   3.6228   12.874   5.2069   13.367   5.0438  121.846   28.437  124.765   27.181 -2.919708 39.33796 
1 1 1    6   12   58 o   86.602   27.834   6.3353   4.1864   10.916   7.0029   3.7882   5.2222  109.724   36.053   77.230   30.295 32.49411 47.09110 
1 1 1    6   12   59 o  154.077   16.962   19.132   3.9339   14.654   5.8489   22.831   5.3160  127.830   30.347  166.134   21.403 -38.30389 37.13503 
1 1 1    6   12   60 o   76.798   26.277   4.8462   3.7158   12.648   5.3631  -2.3563   5.1530  118.265   29.676   56.979   26.116 61.28591 39.53095 
1 1 1    6   12   61 o  106.664   22.668   9.8254   3.5868   3.6365   4.9965   16.406   5.1521   74.049   29.446  136.789   25.547 -62.73968 38.98332 
1 1 1    6   12   62 o   86.159   24.838   6.6266   3.4554   5.8821   4.8271   7.4090   4.9485   82.382   29.798   89.770   30.326 -7.387825 42.51541 
1 1 1    6   12   63 o   45.088   21.005  -2.4027   3.5378  -6.9222   5.1969   1.5007   4.8298   47.256   22.936   64.365   27.544 -17.10864 35.84321 
1 1 1    6   13    1 o  409.796   10.579  128.656   6.6358  128.656   6.6358   0.0000   0.0000  409.796   10.579  ?   ?  0.000000 10.57926 
1 1 1    6   13    2 o  742.471   12.289  422.486   13.966  422.486   13.966   0.0000   0.0000  742.471   12.289  ?   ?  0.000000 12.28928 
1 1 1    6   13    3 o  1396.05   18.741  1496.44   40.046  1496.44   40.046   0.0000   0.0000  1396.05   18.741  ?   ?  0.000000 18.74096 
1 1 1    6   13    4 o   95.588   15.182   7.1802   2.1470   8.4893   3.0852   5.9509   2.9896  103.356   20.226   86.382   22.417 16.97404 30.19326 
1 1 1    6   13    5 o  639.936   6.7412  313.542   6.6031  315.598   8.1604  309.641   11.238  641.962   8.3049  635.685   11.549 6.276550 14.22534 
1 1 1    6   13    6 o  686.377   6.9588  360.710   7.3109  364.326   9.0404  353.876   12.428  689.730   8.5632  679.549   11.949 10.18030 14.70048 
1 1 1    6   13    7 o  330.832   6.4211   83.795   3.2515   82.834   3.9681   85.758   5.6726  328.898   7.8823  334.561   11.077 -5.662964 13.59552 
1 1 1    6   13    8 o  434.453   6.4078  144.506   4.2611  150.060   5.2952  134.303   7.1775  442.682   7.8149  418.676   11.200 24.00702 13.65710 
1 1 1    6   13    9 o  558.526   8.1504  238.880   6.9677  229.925   9.6449  248.654   10.077  547.801   11.503  569.672   11.557 -21.87140 16.30565 
1 1 1    6   13   10 o  729.437   8.9537  407.481   9.9968  399.898   13.975  415.427   14.306  722.377   12.639  736.265   12.694 -13.88806 17.91359 
1 1 1    6   13   11 o  845.841   6.8212  547.747   8.8312  542.459   12.427  553.143   12.552  841.589   9.6472  849.836   9.6498 -8.247375 13.64501 
1 1 1    6   13   12 o  1304.95   9.0079  1304.06   17.992  1310.64   25.599  1297.65   25.294  1307.82   12.788  1301.33   12.699 6.487671 18.02188 
1 1 1    6   13   13 o  550.492   6.8791  232.000   5.7963  238.395   10.277  229.017   7.0193  557.832   12.037  546.896   8.3853 10.93640 14.66943 
1 1 1    6   13   14 o  235.639   8.4031   42.515   3.0308   42.362   5.3575   42.587   3.6755  234.616   14.997  235.812   10.183 -1.196121 18.12753 
1 1 1    6   13   15 o  624.093   6.2293  298.156   5.9506  315.751   8.7602  283.082   8.1084  642.162   8.9125  608.041   8.7123 34.12122 12.46341 
1 1 1    6   13   16 o  1057.45   7.9035  856.093   12.792  861.546   18.209  850.779   17.975  1060.62   11.217  1053.98   11.142 6.642700 15.81021 
1 1 1    6   13   17 o  446.885   6.2837  152.871   4.2981  149.273   6.0196  156.613   6.1391  441.547   8.9068  452.272   8.8682 -10.72534 12.56887 
1 1 1    6   13   18 f  199.486   8.8634   30.468   2.7063   33.412   3.8634   27.631   3.7923  208.510   12.158  189.471   13.158 19.03946 17.91504 
1 1 1    6   13   19 o  602.967   7.4518  278.323   6.8774  284.042   11.997  275.524   8.3935  608.961   12.871  599.885   9.1412 9.075989 15.78710 
1 1 1    6   13   20 o  1297.31   12.889  1289.12   25.594  1300.68   36.638  1278.09   35.767  1302.56   18.377  1291.23   18.097 11.32690 25.79161 
1 1 1    6   13   21 o  735.826   7.9808  414.504   8.9886  412.054   11.130  419.098   15.241  733.584   9.9126  739.673   13.462 -6.088867 16.71763 
1 1 1    6   13   22 o  527.856   5.9458  213.280   4.8040  209.830   5.9782  219.569   8.0713  523.542   7.4601  535.497   9.8472 -11.95459 12.35403 
1 1 1    6   13   23 o  775.098   5.8364  459.868   6.9243  459.565   9.6670  460.187   9.9227  774.775   8.1517  775.292   8.3617 -0.5169067 11.67772 
1 1 1    6   13   24 o  650.892   5.6886  324.293   5.6674  315.882   7.7935  333.733   8.2565  642.339   7.9268  660.233   8.1701 -17.89349 11.38352 
1 1 1    6   13   25 f  950.933   6.3927  692.225   9.3047  688.594   13.007  696.031   13.317  948.323   8.9607  953.421   9.1251 -5.098877 12.78911 
1 1 1    6   13   26 o  334.881   7.5089   85.858   3.8489   85.971   4.7189   85.633   6.6524  335.072   9.2009  334.321   13.000 0.7509766 15.92669 
1 1 1    6   13   27 o  308.634   8.1152   72.933   3.8337   71.784   4.6644   75.325   6.7299  306.158   9.9537  313.514   14.024 -7.355896 17.19758 
1 1 1    6   13   28 o  686.236   6.6348  360.517   6.9690  365.247   10.985  357.332   9.0153  690.560   10.393  683.122   8.6220 7.438843 13.50397 
1 1 1    6   13   29 o  1080.01   7.7145  893.098   12.753  911.269   16.719  867.817   19.721  1090.77   10.014  1064.25   12.106 26.51636 15.71117 
1 1 1    6   13   30 o  312.000   8.0447   74.539   3.8418   75.511   5.5847   73.667   5.2933  313.934   11.622  310.091   11.152 3.842804 16.10752 
1 1 1    6   13   31 o  486.007   6.8770  180.847   5.1158  179.555   7.3642  182.053   7.1120  484.154   9.9374  487.528   9.5306 -3.374451 13.76898 
1 1 1    6   13   32 o  388.755   7.6346  115.729   4.5429  120.095   6.5708  111.732   6.2877  395.903   10.843  381.873   10.757 14.02948 15.27409 
1 1 1    6   13   33 o  781.216   6.7612  467.305   8.0848  478.755   11.736  456.963   11.153  790.519   9.6992  772.339   9.4348 18.17926 13.53105 
1 1 1    6   13   34 o  393.453   8.7122  118.586   5.2467  123.816   7.7050  114.064   7.1644  401.833   12.527  385.708   12.135 16.12570 17.44133 
1 1 1    6   13   35 o  425.219   9.5287  138.556   6.2018  143.056   14.451  137.540   6.8662  430.319   22.014  423.593   10.590 6.725159 24.42875 
1 1 1    6   13   36 o  321.170   7.8305   79.021   3.8494   81.635   6.7795   77.777   4.6763  326.112   13.582  318.553   9.5908 7.558868 16.62686 
1 1 1    6   13   37 o  281.652   8.3400   60.789   3.5954   58.224   5.9722   62.248   4.5029  274.942   14.240  284.912   10.325 -9.970856 17.58973 
1 1 1    6   13   38 o  147.357   13.874   16.832   3.0925   17.089   5.1369   16.685   3.8730  146.774   23.671  146.130   17.675 0.6436768 29.54133 
1 1 1    6   13   39 o  378.608   7.1414  109.836   4.1385  103.956   6.6793  113.500   5.2725  367.942   11.860  384.738   8.9532 -16.79572 14.85997 
1 1 1    6   13   40 o  237.779   10.719   43.403   3.9011   41.481   5.5899   45.228   5.4470  231.498   15.871  241.949   14.779 -10.45126 21.68707 
1 1 1    6   13   41 o  240.821   11.571   44.561   4.2652   44.819   6.3034   44.343   5.7926  240.333   17.250  239.293   15.906 1.039795 23.46395 
1 1 1    6   13   42 o  492.117   5.9915  185.563   4.5131  192.689   6.5206  179.011   6.2527  501.176   8.5002  483.067   8.4565 18.10873 11.99020 
1 1 1    6   13   43 o   74.103   21.778   4.3503   2.6336   3.4816   3.6724   5.2700   3.7788   72.240   26.010   82.667   26.431 -10.42691 37.08300 
1 1 1    6   13   44 o  240.581   8.3949   44.423   3.0913   42.872   4.3771   45.966   4.3666  235.663   12.176  244.398   11.673 -8.735596 16.86745 
1 1 1    6   13   45 o  243.376   8.6178   45.483   3.2103   42.676   4.4260   48.600   4.6634  235.014   12.347  251.164   12.130 -16.14987 17.30902 
1 1 1    6   13   46 f  269.631   9.5751   55.895   3.9517   51.093   6.2798   59.044   5.0846  256.234   16.093  276.758   12.003 -20.52435 20.07661 
1 1 1    6   13   47 o  288.982   8.7172   64.183   3.8558   71.239   6.7327   60.739   4.7036  303.322   14.502  280.780   10.944 22.54178 18.16798 
1 1 1    6   13   48 o  336.061   7.2920   86.714   3.7509   88.349   5.5119   85.303   5.1190  338.598   10.635  332.832   10.048 5.765350 14.63139 
1 1 1    6   13   49 o  127.160   15.073   12.726   2.8766   5.5843   4.0980   19.662   4.0390   84.397   27.572  157.952   16.972 -73.55489 32.37703 
1 1 1    6   13   50 o  300.526   7.7753   69.415   3.5766   69.855   5.2161   69.024   4.9135  300.761   11.331  299.105   10.733 1.656219 15.60678 
1 1 1    6   13   51 o  251.252   8.9826   48.607   3.4545   58.089   5.1158   40.659   4.6836  273.969   12.199  228.559   13.447 45.40994 18.15619 
1 1 1    6   13   52 o   75.198   23.348   4.5289   2.9690   2.5333   4.3632   6.2499   4.0518   69.970   27.613   87.578   27.288 -17.60748 38.82204 
1 1 1    6   13   53 o  160.852   17.960   20.589   4.3463   20.625   4.8012   20.424   10.229  160.273   20.007  149.214   42.652 11.05916 47.11176 
1 1 1    6   13   54 o  190.623   11.793   28.276   3.4241   26.866   4.8788   29.644   4.8068  183.961   17.539  193.753   16.361 -9.791870 23.98571 
1 1 1    6   13   55 o  139.350   16.389   15.456   3.4288   18.318   4.8338   12.558   4.8645  149.852   21.707  121.658   26.843 28.19305 34.52160 
1 1 1    6   13   56 o  238.656   10.683   44.143   3.9025   47.786   5.7647   41.061   5.3022  246.224   15.373  228.219   15.267 18.00488 21.66560 
1 1 1    6   13   57 o  163.947   14.946   21.298   3.7093   19.328   5.0433   23.619   5.4749  153.047   22.175  169.750   21.558 -16.70299 30.92646 
1 1 1    6   13   58 o   67.538   26.351   2.7738   3.9344   8.5709   6.8747  -0.0496   4.7978   99.684   35.620   61.595   26.902 38.08924 44.63739 
1 1 1    6   13   59 o  216.782   12.421   36.917   4.1042   40.659   6.1897   33.981   5.4829  224.319   18.184  205.297   17.619 19.02199 25.31987 
1 1 1    6   13   60 o  260.254   10.481   52.804   4.1752   57.746   6.1614   48.608   5.6775  269.211   15.012  246.874   15.098 22.33632 21.29108 
1 1 1    6   13   61 o  145.831   16.398   17.311   3.5967   13.594   4.9618   21.426   5.2212  122.900   27.104  158.834   22.073 -35.93344 34.95502 
1 1 1    6   13   62 o   56.113   23.210   1.3566   3.2489   1.1731   4.5408   1.5490   4.6504   62.281   26.682   64.070   27.213 -1.788403 38.11081 
1 1 1    6   13   63 o  262.477   15.598   55.966   6.2385   56.312   8.2279   55.499   9.5680  257.281   21.078  249.971   25.358 7.310791 32.97477 
1 1 1    6   14    1 o  220.205   12.745   37.289   4.2775   0.0000   0.0000   37.289   4.2775  ?   ?   220.205   12.745 0.000000 12.74541 
1 1 1    6   14    2 o  742.317   12.395  422.298   14.083   0.0000   0.0000  422.298   14.083  ?   ?   742.317   12.395 0.000000 12.39477 
1 1 1    6   14    3 o  174.103   9.8429   23.292   2.6123   23.783   3.6819   22.795   3.7068  175.594   13.811  171.842   14.221 3.751801 19.82326 
1 1 1    6   14    4 o  202.680   9.0768   31.461   2.8159   32.056   4.0036   30.879   3.9612  204.106   12.881  200.301   12.990 3.805420 18.29425 
1 1 1    6   14    5 o  513.500   6.4597  201.873   5.0772  201.582   6.2377  202.443   8.7396  513.082   7.9427  514.042   11.108 -0.9603882 13.65530 
1 1 1    6   14    6 o  719.954   7.1750  396.862   7.9067  399.920   9.7686  391.052   13.464  722.641   8.8316  714.360   12.313 8.281250 15.15301 
1 1 1    6   14    7 o  276.384   6.9229   58.484   2.9287   60.040   3.6028   55.453   5.0285  280.010   8.4061  269.014   12.212 10.99661 14.82563 
1 1 1    6   14    8 o  304.573   6.8132   71.021   3.1762   69.374   3.8464   74.549   5.6316  300.994   8.3489  311.931   11.795 -10.93680 14.45087 
1 1 1    6   14    9 o  972.297   7.3578  723.805   10.950  723.474   15.437  724.140   15.534  971.871   10.378  972.313   10.438 -0.4418945 14.71900 
1 1 1    6   14   10 o  612.219   6.0017  286.926   5.6241  283.983   7.9171  289.924   7.9907  608.990   8.4935  615.327   8.4842 -6.337402 12.00507 
1 1 1    6   14   11 o  756.953   7.5408  438.683   8.7369  441.968   15.391  437.121   10.612  759.466   13.240  755.532   9.1768 3.934692 16.10970 
1 1 1    6   14   12 o  1330.49   10.601  1355.78   21.589  1332.68   36.836  1367.86   26.645  1318.15   18.257  1336.15   13.028 -18.00781 22.42916 
1 1 1    6   14   13 o  548.639   6.0633  230.416   5.0918  228.521   7.2856  232.227   7.1190  546.311   8.7127  550.731   8.4452 -4.419800 12.13396 
1 1 1    6   14   14 o  664.959   6.3343  338.479   6.4471  328.479   8.9367  349.332   9.3099  654.987   8.9141  675.454   9.0049 -20.46741 12.67079 
1 1 1    6   14   15 o  1860.65   12.103  2651.68   34.470  2692.95   49.701  2613.42   47.848  1874.27   17.325  1846.46   16.930 27.81226 24.22305 
1 1 1    6   14   16 o  770.816   6.7662  454.828   7.9830  463.368   11.413  446.647   11.170  777.924   9.5851  763.760   9.5551 14.16431 13.53416 
1 1 1    6   14   17 o  853.792   10.045  558.170   13.128   0.0000   0.0000  558.170   13.128  ?   ?   853.792   10.045 0.000000 10.04536 
1 1 1    6   14   18 o  778.873   7.9786  464.421   9.5118  461.356   16.347  465.989   11.695  776.056   13.762  780.125   9.7945 -4.068665 16.89170 
1 1 1    6   14   19 o  1598.30   12.399  1956.54   30.334  1923.55   36.509  2030.08   54.508  1584.48   15.054  1626.75   21.891 -42.26709 26.56776 
1 1 1    6   14   20 o  943.168   8.7655  681.061   12.654  676.640   15.508  689.869   21.890  940.009   10.778  948.888   15.072 -8.879456 18.52912 
1 1 1    6   14   21 o  1311.13   9.3606  1316.22   18.785  1300.47   26.238  1332.80   26.908  1302.97   13.156  1319.05   13.327 -16.07922 18.72697 
1 1 1    6   14   22 o  567.737   5.9781  246.728   5.1949  236.349   6.4005  266.763   8.8930  555.636   7.5259  590.241   9.8435 -34.60443 12.39080 
1 1 1    6   14   23 o  565.975   6.1169  245.203   5.2990  242.195   6.5814  250.747   8.9350  562.459   7.6446  572.229   10.201 -9.769592 12.74781 
1 1 1    6   14   24 f  841.154   6.7095  541.638   8.6384  540.556   10.963  543.412   14.029  840.243   8.5243  842.343   10.881 -2.100220 13.82268 
1 1 1    6   14   25 o  701.982   6.5395  377.234   7.0266  385.353   8.9975  364.543   11.250  709.437   8.2859  689.916   10.653 19.52118 13.49602 
1 1 1    6   14   26 o  1073.98   7.5828  883.089   12.465  872.958   15.732  900.181   20.433  1067.68   9.6265  1083.98   12.315 -16.30237 15.63101 
1 1 1    6   14   27 o  653.473   9.8893  327.041   9.8915  327.041   9.8915   0.0000   0.0000  653.473   9.8893  ?   ?  0.000000 9.889299 
1 1 1    6   14   28 o  182.926   11.625   25.739   3.2381   32.736   4.2328   15.866   5.0279  206.236   13.483  141.731   24.035 64.50554 27.55891 
1 1 1    6   14   29 o  815.993   6.4346  509.755   8.0367  516.881   11.435  502.801   11.297  821.535   9.0940  810.268   9.1089 11.26709 12.87141 
1 1 1    6   14   30 o  490.765   6.7016  184.400   5.0341  191.377   7.1935  177.704   7.0473  499.866   9.4020  481.672   9.5587 18.19305 13.40766 
1 1 1    6   14   31 o  251.130   12.904   48.471   4.9432   58.963   6.2352   30.719   8.1103  276.883   14.766  197.763   27.541 79.12044 31.24930 
1 1 1    6   14   32 o  687.532   6.6005  361.933   6.9461  366.468   10.010  357.721   9.6466  691.657   9.4552  683.369   9.2225 8.288147 13.20812 
1 1 1    6   14   33 o  927.931   7.4593  659.419   10.595  671.454   14.241  644.503   15.854  936.118   9.9391  916.981   11.296 19.13794 15.04591 
1 1 1    6   14   34 o  611.326   8.5527  286.299   8.0029  280.183   16.829  288.086   9.0974  603.696   18.212  613.144   9.6936 -9.447571 20.63119 
1 1 1    6   14   35 o  628.467   7.2592  302.526   6.9830  301.062   10.679  303.620   9.2295  626.595   11.135  629.410   9.5803 -2.814880 14.68903 
1 1 1    6   14   36 o  916.625   7.5895  643.677   10.648  633.381   16.220  651.475   14.116  908.630   11.663  921.812   10.004 -13.18152 15.36568 
1 1 1    6   14   37 o  451.690   7.8168  156.335   5.4043  158.502   8.0229  154.535   7.3121  454.481   11.533  448.846   10.643 5.634888 15.69370 
1 1 1    6   14   38 o  494.373   7.3297  187.275   5.5464  187.641   7.9622  186.931   7.7306  494.536   10.519  493.632   10.231 0.9034119 14.67409 
1 1 1    6   14   39 f  529.972   7.2169  215.241   5.8543  217.620   8.3625  212.953   8.1983  532.531   10.259  526.802   10.167 5.728699 14.44404 
1 1 1    6   14   40 o  448.605   9.6871  154.430   6.6516  154.489   8.3513  154.328   11.001  448.345   12.170  447.411   16.063 0.9335022 20.15264 
1 1 1    6   14   41 o  365.747   7.2032  102.544   4.0325  103.656   6.5100  101.853   5.1366  367.247   11.581  364.322   9.2113 2.925598 14.79768 
1 1 1    6   14   42 o  143.167   14.393   15.956   3.1113   10.423   4.9146   19.657   4.0193  112.954   28.443  158.618   16.811 -45.66398 33.03990 
1 1 1    6   14   43 o  484.353   6.6248  179.847   4.9114  182.456   8.0098  178.276   6.2173  487.178   10.741  481.979   8.4276 5.199707 13.65298 
1 1 1    6   14   44 o  396.749   7.1547  120.733   4.3449  109.393   7.0888  127.556   5.4988  376.851   12.289  407.574   8.8144 -30.72345 15.12366 
1 1 1    6   14   45 o  426.504   7.3103  139.571   4.7723  140.556   7.6883  138.953   6.0870  427.143   11.759  425.214   9.3524 1.929474 15.02501 
1 1 1    6   14   46 o  184.404   12.007   26.332   3.3705   30.900   5.8528   24.065   4.1227  198.035   19.565  175.554   15.502 22.48131 24.96173 
1 1 1    6   14   47 o  430.513   8.7164  142.475   5.7437  129.036   13.197  145.616   6.3796  404.719   21.380  435.032   9.5808 -30.31274 23.42869 
1 1 1    6   14   48 o  457.029   6.8004  160.321   4.7572  163.399   6.7755  157.329   6.6808  460.728   9.6079  452.076   9.6549 8.651642 13.62088 
1 1 1    6   14   49 o  481.488   6.3912  177.912   4.7102  181.601   6.8324  174.570   6.5022  485.743   9.1896  476.327   8.9184 9.416901 12.80575 
1 1 1    6   14   50 o  384.364   7.0554  113.472   4.1508  114.883   6.0343  112.204   5.7186  385.988   10.214  381.577   9.7913 4.411041 14.14887 
1 1 1    6   14   51 o  157.395   12.965   19.332   3.0957   27.183   4.7776   13.650   4.0644  185.663   17.001  129.797   21.189 55.86537 27.16631 
1 1 1    6   14   52 o  142.860   19.610   16.389   4.1750   14.862   4.5821   23.855   10.131  134.744   23.045  162.671   40.769 -27.92685 46.83162 
1 1 1    6   14   53 o  336.858   7.7828   87.316   4.0129   95.595   5.9520   80.416   5.4335  351.497   11.063  322.403   11.011 29.09360 15.60841 
1 1 1    6   14   54 o  194.271   11.926   29.386   3.5291   33.936   5.0629   25.085   4.9219  207.431   16.072  177.312   18.404 30.11868 24.43340 
1 1 1    6   14   55 o   57.343   23.341   1.2770   3.2193  -3.6122   4.7628   5.3897   4.3682   52.617   24.465   82.732   28.483 -30.11562 37.54786 
1 1 1    6   14   56 o  224.116   10.790   38.958   3.7015   40.101   5.2640   37.841   5.2059  225.372   15.351  218.769   15.650 6.602921 21.92218 
1 1 1    6   14   57 o  170.753   16.260   23.261   4.1984   26.240   6.8286   21.450   5.3233  176.178   26.114  161.170   22.166 15.00764 34.25247 
1 1 1    6   14   58 o  158.352   15.774   20.048   3.7724   24.423   6.0096   17.202   4.8462  170.723   23.631  143.274   22.867 27.44960 32.88385 
1 1 1    6   14   59 o  192.414   13.143   29.226   3.8476   26.898   5.7222   31.148   5.1981  180.287   21.137  196.422   17.472 -16.13440 27.42367 
1 1 1    6   14   60 o  153.930   15.235   19.050   3.5423   14.219   5.0088   23.884   5.0105  126.651   26.680  169.978   19.619 -43.32697 33.11655 
1 1 1    6   14   61 o   67.444   24.373   3.5655   3.2285   7.7195   4.6386  -0.3375   4.4963   91.692   29.281   57.588   25.560 34.10448 38.86750 
1 1 1    6   14   62 o  137.024   17.368   15.543   3.5608   19.413   5.4848   12.723   4.6815  147.747   25.155  118.057   26.551 29.69035 36.57497 
1 1 1    6   15    0 o  318.587   11.175   78.003   5.4340   78.003   5.4340   78.003   5.4340  318.587   11.175  318.587   11.175 0.000000 0.000000 
1 1 1    6   15    1 o  145.177   15.958   16.357   3.4875   16.357   3.4875   0.0000   0.0000  145.177   15.958  ?   ?  0.000000 15.95772 
1 1 1    6   15    3 o  401.319   7.8251  123.319   4.8067  136.468   7.0826  112.092   6.5447  422.073   10.963  382.518   11.178 39.55563 15.65690 
1 1 1    6   15    4 o  443.029   7.8588  150.285   5.3292  154.256   7.6004  146.444   7.4743  448.737   11.066  437.224   11.169 11.51367 15.72209 
1 1 1    6   15    5 o  590.899   6.7786  267.313   6.1308  260.251   7.4252  282.442   10.867  582.988   8.3211  607.176   11.693 -24.18823 14.35194 
1 1 1    6   15    6 f  327.544   6.8110   82.136   3.4147   84.275   4.2200   78.079   5.8114  331.755   8.3105  319.239   11.893 12.51566 14.50907 
1 1 1    6   15    7 o  946.206   8.3525  685.536   12.097  686.161   14.875  684.317   20.788  946.515   10.267  944.897   14.373 1.618286 17.66378 
1 1 1    6   15    8 o  432.433   6.5985  143.156   4.3675  140.627   5.3624  148.138   7.5272  428.562   8.1748  439.770   11.183 -11.20731 13.85197 
1 1 1    6   15    9 o  286.060   6.3203   62.643   2.7673   65.528   4.0142   60.029   3.8202  292.535   8.9650  279.993   8.9141 12.54202 12.64248 
1 1 1    6   15   10 o  491.589   6.8309  185.001   5.1399  182.114   8.8284  186.481   6.3217  487.594   11.829  493.515   8.3688 -5.920990 14.49017 
1 1 1    6   15   11 o  1038.17   8.9452  825.260   14.214  837.349   25.078  819.538   17.254  1045.22   15.675  1034.45   10.897 10.77820 19.09065 
1 1 1    6   15   12 o  1103.48   8.0837  932.247   13.654  925.124   19.189  939.552   19.432  1099.05   11.407  1107.58   11.462 -8.532837 16.17071 
1 1 1    6   15   13 o  265.925   8.0985   54.140   3.2964   48.761   5.7844   56.726   4.0114  251.810   15.077  272.183   9.6287 -20.37360 17.88955 
1 1 1    6   15   14 o  1141.86   9.5989  998.343   16.777  1009.86   29.516  992.845   20.391  1147.86   16.799  1138.58   11.700 9.276978 20.47247 
1 1 1    6   15   15 o  1109.88   9.4598  943.159   16.070  903.607   26.699  965.629   20.124  1085.89   16.064  1122.88   11.709 -36.99316 19.87807 
1 1 1    6   15   16 f  693.039   7.6042  367.688   8.0664  365.452   13.751  368.861   9.9602  690.737   13.006  694.091   9.3752 -3.354248 16.03283 
1 1 1    6   15   17 o  287.296   7.3747   63.185   3.2430   66.108   4.6789   60.483   4.4989  293.826   10.404  281.048   10.458 12.77814 14.75162 
1 1 1    6   15   18 o  456.079   7.4452  159.235   5.1974  160.514   6.4623  156.891   8.7456  457.874   9.2209  452.594   12.624 5.280273 15.63332 
1 1 1    6   15   19 o  1283.88   9.1960  1262.04   18.071  1275.34   25.724  1249.08   25.393  1290.35   13.024  1277.00   12.991 13.35303 18.39602 
1 1 1    6   15   20 o  336.321   7.6307   86.592   3.9282   80.033   5.4257   93.818   5.6945  323.279   10.965  350.022   10.629 -26.74258 15.27115 
1 1 1    6   15   21 o  455.108   7.3320  158.561   5.1075  163.634   7.2394  153.533   7.2068  462.266   10.232  447.765   10.515 14.50119 14.67159 
1 1 1    6   15   22 o  304.978   8.7679   71.215   4.0930   62.354   5.7595   80.255   5.8175  285.296   13.189  323.701   11.742 -38.40469 17.65848 
1 1 1    6   15   23 o   43.002   18.966  -0.7578   2.4376  -2.1834   2.8262   3.3836   4.8171   41.768   19.217   78.134   29.492 -36.36664 35.19988 
1 1 1    6   15   24 o  598.657   6.3281  274.352   5.7986  264.572   7.1390  293.313   9.9403  587.846   7.9343  618.859   10.494 -31.01282 13.15583 
1 1 1    6   15   25 o  474.025   6.6538  172.018   4.8277  175.411   6.0311  165.965   8.0546  478.639   8.2322  465.478   11.305 13.16083 13.98488 
1 1 1    6   15   26 o  245.858   9.1834   46.289   3.4559   46.624   4.5811   45.845   5.2646  246.692   12.132  244.168   14.147 2.523544 18.63704 
1 1 1    6   15   27 o  1095.72   8.5671  919.357   14.368  911.052   19.881  928.437   20.789  1090.47   11.911  1100.78   12.338 -10.31140 17.14976 
1 1 1    6   15   28 o  1149.41   7.2882  1011.54   12.822  1025.61   18.279  997.911   17.991  1157.12   10.321  1141.40   10.298 15.72913 14.57964 
1 1 1    6   15   29 o  1032.02   8.9197  815.676   14.090  831.288   20.191  800.857   19.671  1041.47   12.666  1022.24   12.572 19.22919 17.84608 
1 1 1    6   15   30 o  496.953   6.6296  189.083   5.0428  187.849   7.1547  190.301   7.1088  495.222   9.4390  498.448   9.3176 -3.226624 13.26318 
1 1 1    6   15   31 o  415.913   7.1658  132.458   4.5618  131.117   6.5000  133.761   6.4037  413.684   10.265  417.845   10.013 -4.161102 14.33985 
1 1 1    6   15   32 o  218.000   10.547   36.418   3.5194   39.512   4.8899   33.093   5.0694  226.511   14.175  207.009   16.127 19.50258 21.47101 
1 1 1    6   15   33 o  407.499   10.045  127.255   6.2654  102.963   13.129  134.419   7.1296  364.689   23.647  418.748   11.124 -54.05939 26.13304 
1 1 1    6   15   34 o  201.062   12.584   31.134   3.8532   27.773   5.7245   33.918   5.2102  188.872   20.111  209.461   16.382 -20.58966 25.93836 
1 1 1    6   15   35 o  501.913   7.0910  192.962   5.4476  184.672   7.5222  202.105   7.8999  490.802   10.013  513.442   10.052 -22.64011 14.18829 
1 1 1    6   15   36 o  281.487   9.4186   60.745   4.0580   56.805   5.7746   64.588   5.7039  271.574   13.939  290.041   12.848 -18.46729 18.95694 
1 1 1    6   15   37 o  334.612   8.7623   85.833   4.4877   83.828   6.6128   87.545   6.1102  330.340   13.078  337.699   11.821 -7.358704 17.62902 
1 1 1    6   15   38 o  144.492   15.594   16.258   3.3941   19.349   4.9529   13.520   4.6604  156.767   21.184  129.943   24.326 26.82358 32.25640 
1 1 1    6   15   39 o  217.741   14.586   36.658   4.8333   35.806   5.7782   38.643   8.8196  214.656   17.746  221.068   26.598 -6.411880 31.97475 
1 1 1    6   15   40 o  537.273   7.4714  221.292   6.1442  214.618   9.3462  226.373   8.1538  528.486   11.554  543.072   9.8092 -14.58612 15.15631 
1 1 1    6   15   41 o  480.605   7.9816  177.153   5.8715  177.753   7.7382  176.338   9.0144  481.040   10.510  478.794   12.300 2.246002 16.17867 
1 1 1    6   15   42 o  124.998   18.440   12.359   3.4221   16.409   4.7570   8.0149   4.9265  143.480   22.392   99.964   29.888 43.51644 37.34528 
1 1 1    6   15   43 o  161.724   15.153   20.378   3.7072   19.522   5.2160   21.251   5.2698  156.622   22.396  163.753   21.548 -7.130753 31.07879 
1 1 1    6   15   44 o  169.374   14.308   22.314   3.6747   19.812   5.2199   24.771   5.1740  157.679   22.246  177.397   19.370 -19.71764 29.49729 
1 1 1    6   15   45 o  273.279   8.8021   57.378   3.6818   53.304   5.9788   59.867   4.6730  262.021   14.970  278.847   10.949 -16.82605 18.54640 
1 1 1    6   15   46 f  187.799   13.021   27.374   3.7198   25.658   10.630   27.614   3.9709  172.122   40.943  188.447   13.864 -16.32504 43.22703 
1 1 1    6   15   47 o  264.087   9.2061   53.650   3.7213   53.196   6.8960   53.836   4.4201  260.711   17.381  264.269   10.927 -3.557709 20.53029 
1 1 1    6   15   48 o  489.362   7.3526  183.916   5.5074  177.589   8.6142  188.290   7.1624  479.577   11.735  494.581   9.4613 -15.00406 15.07406 
1 1 1    6   15   49 o  384.297   8.1315  113.548   4.7831  112.928   7.8697  113.911   6.0233  381.718   13.469  384.394   10.237 -2.675964 16.91815 
1 1 1    6   15   50 o  274.719   9.4393   58.144   3.9691   57.713   7.0984   58.340   4.7875  271.120   17.194  274.769   11.383 -3.648926 20.62087 
1 1 1    6   15   51 o  141.464   16.474   15.844   3.5003   17.920   6.9070   15.127   4.0603  144.755   32.022  137.139   19.926 7.616150 37.71576 
1 1 1    6   15   52 o  218.545   17.369   37.722   5.7622   35.175   6.8607   43.820   10.616  209.166   21.747  228.313   31.195 -19.14713 38.02742 
1 1 1    6   15   53 o  195.997   13.707   30.048   4.0862   21.812   6.8090   34.684   5.1082  160.886   28.703  209.837   16.026 -48.95090 32.87347 
1 1 1    6   15   54 o  219.621   10.576   37.326   3.5553   40.266   5.0114   34.346   5.0448  226.566   14.527  208.663   15.915 17.90282 21.54869 
1 1 1    6   15   55 o  183.891   12.297   26.419   3.4413   19.421   5.0439   32.513   4.7070  153.967   22.031  203.015   15.259 -49.04819 26.79934 
1 1 1    6   15   56 o  106.821   21.253   9.4890   3.3528   9.9267   4.6348   9.0085   4.8560  106.951   27.988  101.725   29.479 5.226463 40.64909 
1 1 1    6   15   57 o  224.817   12.297   39.586   4.2156   34.511   7.3744   42.050   5.1379  203.354   24.165  230.647   14.629 -27.29243 28.24833 
1 1 1    6   15   58 o  223.787   12.104   39.266   4.1307   41.404   6.9301   38.088   5.1444  225.047   20.338  218.755   15.464 6.292542 25.54945 
1 1 1    6   15   59 o  215.431   11.757   36.431   3.8620   36.291   5.9265   36.534   5.0915  211.179   18.522  213.684   15.676 -2.505585 24.26553 
1 1 1    6   15   60 o   62.852   24.196   2.6295   3.2832   7.4721   4.7349  -1.8551   4.5565   90.909   29.634   54.030   24.687 36.87851 38.57005 
1 1 1    6   15   61 o  147.230   15.339   17.582   3.4061   12.280   4.9940   22.193   4.6574  115.061   28.504  163.258   18.993 -48.19729 34.25178 
1 1 1    6   15   62 o   92.742   23.344   7.6800   3.3114   0.0729   4.9206   13.977   4.4768   60.444   26.788  125.379   24.205 -64.93495 36.10345 
1 1 1    6   16    0 o  1730.97   22.590  2298.31   59.829  2298.31   59.829  2298.31   59.829  1730.97   22.590  1730.97   22.590 0.000000 0.000000 
1 1 1    6   16    1 o  1058.87   10.904  858.782   17.673  844.972   24.572  873.584   25.438  1049.91   15.290  1067.50   15.569 -17.59558 21.82138 
1 1 1    6   16    2 f  763.611   12.935  446.768   15.118   0.0000   0.0000  446.768   15.118  ?   ?   763.611   12.935 0.000000 12.93451 
1 1 1    6   16    3 o  749.498   12.822  430.392   14.709  430.392   14.709   0.0000   0.0000  749.498   12.822  ?   ?  0.000000 12.82204 
1 1 1    6   16    4 o  1320.48   18.175  1337.39   36.735  1337.39   36.735   0.0000   0.0000  1320.48   18.175  ?   ?  0.000000 18.17524 
1 1 1    6   16    5 o  443.907   6.6635  150.852   4.5275  157.077   5.6930  140.139   7.4683  452.940   8.2116  427.735   11.407 25.20535 14.05533 
1 1 1    6   16    6 o  476.214   6.6886  173.607   4.8754  173.881   6.0076  173.079   8.3438  476.555   8.2361  475.358   11.468 1.196991 14.11881 
1 1 1    6   16    7 o  996.515   8.6721  760.341   13.228  760.811   16.256  759.421   22.757  996.705   10.655  995.458   14.935 1.246399 18.34674 
1 1 1    6   16    8 o  385.101   8.3844  113.546   4.9422  107.669   6.9319  119.621   7.0481  374.918   12.080  395.193   11.652 -20.27493 16.78325 
1 1 1    6   16    9 o  438.929   8.3665  147.503   5.6209  155.856   8.2113  140.139   7.7106  451.092   11.893  427.746   11.777 23.34625 16.73715 
1 1 1    6   16   10 o  1026.21   7.7052  806.217   12.103  823.655   17.472  790.130   16.781  1037.07   11.007  1015.76   10.793 21.31219 15.41583 
1 1 1    6   16   11 o  384.156   6.1680  112.965   3.6268  110.317   5.0150  115.868   5.2513  379.590   8.6315  389.020   8.8191 -9.430420 12.34015 
1 1 1    6   16   12 o  1236.91   8.8106  1171.35   16.681  1146.15   23.173  1198.46   24.030  1223.29   12.376  1250.88   12.551 -27.59058 17.62653 
1 1 1    6   16   13 o  419.714   7.1620  134.852   4.6011  134.303   7.8690  135.138   5.6716  418.755   12.277  420.130   8.8197 -1.375183 15.11659 
1 1 1    6   16   14 o  488.572   7.2549  182.730   5.4254  171.573   9.2517  188.577   6.6979  473.294   12.771  496.297   8.8172 -23.00342 15.51895 
1 1 1    6   16   15 o  770.050   7.9150  453.953   9.3291  473.309   16.837  445.378   11.207  786.040   13.994  762.687   9.5997 23.35284 16.97052 
1 1 1    6   16   16 o   91.999   21.529   6.7538   2.9779   8.6540   5.4275   5.9354   3.5619  105.439   31.336   87.081   25.251 18.35799 40.24360 
1 1 1    6   16   17 o  584.707   7.5512  261.722   6.7581  258.468   8.3179  268.042   11.592  581.017   9.3531  591.568   12.802 -10.55066 15.85485 
1 1 1    6   16   18 o  1770.25   11.713  2400.00   31.737  2417.60   45.251  2382.97   44.523  1776.09   16.645  1763.35   16.496 12.74377 23.43459 
1 1 1    6   16   19 o  1601.06   10.832  1963.02   26.544  1945.74   37.107  1981.13   37.987  1593.51   15.213  1607.91   15.435 -14.39795 21.67232 
1 1 1    6   16   20 o  577.722   6.9543  255.501   6.1495  257.755   8.5744  253.114   8.8245  580.192   9.6552  574.933   10.028 5.258972 13.92042 
1 1 1    6   16   21 o  370.093   7.8300  104.862   4.4355  103.055   6.1399  106.834   6.4146  366.828   10.935  373.488   11.221 -6.659546 15.66795 
1 1 1    6   16   22 o  836.215   7.5790  535.339   9.7006  531.118   13.614  539.691   13.825  832.767   10.681  839.458   10.760 -6.690063 15.16101 
1 1 1    6   16   23 o  444.183   7.8146  151.055   5.3130  156.615   7.6237  145.806   7.4083  452.195   11.015  436.309   11.093 15.88568 15.63266 
1 1 1    6   16   24 f  1120.06   7.7750  960.514   13.329  972.077   17.100  942.611   21.279  1126.64   9.9163  1109.21   12.533 17.42993 15.98172 
1 1 1    6   16   25 o  362.460   22.047  101.269   12.174   0.0000   0.0000  101.269   12.174  ?   ?   362.460   22.047 0.000000 22.04733 
1 1 1    6   16   26 o  869.892   7.8348  579.397   10.432  584.866   14.356  573.277   15.185  873.806   10.733  865.052   11.469 8.754639 15.70778 
1 1 1    6   16   27 o  609.658   6.1410  284.543   5.7305  284.489   7.9779  284.599   8.2366  609.513   8.5513  609.618   8.8272 -0.1058960 12.29001 
1 1 1    6   16   28 o   93.962   19.869   7.0367   2.7682   3.1209   3.8718   11.132   3.9595   72.010   26.587  118.378   22.678 -46.36763 34.94477 
1 1 1    6   16   29 o  398.746   6.9545  121.740   4.2446  124.526   5.9896  118.929   6.0159  403.196   9.7054  394.020   9.9751 9.175598 13.91751 
1 1 1    6   16   30 o  595.533   6.3874  271.541   5.8224  277.454   8.2729  265.737   8.1958  601.857   8.9804  589.006   9.0908 12.85126 12.77851 
1 1 1    6   16   31 o  577.686   6.5263  255.528   5.7707  265.819   8.2778  245.797   8.0491  589.062   9.1809  566.437   9.2838 22.62531 13.05670 
1 1 1    6   16   32 o  264.417   12.387   53.615   5.0133   50.616   11.225   54.363   5.6032  254.099   29.405  265.832   13.818 -11.73270 32.48986 
1 1 1    6   16   33 o  596.480   7.7613  272.534   7.0859  276.871   12.195  270.323   8.7065  600.692   13.264  593.917   9.5774 6.774353 16.36002 
1 1 1    6   16   34 o  589.350   6.7047  266.020   6.0481  253.884   8.4479  278.781   8.6629  575.522   9.5900  603.101   9.3843 -27.57922 13.41762 
1 1 1    6   16   35 o  453.820   7.1448  157.771   4.9630  156.932   7.0082  158.615   7.0293  452.391   10.121  454.812   10.097 -2.421082 14.29665 
1 1 1    6   16   36 o  402.152   7.5468  123.922   4.6454  118.466   6.4746  129.710   6.6689  392.953   10.765  411.195   10.596 -18.24133 15.10466 
1 1 1    6   16   37 o  262.644   9.3491   52.903   3.7584   49.295   5.2752   56.623   5.3561  252.863   13.681  271.466   12.890 -18.60272 18.79685 
1 1 1    6   16   38 o  270.726   11.232   56.281   4.6545   58.751   5.5682   50.551   8.4805  276.430   13.160  254.458   21.990 21.97220 25.62697 
1 1 1    6   16   39 o  326.810   9.2266   81.944   4.6154   81.184   7.5088   82.406   5.8512  324.608   15.113  327.483   11.673 -2.875122 19.09595 
1 1 1    6   16   40 f  483.985   8.1461  179.655   6.0347  176.963   8.1627  182.900   8.9618  479.900   11.113  487.721   12.005 -7.821075 16.35857 
1 1 1    6   16   41 o  193.030   11.636   28.758   3.4218   24.718   4.7713   33.035   4.9101  177.855   17.765  206.274   15.669 -28.41925 23.68724 
1 1 1    6   16   42 o  339.201   8.5000   88.307   4.4131   92.489   6.3198   84.328   6.1652  346.661   11.910  330.973   12.170 15.68759 17.02830 
1 1 1    6   16   43 o  252.192   10.330   48.903   3.9873   55.195   5.8747   43.528   5.4294  266.956   14.431  236.846   15.055 30.10950 20.85432 
1 1 1    6   16   44 o  388.183   8.8286  115.759   5.2457  111.663   7.0701  120.774   7.8240  380.617   12.136  395.654   12.919 -15.03677 17.72538 
1 1 1    6   16   45 o  289.376   9.8159   64.418   4.3477   63.616   6.1677   65.210   6.1298  286.795   14.050  290.424   13.789 -3.628510 19.68629 
1 1 1    6   16   46 o  258.146   13.878   51.722   5.4636   43.359   14.242   53.166   5.9162  223.249   43.241  261.472   14.844 -38.22260 45.71793 
1 1 1    6   16   47 o  137.415   18.458   15.006   3.7842   14.961   5.2980   15.052   5.4070  134.744   26.632  135.008   27.107 -0.2637024 38.00090 
1 1 1    6   16   48 o  385.175   8.8091  114.135   5.1935  111.582   7.5320  116.450   7.1707  379.693   12.960  388.176   12.069 -8.483002 17.70929 
1 1 1    6   16   49 o  163.820   16.513   21.140   4.0840   25.824   6.1733   17.495   5.4461  178.993   23.070  146.057   25.276 32.93523 34.22108 
1 1 1    6   16   50 o  341.282   10.592   89.913   5.5329   89.558   7.6751   90.296   7.9832  339.227   14.782  340.412   15.322 -1.185333 21.28971 
1 1 1    6   16   51 o  121.943   32.530   12.816   6.1837   15.377   6.8245   1.0645   14.617  133.202   33.504  105.087   46.391 28.11479 57.22477 
1 1 1    6   16   52 o  112.018   20.932   10.264   3.4570   12.173   6.1015   9.3620   4.1954  118.570   32.604  105.458   26.126 13.11179 41.78028 
1 1 1    6   16   53 o   90.869   25.145   6.9148   3.6158   8.8836   6.4712   6.0211   4.3600  103.112   34.680   86.347   28.451 16.76514 44.85706 
1 1 1    6   16   54 o  123.918   20.577   12.550   3.7660   20.993   6.9561   9.0494   4.4793  156.341   30.162  102.861   27.792 53.47952 41.01366 
1 1 1    6   16   55 f  219.516   13.888   37.834   4.6422   19.697   11.646   41.260   5.0617  141.493   46.493  229.013   14.515 -87.52048 48.70594 
1 1 1    6   16   56 o   74.580   26.335   4.2729   3.7471  -8.1302   6.2504   11.232   4.6817   53.367   25.718  113.831   27.235 -60.46378 37.45934 
1 1 1    6   16   57 o  242.523   13.668   46.335   5.0531   53.734   7.4179   39.928   6.9023  257.949   18.920  221.076   20.636 36.87241 27.99693 
1 1 1    6   16   58 o  166.242   18.519   22.498   4.6321 -11.1904   16.744   25.290   4.8203   88.075   42.356  176.588   18.089 -88.51250 46.05696 
1 1 1    6   16   59 o   53.963   23.509   0.0201   3.6433   1.3365   6.5951  -0.5580   4.3707   73.070   31.733   56.723   25.188 16.34700 40.51408 
1 1 1    6   16   60 o   94.311   24.976   7.9301   3.6624   3.8478   6.5142   9.8169   4.4286   79.032   32.792  103.735   27.461 -24.70303 42.77119 
1 1 1    6   16   61 o   57.437   23.973   1.3303   3.5109  -2.0937   6.1421   2.9921   4.2789   61.437   28.289   67.884   27.165 -6.446693 39.22030 
1 1 1    6   17    0 o  1521.61   20.327  1775.03   47.322  1775.03   47.322  1775.03   47.322  1521.61   20.327  1521.61   20.327 0.000000 0.000000 
1 1 1    6   17    1 o  515.519   8.0832  203.467   6.3782  215.714   9.3361  192.749   8.7342  530.702   11.493  501.663   11.375 29.03931 16.17039 
1 1 1    6   17    2 o  1057.48   15.466  857.019   25.034   0.0000   0.0000  857.019   25.034  ?   ?   1057.48   15.466 0.000000 15.46629 
1 1 1    6   17    3 o  608.866   11.914  283.948   11.104   0.0000   0.0000  283.948   11.104  ?   ?   608.866   11.914 0.000000 11.91441 
1 1 1    6   17    4 o  710.878   9.0085  386.928   9.8021  391.993   13.902  381.922   13.822  715.353   12.697  706.100   12.789 9.253235 18.02164 
1 1 1    6   17    5 o  1488.19   20.180  1698.79   45.967  1698.79   45.967   0.0000   0.0000  1488.19   20.180  ?   ?  0.000000 20.17974 
1 1 1    6   17    6 o  407.444   12.044  127.151   7.5115  127.151   7.5115   0.0000   0.0000  407.444   12.044  ?   ?  0.000000 12.04449 
1 1 1    6   17    7 o  1223.22   10.046  1145.72   18.810  1162.21   23.484  1116.21   31.416  1231.81   12.456  1206.76   17.008 25.05493 21.08138 
1 1 1    6   17    8 o  695.661   7.4865  370.478   7.9717  360.522   9.6414  391.993   14.173  686.199   9.1795  715.368   12.943 -29.16846 15.86809 
1 1 1    6   17    9 o  910.644   10.200  634.990   14.217  626.435   19.782  644.129   20.446  904.258   14.292  916.921   14.568 -12.66302 20.40851 
1 1 1    6   17   10 o  327.382   7.4455   82.048   3.7310   89.259   6.5124   78.525   4.5520  341.381   12.463  320.252   9.2863 21.12943 15.54251 
1 1 1    6   17   11 o  1359.42   10.861  1415.12   22.599  1411.74   38.916  1416.85   27.758  1357.02   18.736  1360.04   13.334 -3.027588 22.99653 
1 1 1    6   17   12 o  665.030   6.4861  338.541   6.6023  335.658   9.2743  341.503   9.4012  662.126   9.1510  667.864   9.1966 -5.738464 12.97374 
1 1 1    6   17   13 o  231.746   8.1211   41.115   2.8807   43.796   4.0035   38.237   4.1481  239.152   10.937  223.110   12.193 16.04239 16.37953 
1 1 1    6   17   14 o  1620.65   10.866  2011.26   26.953  1990.31   37.643  2033.31   38.610  1611.74   15.259  1629.03   15.485 -17.29309 21.73959 
1 1 1    6   17   15 o  958.211   8.7832  702.955   12.882  703.912   15.816  701.069   22.202  958.771   10.778  956.564   15.164 2.206421 18.60382 
1 1 1    6   17   16 o  1512.13   11.949  1751.18   27.657  1705.32   32.861  1862.55   51.214  1491.96   14.390  1558.23   21.473 -66.26782 25.84841 
1 1 1    6   17   17 o  704.242   8.0324  379.690   8.6584  378.534   14.906  380.279   10.637  702.935   13.854  704.728   9.8611 -1.792603 17.00494 
1 1 1    6   17   18 o  1982.05   14.939  3010.18   45.322  2970.30   77.206  3031.15   55.984  1966.56   25.649  1988.32   18.395 -21.75598 31.56364 
1 1 1    6   17   19 o  232.817   9.5380   41.504   3.3989   45.063   4.8903   38.179   4.7275  242.174   13.243  222.796   13.933 19.37836 19.22236 
1 1 1    6   17   20 o  249.423   9.7050   47.638   3.7051   45.104   5.1745   50.305   5.3078  242.220   14.017  255.878   13.601 -13.65843 19.53084 
1 1 1    6   17   21 o  508.236   7.2543  197.749   5.6432  203.898   7.9720  191.572   7.9895  515.998   10.094  500.148   10.436 15.85031 14.51899 
1 1 1    6   17   22 o  882.898   7.7869  596.807   10.523  589.394   14.693  604.615   15.078  877.227   10.943  888.473   11.088 -11.24579 15.57829 
1 1 1    6   17   23 o  672.048   8.7678  345.837   9.0191  351.442   10.883  333.547   16.115  677.394   10.496  659.592   15.962 17.80157 19.10419 
1 1 1    6   17   24 o  177.456   23.780   24.627   6.2967   20.009   8.3158   30.832   9.6400  157.911   35.293  197.312   33.091 -39.40100 48.37963 
1 1 1    6   17   25 o  180.938   18.417   25.380   5.0295   27.745   8.8090   24.236   6.1261  187.112   31.902  176.068   23.305 11.04434 39.50743 
1 1 1    6   17   26 o  637.681   6.8247  311.325   6.6613  305.794   8.2267  321.854   11.351  631.924   8.5054  648.149   11.442 -16.22510 14.25704 
1 1 1    6   17   27 o  357.220   10.520   97.754   5.7520   98.771   8.2463   96.791   8.0272  358.892   15.011  355.286   14.761 3.605560 21.05302 
1 1 1    6   17   28 o  894.505   6.5831  612.611   9.0133  616.795   12.779  608.469   12.715  897.369   9.3035  891.290   9.3202 6.079163 13.16891 
1 1 1    6   17   29 o  519.877   6.4509  206.933   5.1333  219.121   7.3764  195.487   7.1480  534.858   9.0102  505.180   9.2443 29.67834 12.90891 
1 1 1    6   17   30 o  431.668   6.8075  142.683   4.4979  140.651   6.3305  144.755   6.3919  428.467   9.6528  434.675   9.6072 -6.207916 13.61888 
1 1 1    6   17   31 f  488.217   7.4286  182.548   5.5512  170.177   7.6962  195.964   8.0147  471.204   10.671  505.667   10.355 -34.46292 14.86921 
1 1 1    6   17   32 o  274.610   10.397   57.805   4.3702   50.521   8.2888   60.609   5.1431  255.189   21.419  281.120   11.953 -25.93092 24.52826 
1 1 1    6   17   33 f  455.724   6.9287  159.071   4.8331  158.292   6.7508  159.890   6.9225  454.433   9.7055  456.707   9.9027 -2.273712 13.86580 
1 1 1    6   17   34 o   84.318   22.437   5.6847   2.9466   7.8595   4.1326   3.4356   4.2025   99.014   26.671   74.961   27.694 24.05309 38.44855 
1 1 1    6   17   35 o  773.785   6.7183  458.660   7.9570  461.843   11.334  455.566   11.174  776.092   9.5409  770.811   9.4706 5.281250 13.44328 
1 1 1    6   17   36 o  320.015   8.0019   78.493   3.9195   75.578   5.4551   81.603   5.6354  313.779   11.358  326.052   11.292 -12.27283 16.01607 
1 1 1    6   17   37 o   75.312   25.854   4.0497   3.5977   3.0392   4.0156   8.1608   8.0996   71.917   26.972  108.304   38.667 -36.38669 47.14432 
1 1 1    6   17   38 o  187.587   12.253   27.161   3.4988   25.295   5.0542   28.878   4.8483  179.973   18.617  192.792   16.591 -12.81889 24.93700 
1 1 1    6   17   39 o  365.012   8.3662  102.192   4.6742   96.228   6.0420  111.081   7.3765  353.897   11.154  380.011   12.682 -26.11407 16.88921 
1 1 1    6   17   40 f  307.799   8.7884   72.702   4.1404   65.468   5.9676   79.415   5.7493  291.570   13.372  321.365   11.688 -29.79443 17.76006 
1 1 1    6   17   41 o  120.825   17.952   11.548   3.2190   11.108   4.5722   11.980   4.5329  116.732   26.229  121.507   25.199 -4.775177 36.37274 
1 1 1    6   17   42 o  152.723   14.058   18.148   3.2493   17.139   4.4979   19.250   4.6990  146.993   20.554  156.033   20.146 -9.040939 28.78018 
1 1 1    6   17   43 o   66.769   24.122   2.9659   3.1619   1.2506   4.6332   4.4611   4.3258   67.262   27.761   79.719   28.279 -12.45686 39.62795 
1 1 1    6   17   44 o  176.369   13.865   24.187   3.7127   21.691   5.1368   26.917   5.3723  165.310   20.759  184.826   19.274 -19.51616 28.32700 
1 1 1    6   17   45 o  321.746   11.963   79.871   5.8914   99.669   15.307   76.428   6.3831  351.730   28.682  314.444   13.262 37.28592 31.60007 
1 1 1    6   17   46 o  180.004   13.847   25.231   3.7859   35.119   5.4655   16.110   5.2491  211.704   17.010  140.430   25.353 71.27386 30.53110 
1 1 1    6   17   47 o  151.727   16.944   18.156   3.8678   17.234   5.5065   19.055   5.4340  145.066   25.742  153.339   23.934 -8.272675 35.14957 
1 1 1    6   17   48 o  141.690   17.635   15.923   3.7419   14.310   5.4438   17.367   5.1518  130.969   28.004  146.092   23.863 -15.12366 36.79228 
1 1 1    6   17   49 f  103.221   24.402   8.8368   3.7945   7.6292   5.5787   9.8765   5.1764   97.304   32.188  108.229   30.135 -10.92522 44.09328 
1 1 1    6   17   50 o  265.895   26.822   57.697   10.767   0.0000   0.0000   57.697   10.767  ?   ?   265.895   26.822 0.000000 26.82219 
1 1 1    6   17   51 o   92.559   27.579   7.1234   4.2001  -0.9547   5.7162   16.602   6.1920   65.664   28.998  139.754   29.853 -74.08962 41.61868 
1 1 1    6   17   52 o   81.578   28.340   5.1028   4.3290   3.7458   6.0116   6.5645   6.2390   81.632   32.350   93.152   33.848 -11.52015 46.82108 
1 1 1    6   17   53 o  138.842   22.005   15.783   4.5205   8.9473   6.6796   21.559   6.1402  103.382   35.232  160.979   25.791 -57.59605 43.66278 
1 1 1    6   17   54 o   72.201   27.800   3.2500   4.3347   8.1157   6.5153  -0.6142   5.8062   99.138   34.749   66.416   29.283 32.72155 45.44202 
1 1 1    6   17   55 f  135.249   23.713   15.296   4.7300   12.403   6.4207   18.728   6.9944  117.439   33.859  145.293   32.289 -27.85374 46.78663 
1 1 1    6   17   56 o  246.857   12.833   47.793   4.8323   46.685   6.9959   48.804   6.6826  240.443   19.168  246.738   17.814 -6.295776 26.16823 
1 1 1    6   17   57 o   51.626   25.890 -22.1143   8.8459  -8.9674   16.573 -27.3518   10.461   90.536   43.159   54.779   27.564 35.75695 51.21043 
1 1 1    6   17   58 o  225.613   11.922   39.968   4.1025   30.849   6.9006   44.953   5.1020  190.746   24.178  238.146   14.059 -47.40024 27.96866 
1 1 1    6   17   59 o   83.696   25.806   6.1552   3.6344   7.4258   6.3171   5.5266   4.4434   91.755   33.943   80.899   28.665 10.85655 44.42794 
1 1 1    6   17   60 o  108.333   22.257   10.192   3.5672   11.781   6.2178   9.4126   4.3552  109.363   33.760  101.247   27.425 8.115334 43.49525 
1 1 1    6   17   61 o   52.796   23.242  -0.0853   3.6443   1.1664   6.8321  -0.5831   4.3084   71.524   31.638   55.303   24.751 16.22069 40.16983 
1 1 1    6   18    0 o  382.912   11.661  112.563   6.8199  112.563   6.8199  112.563   6.8199  382.912   11.661  382.912   11.661 0.000000 0.000000 
1 1 1    6   18    1 o  585.562   8.4712  262.509   7.5926  259.007   10.628  266.160   10.851  581.537   11.940  589.509   12.025 -7.972168 16.94597 
1 1 1    6   18    2 o  1108.22   16.108  941.159   27.323   0.0000   0.0000  941.159   27.323  ?   ?   1108.22   16.108 0.000000 16.10752 
1 1 1    6   18    3 o  496.133   11.838  188.514   8.9894   0.0000   0.0000  188.514   8.9894  ?   ?   496.133   11.838 0.000000 11.83760 
1 1 1    6   18    4 o  219.417   10.334   36.865   3.4708   40.978   4.9114   32.762   4.9055  230.861   13.965  206.182   15.661 24.67966 20.98290 
1 1 1    6   18    5 o  738.741   9.2149  417.837   10.420  408.934   14.452  427.474   15.036  730.679   12.922  747.049   13.150 -16.36975 18.43642 
1 1 1    6   18    6 o  503.288   8.5989  193.923   6.6241  193.879   9.1409  193.973   9.6127  503.148   11.869  503.252   12.479 -0.1038208 17.22245 
1 1 1    6   18    8 o  859.483   10.050  565.621   13.221  565.621   13.221   0.0000   0.0000  859.483   10.050  ?   ?  0.000000 10.05013 
1 1 1    6   18    9 o  857.935   8.2272  563.494   10.804  580.224   13.558  534.390   17.882  870.503   10.176  835.229   13.988 35.27362 17.29728 
1 1 1    6   18   10 o   49.787   20.566   0.5012   2.5461   1.1499   3.1075  -0.8238   4.4411   57.517   23.103   59.761   25.997 -2.243927 34.77870 
1 1 1    6   18   11 o  591.870   6.3953  268.149   5.7937  266.898   8.1908  269.403   8.1963  590.429   9.0634  593.194   9.0272 -2.765381 12.79201 
1 1 1    6   18   12 o  1400.11   9.6940  1500.93   20.775  1489.51   29.148  1512.72   29.617  1394.46   13.656  1405.27   13.769 -10.81396 19.39301 
1 1 1    6   18   13 o  889.091   7.4230  605.132   10.102  627.919   14.578  584.081   14.011  905.553   10.517  873.372   10.481 32.18030 14.84814 
1 1 1    6   18   14 o  341.249   8.0412   89.150   4.2001   88.057   5.1623   91.292   7.2240  339.120   9.9453  345.218   13.672 -6.098389 16.90620 
1 1 1    6   18   15 o  1746.79   11.587  2336.82   30.979  2352.43   44.114  2321.64   43.514  1752.00   16.450  1740.51   16.334 11.48474 23.18186 
1 1 1    6   18   16 f  673.373   9.5327  347.187   9.8252  347.187   9.8252   0.0000   0.0000  673.373   9.5327  ?   ?  0.000000 9.532731 
1 1 1    6   18   17 o  1499.15   10.306  1721.02   23.648  1686.00   32.548  1760.17   34.417  1483.41   14.335  1515.62   14.836 -32.21252 20.62996 
1 1 1    6   18   18 o  266.139   8.8503   54.232   3.6053   55.769   5.0341   52.614   5.1656  269.829   12.189  262.072   12.877 7.756622 17.73133 
1 1 1    6   18   19 o  789.283   8.4657  476.975   10.227  458.627   17.141  487.118   12.745  773.628   14.475  797.541   10.440 -23.91278 17.84745 
1 1 1    6   18   20 o  1240.53   10.538  1178.60   20.009  1185.86   34.841  1175.02   24.441  1243.46   18.306  1238.43   12.894 5.026733 22.39082 
1 1 1    6   18   21 o  222.549   13.786   38.098   4.6731   38.537   5.5983   37.091   8.4865  223.589   16.474  218.141   25.925 5.448593 30.71619 
1 1 1    6   18   22 o  1192.85   10.452  1089.80   19.084  1086.19   23.175  1097.39   33.635  1190.65   12.716  1196.04   18.373 -5.381348 22.34434 
1 1 1    6   18   23 o  801.153   9.0309  491.512   11.074  468.603   18.652  503.985   13.763  781.789   15.587  811.129   11.085 -29.34033 19.12687 
1 1 1    6   18   24 o  647.795   7.8781  321.312   7.8114  324.898   11.259  317.984   10.846  651.232   11.296  644.282   10.999 6.949707 15.76569 
1 1 1    6   18   25 o  388.588   9.3363  115.647   5.5531  124.208   7.8944  107.262   7.8128  402.585   12.811  374.080   13.645 28.50430 18.71655 
1 1 1    6   18   26 o  499.040   8.6559  190.722   6.6117  193.227   9.2268  188.078   9.4791  502.152   12.005  495.388   12.501 6.763245 17.33179 
1 1 1    6   18   27 o  466.555   7.3128  166.674   5.2223  162.275   6.3641  175.745   9.1373  460.293   9.0330  478.846   12.467 -18.55286 15.39528 
1 1 1    6   18   28 o  737.878   7.1483  416.911   8.0734  426.692   10.318  401.470   12.964  746.364   9.0322  723.758   11.703 22.60571 14.78298 
1 1 1    6   18   29 o  297.650   9.9059   67.881   4.5130   69.996   5.5813   63.886   7.6707  302.167   12.067  287.884   17.491 14.28268 21.24972 
1 1 1    6   18   30 o  380.827   8.0005  111.086   4.6635  108.954   6.6166  113.190   6.5741  376.989   11.467  384.263   11.177 -7.274292 16.01296 
1 1 1    6   18   31 o  410.355   8.2035  129.000   5.1527  155.018   9.6129  118.512   6.1035  449.414   13.975  393.216   10.141 56.19772 17.26640 
1 1 1    6   18   32 o  473.509   6.7387  171.721   4.8840  168.705   6.8400  174.858   6.9760  469.156   9.5251  477.634   9.5420 -8.478027 13.48251 
1 1 1    6   18   33 o  642.121   6.4999  315.802   6.3884  315.001   8.9228  316.643   9.1507  641.066   9.0935  642.712   9.3019 -1.646423 13.00831 
1 1 1    6   18   34 o  473.353   6.8018  171.643   4.9281  172.091   6.9225  171.184   7.0172  473.749   9.5465  472.484   9.7031 1.264984 13.61200 
1 1 1    6   18   35 o  330.061   7.8009   83.491   3.9410   82.796   5.4912   84.229   5.6594  328.463   10.922  331.274   11.161 -2.810699 15.61643 
1 1 1    6   18   36 o  798.694   7.6404  488.936   9.3404  480.966   11.538  504.088   15.909  791.830   9.5201  809.871   12.834 -18.04120 15.97943 
1 1 1    6   18   37 o  289.792   10.668   64.478   4.7320   57.085   5.5735   83.565   8.9559  272.425   13.366  328.483   17.880 -56.05786 22.32380 
1 1 1    6   18   38 o  291.963   8.8244   65.395   3.9435   71.561   5.2559   57.452   5.9651  305.188   11.252  272.750   14.339 32.43732 18.22625 
1 1 1    6   18   39 o  288.726   8.3536   63.951   3.6917   66.100   5.2125   61.789   5.2293  293.211   11.614  283.438   12.054 9.772461 16.73875 
1 1 1    6   18   40 o   68.826   22.766   3.5318   2.7907   5.5135   3.8361   1.3040   4.0674   84.200   26.600   64.203   26.197 19.99644 37.33432 
1 1 1    6   18   41 o  244.121   9.8301   45.791   3.6731   50.752   5.2298   40.962   5.1599  256.228   13.381  229.860   14.744 26.36792 19.91079 
1 1 1    6   18   42 o  522.005   7.5299  209.080   6.0163  212.036   8.9698  206.663   8.1116  524.869   11.165  518.414   10.223 6.454956 15.13802 
1 1 1    6   18   43 o  218.971   11.680   37.049   3.9004   42.955   5.6590   31.705   5.3834  234.928   15.830  201.233   17.656 33.69550 23.71334 
1 1 1    6   18   44 o  142.799   15.955   16.013   3.4278   13.090   4.8256   18.990   4.8699  126.365   25.822  154.292   21.180 -27.92759 33.39647 
1 1 1    6   18   45 o  170.319   17.697   22.844   4.5462   14.266   9.7979   25.197   5.1320  130.143   42.639  178.576   19.071 -48.43237 46.70922 
1 1 1    6   18   46 o  191.487   12.889   28.481   3.7556   21.987   5.2268   35.412   5.3999  165.979   21.047  212.611   16.728 -46.63196 26.88489 
1 1 1    6   18   47 o   53.788   22.993   0.0782   3.3590   0.3274   4.9265  -0.1384   4.5918   65.274   27.873   61.659   26.627 3.615120 38.54758 
1 1 1    6   18   48 o  130.759   19.035   13.685   3.6978   13.714   5.2528   13.657   5.2065  128.170   27.592  127.956   27.409 0.2141266 38.89194 
1 1 1    6   18   49 o  218.990   12.775   37.288   4.2634   44.700   6.4070   31.398   5.7115  238.185   17.700  198.956   18.986 39.22870 25.95702 
1 1 1    6   18   50 o  351.134   22.988   98.883   12.287   0.0000   0.0000   98.883   12.287  ?   ?   351.134   22.988 0.000000 22.98770 
1 1 1    6   18   51 o  162.921   18.064   21.136   4.4289   18.394   5.9169   24.630   6.6790  148.354   27.054  172.658   26.086 -24.30331 37.58194 
1 1 1    6   18   52 o  124.887   23.153   12.888   4.2628   19.103   6.1625   7.1865   5.9030  150.623   27.752   94.867   33.085 55.75636 43.18376 
1 1 1    6   18   53 f  113.768   26.575   11.011   4.5441   12.724   6.4225   9.2949   6.4303  119.969   33.625  104.324   34.560 15.64498 48.21836 
1 1 1    6   18   54 o  249.701   13.540   48.860   5.1558   57.014   7.8482   42.670   6.8385  266.624   19.363  230.363   19.580 36.26105 27.53740 
1 1 1    6   18   55 o  175.142   17.681   24.632   4.6751   25.841   6.4595   23.301   6.7749  175.705   24.701  164.863   27.839 10.84210 37.21754 
1 1 1    6   18   56 o  108.930   26.188   10.302   4.3125   10.653   6.3839   10.008   5.8488  108.197   34.329  105.423   32.776 2.774208 47.46276 
1 1 1    6   18   57 o   69.780   29.595   1.5715   5.4873 -11.5292   15.161   3.5462   5.8863   83.634   40.241   77.923   31.621 5.711006 51.17883 
1 1 1    6   18   58 o  151.540   20.133   19.085   4.5543   15.772   6.3364   22.625   6.5505  130.001   32.048  159.934   27.766 -29.93297 42.40252 
1 1 1    6   18   59 f   41.496   20.146  -5.9329   4.0182  -7.7515   5.7906  -4.2438   5.5806   49.999   24.254   54.690   25.765 -4.690681 35.38511 
1 1 1    6   18   60 o   49.630   23.067  -2.5826   4.2266  -3.9175   6.5757  -1.6428   5.5173   60.010   28.176   59.391   27.148 0.6186867 39.12714 
1 1 1    6   19    0 o  1685.85   22.265  2178.78   57.429  2178.78   57.429  2178.78   57.429  1685.85   22.265  1685.85   22.265 0.000000 0.000000 
1 1 1    6   19    1 o  1242.31   12.407  1181.99   23.592  1174.57   33.141  1189.62   33.594  1237.95   17.490  1245.85   17.617 -7.897217 24.82420 
1 1 1    6   19    2 o  1335.19   18.517  1366.56   37.843   0.0000   0.0000  1366.56   37.843  ?   ?   1335.19   18.517 0.000000 18.51738 
1 1 1    6   19    3 o  722.567   13.111  399.898   14.501   0.0000   0.0000  399.898   14.501  ?   ?   722.567   13.111 0.000000 13.11145 
1 1 1    6   19    4 o  803.081   13.615  494.014   16.736   0.0000   0.0000  494.014   16.736  ?   ?   803.081   13.615 0.000000 13.61536 
1 1 1    6   19    5 o  453.708   7.2270  157.580   5.0189  152.608   6.1001  167.997   8.8296  446.464   8.9266  468.355   12.317 -21.89047 15.21135 
1 1 1    6   19    6 o  469.541   7.2363  168.770   5.2007  168.402   6.3740  169.503   8.9953  469.000   8.8791  470.445   12.492 -1.444855 15.32613 
1 1 1    6   19    7 o  1102.53   9.4647  930.690   15.972  943.982   19.872  906.430   26.846  1110.25   11.694  1087.63   16.126 22.62427 19.91960 
1 1 1    6   19    8 o  206.206   10.125   32.558   3.1958   34.309   3.8358   28.583   5.7785  211.324   11.907  192.044   19.949 19.27966 23.23274 
1 1 1    6   19    9 o  272.289   10.421   56.771   4.3434   56.771   4.3434   0.0000   0.0000  272.289   10.421  ?   ?  0.000000 10.42139 
1 1 1    6   19   10 o  291.740   10.259   65.171   4.5811   65.171   4.5811   0.0000   0.0000  291.740   10.259  ?   ?  0.000000 10.25903 
1 1 1    6   19   11 o  696.616   7.7514  371.498   8.2650  371.976   10.111  370.534   14.349  697.013   9.4771  695.502   13.479 1.510742 16.47695 
1 1 1    6   19   12 o  561.993   7.5022  241.783   6.4534  239.665   7.8752  246.113   11.260  559.486   9.1961  566.841   12.978 -7.355347 15.90572 
1 1 1    6   19   13 o  1206.86   8.7891  1115.13   16.236  1131.56   23.267  1099.55   22.667  1215.46   12.506  1198.16   12.360 17.30359 17.58307 
1 1 1    6   19   14 o  1533.72   10.454  1801.31   24.541  1774.52   34.092  1830.13   35.356  1521.84   14.636  1545.47   14.946 -23.62378 20.91857 
1 1 1    6   19   15 o  563.946   6.7214  243.458   5.8018  247.000   8.2344  239.966   8.1759  567.963   9.4720  559.815   9.5417 8.148438 13.44480 
1 1 1    6   19   16 o  619.152   6.8660  293.463   6.5068  294.542   9.1483  292.358   9.2567  620.207   9.6368  617.898   9.7874 2.308960 13.73545 
1 1 1    6   19   17 o  1347.03   9.5558  1389.42   19.702  1384.82   27.681  1394.14   28.049  1344.44   13.452  1348.94   13.585 -4.500122 19.11772 
1 1 1    6   19   18 o  261.876   12.551   52.537   5.0310   52.537   5.0310   0.0000   0.0000  261.876   12.551  ?   ?  0.000000 12.55118 
1 1 1    6   19   19 o  379.798   9.2107  110.456   5.3545  116.127   6.4728   98.163   9.5299  389.384   10.860  357.784   17.402 31.59991 20.51280 
1 1 1    6   19   20 o  970.151   9.4067  720.748   13.968  701.004   16.604  768.550   25.836  956.639   11.340  1001.13   16.861 -44.49304 20.31917 
1 1 1    6   19   21 o  1157.75   10.270  1026.59   18.199  999.511   30.780  1041.15   22.565  1141.53   17.616  1165.70   12.647 -24.16895 21.68578 
1 1 1    6   19   22 o  1063.53   9.9729  866.307   16.235  845.725   27.558  877.246   20.091  1050.05   17.146  1070.02   12.267 -19.97412 21.08256 
1 1 1    6   19   23 f  525.000   8.0490  211.050   6.4680  203.961   9.0899  218.320   9.2056  515.967   11.510  533.832   11.266 -17.86499 16.10597 
1 1 1    6   19   24 o  745.773   7.8715  425.876   8.9853  426.163   12.558  425.576   12.861  745.836   11.001  745.303   11.274 0.5328369 15.75185 
1 1 1    6   19   25 o  220.895   14.018   37.560   4.7149   39.467   6.6260   35.604   6.7106  225.882   19.351  214.284   20.718 11.59868 28.35006 
1 1 1    6   19   26 o  541.615   8.5284  224.663   7.0701  237.525   10.206  212.796   9.8035  556.709   11.977  526.921   12.155 29.78815 17.06478 
1 1 1    6   19   27 o  499.983   8.7881  191.475   6.7254  187.809   9.5323  195.108   9.4902  494.958   12.582  504.504   12.290 -9.545715 17.58842 
1 1 1    6   19   28 o  423.494   8.4428  137.373   5.4727  149.895   7.1311  119.431   8.5363  442.269   10.534  394.568   14.134 47.70047 17.62813 
1 1 1    6   19   29 o  961.000   9.9993  707.724   14.708  693.852   18.092  734.763   25.258  951.190   12.427  977.984   16.873 -26.79382 20.95551 
1 1 1    6   19   30 o  350.523   11.251   94.210   6.0364  103.638   8.7517   85.653   8.3369  367.328   15.566  333.879   16.314 33.44901 22.54824 
1 1 1    6   19   31 o  702.909   6.4363  378.389   6.9248  366.543   9.5329  391.622   10.076  691.589   9.0055  714.836   9.2089 -23.24646 12.88037 
1 1 1    6   19   32 o  330.069   9.1551   83.508   4.6252   92.918   5.5500   62.113   8.3685  348.089   10.417  283.239   19.420 64.84998 22.03765 
1 1 1    6   19   33 o  295.447   8.0002   66.892   3.6179   65.381   5.0187   68.528   5.2201  291.902   11.233  298.832   11.413 -6.930420 16.01314 
1 1 1    6   19   34 o  298.982   7.8895   68.510   3.6105   65.321   4.9457   72.149   5.2829  291.738   11.076  306.593   11.257 -14.85474 15.79235 
1 1 1    6   19   35 o  832.080   7.5855  530.648   9.6610  528.758   12.035  534.075   16.202  830.257   9.4700  833.662   12.697 -3.405884 15.83961 
1 1 1    6   19   36 o  391.269   9.3153  117.448   5.5788  126.287   6.9939  101.984   9.2504  405.498   11.268  363.642   16.619 41.85593 20.07943 
1 1 1    6   19   37 o  193.036   12.022   28.753   3.5345   33.584   4.9660   23.794   5.0317  208.117   15.705  174.331   19.174 33.78581 24.78457 
1 1 1    6   19   38 o  222.491   9.5423   38.001   3.2496   39.352   4.5434   36.586   4.6498  225.717   13.208  217.478   14.044 8.238708 19.27888 
1 1 1    6   19   39 o  154.176   12.659   18.420   2.9610   21.065   4.0944   15.521   4.2871  164.280   16.507  139.883   20.644 24.39674 26.43150 
1 1 1    6   19   40 o  192.334   10.858   28.535   3.1835   33.820   4.4519   23.005   4.5541  208.930   14.002  171.437   17.605 37.49332 22.49438 
1 1 1    6   19   41 o  595.216   6.9083  271.716   6.2938  271.511   8.9050  271.920   8.8966  594.355   9.7886  594.807   9.7719 -0.4519043 13.83139 
1 1 1    6   19   42 o   86.190   23.009   6.0354   3.0924   8.6701   4.2703   3.1304   4.4841  102.760   26.852   74.053   28.333 28.70732 39.03591 
1 1 1    6   19   43 o  409.195   9.8294  128.813   6.1564  131.812   7.4939  122.587   10.797  413.448   11.842  396.855   17.775 16.59259 21.35846 
1 1 1    6   19   44 o  117.470   25.237   11.338   4.4024   3.3355   12.032   12.575   4.7304  104.342   44.014  123.687   25.820 -19.34480 51.02878 
1 1 1    6   19   45 o  105.473   22.255   9.0826   3.4799   9.0102   4.8584   9.1588   4.9868  104.202   29.259  105.024   29.697 -0.8224564 41.68964 
1 1 1    6   19   46 o   82.392   24.259   5.5034   3.2653   7.9382   4.8305   3.4546   4.4310   98.255   29.644   74.749   28.268 23.50563 40.96185 
1 1 1    6   19   47 o  305.474   9.5560   71.876   4.4681   69.874   6.4074   73.770   6.2338  300.104   13.949  308.577   13.198 -8.473083 19.20335 
1 1 1    6   19   48 f  309.010   9.8880   73.618   4.6768   75.595   6.8451   71.888   6.4048  311.869   14.340  304.316   13.750 7.553314 19.86702 
1 1 1    6   19   49 o  289.625   13.650   65.167   6.0511   69.832   7.2480   54.437   10.993  298.617   15.915  257.167   28.401 41.45020 32.55650 
1 1 1    6   19   50 o  381.348   13.057  112.940   7.6214  112.940   7.6214   0.0000   0.0000  381.348   13.057  ?   ?  0.000000 13.05706 
1 1 1    6   19   51 f  284.422   11.155   62.624   4.8561   65.107   7.0185   60.343   6.7261  287.870   15.992  277.138   15.923 10.73264 22.56711 
1 1 1    6   19   52 o  245.243   12.792   46.908   4.7851   50.144   7.0640   44.165   6.5047  251.060   18.513  235.708   18.170 15.35173 25.93985 
1 1 1    6   19   53 o  231.446   13.264   41.920   4.6793   47.787   6.8461   36.775   6.4106  244.733   18.411  213.833   19.811 30.90089 27.04527 
1 1 1    6   19   54 o  113.676   26.983   11.144   4.6246   8.2175   5.9463   15.623   7.3568   98.139   33.243  130.597   35.756 -32.45805 48.82216 
1 1 1    6   19   55 o   80.010   28.706   4.9867   4.4694   8.7776   6.1507   0.7456   6.5057  100.107   33.810   72.678   31.540 27.42892 46.23695 
1 1 1    6   19   56 o  129.328   29.859   14.928   5.7910  -6.6305   15.640   18.353   6.2341   90.664   42.841  144.164   29.252 -53.50043 51.87519 
1 1 1    6   19   57 o   73.044   27.573   3.8801   4.2109   9.3622   6.1264  -1.0290   5.7974  100.977   33.745   63.669   28.588 37.30764 44.22678 
1 1 1    6   19   58 o  155.053   18.213   19.768   4.2402   23.157   6.0416   16.478   5.9524  163.356   24.954  133.969   29.798 29.38712 38.86706 
1 1 1    6   19   59 o   77.681   27.077   5.1697   3.9533   5.7546   5.5870   4.5833   5.5945   83.075   31.664   78.577   31.186 4.497734 44.44276 
1 1 1    6   20    0 o  744.641   13.179  424.933   15.011  424.933   15.011  424.933   15.011  744.641   13.179  744.641   13.179 0.000000 0.000000 
1 1 1    6   20    1 o  711.055   9.2147  387.099   10.029  378.252   13.902  396.698   14.482  702.745   12.925  719.667   13.147 -16.92194 18.43583 
1 1 1    6   20    2 o  1347.51   18.704  1391.97   38.578   0.0000   0.0000  1391.97   38.578  ?   ?   1347.51   18.704 0.000000 18.70406 
1 1 1    6   20    3 o  279.441   14.429   59.980   6.1503   0.0000   0.0000   59.980   6.1503  ?   ?   279.441   14.429 0.000000 14.42859 
1 1 1    6   20    4 o  781.205   13.619  467.474   16.285   0.0000   0.0000  467.474   16.285  ?   ?   781.205   13.619 0.000000 13.61890 
1 1 1    6   20    5 o  1207.05   10.096  1115.58   18.652  1114.78   22.920  1117.16   32.097  1206.46   12.411  1207.31   17.369 -0.8527832 21.34790 
1 1 1    6   20    6 o  1312.47   10.687  1319.06   21.470  1283.63   25.549  1404.21   39.610  1294.57   12.894  1353.35   19.121 -58.78296 23.06245 
1 1 1    6   20    7 o  1973.62   14.802  2984.26   44.716  2941.37   53.852  3079.47   80.245  1958.89   17.961  2002.56   26.180 -43.66931 31.74835 
1 1 1    6   20    8 o  243.233   9.4569   45.298   3.5208   45.216   4.3320   45.458   6.0430  242.984   11.648  243.007   16.342 -0.2265930E-01 20.06779 
1 1 1    6   20    9 o  1718.96   16.161  2264.39   42.521  2264.39   42.521   0.0000   0.0000  1718.96   16.161  ?   ?  0.000000 16.16106 
1 1 1    6   20   10 o  1050.23   11.373  844.697   18.283  844.697   18.283   0.0000   0.0000  1050.23   11.373  ?   ?  0.000000 11.37329 
1 1 1    6   20   11 o  975.064   10.957  728.090   16.353  728.090   16.353   0.0000   0.0000  975.064   10.957  ?   ?  0.000000 10.95715 
1 1 1    6   20   12 o  929.247   8.7799  661.130   12.488  672.685   15.482  639.612   21.127  937.231   10.792  913.620   15.108 23.61090 18.56664 
1 1 1    6   20   13 o  188.390   10.427   27.262   2.9949   31.283   4.1746   22.997   4.2989  201.614   13.607  172.430   16.489 29.18356 21.37885 
1 1 1    6   20   14 o  317.807   7.8470   77.326   3.8171   75.653   5.2919   79.140   5.5113  314.297   11.000  321.454   11.201 -7.156738 15.69943 
1 1 1    6   20   15 o  1024.42   8.0634  803.471   12.643  792.675   17.619  814.934   18.154  1017.32   11.315  1031.49   11.498 -14.17218 16.13199 
1 1 1    6   20   16 o  392.620   8.6723  118.029   5.2116  118.244   6.2731  117.551   9.3637  392.935   10.430  391.615   15.621 1.320526 18.78339 
1 1 1    6   20   17 o  241.756   11.689   44.770   4.3252   43.297   5.1552   48.272   7.9490  237.267   14.261  249.913   20.974 -12.64650 25.36353 
1 1 1    6   20   18 o  587.522   7.2018  264.266   6.4764  262.078   8.9784  266.639   9.3511  584.988   10.027  590.042   10.354 -5.054138 14.41359 
1 1 1    6   20   19 o  248.645   10.393   47.352   3.9553   45.971   5.5175   48.812   5.6730  244.448   14.816  251.919   14.777 -7.470337 20.92565 
1 1 1    6   20   20 o  567.971   8.7783  247.026   7.6314  239.995   13.011  250.713   9.4225  559.508   15.193  572.111   10.760 -12.60229 18.61707 
1 1 1    6   20   21 o  298.452   11.926   68.246   5.4480   58.107   9.2713   73.592   6.7330  274.115   22.290  309.851   14.197 -35.73569 26.42736 
1 1 1    6   20   22 o  556.586   7.9206  237.209   6.7478  227.035   9.3963  248.043   9.6964  544.374   11.277  569.011   11.133 -24.63635 15.84665 
1 1 1    6   20   23 o  536.963   9.4248  220.835   7.7462  197.643   13.016  233.552   9.6388  507.559   16.755  552.107   11.406 -44.54865 20.26849 
1 1 1    6   20   24 o  801.141   16.215  492.414   19.883  492.414   19.883   0.0000   0.0000  801.141   16.215  ?   ?  0.000000 16.21469 
1 1 1    6   20   25 o  357.583   10.130   97.960   5.5443   92.142   7.9483  103.473   7.7375  346.588   14.983  367.346   13.761 -20.75827 20.34335 
1 1 1    6   20   26 o  292.138   13.081   65.440   5.8494   58.832   9.9792   68.898   7.2198  275.366   23.914  299.212   15.821 -23.84634 28.67339 
1 1 1    6   20   27 o  568.042   9.9734  247.248   8.6715  284.418   15.512  230.352   10.458  608.581   16.652  548.101   12.466 60.48022 20.80149 
1 1 1    6   20   28 o  1066.50   10.320  871.754   16.847  881.856   21.125  854.102   27.924  1072.23   12.872  1054.26   17.305 17.97095 21.56677 
1 1 1    6   20   29 o  405.574   10.315  126.092   6.4033  118.116   9.0232  134.183   9.0883  392.179   15.032  418.080   14.202 -25.90103 20.67979 
1 1 1    6   20   30 o  296.850   9.1713   67.536   4.1671   69.651   4.9424   62.335   7.7500  301.385   10.714  284.065   17.916 17.31989 20.87529 
1 1 1    6   20   31 o  380.471   8.2234  110.927   4.7890  110.966   5.7367  110.837   8.6985  380.433   9.8517  379.756   14.965 0.6764526 17.91651 
1 1 1    6   20   32 o  387.252   6.9232  114.885   4.1036  121.661   5.7496  107.849   5.8588  398.338   9.4300  374.986   10.208 23.35236 13.89685 
1 1 1    6   20   33 o  323.373   8.7866   80.172   4.3490   81.845   5.1252   75.868   8.2195  326.625   10.252  313.319   17.205 13.30582 20.02775 
1 1 1    6   20   34 o  379.669   8.4704  110.521   4.9224  109.259   5.8605  113.544   9.0703  377.345   10.147  384.014   15.431 -6.669159 18.46848 
1 1 1    6   20   35 o  628.385   9.6942  302.990   9.3241  311.728   10.673  274.818   19.163  637.153   10.944  595.584   21.021 41.56903 23.69870 
1 1 1    6   20   36 o  109.301   17.821   9.4635   2.8787   7.3008   3.8439   12.226   4.3442   95.130   25.763  123.317   23.878 -28.18745 35.12695 
1 1 1    6   20   37 o   43.070   19.121  -0.8839   2.5177  -3.2102   3.3707   2.0519   3.7866   43.665   20.396   65.795   25.801 -22.12968 32.88852 
1 1 1    6   20   38 o  398.485   7.2627  121.759   4.4298  124.649   6.2243  118.792   6.3058  402.826   10.095  393.192   10.478 9.633820 14.54954 
1 1 1    6   20   39 o  176.650   11.772   24.119   3.1648   31.067   4.4498   17.006   4.5022  200.103   14.630  146.460   20.657 53.64348 25.31285 
1 1 1    6   20   40 o  320.485   8.2326   78.840   4.0385   75.226   5.5488   82.912   5.8889  312.595   11.597  328.155   11.724 -15.55954 16.49087 
1 1 1    6   20   41 o  432.695   7.6804  143.692   5.0867  144.676   6.8918  142.515   7.5391  433.666   10.383  430.177   11.450 3.489410 15.45637 
1 1 1    6   20   42 o  386.690   9.9885  115.041   5.9120  122.842   7.1614   98.349   10.476  399.190   11.721  354.476   19.381 44.71481 22.64926 
1 1 1    6   20   43 o  430.024   9.2215  142.212   6.0697  132.228   11.247  146.314   7.2096  411.926   17.839  435.788   10.809 -23.86127 20.85766 
1 1 1    6   20   44 o  769.141   9.0766  455.008   10.686  471.856   14.055  431.936   16.448  781.940   11.744  746.577   14.394 35.36353 18.57685 
1 1 1    6   20   45 o  286.802   9.8893   63.351   4.3413   60.770   6.3633   65.597   5.9377  279.393   14.934  291.095   13.326 -11.70148 20.01540 
1 1 1    6   20   46 o  285.749   9.9558   62.918   4.3544   59.395   6.3819   65.986   5.9563  276.002   15.165  291.849   13.334 -15.84698 20.19310 
1 1 1    6   20   47 o   63.792   24.048   2.4848   3.2002   3.0592   4.5702   1.9322   4.4827   73.425   28.469   68.319   27.640 5.105507 39.67891 
1 1 1    6   20   48 o   87.078   29.027   5.9896   4.5337   10.206   5.1218  -9.2717   9.7443  109.790   29.741   71.174   33.688 38.61661 44.93782 
1 1 1    6   20   49 o  283.239   10.992   62.023   4.7652   64.910   6.4889   58.645   7.0205  288.233   14.758  273.067   16.880 15.16580 22.42126 
1 1 1    6   20   50 o  210.400   13.574   34.577   4.3480   28.909   6.2740   39.814   6.0312  189.133   22.088  224.298   17.712 -35.16490 28.31253 
1 1 1    6   20   51 o  111.080   24.310   10.328   4.0185   4.4895   5.5390   16.816   5.8388   82.478   31.506  140.881   28.063 -58.40385 42.19154 
1 1 1    6   20   52 o  335.660   10.909   87.317   5.6046   77.447   7.6746   98.597   8.2041  313.472   16.049  354.651   15.113 -41.17911 22.04489 
1 1 1    6   20   53 o  152.650   19.846   18.921   4.5274   18.134   6.2589   19.784   6.5571  144.815   29.244  151.351   29.364 -6.535522 41.44189 
1 1 1    6   20   54 f  183.394   19.266   27.235   5.3274   11.001   9.7478   34.150   6.3614  111.744   42.000  204.798   20.572 -93.05474 46.76765 
1 1 1    6   20   55 o   99.544   28.729   8.7271   4.6204   2.3720   6.6173   14.773   6.4542   77.465   32.657  127.190   32.904 -49.72490 46.35881 
1 1 1    6   20   56 o   75.066   30.223   3.3348   5.3316  -4.8552   9.1606   7.5302   6.5564   71.806   33.568   94.126   34.623 -22.32018 48.22395 
1 1 1    6   20   57 o   83.375   27.590   6.0293   4.0985   8.9743   5.7090   2.8974   5.8874   98.562   32.560   74.805   31.117 23.75729 45.03815 
1 1 1    6   20   58 o   86.148   27.084   6.6430   3.9813   7.7584   5.6325   5.5292   5.6283   91.994   32.305   82.633   31.713 9.360619 45.26954 
1 1 1    6   20   59 o  111.486   25.044   11.144   4.1692   15.563   6.2997   7.6998   5.5615  126.451   32.401   90.855   32.083 35.59595 45.59753 
1 1 1    6   21    0 o  647.345   12.795  321.217   12.667  321.217   12.667  321.217   12.667  647.345   12.795  647.345   12.795 0.000000 0.000000 
1 1 1    6   21    1 o  943.597   10.520  681.798   15.194  670.293   21.134  694.105   21.859  935.348   14.762  951.799   15.004 -16.45129 21.04837 
1 1 1    6   21    2 o  1011.87   15.517  784.550   24.033   0.0000   0.0000  784.550   24.033  ?   ?   1011.87   15.517 0.000000 15.51688 
1 1 1    6   21    3 o  1565.72   21.130  1880.44   50.639   0.0000   0.0000  1880.44   50.639  ?   ?   1565.72   21.130 0.000000 21.13007 
1 1 1    6   21    4 o  799.732   14.003  489.967   17.141   0.0000   0.0000  489.967   17.141  ?   ?   799.732   14.003 0.000000 14.00272 
1 1 1    6   21    5 o  524.011   9.2296  210.239   7.4028  212.796   10.712  207.902   10.242  527.064   13.279  520.983   12.843 6.080811 18.47358 
1 1 1    6   21    6 o  667.816   9.4556  341.474   9.6653  341.474   9.6653   0.0000   0.0000  667.816   9.4556  ?   ?  0.000000 9.455588 
1 1 1    6   21    7 o  186.254   14.482   26.739   4.0961   26.739   4.0961   0.0000   0.0000  186.254   14.482  ?   ?  0.000000 14.48182 
1 1 1    6   21    8 o  1601.19   15.280  1964.61   37.448  1964.61   37.448   0.0000   0.0000  1601.19   15.280  ?   ?  0.000000 15.27985 
1 1 1    6   21    9 o  948.136   8.8157  688.286   12.794  676.771   15.442  713.492   22.847  940.074   10.732  964.908   15.469 -24.83429 18.82733 
1 1 1    6   21   10 o  1122.88   9.6977  965.465   16.668  956.007   20.240  985.393   29.380  1117.22   11.836  1133.79   16.930 -16.56824 20.65688 
1 1 1    6   21   11 o  814.195   8.3209  507.542   10.370  515.386   12.834  492.791   17.600  820.378   10.220  801.957   14.338 18.42108 17.60821 
1 1 1    6   21   12 o  972.284   9.1307  723.841   13.588  799.094   17.969  623.330   20.767  1021.42   11.493  901.870   15.044 119.5557 18.93187 
1 1 1    6   21   13 o  664.248   9.7892  337.876   9.9529  337.876   9.9529   0.0000   0.0000  664.248   9.7892  ?   ?  0.000000 9.789212 
1 1 1    6   21   14 o  859.486   10.578  565.754   13.916  565.754   13.916   0.0000   0.0000  859.486   10.578  ?   ?  0.000000 10.57799 
1 1 1    6   21   15 o  1125.43   9.9126  969.962   17.075  986.989   21.168  938.241   28.892  1135.07   12.184  1106.17   17.064 28.90649 20.96753 
1 1 1    6   21   16 o  934.038   7.8541  667.963   11.229  659.294   15.658  677.142   16.112  927.767   11.026  940.229   11.196 -12.46173 15.71344 
1 1 1    6   21   17 o  875.775   7.7310  587.232   10.363  596.492   14.857  578.458   14.463  882.460   11.000  869.027   10.873 13.43317 15.46634 
1 1 1    6   21   18 o  327.176   13.041   82.026   6.5306   0.0000   0.0000   82.026   6.5306  ?   ?   327.176   13.041 0.000000 13.04078 
1 1 1    6   21   19 o  482.656   9.0039  178.398   6.6518  169.597   11.484  182.842   8.1602  470.283   15.953  488.559   10.912 -18.27560 19.32829 
1 1 1    6   21   20 o  434.791   8.3458  144.760   5.5542  145.071   7.6882  144.420   8.0326  435.145   11.543  434.145   12.088 1.000580 16.71411 
1 1 1    6   21   21 o  829.937   7.9304  527.430   10.074  519.614   13.936  535.985   14.580  823.555   11.055  836.400   11.389 -12.84546 15.87210 
1 1 1    6   21   22 o  1039.61   8.6230  827.708   13.721  818.902   19.040  837.223   19.792  1033.73   12.034  1045.19   12.371 -11.45984 17.25845 
1 1 1    6   21   23 o  347.336   9.9580   92.419   5.2941   95.175   7.2888   89.342   7.7023  352.333   13.515  341.307   14.744 11.02652 20.00112 
1 1 1    6   21   24 o  529.978   9.6000  215.169   7.7875  192.373   12.951  228.080   9.7463  500.603   16.902  545.518   11.672 -44.91525 20.54067 
1 1 1    6   21   25 o  535.124   11.868  219.513   9.7209   0.0000   0.0000  219.513   9.7209  ?   ?   535.124   11.868 0.000000 11.86820 
1 1 1    6   21   26 o  364.258   13.817  101.794   7.7033  108.233   12.104   97.410   9.9871  374.392   21.209  355.520   18.416 18.87238 28.08837 
1 1 1    6   21   27 o  829.014   9.6851  526.677   12.290  519.323   15.302  540.037   20.626  822.891   12.149  838.482   16.071 -15.59088 20.14680 
1 1 1    6   21   28 o  441.736   9.6062  149.554   6.4951  155.316   9.2817  144.025   9.0922  449.848   13.480  433.167   13.713 16.68036 19.22935 
1 1 1    6   21   29 o  161.430   20.576   20.409   4.9685   15.566   7.0222   25.264   7.0309  138.555   33.484  178.731   26.503 -40.17604 42.70369 
1 1 1    6   21   30 o  348.388   8.3572   93.015   4.4565   93.001   5.3036   93.048   8.2196  348.265   9.9494  347.885   15.436 0.3798828 18.36504 
1 1 1    6   21   31 o  455.219   7.6253  158.788   5.3131  160.087   6.4209  155.966   9.4621  456.951   9.1804  450.533   13.721 6.417816 16.50907 
1 1 1    6   21   32 o  195.665   11.877   29.504   3.5403   30.929   4.0959   25.295   7.0395  200.161   13.447  178.479   26.579 21.68250 29.78735 
1 1 1    6   21   33 o  656.221   7.2338  330.008   7.2659  323.156   8.8458  344.217   12.739  649.149   8.9027  669.320   12.435 -20.17151 15.29320 
1 1 1    6   21   34 o  253.986   9.3275   49.490   3.6262   51.166   4.9799   47.598   5.2906  257.991   12.611  248.322   13.976 9.669159 18.82452 
1 1 1    6   21   35 o  356.608   7.6994   97.501   4.2026  100.485   6.2806   95.081   5.6552  361.642   11.346  351.883   10.500 9.758850 15.45904 
1 1 1    6   21   36 o  279.982   7.9581   60.120   3.4104   61.161   4.7675   59.028   4.8807  282.122   11.040  277.112   11.507 5.010529 15.94665 
1 1 1    6   21   37 o  213.831   9.7353   35.114   3.1863   34.623   4.3714   35.670   4.6542  211.563   13.571  214.637   14.248 -3.073242 19.67651 
1 1 1    6   21   38 o  480.510   7.0044  177.048   5.1516  171.796   7.0953  182.903   7.4919  472.890   9.8026  487.893   10.032 -15.00360 14.02624 
1 1 1    6   21   39 o  354.119   7.6886   96.218   4.1674   95.079   5.7388   97.488   6.0617  351.601   10.664  355.949   11.126 -4.348358 15.41098 
1 1 1    6   21   40 o   87.158   21.890   6.1739   2.9163   5.2887   4.0430   7.1340   4.2105   83.158   27.397   93.910   27.518 -10.75260 38.83109 
1 1 1    6   21   41 o  353.054   11.931   96.103   6.4475   0.0000   0.0000   96.103   6.4475  ?   ?   353.054   11.931 0.000000 11.93103 
1 1 1    6   21   42 o  160.904   16.380   20.312   3.9779   14.683   8.9481   21.698   4.4408  131.557   40.481  166.016   17.751 -34.45891 44.20176 
1 1 1    6   21   43 o  116.040   18.260   10.749   3.1362   6.4891   4.2099   16.059   4.7009   89.839   27.787  141.147   22.516 -51.30836 35.76405 
1 1 1    6   21   44 o  143.219   15.017   16.089   3.2430   10.910   4.4640   21.878   4.7191  114.823   26.004  166.205   18.886 -51.38165 32.13795 
1 1 1    6   21   45 o  456.844   8.1175  160.439   5.6762  160.139   7.7506  160.786   8.3362  455.531   11.116  456.159   11.939 -0.6275940 16.31295 
1 1 1    6   21   46 o  363.505   8.8593  101.701   4.9292  102.107   7.2880  101.358   6.6920  363.009   13.117  362.014   12.077 0.9949951 17.82981 
1 1 1    6   21   47 o  122.679   27.297   12.605   4.9935   18.588   5.8482  -3.4945   9.5933  149.965   26.444   79.853   36.228 70.11242 44.85250 
1 1 1    6   21   48 o  261.300   15.934   53.535   6.3424   57.757   6.8009   25.355   17.571  271.228   16.460  160.823   57.001 110.4048 59.32995 
1 1 1    6   21   49 f  201.202   13.218   31.587   4.0479   34.664   5.8030   28.671   5.6494  209.025   18.323  189.397   19.779 19.62732 26.96206 
1 1 1    6   21   50 o  208.435   13.233   33.929   4.2000   43.297   5.9734   24.769   5.9066  234.203   16.774  174.477   22.652 59.72572 28.18647 
1 1 1    6   21   51 o  141.101   19.587   16.100   4.1162   6.7589   5.5323   27.684   6.1607   91.903   32.031  184.413   22.277 -92.50986 39.01608 
1 1 1    6   21   52 o   57.419   24.793   0.0652   3.9799  -3.1054   5.7405   2.9997   5.5227   59.838   27.477   76.144   30.723 -16.30548 41.21809 
1 1 1    6   21   53 f  144.169   20.720   17.046   4.4409   9.8236   5.7104   28.098   7.0642  105.350   32.325  182.641   26.004 -77.29142 41.48619 
1 1 1    6   21   54 o   88.422   28.729   6.6518   4.4514   14.241   6.4857  -0.1070   6.1205  124.911   33.311   68.523   30.145 56.38780 44.92578 
1 1 1    6   21   55 o   55.838   25.317  -1.7268   4.6758  -8.2904   8.9920   0.7056   5.4741   66.334   31.669   67.193   29.045 -0.8590393 42.97129 
1 1 1    6   21   56 o   49.606   22.845  -2.2675   4.0080  -1.7759   5.6377  -2.7699   5.6990   60.887   27.680   58.962   27.186 1.925053 38.79803 
1 1 1    6   21   57 o   47.918   22.359  -2.9030   4.0344  -3.7961   5.3651  -1.7410   6.1200   54.467   25.534   62.898   28.690 -8.431515 38.40703 
1 1 1    6   21   58 o  114.185   24.538   11.567   4.1608   7.6645   5.4961   16.808   6.3684   91.027   31.915  132.549   31.797 -41.52278 45.05136 
1 1 1    6   22    1 o  1140.84   16.827  997.628   29.384  997.628   29.384   0.0000   0.0000  1140.84   16.827  ?   ?  0.000000 16.82723 
1 1 1    6   22    5 o  478.577   9.3622  175.372   6.8580  180.138   10.036  171.197   9.3930  484.905   13.522  472.737   12.981 12.16782 18.74473 
1 1 1    6   22    6 o  923.414   10.738  653.012   15.177  658.999   21.750  647.329   21.188  927.318   15.324  919.092   15.061 8.226685 21.48619 
1 1 1    6   22    7 o  534.297   7.7258  218.553   6.3182  207.618   7.5529  244.042   11.531  520.713   9.4764  564.399   13.348 -43.68579 16.36990 
1 1 1    6   22    8 o  347.550   8.5434   92.483   4.5448   91.416   5.4676   94.869   8.1751  345.504   10.339  351.838   15.180 -6.334686 18.36670 
1 1 1    6   22    9 o  555.880   7.8353  236.572   6.6666  230.939   8.0927  248.466   11.760  549.169   9.6276  569.473   13.491 -20.30328 16.57408 
1 1 1    6   22   10 o  577.209   7.9103  255.079   6.9887  253.168   8.5205  259.007   12.217  574.987   9.6814  581.408   13.728 -6.421021 16.79858 
1 1 1    6   22   11 o  1005.47   9.2600  774.136   14.251  760.304   17.202  804.408   25.447  996.317   11.280  1024.36   16.230 -28.04547 19.76484 
1 1 1    6   22   12 o  763.628   8.3364  446.480   9.7438  446.570   11.932  446.297   16.882  763.619   10.208  763.124   14.453 0.4950562 17.69498 
1 1 1    6   22   13 o  569.729   7.1102  248.499   6.2004  252.857   8.7702  244.145   8.7672  574.608   9.9716  564.616   10.145 9.992065 14.22491 
1 1 1    6   22   14 o  903.710   8.9635  625.376   12.399  631.316   15.278  613.918   21.220  907.863   10.994  894.895   15.492 12.96851 18.99682 
1 1 1    6   22   15 o  1044.06   9.6088  834.790   15.355  839.867   18.898  824.926   26.342  1047.05   11.792  1037.18   16.593 9.865479 20.35605 
1 1 1    6   22   16 o  791.775   8.6986  480.053   10.542  478.826   12.891  482.532   18.317  790.650   10.652  793.365   15.084 -2.715149 18.46577 
1 1 1    6   22   17 f  550.501   8.7183  232.067   7.3462  223.337   12.620  236.541   9.0346  539.716   15.277  555.703   10.622 -15.98669 18.60631 
1 1 1    6   22   18 o  399.642   9.6470  122.324   5.9011  131.009   10.419  118.223   7.1602  413.287   16.471  392.807   11.909 20.47931 20.32533 
1 1 1    6   22   19 o  1329.79   9.7378  1354.43   19.820  1332.15   27.458  1378.66   28.640  1318.30   13.608  1341.06   13.953 -22.76245 19.48969 
1 1 1    6   22   20 o  1182.42   9.1187  1070.81   16.504  1070.12   23.234  1071.51   23.447  1181.60   12.846  1182.36   12.956 -0.7539063 18.24495 
1 1 1    6   22   21 o  626.689   7.8336  300.746   7.5142  306.636   10.657  294.924   10.597  632.613   11.006  620.404   11.159 12.20911 15.67329 
1 1 1    6   22   22 o  377.057   10.663  108.934   6.1540  109.645   10.449  108.557   7.6148  377.869   18.066  376.284   13.221 1.585144 22.38720 
1 1 1    6   22   23 f  494.811   9.5838  187.571   7.2585  187.949   12.142  187.361   9.0544  494.850   16.031  494.391   11.965 0.4591675 20.00385 
1 1 1    6   22   24 o  783.602   8.1562  470.313   9.7826  469.175   13.806  471.460   13.864  782.334   11.529  784.234   11.550 -1.900208 16.31912 
1 1 1    6   22   25 o  261.956   22.672   53.270   9.0010   0.0000   0.0000   53.270   9.0010  ?   ?   261.956   22.672 0.000000 22.67225 
1 1 1    6   22   26 o  399.634   10.012  122.410   6.1240  116.841   8.3844  128.777   8.9660  390.156   14.040  409.577   14.302 -19.42145 20.04157 
1 1 1    6   22   27 o  756.608   9.8379  438.807   11.393  452.415   20.139  432.401   13.817  767.005   17.154  750.770   12.023 16.23529 20.94790 
1 1 1    6   22   28 f  833.346   9.9264  532.432   12.661  516.602   21.805  540.485   15.552  819.357   17.386  839.260   12.107 -19.90265 21.18612 
1 1 1    6   22   29 o  814.947   9.9763  509.280   12.444  507.473   21.562  510.182   15.238  811.879   17.351  815.268   12.211 -3.389099 21.21734 
1 1 1    6   22   30 o  177.509   18.007   24.529   4.8247   21.532   6.7749   27.613   6.8726  164.168   27.964  187.182   24.582 -23.01413 37.23226 
1 1 1    6   22   31 o  476.575   9.5023  174.196   6.9315  174.380   9.6491  174.000   9.9638  476.345   13.234  475.757   13.683 0.5880127 19.03567 
1 1 1    6   22   32 o  212.282   12.051   34.729   3.8995   32.808   4.0824   54.728   13.175  206.191   13.002  261.615   33.684 -55.42403 36.10632 
1 1 1    6   22   33 o  296.247   11.082   67.399   5.0250   71.522   5.4516   44.103   12.958  305.117   11.673  232.839   37.644 72.27809 39.41191 
1 1 1    6   22   34 o  283.434   8.2867   61.611   3.5951   54.496   5.0652   68.833   5.1033  266.216   12.431  299.332   11.139 -33.11517 16.69104 
1 1 1    6   22   35 o  213.510   9.1433   34.986   2.9881   36.038   4.0794   33.767   4.3891  216.096   12.385  208.940   13.802 7.156586 18.54405 
1 1 1    6   22   36 o  237.735   8.7806   43.376   3.1951   38.487   4.3376   49.175   4.7243  223.234   12.748  252.798   12.209 -29.56435 17.65127 
1 1 1    6   22   37 o  236.786   9.0085   43.047   3.2649   44.407   4.5304   41.578   4.7095  239.841   12.383  231.892   13.324 7.948944 18.19003 
1 1 1    6   22   38 o  287.571   8.0669   63.468   3.5508   59.101   4.8984   68.304   5.1545  277.091   11.549  297.920   11.304 -20.82886 16.16039 
1 1 1    6   22   39 o  156.598   12.226   19.013   2.9073   17.526   3.8641   20.951   4.4136  149.342   17.220  163.280   17.957 -13.93855 24.87911 
1 1 1    6   22   40 o  183.745   11.469   26.113   3.2096   21.825   4.3224   31.384   4.7918  166.760   17.180  200.633   15.730 -33.87260 23.29346 
1 1 1    6   22   41 o  296.064   10.709   67.512   4.8530   71.614   9.9203   66.221   5.5643  301.266   21.658  292.901   12.411 8.365356 24.96199 
1 1 1    6   22   42 o  240.199   18.371   45.280   6.7029   53.353   9.9547   38.584   9.0661  258.000   25.544  218.115   27.787 39.88487 37.74387 
1 1 1    6   22   43 o   86.058   22.949   6.0596   3.0784   9.3992   4.2939   2.5280   4.4156  106.478   26.462   70.702   27.818 35.77585 38.39368 
1 1 1    6   22   44 o  147.291   14.758   17.005   3.2824   15.558   4.8292   18.247   4.4751  138.288   23.666  151.262   19.804 -12.97441 30.85919 
1 1 1    6   22   45 o   96.811   21.018   7.6659   3.0251   11.373   4.3405   4.1640   4.2184  117.306   24.942   77.109   27.861 40.19640 37.39426 
1 1 1    6   22   46 o   42.445   20.301  -4.8755   3.7304  -2.6147   4.0926 -15.9770   9.0692   50.670   23.243   59.848   29.319 -9.178646 37.41393 
1 1 1    6   22   47 o  540.461   12.270  226.277   10.150  229.925   11.615  214.490   20.878  543.838   13.954  514.256   26.615 29.58228 30.05091 
1 1 1    6   22   48 o  129.592   20.037   13.573   3.8462   13.285   5.5995   13.830   5.2922  124.796   29.737  128.061   27.797 -3.264961 40.70545 
1 1 1    6   22   49 o  137.705   19.335   15.272   3.9631   20.211   5.6167   10.375   5.5927  156.802   24.180  109.832   31.581 46.96990 39.77470 
1 1 1    6   22   50 o  275.456   11.313   58.815   4.7697   55.816   6.8389   61.655   6.6556  265.785   16.898  280.036   15.589 -14.25110 22.99097 
1 1 1    6   22   51 o   95.703   25.535   7.7761   3.8098   10.914   5.4409   4.7571   5.3363  111.757   30.812   82.376   31.053 29.38077 43.74586 
1 1 1    6   22   52 o   82.166   27.661   5.4812   4.1167   9.1329   5.5078   0.8587   6.1968  102.206   31.811   72.043   31.023 30.16274 44.43349 
1 1 1    6   22   53 o   70.493   27.273   3.1506   4.1874   7.2612   6.6099   0.3950   5.4119   94.504   34.763   66.454   28.803 28.04951 45.14502 
1 1 1    6   22   54 o   70.209   28.613   2.4615   4.8448   3.6359   9.2238   2.0141   5.6933   89.312   38.138   72.418   30.398 16.89411 48.77047 
1 1 1    6   22   55 o   70.024   28.751   2.4537   4.9376   9.5056   5.8807 -14.3953   9.0900  101.770   33.018   59.106   29.035 42.66397 43.96889 
1 1 1    6   22   56 o   58.781   25.277   0.6239   4.1032   1.7342   5.6641  -0.6023   5.9522   70.083   29.906   64.963   29.082 5.120232 41.71474 
1 1 1    6   22   57 o  182.547   15.437   26.911   4.2730   29.060   5.9334   24.595   6.1587  185.558   21.275  167.947   24.695 17.61096 32.59560 
1 1 1    6   23    0 o  868.088   14.635  577.589   19.433  577.589   19.433  577.589   19.433  868.088   14.635  868.088   14.635 0.000000 0.000000 
1 1 1    6   23    1 o  1768.44   16.534  2397.40   44.754  2359.49   62.037  2438.54   64.626  1753.01   23.120  1781.99   23.694 -28.98157 33.10496 
1 1 1    6   23    2 o  1089.43   16.467  909.818   27.458   0.0000   0.0000  909.818   27.458  ?   ?   1089.43   16.467 0.000000 16.46676 
1 1 1    6   23    3 o  1269.90   18.184  1236.68   35.346   0.0000   0.0000  1236.68   35.346  ?   ?   1269.90   18.184 0.000000 18.18450 
1 1 1    6   23    4 o  1042.05   16.127  832.361   25.723   0.0000   0.0000  832.361   25.723  ?   ?   1042.05   16.127 0.000000 16.12725 
1 1 1    6   23    5 o  969.234   11.096  719.501   16.462  731.186   23.857  708.881   22.744  976.672   15.959  961.707   15.451 14.96454 22.21285 
1 1 1    6   23    6 o  560.380   9.6011  240.469   8.2352  247.054   12.013  234.631   11.311  567.824   13.822  553.385   13.354 14.43854 19.21915 
1 1 1    6   23    7 o  917.030   8.8636  643.911   12.441  639.318   15.169  653.352   21.748  913.639   10.847  923.260   15.389 -9.620422 18.82769 
1 1 1    6   23    8 o  1029.01   9.4197  810.824   14.836  818.571   18.375  796.315   25.147  1033.75   11.613  1019.19   16.120 14.56647 19.86746 
1 1 1    6   23    9 o  1053.89   9.5508  850.537   15.407  836.404   18.603  881.395   27.489  1044.94   11.631  1072.16   16.751 -27.21680 20.39273 
1 1 1    6   23   10 o  905.666   8.9082  628.074   12.349  619.820   14.947  645.823   21.918  899.577   10.855  917.860   15.601 -18.28296 19.00636 
1 1 1    6   23   11 o  808.832   8.6018  500.935   10.649  496.703   12.983  509.638   18.617  805.304   10.533  815.403   14.917 -10.09906 18.26046 
1 1 1    6   23   12 o  217.104   12.702   36.238   4.2027   31.675   5.0377   46.681   7.6219  202.586   16.387  245.762   20.447 -43.17656 26.20340 
1 1 1    6   23   13 o  1380.51   11.374  1459.94   24.034  1442.57   29.081  1497.38   42.690  1371.95   13.848  1396.71   19.969 -24.75305 24.30073 
1 1 1    6   23   14 o  426.519   7.8487  139.291   5.1240  134.260   7.1526  144.593   7.3439  418.646   11.162  434.462   11.044 -15.81567 15.70198 
1 1 1    6   23   15 o   73.528   27.363   3.1654   4.1173   2.7576   7.1594   3.3670   5.0329   87.335   35.071   79.081   30.074 8.254578 46.20005 
1 1 1    6   23   16 f  894.757   11.308  613.350   15.486  615.800   21.915  610.906   21.887  896.071   15.978  892.498   16.022 3.572937 22.62752 
1 1 1    6   23   17 o  917.881   9.2790  645.262   13.036  652.471   16.077  631.424   22.275  922.821   11.382  907.315   16.039 15.50635 19.66764 
1 1 1    6   23   18 o  278.486   11.776   59.429   5.0197   58.529   6.1679   61.194   8.6383  275.886   14.659  281.534   20.180 -5.647919 24.94201 
1 1 1    6   23   19 o  349.080   9.2307   93.336   4.9321   98.269   7.0613   88.636   6.8919  358.049   12.885  340.030   13.242 18.01868 18.47600 
1 1 1    6   23   20 o  929.090   9.4814  661.239   13.483  671.140   23.299  656.253   16.533  935.176   16.277  925.359   11.673 9.817078 20.02971 
1 1 1    6   23   21 o  942.646   9.5660  680.737   13.802  677.258   23.590  682.549   17.019  939.307   16.408  943.651   11.783 -4.344849 20.20041 
1 1 1    6   23   22 o  656.220   7.9362  329.814   7.9714  327.834   11.199  331.848   11.349  654.000   11.188  657.985   11.268 -3.985107 15.87895 
1 1 1    6   23   23 o  978.091   9.7863  733.073   14.651  729.216   17.908  740.880   25.478  975.205   11.997  982.047   16.950 -6.841675 20.76616 
1 1 1    6   23   24 o  245.098   14.407   46.271   5.3812   45.483   6.6741   47.736   9.0971  242.542   18.108  247.528   24.325 -4.985596 30.32550 
1 1 1    6   23   25 o  543.330   8.4734  226.183   7.0468  224.310   9.7423  228.237   10.205  540.791   11.770  545.457   12.223 -4.666565 16.96864 
1 1 1    6   23   26 f  460.838   8.9665  162.757   6.3247  165.555   8.7294  159.665   9.1762  464.499   12.278  456.076   13.145 8.423126 17.98723 
1 1 1    6   23   27 o  382.557   9.9479  112.214   5.8250  107.462   7.9773  117.642   8.5256  374.033   13.934  391.317   14.234 -17.28439 19.91901 
1 1 1    6   23   28 o  222.928   14.506   38.359   4.9227   37.877   6.8717   38.866   7.0553  220.570   20.592  223.404   20.874 -2.834229 29.32199 
1 1 1    6   23   29 o  300.558   13.762   69.430   6.3310   67.839   11.393   70.141   7.6150  294.517   25.525  301.357   16.573 -6.840637 30.43332 
1 1 1    6   23   30 o   73.744   30.232   1.5505   5.4490   1.0099   10.060   1.7750   6.4821   94.737   40.120   80.036   32.911 14.70080 51.89194 
1 1 1    6   23   31 o  547.439   13.623  230.488   11.415  234.160   16.148  226.819   16.139  550.463   19.165  541.683   19.465 8.779968 27.31660 
1 1 1    6   23   32 o  341.395   13.541   89.668   7.0761   83.095   12.800   92.561   8.4916  325.413   25.913  346.498   16.011 -21.08463 30.46037 
1 1 1    6   23   33 f  302.656   9.6677   70.308   4.4786   72.039   5.3773   66.386   8.0921  306.178   11.474  292.475   18.166 13.70322 21.48613 
1 1 1    6   23   34 o  114.281   29.708   10.671   5.2446   4.6193   7.4932   16.483   7.3431   93.380   36.384  141.261   34.304 -47.88136 50.00534 
1 1 1    6   23   35 f  186.747   9.8679   26.859   2.8106   21.206   3.7466   34.136   4.2506  165.119   14.987  210.104   13.286 -44.98427 20.02838 
1 1 1    6   23   36 o  233.853   8.7530   41.981   3.1331   38.158   4.1688   46.943   4.7495  222.288   12.300  246.563   12.627 -24.27498 17.62791 
1 1 1    6   23   37 o  357.332   7.3891   97.952   4.0414   95.848   5.6091  100.225   5.8281  353.064   10.379  361.009   10.547 -7.944580 14.79780 
1 1 1    6   23   38 o  333.965   8.1698   85.627   4.1762   87.027   5.8668   84.189   5.9461  336.183   11.401  330.592   11.751 5.590759 16.37294 
1 1 1    6   23   39 o  549.236   7.5199  231.539   6.3218  227.213   8.7261  236.317   9.1712  543.334   10.493  554.014   10.815 -10.67975 15.06868 
1 1 1    6   23   40 o  289.738   10.452   64.635   4.6353   78.778   9.8878   60.652   5.2477  316.548   20.518  280.357   12.229 36.19110 23.88593 
1 1 1    6   23   41 o  211.902   13.292   34.852   4.2892   47.619   9.5701   31.642   4.7981  243.421   26.092  201.307   15.696 42.11392 30.44956 
1 1 1    6   23   42 o  233.510   9.8158   41.981   3.5083   35.809   4.7703   49.252   5.1778  214.409   14.623  251.915   13.477 -37.50633 19.88618 
1 1 1    6   23   43 o  460.161   9.2223  162.963   6.4956  176.836   7.9015  134.044   11.408  478.858   10.780  414.105   17.999 64.75330 20.98024 
1 1 1    6   23   44 o   82.253   22.721   5.5335   2.9551   7.7024   4.2457   3.4954   4.1157   96.436   27.448   73.446   27.353 22.99003 38.75008 
1 1 1    6   23   45 o  367.570   8.6977  103.985   4.8934  121.522   7.2840   89.560   6.6062  396.350   12.007  340.046   12.692 56.30435 17.47162 
1 1 1    6   23   46 o  232.560   15.124   42.315   5.3542   41.433   5.6234   50.860   17.513  229.787   16.090  232.139   50.708 -2.351624 53.19969 
1 1 1    6   23   47 o  240.009   10.933   44.532   4.0163   45.620   5.5746   43.359   5.7914  241.359   15.167  234.898   16.207 6.460464 22.19674 
1 1 1    6   23   48 o  197.480   13.074   30.434   3.9296   25.896   5.3775   35.634   5.7566  179.788   19.874  212.038   17.904 -32.25040 26.74928 
1 1 1    6   23   49 o  225.936   12.699   39.805   4.3738   44.582   6.2205   35.133   6.1511  237.345   17.240  209.628   19.390 27.71722 25.94638 
1 1 1    6   23   50 o   92.067   26.355   7.1697   3.9028   13.278   5.7451   1.9353   5.3184  123.404   30.573   71.668   29.674 51.73519 42.60588 
1 1 1    6   23   51 o  139.652   20.465   15.942   4.2447   18.044   5.8775   13.651   6.1367  145.358   27.423  123.916   32.098 21.44199 42.21680 
1 1 1    6   23   52 o   57.961   24.950   0.2596   4.0051  -4.0153   6.4866   2.8934   5.0915   61.756   28.660   73.375   29.537 -11.61908 41.15604 
1 1 1    6   23   53 o  125.989   20.900   13.169   3.8892   16.025   5.4212   10.140   5.5826  136.080   26.981  106.212   31.829 29.86831 41.72582 
1 1 1    6   23   54 o  147.856   21.981   18.302   4.8232  -0.3024   8.8312   26.210   5.7577   78.609   35.291  177.586   21.629 -98.97742 41.39180 
1 1 1    6   23   55 f   87.539   26.928   6.7688   3.9599   8.2017   5.5588   5.2925   5.6424   95.010   32.141   82.630   31.743 12.38036 45.17369 
1 1 1    6   23   56 f   98.748   25.999   8.7627   3.9838   6.1232   5.4882   11.702   5.7918   84.918   31.593  110.579   32.238 -25.66165 45.13797 
1 1 1    6   23   57 o  200.867   15.200   32.568   4.6386   24.519   6.6457   40.215   6.4773  165.090   27.251  219.802   19.454 -54.71213 33.48212 
1 1 1    6   24    0 o  554.920   13.516  236.231   11.465  236.231   11.465  236.231   11.465  554.920   13.516  554.920   13.516 0.000000 0.000000 
1 1 1    6   24    1 o  240.120   12.995   44.305   4.7584   40.555   6.6961   48.131   6.7631  229.107   19.274  249.886   17.798 -20.77898 26.23482 
1 1 1    6   24    2 o  422.579   14.014  136.844   9.0641   0.0000   0.0000  136.844   9.0641  ?   ?   422.579   14.014 0.000000 14.01354 
1 1 1    6   24    3 o  856.555   14.905  562.342   19.541   0.0000   0.0000  562.342   19.541  ?   ?   856.555   14.905 0.000000 14.90452 
1 1 1    6   24    4 o  465.172   14.263  165.832   10.155   0.0000   0.0000  165.832   10.155  ?   ?   465.172   14.263 0.000000 14.26253 
1 1 1    6   24    5 o  268.878   12.736   55.391   5.2417   55.284   7.7371   55.481   7.1264  267.767   19.001  268.404   17.441 -0.6374207 25.79216 
1 1 1    6   24    6 o  1280.54   13.212  1256.48   25.895  1251.74   36.745  1261.15   36.499  1277.33   18.794  1282.15   18.598 -4.825684 26.44089 
1 1 1    6   24    7 o  1019.86   11.640  796.781   18.171  790.856   25.793  802.620   25.603  1015.56   16.593  1023.11   16.349 -7.554810 23.29449 
1 1 1    6   24    8 o  1173.72   10.231  1055.11   18.380  1045.19   22.367  1075.74   32.258  1167.97   12.511  1184.24   17.796 -16.26794 21.75384 
1 1 1    6   24    9 o  1322.26   11.030  1339.26   22.323  1338.31   27.371  1341.15   38.578  1321.49   13.532  1322.02   19.065 -0.5272217 23.37882 
1 1 1    6   24   10 o  962.496   9.2776  709.446   13.668  703.163   16.649  722.433   23.936  958.070   11.353  970.632   16.111 -12.56183 19.70976 
1 1 1    6   24   11 o  811.994   8.7415  504.897   10.865  503.475   13.294  507.755   18.853  810.731   10.713  813.810   15.135 -3.078979 18.54292 
1 1 1    6   24   12 o  582.762   10.481  260.137   9.3491  262.677   13.346  257.689   13.100  585.340   14.896  579.765   14.763 5.575256 20.97236 
1 1 1    6   24   13 o  604.336   10.560  279.766   9.7684  277.736   13.837  281.783   13.793  601.858   15.020  606.238   14.864 -4.380615 21.13138 
1 1 1    6   24   14 o  533.183   8.8922  217.714   7.2570  207.620   12.637  222.680   8.8643  520.294   15.868  539.147   10.742 -18.85339 19.16213 
1 1 1    6   24   15 f  634.347   7.5502  308.116   7.3308  309.527   10.374  306.709   10.361  635.637   10.662  632.736   10.698 2.901550 15.10423 
1 1 1    6   24   16 o  531.443   7.7960  216.271   6.3416  216.717   9.0524  215.842   8.8866  531.834   11.120  530.769   10.939 1.064331 15.59853 
1 1 1    6   24   17 o  854.037   9.1520  558.665   11.964  553.213   20.153  561.632   14.867  849.204   15.504  856.112   11.345 -6.907715 19.21203 
1 1 1    6   24   18 o  1449.50   14.588  1611.57   32.366  1602.79   45.350  1620.68   46.208  1443.98   20.519  1451.92   20.792 -7.946655 29.21191 
1 1 1    6   24   19 o  104.921   27.627   8.8033   4.4979   5.1171   5.6351   15.275   7.4666   89.085   32.199  137.717   35.268 -48.63245 47.75562 
1 1 1    6   24   20 o  987.784   9.7297  747.589   14.711  744.350   18.022  754.057   25.466  985.354   11.949  990.922   16.790 -5.567688 20.60792 
1 1 1    6   24   21 o  425.439   8.9040  138.665   5.7982  137.327   8.0383  140.116   8.3716  423.173   12.410  427.422   12.796 -4.248657 17.82564 
1 1 1    6   24   22 o  881.851   9.4986  595.923   12.821  590.536   15.642  606.953   22.382  877.571   11.645  888.828   16.452 -11.25708 20.15580 
1 1 1    6   24   23 o  593.514   8.2369  269.873   7.4828  277.758   10.557  261.913   10.607  601.826   11.461  584.367   11.859 17.45978 16.49206 
1 1 1    6   24   24 o  231.577   13.111   41.292   4.6282   40.893   6.3892   41.733   6.7133  229.788   18.318  232.037   19.071 -2.249542 26.44294 
1 1 1    6   24   25 o  525.153   8.5006  211.342   6.8329  215.959   9.5151  206.426   9.8183  530.542   11.717  518.625   12.368 11.91687 17.03730 
1 1 1    6   24   26 o  565.511   8.4170  245.095   7.2857  247.882   10.168  242.153   10.445  568.347   11.688  561.680   12.149 6.667480 16.85852 
1 1 1    6   24   27 o  124.355   24.161   12.382   4.4332   17.143   6.2963   7.7009   6.2430  145.847   29.223  101.785   34.064 44.06166 44.88132 
1 1 1    6   24   28 o  401.633   9.5872  123.718   5.8937  115.523   8.1510  132.697   8.5320  387.664   13.737  415.525   13.415 -27.86121 19.20048 
1 1 1    6   24   29 o  302.518   13.892   70.382   6.4325   72.151   7.5406   65.655   12.327  305.612   16.178  288.691   28.259 16.92072 32.56234 
1 1 1    6   24   30 o  242.608   17.037   45.619   6.2866   39.863   7.1472   65.298   13.215  225.954   20.902  286.973   30.554 -61.01891 37.01999 
1 1 1    6   24   31 o  328.718   13.378   83.132   6.7313   89.532   12.547   80.546   7.9762  338.250   24.399  323.181   16.124 15.06943 29.24561 
1 1 1    6   24   32 o  209.732   18.741   34.302   5.9530   26.889   10.962   37.402   7.0894  179.463   40.828  218.465   21.479 -39.00243 46.13346 
1 1 1    6   24   33 o  125.544   31.535   12.948   6.0517   13.534   11.902   12.744   7.0280  133.605   46.958  124.626   35.260 8.979729 58.72277 
1 1 1    6   24   34 o  325.158   8.7722   81.147   4.3659   81.192   5.0864   81.020   8.5093  325.083   10.222  323.133   17.267 1.949738 20.06597 
1 1 1    6   24   35 o  224.590   10.714   38.782   3.6832   40.700   4.2081   32.500   7.6160  229.631   12.014  202.068   25.170 27.56326 27.89021 
1 1 1    6   24   36 o  149.493   11.689   17.309   2.6534   10.683   3.5012   26.250   4.0672  115.442   20.568  183.786   14.578 -68.34444 25.21050 
1 1 1    6   24   37 o  425.479   7.4971  138.918   4.8825  129.792   6.6427  149.642   7.2008  410.724   10.566  440.993   10.668 -30.26892 15.01503 
1 1 1    6   24   38 o  232.528   12.569   41.837   4.4569   41.837   4.4569   0.0000   0.0000  232.528   12.569  ?   ?  0.000000 12.56909 
1 1 1    6   24   39 o   78.566   24.859   4.8404   3.3494   7.2164   8.8499   4.4431   3.6186  104.863   39.879   76.933   25.933 27.92937 47.56963 
1 1 1    6   24   40 o   94.231   24.809   7.2906   3.6273  -4.8836   8.8204   9.7686   3.9794   74.691   34.210  109.074   24.441 -34.38351 42.04388 
1 1 1    6   24   41 o  184.977   11.022   26.475   3.1065   29.986   4.4041   22.998   4.3825  196.087   14.782  171.038   16.964 25.04875 22.50076 
1 1 1    6   24   42 o   80.936   22.315   5.3391   2.8536   7.5509   4.0311   3.1174   4.0402   95.646   26.580   71.411   26.996 24.23419 37.88455 
1 1 1    6   24   43 o  224.096   10.214   38.713   3.5036   38.692   4.8922   38.735   5.0200  222.794   14.424  222.810   14.804 -0.1635742E-01 20.66867 
1 1 1    6   24   44 o  375.908   9.8562  108.921   5.6710  113.001   6.6381   97.900   10.911  382.441   11.340  351.776   20.351 30.66528 23.29731 
1 1 1    6   24   45 o  508.046   11.157  199.476   8.6761  198.772   9.3915  203.573   22.664  506.712   12.109  497.807   29.882 8.904144 32.24260 
1 1 1    6   24   46 o  319.521   9.1879   78.685   4.4935   76.941   6.1531   80.679   6.5777  314.934   12.764  322.296   13.334 -7.361969 18.45860 
1 1 1    6   24   47 o  157.504   15.816   19.589   3.7614   21.191   5.3514   18.025   5.2880  161.578   22.227  148.044   24.170 13.53410 32.83638 
1 1 1    6   24   48 o  175.184   19.069   24.564   5.0306   6.7999   10.532   29.815   5.7261  104.459   42.330  192.922   19.666 -88.46300 46.67491 
1 1 1    6   24   49 o   72.028   25.919   3.7627   3.6462   6.9153   5.1637   0.6273   5.1495   91.868   30.979   66.530   28.455 25.33887 42.06391 
1 1 1    6   24   50 o  226.546   14.192   40.341   4.8962   43.248   6.7128   37.037   7.1572  232.197   19.056  212.983   22.285 19.21416 29.32105 
1 1 1    6   24   51 o   74.801   26.861   4.2165   3.9142   7.1727   6.0430   2.0797   5.1377   93.487   33.397   70.699   29.210 22.78806 44.36854 
1 1 1    6   24   52 o  107.462   23.462   9.8153   3.7509   19.833   5.5319   1.2904   5.1032  153.419   24.372   67.547   28.588 85.87164 37.56701 
1 1 1    6   24   53 o   82.709   29.131   5.6120   4.5825  -2.2204   8.8276   8.5012   5.3614   75.141   34.344   97.603   31.512 -22.46268 46.61082 
1 1 1    6   24   54 o   96.512   26.619   8.2825   4.0598   4.9467   5.8140   11.457   5.6716   81.949   32.016  110.907   31.778 -28.95776 45.10917 
1 1 1    6   24   55 f   69.717   26.452   3.5476   3.8879   4.9421   5.4520   2.1048   5.5459   80.271   31.102   70.516   29.821 9.755417 43.08855 
1 1 1    6   24   56 o   57.792   25.259   0.2386   4.2360   1.5008   6.5775  -0.6558   5.5372   72.207   31.519   62.150   27.920 10.05690 42.10709 
1 1 1    6   25    0 o   69.088   38.157   5.0550   5.8840   5.0550   5.8840   5.0550   5.8840   69.088   38.157   69.088   38.157 0.000000 0.000000 
1 1 1    6   25    1 o  417.849   10.446  133.730   6.6811  125.268   9.2723  142.868   9.6352  404.240   14.986  431.723   14.581 -27.48322 20.90880 
1 1 1    6   25    2 o  760.586   10.188  443.069   11.860  446.580   16.728  439.521   16.818  763.306   14.317  757.234   14.510 6.072083 20.38469 
1 1 1    6   25    3 o  109.076   35.429   8.8855   6.7702   0.0000   0.0000   8.8855   6.7702  ?   ?   109.076   35.429 0.000000 35.42945 
1 1 1    6   25    4 o  1634.84   15.817  2049.32   39.578  2052.67   56.413  2046.08   55.542  1634.58   22.548  1632.05   22.234 2.539063 31.66626 
1 1 1    6   25    5 o  237.103   14.798   43.263   5.3437   39.115   7.8864   46.785   7.2661  224.415   23.299  246.132   19.445 -21.71645 30.34706 
1 1 1    6   25    6 o  462.087   10.728  163.559   7.5880  168.373   11.388  159.715   10.176  468.590   15.878  456.453   14.565 12.13724 21.54641 
1 1 1    6   25    7 o  738.451   10.588  417.701   11.968  420.886   17.433  414.863   16.458  740.899   15.373  735.644   14.617 5.255188 21.21226 
1 1 1    6   25    8 o  951.137   9.2736  692.828   13.501  681.696   16.423  716.034   23.711  943.301   11.374  966.273   16.032 -22.97168 19.65709 
1 1 1    6   25    9 o  1024.50   16.485  805.067   25.851   0.0000   0.0000  805.067   25.851  ?   ?   1024.50   16.485 0.000000 16.48500 
1 1 1    6   25   10 o  581.528   10.596  259.054   9.4319  262.489   13.742  255.995   12.969  585.067   15.346  577.834   14.663 7.232849 21.22490 
1 1 1    6   25   11 o  545.227   10.684  227.732   8.9166  213.173   12.443  243.101   12.784  527.227   15.419  563.066   14.833 -35.83875 21.39546 
1 1 1    6   25   12 o  442.747   9.2174  150.135   6.2464  147.192   7.6253  156.138   10.891  438.299   11.366  451.180   15.770 -12.88083 19.43953 
1 1 1    6   25   13 f  311.549   13.401   74.408   6.3905   65.081   8.5952   85.937   9.5560  290.456   19.446  334.025   18.767 -43.56894 27.02459 
1 1 1    6   25   14 o  886.874   11.190  602.692   15.190  604.506   21.358  600.836   21.608  887.678   15.719  884.947   15.953 2.731018 22.39585 
1 1 1    6   25   15 o  722.174   8.7636  399.454   9.6871  389.922   16.179  404.782   12.095  712.980   14.825  726.818   10.872 -13.83868 18.38431 
1 1 1    6   25   16 o  587.391   7.7339  264.228   6.9534  247.988   9.5757  282.344   10.114  568.864   10.997  606.999   10.885 -38.13519 15.47373 
1 1 1    6   25   17 o  672.461   7.7609  346.321   7.9882  332.058   10.950  362.548   11.680  658.246   10.868  687.783   11.095 -29.53638 15.53064 
1 1 1    6   25   18 o  659.684   7.8068  333.305   7.8828  315.949   10.777  353.274   11.560  642.042   10.966  678.893   11.125 -36.85132 15.62117 
1 1 1    6   25   19 o  836.874   8.1154  536.468   10.395  539.917   14.694  533.012   14.708  839.194   11.440  833.800   11.525 5.394470 16.23833 
1 1 1    6   25   20 o  656.995   9.0562  330.733   9.1071  333.167   11.176  325.923   15.712  659.214   11.076  651.418   15.758 7.796387 19.26097 
1 1 1    6   25   21 o  927.799   9.6113  659.737   13.649  650.916   16.526  678.670   24.210  921.254   11.720  939.625   16.833 -18.37091 20.51131 
1 1 1    6   25   22 o  459.937   9.6818  162.151   6.8159  152.495   8.2236  183.338   12.182  445.841   12.051  488.361   16.297 -42.51993 20.26834 
1 1 1    6   25   23 o  369.199   9.6142  104.493   5.4330  104.991   7.5034  103.944   7.8771  369.800   13.256  367.885   13.989 1.915100 19.27229 
1 1 1    6   25   24 o  101.386   26.604   8.2645   4.1803   11.066   5.9857   5.5973   5.8406  117.237   32.317   91.532   32.818 25.70459 46.05856 
1 1 1    6   25   25 o  127.948   22.756   13.033   4.2933   10.388   6.0692   15.683   6.0741  113.934   32.939  139.362   29.400 -25.42840 44.15139 
1 1 1    6   25   26 o  406.099   9.4130  126.467   5.8510  121.713   8.0968  131.663   8.4647  397.994   13.291  413.936   13.360 -15.94147 18.84535 
1 1 1    6   25   27 f  336.354   12.473   86.914   6.4213   87.515   7.6179   85.438   11.934  337.259   14.757  331.034   23.711 6.224609 27.92809 
1 1 1    6   25   28 o  361.604   11.949  100.446   6.6137  104.891   7.9053   90.078   12.074  369.263   13.987  339.883   23.350 29.38022 27.21831 
1 1 1    6   25   29 o  123.457   24.457   12.260   4.4581   15.103   6.3215   9.4476   6.2880  136.047   31.043  109.373   33.981 26.67449 46.02530 
1 1 1    6   25   30 o  289.280   14.918   64.645   6.5830   39.331   11.886   75.845   7.9064  219.670   36.642  313.078   16.558 -93.40866 40.20903 
1 1 1    6   25   31 o   86.508   29.620   5.4551   4.7213   4.8666   6.6709   6.0456   6.6829   91.099   34.629   95.600   34.987 -4.500664 49.22599 
1 1 1    6   25   32 o  131.735   25.388   14.015   4.9335   12.101   6.9236   15.989   7.0316  121.632   35.186  139.159   33.430 -17.52716 48.53504 
1 1 1    6   25   33 o  158.855   25.576   20.252   6.0077   36.875   11.925   14.598   6.9547  210.902   38.354  132.730   34.062 78.17221 51.29611 
1 1 1    6   25   34 o  291.242   15.294   65.717   6.7938   40.235   12.770   75.776   8.0236  219.596   39.442  312.403   16.842 -92.80653 42.88735 
1 1 1    6   25   35 o  255.792   11.431   50.365   4.4754   55.585   5.4436   39.479   7.8615  268.453   13.248  223.307   23.345 45.14575 26.84234 
1 1 1    6   25   36 o  390.347   19.975  119.151   11.894   0.0000   0.0000  119.151   11.894  ?   ?   390.347   19.975 0.000000 19.97475 
1 1 1    6   25   37 o  203.898   9.6129   31.971   3.0001   32.914   4.0385   30.809   4.4816  206.103   12.866  198.974   14.821 7.128555 19.62673 
1 1 1    6   25   38 o  137.753   17.810   15.008   3.6673   6.9695   8.2532   16.985   4.0936  102.352   38.610  146.457   18.687 -44.10547 42.89448 
1 1 1    6   25   39 o  313.056   8.0031   75.283   3.8349   75.283   5.3652   75.282   5.4834  312.501   11.217  312.447   11.466 0.5416870E-01 16.03991 
1 1 1    6   25   40 o  189.316   10.803   27.715   3.1175   31.561   4.4625   24.049   4.3569  201.247   14.586  175.076   16.452 26.17151 21.98643 
1 1 1    6   25   41 o   54.544   21.339   1.4675   2.5856  -0.5166   3.6221   3.5293   3.6922   53.622   23.399   71.915   26.053 -18.29356 35.01790 
1 1 1    6   25   42 o  299.688   8.6104   69.088   3.9497   70.476   5.5697   67.683   5.6019  301.945   12.051  295.823   12.372 6.122162 17.27119 
1 1 1    6   25   43 o  213.585   13.089   35.480   4.2586   37.634   4.7973   27.469   9.2494  219.652   14.348  179.143   34.987 40.50896 37.81499 
1 1 1    6   25   44 o  373.528   36.425  118.586   20.560   0.0000   0.0000  118.586   20.560  ?   ?   373.528   36.425 0.000000 36.42456 
1 1 1    6   25   45 o  196.469   12.269   30.021   3.6711   30.303   4.8634   29.647   5.5970  196.196   16.344  193.033   19.198 3.163071 25.21262 
1 1 1    6   25   46 o  210.787   11.846   34.529   3.8064   29.443   5.1345   40.734   5.6715  192.794   17.593  227.478   16.399 -34.68390 24.05076 
1 1 1    6   25   47 o  135.000   17.732   14.587   3.5755   18.950   5.0523   10.209   5.0607  152.405   22.320  109.117   29.565 43.28831 37.04427 
1 1 1    6   25   48 o   62.975   24.439   2.2544   3.3702   5.7756   4.7015  -1.4677   4.8338   85.487   29.543   58.472   26.190 27.01564 39.48043 
1 1 1    6   25   49 o  203.629   13.318   32.505   4.1280   31.492   5.4661   33.849   6.2974  198.398   18.203  204.650   20.375 -6.251770 27.32185 
1 1 1    6   25   50 o  104.646   25.477   9.3847   4.0425   5.2329   5.9362   12.975   5.5204   85.500   32.626  121.410   29.903 -35.91032 44.25699 
1 1 1    6   25   51 o  106.940   23.500   9.7128   3.7416   9.6898   5.3441   9.7348   5.2402  104.419   31.108  104.719   30.703 -0.3004150 43.70794 
1 1 1    6   25   52 o   95.420   30.066   8.0386   4.9034   26.221   13.509   5.2797   5.2623  153.378   50.058   82.839   30.913 70.53867 58.83416 
1 1 1    6   25   53 o   71.803   27.388   3.6524   4.1818  -0.2131   6.2059   6.8675   5.6597   67.618   30.020   89.567   32.285 -21.94968 44.08561 
1 1 1    6   25   54 o   68.650   28.092   2.5406   4.6941 -14.5822   8.9394   9.0592   5.5157   57.635   28.406   98.642   31.974 -41.00713 42.77018 
1 1 1    6   25   55 f  122.860   26.494   13.567   4.8358   1.1118   8.9602   18.685   5.7441   79.459   35.619  144.386   26.984 -64.92650 44.68608 
1 1 1    6   26    0 o  582.559   14.308  260.419   12.741  260.419   12.741  260.419   12.741  582.559   14.308  582.559   14.308 0.000000 0.000000 
1 1 1    6   26    1 o  774.502   10.437  459.492   12.372  465.685   17.677  453.544   17.323  779.346   14.819  769.129   14.714 10.21649 20.88307 
1 1 1    6   26    2 o  672.992   10.103  346.920   10.407  339.947   14.492  354.346   14.954  665.915   14.218  679.860   14.371 -13.94501 20.21521 
1 1 1    6   26    3 o  1112.00   17.148  948.688   29.187   0.0000   0.0000  948.688   29.187  ?   ?   1112.00   17.148 0.000000 17.14807 
1 1 1    6   26    4 o  927.069   11.383  658.479   16.152  675.752   23.935  644.035   21.887  938.559   16.661  916.401   15.604 22.15814 22.82689 
1 1 1    6   26    5 o  1153.77   12.568  1020.16   22.195  1022.10   31.899  1018.33   30.902  1154.03   18.059  1151.99   17.525 2.033325 25.16474 
1 1 1    6   26    6 o  447.983   11.079  153.755   7.5971  156.515   11.238  151.432   10.310  451.706   16.254  444.379   15.157 7.327362 22.22501 
1 1 1    6   26    7 o  1667.71   22.683  2138.31   57.902   0.0000   0.0000  2138.31   57.902  ?   ?   1667.71   22.683 0.000000 22.68302 
1 1 1    6   26    8 f  860.983   15.415  568.554   20.315   0.0000   0.0000  568.554   20.315  ?   ?   860.983   15.415 0.000000 15.41522 
1 1 1    6   26    9 o  1752.26   16.708  2356.01   44.811  2309.60   62.065  2406.54   64.767  1732.73   23.402  1768.52   23.926 -35.78394 33.46789 
1 1 1    6   26   10 o  796.831   10.821  486.483   13.198  485.732   18.638  487.238   18.693  795.764   15.302  796.994   15.323 -1.229980 21.65500 
1 1 1    6   26   11 o  1076.02   12.149  887.414   20.009  874.901   27.839  900.783   28.778  1067.64   17.036  1083.25   17.356 -15.61658 24.31998 
1 1 1    6   26   12 o  579.333   8.7439  257.067   7.7536  256.356   9.5487  258.442   13.285  578.410   10.785  580.431   14.953 -2.020508 18.43691 
1 1 1    6   26   13 o  271.871   11.747   56.654   4.8882   57.817   5.8737   54.032   8.8162  274.202   14.042  264.100   22.010 10.10153 26.10766 
1 1 1    6   26   14 o  343.967   10.578   90.665   5.5692   87.825   6.6818   97.128   10.079  338.429   12.899  355.049   18.611 -16.61935 22.64419 
1 1 1    6   26   15 o  292.828   11.760   65.736   5.2708   68.740   6.3987   59.397   9.2962  299.339   13.966  276.884   22.120 22.45486 26.15953 
1 1 1    6   26   16 o  403.011   8.6618  124.423   5.3431  129.674   7.5350  119.113   7.5777  411.243   11.971  394.103   12.562 17.14032 17.35223 
1 1 1    6   26   17 o  676.320   7.8560  350.364   8.1325  335.068   11.124  367.922   11.919  661.119   10.993  692.747   11.240 -31.62781 15.72264 
1 1 1    6   26   18 o  783.082   9.1802  469.892   11.003  462.580   13.328  485.544   19.500  776.726   11.211  794.998   16.025 -18.27185 19.55686 
1 1 1    6   26   19 o  117.810   25.727   11.144   4.5092   13.384   5.6254   7.1189   7.5420  128.868   29.196  103.546   37.275 25.32262 47.34811 
1 1 1    6   26   20 o   82.550   27.062   5.0709   3.9465   4.4329   5.3768   5.8160   5.8108   84.852   31.330   92.488   32.779 -7.635849 45.34383 
1 1 1    6   26   21 o  474.875   8.4141  172.806   6.1159  179.224   8.5815  166.181   8.7184  483.333   11.600  465.349   12.240 17.98416 16.86347 
1 1 1    6   26   22 o  402.364   9.2153  124.107   5.6754  120.194   7.6171  128.991   8.5093  395.687   12.577  409.810   13.566 -14.12283 18.49874 
1 1 1    6   26   23 o  912.306   9.6259  638.206   13.442  633.812   16.418  647.141   23.410  908.717   11.804  916.896   16.681 -8.178894 20.43435 
1 1 1    6   26   24 o  286.103   12.532   62.865   5.4879   60.271   6.7943   67.735   9.3085  279.385   15.954  295.375   20.720 -15.99026 26.15068 
1 1 1    6   26   25 o  786.185   9.6868  474.099   11.657  482.195   14.179  457.215   20.475  792.463   11.689  770.140   17.369 22.32275 20.93641 
1 1 1    6   26   26 o  750.889   9.6717  432.545   11.116  436.809   13.558  423.804   19.415  754.152   11.746  741.376   17.109 12.77570 20.75282 
1 1 1    6   26   27 o  292.363   11.499   65.653   5.1457   60.349   7.0984   71.527   7.4701  279.261   16.683  304.219   16.100 -24.95801 23.18442 
1 1 1    6   26   28 f  705.486   9.9279  382.008   10.721  380.887   18.829  382.546   13.041  702.310   17.515  705.494   12.076 -3.183655 21.27509 
1 1 1    6   26   29 o  300.690   14.051   69.626   6.4668   65.505   11.769   71.409   7.7399  288.093   27.005  303.678   16.716 -15.58472 31.76021 
1 1 1    6   26   30 o  108.202   26.987   9.5332   4.4544   6.2284   6.1924   13.077   6.4122   94.670   33.808  126.118   32.880 -31.44761 47.16003 
1 1 1    6   26   31 o  223.097   15.115   38.579   5.1311   49.866   7.3650   27.933   7.1527  252.880   19.170  187.219   25.633 65.66132 32.00899 
1 1 1    6   26   32 o  213.965   16.163   35.590   5.2543   34.448   7.3343   36.794   7.5309  208.726   23.357  215.854   23.155 -7.128036 32.88980 
1 1 1    6   26   33 o  529.857   9.6510  215.706   7.8271  199.678   10.924  232.617   11.221  508.684   14.030  549.254   13.347 -40.57025 19.36417 
1 1 1    6   26   34 o  142.108   27.253   16.463   5.7123   20.066   9.3413   14.311   7.2195  153.708   39.493  130.820   35.257 22.88774 52.94100 
1 1 1    6   26   35 o  206.088   24.523   33.890   7.5837   29.590   12.991   36.112   9.3405  183.837   46.217  210.885   29.764 -27.04729 54.97216 
1 1 1    6   26   36 o  150.585   15.918   17.773   3.6133   20.639   4.1025   7.8588   7.6299  162.198   16.767  103.985   37.485 58.21296 41.06432 
1 1 1    6   26   37 o  200.836   23.823   32.235   7.1805   14.221   14.740   37.840   8.2220  136.888   51.608  217.286   25.189 -80.39818 57.42734 
1 1 1    6   26   38 o   62.367   21.157   2.8537   2.4086   8.7380   3.4525  -2.7262   3.3620  103.459   22.447   44.642   20.687 58.81701 30.52596 
1 1 1    6   26   39 o  284.243   8.4450   62.105   3.6742   56.699   5.0018   68.442   5.4148  270.971   12.060  297.752   11.881 -26.78116 16.92918 
1 1 1    6   26   40 o  218.545   9.7608   36.780   3.2651   36.465   4.5619   37.111   4.6752  216.510   13.838  218.368   14.062 -1.857971 19.72928 
1 1 1    6   26   41 o  335.871   8.0105   86.717   4.1182   89.587   5.8656   83.927   5.7832  340.655   11.249  329.664   11.461 10.99158 16.05943 
1 1 1    6   26   42 o  137.246   19.469   15.083   3.9752   15.171   4.0868   13.524   17.131  137.490   20.006  135.546   54.315 1.943756 57.88251 
1 1 1    6   26   43 o  255.770   10.772   50.517   4.2172   50.200   5.6183   50.926   6.3824  253.646   14.532  254.797   16.453 -1.151062 21.95182 
1 1 1    6   26   44 o  172.544   13.166   23.238   3.4510   27.978   4.8108   18.212   4.9532  188.309   16.870  149.811   22.279 38.49776 27.94530 
1 1 1    6   26   45 o   55.770   23.005   0.9330   3.1793  -1.2494   4.1319   4.1000   4.9776   54.644   24.363   79.180   29.957 -24.53610 38.61317 
1 1 1    6   26   46 o  221.158   11.657   38.014   3.9320   38.174   5.3917   37.833   5.7465  220.104   16.116  218.635   17.313 1.468582 23.65335 
1 1 1    6   26   47 o  169.505   14.732   22.637   3.7842   23.569   5.3829   21.728   5.3209  170.522   21.072  163.308   21.833 7.213593 30.34332 
1 1 1    6   26   48 o  213.591   12.788   35.678   4.1616   30.056   5.5098   43.146   6.3499  193.532   18.839  232.615   17.974 -39.08340 26.03785 
1 1 1    6   26   49 o  173.774   15.485   23.963   4.0756   23.015   5.7083   24.948   5.8210  166.835   22.962  174.115   22.358 -7.280136 32.04942 
1 1 1    6   26   50 o   80.921   25.596   5.4677   3.5511   10.701   5.2166   0.9487   4.8477  109.846   30.124   65.208   27.742 44.63816 40.95181 
1 1 1    6   26   51 o  110.276   27.271   10.687   4.5774   5.4722   9.1567   12.424   5.2852   93.555   38.853  118.002   29.376 -24.44629 48.70827 
1 1 1    6   26   52 o   53.103   23.764  -0.9629   3.9700  -4.1038   5.7342   1.9287   5.5019   56.515   26.464   70.616   29.774 -14.10095 39.83497 
1 1 1    6   26   53 o  114.018   24.289   11.349   4.1092   7.9338   6.1682   14.074   5.5098   93.895   33.720  124.001   29.465 -30.10679 44.77932 
1 1 1    6   26   54 o  148.550   19.539   18.414   4.3348   15.291   6.7046   20.657   5.6823  125.004   34.097  153.653   25.022 -28.64921 42.29310 
1 1 1    6   27    0 o  512.737   14.411  201.879   11.290  201.879   11.290  201.879   11.290  512.737   14.411  512.737   14.411 0.000000 0.000000 
1 1 1    6   27    1 o  1371.02   13.876  1441.23   29.119  1421.15   40.574  1462.56   41.815  1360.20   19.489  1379.79   19.799 -19.59375 27.78150 
1 1 1    6   27    2 o  1027.47   11.662  809.009   18.340  815.138   26.061  802.997   25.814  1030.67   16.520  1022.97   16.486 7.698914 23.33856 
1 1 1    6   27    3 o  988.865   16.175  750.292   24.482   0.0000   0.0000  750.292   24.482  ?   ?   988.865   16.175 0.000000 16.17469 
1 1 1    6   27    4 o  493.131   15.230  186.538   11.496   0.0000   0.0000  186.538   11.496  ?   ?   493.131   15.230 0.000000 15.23015 
1 1 1    6   27    5 o  276.045   14.729   58.611   6.2010   51.820   9.0771   64.554   8.4914  258.489   23.189  289.250   19.290 -30.76105 30.16338 
1 1 1    6   27    6 o  676.302   10.639  350.451   11.013  347.570   15.878  353.123   15.288  673.084   15.411  678.512   14.721 -5.428101 21.31238 
1 1 1    6   27    7 o  358.369   12.337   98.446   6.7673   99.386   9.8270   97.598   9.3329  359.760   17.846  356.558   17.101 3.202179 24.71669 
1 1 1    6   27    8 o  267.463   15.145   55.059   6.1747   57.270   8.9408   53.044   8.5378  272.010   21.654  261.740   21.501 10.27066 30.51533 
1 1 1    6   27    9 o  691.888   10.796  366.844   11.433  380.605   16.573  354.346   15.793  704.271   15.374  679.565   15.183 24.70618 21.60767 
1 1 1    6   27   10 o  454.109   9.2606  157.977   6.4368  155.591   7.8643  162.820   11.203  450.549   11.404  460.569   15.892 -10.01944 19.56034 
1 1 1    6   27   11 o  221.521   25.403   38.333   8.4576   0.0000   0.0000   38.333   8.4576  ?   ?   221.521   25.403 0.000000 25.40305 
1 1 1    6   27   12 o  903.182   9.3608  624.992   12.941  620.758   15.781  633.682   22.609  899.868   11.458  908.418   16.260 -8.550293 19.89152 
1 1 1    6   27   13 o  149.641   19.956   17.528   4.4569   17.567   5.4312   17.449   7.7985  148.969   24.684  146.903   35.153 2.066254 42.95338 
1 1 1    6   27   14 o  488.542   9.2005  182.878   6.8799  185.184   8.3954  178.161   12.005  491.476   11.160  481.590   16.286 9.885345 19.74274 
1 1 1    6   27   15 o  524.687   9.1979  210.953   7.3868  218.682   9.0456  195.479   12.798  534.065   11.066  504.368   16.578 29.69638 19.93190 
1 1 1    6   27   16 o  221.603   14.198   37.855   4.7905   38.881   5.8239   35.708   8.4237  224.241   17.097  213.280   26.365 10.96140 31.42334 
1 1 1    6   27   17 o  444.095   9.6908  151.170   6.5873  154.794   8.0470  143.809   11.469  449.227   11.703  432.409   17.328 16.81708 20.90982 
1 1 1    6   27   18 o  529.302   8.0907  214.658   6.5548  210.525   9.1279  219.059   9.4187  523.887   11.383  534.385   11.515 -10.49860 16.19180 
1 1 1    6   27   19 o  385.500   9.0386  113.907   5.3333  111.018   7.4631  116.922   7.6242  380.288   12.822  390.273   12.763 -9.985168 18.09113 
1 1 1    6   27   20 o  416.070   8.7812  132.690   5.5923  140.044   7.9276  125.405   7.8901  427.149   12.125  404.146   12.755 23.00305 17.59845 
1 1 1    6   27   21 o  182.566   15.609   25.824   4.3199   25.289   6.0074   26.396   6.2164  179.496   22.350  183.388   22.626 -3.891907 31.80307 
1 1 1    6   27   22 o  222.570   15.041   38.276   5.0939   34.934   5.9687   47.237   9.7733  212.035   18.578  245.157   26.465 -33.12175 32.33499 
1 1 1    6   27   23 o  218.467   16.575   36.975   5.5012   34.627   6.4681   43.114   10.460  210.723   20.305  233.053   30.020 -22.32961 36.24205 
1 1 1    6   27   24 o  367.532   11.596  103.732   6.5231  105.335   7.6550   99.480   12.465  370.136   13.512  357.458   22.903 12.67868 26.59166 
1 1 1    6   27   25 o  319.145   11.858   78.246   5.7926   78.740   7.2340   77.363   9.6702  319.816   14.778  315.601   20.123 4.215668 24.96645 
1 1 1    6   27   26 o  107.085   28.239   9.2991   4.6948   7.2769   5.7864   13.195   8.0317   98.351   32.794  127.648   38.161 -29.29705 50.31590 
1 1 1    6   27   27 o  384.366   11.738  113.544   6.9060  108.327   11.977  116.143   8.4526  373.121   21.058  388.356   14.220 -15.23474 25.40909 
1 1 1    6   27   28 o  266.386   12.261   54.576   4.9994   60.058   7.0133   48.913   7.1285  278.408   16.532  250.697   18.712 27.71181 24.96898 
1 1 1    6   27   29 f  276.616   12.072   58.859   5.1113   62.316   7.1727   55.292   7.2855  283.511   16.601  266.699   17.952 16.81122 24.45127 
1 1 1    6   27   30 o  231.272   20.059   41.851   7.0304   41.851   7.0304   0.0000   0.0000  231.272   20.059  ?   ?  0.000000 20.05910 
1 1 1    6   27   31 o   56.130   25.279  -2.1250   4.5716  -6.9693   6.4519   2.7594   6.4786   58.341   27.552   82.506   33.281 -24.16508 43.20585 
1 1 1    6   27   32 o  146.204   25.926   17.293   5.5894   16.404   9.0837   17.835   7.0907  139.648   40.276  146.701   32.440 -7.052383 51.71510 
1 1 1    6   27   33 o  320.760   12.291   79.298   6.0345   80.880   8.3369   77.557   8.7461  322.498   16.948  315.404   18.194 7.094086 24.86498 
1 1 1    6   27   34 o   88.529   31.826   5.4978   5.4962   6.6336   7.0759   3.7703   8.7268   98.060   35.984   94.487   38.442 3.572144 52.65573 
1 1 1    6   27   35 o  255.230   14.860   50.603   5.7800   50.670   8.1198   50.534   8.2297  253.515   21.117  253.054   21.449 0.4605713 30.09998 
1 1 1    6   27   36 o  146.275   25.440   17.398   5.4891   21.798   7.9589   13.406   7.5803  161.288   33.341  126.075   36.917 35.21282 49.74435 
1 1 1    6   27   37 o  229.414   18.635   41.353   6.4870   28.724   9.3822   52.919   8.9790  184.982   34.403  258.065   22.972 -73.08310 41.36709 
1 1 1    6   27   38 o  402.294   9.6394  124.571   5.9356  129.832   7.2959  114.274   10.207  410.169   11.621  382.837   17.419 27.33191 20.93990 
1 1 1    6   27   39 o  148.721   13.261   17.253   2.9871   16.688   4.2356   17.812   4.2133  144.632   19.641  149.749   18.796 -5.117050 27.18554 
1 1 1    6   27   40 o   57.494   21.598   1.9923   2.5771   7.7808   3.4772  -5.0623   3.8387   97.115   23.619   43.010   20.577 54.10413 31.32566 
1 1 1    6   27   41 o  149.665   17.497   17.748   3.9326   17.779   4.0489   17.233   16.527  149.639   18.041  142.954   54.466 6.684967 57.37647 
1 1 1    6   27   42 o  132.889   15.797   13.957   3.1502   17.836   4.5536   10.397   4.3627  149.001   20.510  111.595   26.021 37.40662 33.13191 
1 1 1    6   27   43 o  106.453   19.629   9.2035   3.0805   14.686   4.3465   3.6708   4.3665  134.387   21.884   75.020   28.127 59.36663 35.63780 
1 1 1    6   27   44 o  132.911   17.053   14.070   3.3892   18.459   4.6471   9.0832   4.9536  151.294   20.603  103.520   29.709 47.77404 36.15412 
1 1 1    6   27   45 o  261.012   10.691   52.700   4.2711   48.585   6.0564   56.772   6.0244  248.500   16.008  269.270   14.672 -20.76961 21.71458 
1 1 1    6   27   46 o   57.747   23.953   0.9774   3.4742   1.6580   4.9377   0.3102   4.8892   68.937   28.572   64.110   27.581 4.826973 39.71251 
1 1 1    6   27   47 o  104.065   24.214   9.1486   3.7845   6.5179   5.2096   12.088   5.5068   89.775   31.095  117.562   30.383 -27.78639 43.47436 
1 1 1    6   27   48 o   78.720   26.547   4.9758   3.7920   0.1047   5.2174   10.430   5.5209   64.844   28.192  108.646   31.418 -43.80230 42.21228 
1 1 1    6   27   49 o   47.623   21.658  -1.6845   3.4553   2.7343   5.0412  -5.5997   4.7453   72.517   29.321   48.014   22.946 24.50256 37.23166 
1 1 1    6   27   50 o  144.688   21.023   17.331   4.5197   7.9637   9.4405   20.117   5.1480  100.994   40.373  155.373   22.285 -54.37879 46.11502 
1 1 1    6   27   51 o   53.710   23.568  -0.2588   3.7205  -4.6783   5.3364   3.9211   5.1897   53.084   25.065   76.549   30.145 -23.46581 39.20485 
1 1 1    6   27   52 o  202.528   21.672   34.346   6.6138   26.456   9.5779   41.537   9.1439  162.455   39.010  216.788   28.226 -54.33243 48.15070 
1 1 1    6   27   53 o   55.196   24.058   0.1414   3.8196   6.2269   5.4813  -5.6030   5.3254   85.390   31.612   50.747   24.267 34.64226 39.85258 
1 1 1    6   28    0 o  174.527   28.975   25.251   7.0988   25.251   7.0988   25.251   7.0988  174.527   28.975  174.527   28.975 0.000000 0.000000 
1 1 1    6   28    1 o  686.795   10.460  361.452   10.996  361.499   15.550  361.405   15.550  686.399   14.801  686.310   14.803 0.8959961E-01 20.93342 
1 1 1    6   28    2 o  816.143   10.862  510.477   13.569  520.931   19.240  500.132   19.140  823.901   15.257  807.252   15.490 16.64984 21.74203 
1 1 1    6   28    3 o  997.957   16.606  764.692   25.366   0.0000   0.0000  764.692   25.366  ?   ?   997.957   16.606 0.000000 16.60596 
1 1 1    6   28    4 o  425.367   11.729  138.703   7.6364  139.856   11.170  137.691   10.464  426.733   17.101  423.499   16.143 3.234222 23.51633 
1 1 1    6   28    5 o  693.075   10.858  368.153   11.518  348.040   16.096  389.263   16.490  673.357   15.617  712.184   15.127 -38.82703 21.74217 
1 1 1    6   28    6 o  206.905   17.845   33.135   5.5960   29.458   8.2540   36.263   7.6128  193.141   28.801  215.689   23.436 -22.54779 37.13167 
1 1 1    6   28    7 o  535.727   10.950  219.987   8.9788  216.372   12.946  223.337   12.464  530.850   15.932  539.416   15.096 -8.565735 21.94840 
1 1 1    6   28    8 o  321.823   13.617   79.459   6.7077   68.516   9.3474   91.076   9.6311  297.666   20.644  343.716   18.373 -46.04977 27.63559 
1 1 1    6   28    9 o  199.953   19.333   31.037   5.8432   31.510   8.5110   30.616   8.0364  199.830   28.645  197.180   27.365 2.649933 39.61557 
1 1 1    6   28   10 o  829.037   9.1410  526.625   11.599  530.873   14.282  518.390   19.882  832.126   11.213  821.563   15.811 10.56287 19.38343 
1 1 1    6   28   11 o  300.056   11.284   69.033   5.1825   71.517   6.4517   64.516   8.7011  305.264   13.808  288.847   19.800 16.41714 24.13918 
1 1 1    6   28   12 o  259.053   12.398   51.480   4.9160   52.956   6.0428   48.592   8.4534  262.158   15.124  250.053   22.321 12.10460 26.96216 
1 1 1    6   28   13 o  579.351   10.936  257.368   9.6975  257.368   9.6975   0.0000   0.0000  579.351   10.936  ?   ?  0.000000 10.93577 
1 1 1    6   28   14 o  338.710   13.140   88.054   6.8123   88.054   6.8123   0.0000   0.0000  338.710   13.140  ?   ?  0.000000 13.13993 
1 1 1    6   28   15 o  384.725   10.262  113.487   6.0429  112.687   7.3869  115.104   10.507  383.188   12.595  386.744   17.749 -3.556091 21.76321 
1 1 1    6   28   16 o  312.443   11.418   74.890   5.4605   76.101   6.5740   72.196   9.8062  314.796   13.644  305.174   21.123 9.622681 25.14655 
1 1 1    6   28   17 o  641.487   7.8850  315.312   7.7421  311.286   10.747  319.657   11.163  637.011   11.022  645.481   11.299 -8.469360 15.78438 
1 1 1    6   28   18 o  296.138   10.563   67.270   4.7878   69.735   6.6512   64.619   6.8975  301.217   14.426  289.436   15.627 11.78061 21.26795 
1 1 1    6   28   19 o  326.062   10.182   81.549   5.0815   79.906   7.0588   83.316   7.3211  322.410   14.304  329.193   14.530 -6.783508 20.38905 
1 1 1    6   28   20 o  469.691   9.9308  169.218   7.1394  166.639   8.5937  174.961   12.827  465.850   12.052  476.448   17.589 -10.59750 21.32171 
1 1 1    6   28   21 o  303.199   12.357   70.615   5.7346   68.373   6.7191   76.629   11.005  298.116   14.725  313.594   23.089 -15.47803 27.38469 
1 1 1    6   28   22 o  260.460   11.721   52.100   4.6729   51.090   6.4467   53.219   6.7832  256.967   16.477  262.200   16.993 -5.233032 23.66994 
1 1 1    6   28   23 o  249.447   12.255   47.814   4.6792   47.244   6.4884   48.431   6.7542  246.875   17.280  249.883   17.775 -3.007690 24.79008 
1 1 1    6   28   24 o  227.017   13.124   39.767   4.5407   41.903   6.2500   37.379   6.6080  232.294   17.712  218.881   19.943 13.41328 26.67248 
1 1 1    6   28   25 o  666.706   9.8026  341.175   10.003  338.911   17.437  342.286   12.213  662.486   17.196  667.316   11.957 -4.829529 20.94452 
1 1 1    6   28   26 o  252.474   15.069   49.313   5.7968   63.246   10.561   43.305   6.9350  283.716   24.561  235.676   19.397 48.03970 31.29662 
1 1 1    6   28   27 o  139.204   23.349   15.495   4.7989   8.8812   5.8338   29.336   8.4396  105.687   32.713  190.802   29.879 -85.11523 44.30452 
1 1 1    6   28   28 o  380.862   11.440  111.548   6.6691  106.411   8.1725  121.786   11.538  371.476   14.373  396.286   19.022 -24.80997 23.84186 
1 1 1    6   28   29 o  345.454   11.213   91.784   5.9289   87.772   8.2489   96.070   8.5276  336.964   15.993  352.574   15.802 -15.61035 22.48308 
1 1 1    6   28   30 o  339.284   13.070   88.731   6.7877   82.954   11.017   92.267   8.6178  325.141   22.270  345.293   16.306 -20.15222 27.60165 
1 1 1    6   28   31 o  297.979   12.632   68.442   5.7613   79.296   8.4401   58.971   7.8838  319.282   17.335  274.778   18.859 44.50397 25.61611 
1 1 1    6   28   32 o  208.926   18.288   34.191   5.7894   22.609   7.1977   55.415   9.7438  166.285   29.352  264.307   24.359 -98.02254 38.14370 
1 1 1    6   28   33 o  532.185   10.750  218.036   8.7570  221.601   10.996  211.855   14.479  535.643   13.412  521.766   18.129 13.87616 22.55128 
1 1 1    6   28   34 o  175.159   20.677   24.325   5.4366   18.844   7.5143   30.347   7.8755  149.785   33.603  193.623   27.334 -43.83864 43.31607 
1 1 1    6   28   35 o  217.998   17.391   37.209   5.7546   32.213   7.9308   42.765   8.3630  199.693   26.609  231.580   23.939 -31.88622 35.79258 
1 1 1    6   28   36 o  123.436   30.098   12.746   5.6352   4.6084   7.9614   20.916   7.9775   93.503   37.173  157.322   34.112 -63.81863 50.45263 
1 1 1    6   28   37 o  192.144   21.068   29.351   6.0944   26.015   8.8744   32.328   8.3840  175.578   34.252  198.930   28.336 -23.35158 44.45314 
1 1 1    6   28   38 o  156.851   26.204   20.132   6.0692   8.9392   8.4967   31.792   8.6724  108.859   39.509  196.338   29.793 -87.47836 49.48333 
1 1 1    6   28   39 o  188.759   14.708   27.837   4.2158   30.016   4.3789   0.2054   15.593  196.049   14.699  108.140   47.818 87.90960 50.02632 
1 1 1    6   28   40 o  156.083   17.805   19.307   4.1776   21.883   4.3385 -13.4962   15.482  166.442   17.282   89.030   42.233 77.41216 45.63168 
1 1 1    6   28   41 o  169.898   12.782   22.492   3.2996   20.893   4.4907   24.368   4.8644  162.149   18.421  175.268   18.407 -13.11829 26.04146 
1 1 1    6   28   42 o  120.619   18.205   11.669   3.2565   16.576   4.6308   6.8680   4.5805  142.958   21.857   91.688   29.077 51.27049 36.37615 
1 1 1    6   28   43 o  121.974   17.506   11.908   3.1746   12.247   4.5107   11.576   4.4689  121.209   25.137  117.635   25.551 3.573860 35.84308 
1 1 1    6   28   44 o  177.313   12.999   24.569   3.5033   27.280   4.9311   21.805   4.9780  185.358   17.591  164.581   20.184 20.77679 26.77394 
1 1 1    6   28   45 o  274.822   9.9569   58.390   4.1884   61.008   5.9526   55.824   5.8943  279.578   13.910  266.851   14.485 12.72650 20.08271 
1 1 1    6   28   46 o  162.546   16.404   21.021   4.0254   20.246   5.4952   21.919   5.9132  156.368   23.703  162.378   24.559 -6.010422 34.13164 
1 1 1    6   28   47 o  454.233   12.897  161.094   8.9671  161.094   8.9671   0.0000   0.0000  454.233   12.897  ?   ?  0.000000 12.89748 
1 1 1    6   28   48 o  102.041   22.997   8.8122   3.5058   5.9531   4.9364   11.722   4.9799   85.860   30.236  115.743   28.337 -29.88227 41.43945 
1 1 1    6   28   49 o  248.732   18.652   49.974   7.0494   44.990   10.668   53.838   9.3923  225.207   31.835  253.523   24.510 -28.31653 40.17694 
1 1 1    6   28   50 o  191.964   15.982   29.552   4.6532   34.254   7.3404   26.394   6.0166  201.023   24.353  177.341   22.685 23.68176 33.28221 
1 1 1    6   28   51 o  176.427   16.410   25.155   4.3806   27.981   6.7346   23.082   5.7674  180.146   25.106  164.482   23.583 15.66365 34.44551 
1 1 1    6   28   52 o   77.999   26.935   5.1602   3.9077   5.5170   5.6309   4.8287   5.4273   82.867   31.739   79.696   30.989 3.170647 44.35878 
1 1 1    6   29    0 o  859.164   15.704  566.484   20.636  566.484   20.636  566.484   20.636  859.164   15.704  859.164   15.704 0.000000 0.000000 
1 1 1    6   29    1 o  274.167   14.121   57.843   5.9056   55.538   8.1762   60.357   8.5391  267.874   20.087  279.313   20.108 -11.43857 28.42237 
1 1 1    6   29    2 o  284.629   13.928   62.174   6.0679   61.655   8.3105   62.766   8.8806  282.425   19.341  284.796   20.510 -2.370636 28.19059 
1 1 1    6   29    3 o  479.096   15.536  176.279   11.393   0.0000   0.0000  176.279   11.393  ?   ?   479.096   15.536 0.000000 15.53649 
1 1 1    6   29    4 o  801.185   11.198  492.158   13.732  487.897   19.591  496.273   19.253  796.936   16.061  803.825   15.649 -6.888794 22.42389 
1 1 1    6   29    5 o  600.367   11.006  276.349   10.114  254.395   13.935  300.794   14.704  575.473   15.820  625.825   15.350 -50.35156 22.04289 
1 1 1    6   29    7 o  116.660   28.929   10.963   5.1403   6.5702   7.3282   15.219   7.2121  100.824   36.677  137.119   34.416 -36.29459 50.29568 
1 1 1    6   29    8 o  1186.43   13.094  1080.22   23.778  1055.98   33.162  1105.86   34.112  1171.46   18.494  1198.77   18.591 -27.31470 26.22332 
1 1 1    6   29    9 o  264.564   15.845   53.979   6.3867   58.164   9.1677   50.032   8.9026  273.721   22.069  253.535   23.198 20.18622 32.01871 
1 1 1    6   29   10 o   64.114   30.033  -7.3382   7.3961  -7.3382   7.3961   0.0000   0.0000   64.114   30.033  ?   ?  0.000000 30.03260 
1 1 1    6   29   11 o  171.325   21.432   22.989   5.4971   22.989   5.4971   0.0000   0.0000  171.325   21.432  ?   ?  0.000000 21.43158 
1 1 1    6   29   12 f  288.788   11.667   63.984   5.1573   63.511   6.2761   64.968   9.0496  287.543   14.260  289.537   20.554 -1.994354 25.01600 
1 1 1    6   29   13 o  733.615   9.0792  412.528   10.195  411.076   12.423  415.522   17.840  732.043   11.087  735.100   15.856 -3.056458 19.34781 
1 1 1    6   29   14 o  137.584   21.778   14.971   4.4334   16.371   5.4575   12.254   7.6026  143.199   25.850  124.048   37.137 19.15087 45.24815 
1 1 1    6   29   15 o  531.305   9.2759  216.420   7.5434  221.579   9.3294  206.678   12.820  537.364   11.343  518.276   16.161 19.08838 19.74413 
1 1 1    6   29   16 o   48.617   22.820  -4.4560   4.3070  -0.8915   5.2479 -11.8115   7.5385   64.738   28.209   58.009   28.027 6.729645 39.76526 
1 1 1    6   29   17 o  231.544   14.421   41.381   5.0855   38.699   6.1530   47.161   9.0339  223.317   18.158  245.439   24.369 -22.12204 30.39059 
1 1 1    6   29   18 o  237.332   13.996   43.456   5.0618   50.265   6.2474   30.446   8.6360  254.999   16.089  195.315   29.834 59.68456 33.89536 
1 1 1    6   29   19 o  144.046   19.292   16.303   4.1467   17.865   5.6617   14.496   6.0903  149.561   25.656  133.535   30.470 16.02603 39.83231 
1 1 1    6   29   20 o  268.215   11.683   55.252   4.7963   50.383   6.5102   61.031   7.0934  255.110   16.766  280.913   16.571 -25.80318 23.57269 
1 1 1    6   29   21 f   61.011   25.367   0.7181   3.9100  -2.8597   5.4047   4.6468   5.6636   60.326   27.297   86.507   32.112 -26.18132 42.14646 
1 1 1    6   29   22 o  214.416   13.844   35.524   4.5193   38.178   6.3725   32.839   6.4104  221.413   18.987  204.868   20.728 16.54457 28.10968 
1 1 1    6   29   23 o  214.713   16.737   35.794   5.4571   35.152   10.004   36.066   6.5112  208.788   32.350  214.874   20.028 -6.085281 38.04845 
1 1 1    6   29   24 o  244.060   15.513   46.122   5.7651   44.583   10.717   46.748   6.8388  236.107   30.359  245.154   18.359 -9.047211 35.47820 
1 1 1    6   29   25 o  177.817   16.400   24.622   4.4133   16.510   5.8947   34.970   6.6575  142.665   27.994  211.211   20.866 -68.54536 34.91507 
1 1 1    6   29   26 o  427.765   13.254  140.934   8.6783  140.934   8.6783   0.0000   0.0000  427.765   13.254  ?   ?  0.000000 13.25442 
1 1 1    6   29   27 o  222.954   14.222   38.493   4.8280   40.042   6.7913   36.909   6.8649  226.197   19.815  216.816   20.947 9.381058 28.83414 
1 1 1    6   29   28 o  237.847   15.483   43.902   5.6060   41.590   8.9115   45.416   7.2117  228.633   25.923  240.913   19.730 -12.27934 32.57761 
1 1 1    6   29   29 o  210.018   17.861   34.465   5.6870   35.416   7.0911   32.752   9.5207  211.751   22.209  200.204   32.157 11.54755 39.08134 
1 1 1    6   29   30 o  227.628   16.458   40.359   5.6954   39.565   7.1929   41.693   9.3250  224.076   21.225  228.018   27.259 -3.941956 34.54768 
1 1 1    6   29   31 o  424.054   11.457  138.519   7.4367  138.283   9.3988  138.915   12.161  422.861   14.521  422.341   18.812 0.5200195 23.76506 
1 1 1    6   29   32 f  175.851   20.005   24.449   5.2888   21.921   7.5716   26.857   7.3907  162.662   31.550  182.036   27.373 -19.37447 41.76879 
1 1 1    6   29   33 o  103.618   31.038   8.7877   5.3094   11.525   7.3747   5.8419   7.6501  118.055   36.820   96.767   37.011 21.28799 52.20677 
1 1 1    6   29   34 o  112.329   30.126   10.509   5.2864   16.526   7.4001   4.2381   7.5544  139.588   34.766   90.971   36.197 48.61713 50.18839 
1 1 1    6   29   35 o  164.448   23.127   21.732   5.6605   17.666   7.9865   25.837   8.0239  143.683   36.301  176.635   30.798 -32.95215 47.60597 
1 1 1    6   29   36 o  149.058   26.093   18.183   5.7363   24.479   8.0768   11.775   8.1484  171.084   32.020  119.060   38.878 52.02348 50.36683 
1 1 1    6   29   37 o  344.012   13.161   91.612   6.9298   88.863   9.8273   94.330   9.7734  336.167   19.178  346.710   18.483 -10.54291 26.63534 
1 1 1    6   29   38 o   90.598   35.666   4.6856   7.2625   8.4855   8.2671  -8.1608   15.201  106.438   38.919   94.715   43.926 11.72340 58.68724 
1 1 1    6   29   39 o   59.250   24.249   1.1756   3.4981   2.4059   3.8738  -4.2600   8.1424   67.033   26.149   71.783   32.875 -4.749947 42.00571 
1 1 1    6   29   40 f  206.516   13.573   33.244   4.2664   35.023   4.8566   27.231   8.9295  211.543   15.098  178.510   33.921 33.03329 37.12936 
1 1 1    6   29   41 o  282.214   10.999   61.560   4.7511   68.939   5.4730   38.993   9.5710  298.375   11.984  216.466   29.667 81.90977 31.99623 
1 1 1    6   29   42 o  229.221   10.546   40.606   3.7000   40.259   5.2200   40.956   5.2452  226.601   15.137  228.584   15.076 -1.983368 21.36405 
1 1 1    6   29   43 o  216.186   11.520   36.318   3.7983   32.225   5.3960   40.337   5.3475  201.528   17.672  226.506   15.518 -24.97771 23.51777 
1 1 1    6   29   44 o  270.458   24.350   59.788   9.9721   0.0000   0.0000   59.788   9.9721  ?   ?   270.458   24.350 0.000000 24.34998 
1 1 1    6   29   45 o   88.698   25.194   6.6417   3.5808   7.8808   5.1521   5.4838   4.9803   96.272   30.871   84.433   30.302 11.83952 43.25742 
1 1 1    6   29   46 o  143.673   16.718   16.527   3.6077   21.496   5.2634   12.123   4.9548  161.803   21.808  118.338   27.823 43.46561 35.35129 
1 1 1    6   29   47 o   79.794   25.177   5.2977   3.4376   5.1291   4.9484   5.4549   4.7789   82.084   30.096   83.165   29.700 -1.080566 42.28306 
1 1 1    6   29   48 f   76.856   28.444   4.4150   4.4369  -2.5835   9.8411   6.2004   4.9707   78.725   36.086   86.521   30.350 -7.796089 47.15239 
1 1 1    6   29   49 f  105.384   23.993   9.6027   3.7833   10.284   5.3933   8.9425   5.3086  106.033   31.165   99.362   31.280 6.671585 44.15574 
1 1 1    6   29   50 o  149.418   17.732   18.250   3.9763   9.6488   5.5007   27.663   5.7545  101.986   31.798  182.149   21.026 -80.16299 38.12110 
1 1 1    6   29   51 o  199.943   17.964   32.707   5.4390   17.000   9.1450   41.303   6.7657  126.327   41.184  223.156   20.021 -96.82840 45.79259 
1 1 1    6   30    0 o  173.387   31.751   25.355   7.5915   25.355   7.5915   25.355   7.5915  173.387   31.751  173.387   31.751 0.000000 0.000000 
1 1 1    6   30    1 o  140.023   23.823   15.562   4.9230   22.202   6.9567   8.9005   6.9675  166.981   28.225  108.961   35.969 58.01984 45.72091 
1 1 1    6   30    2 o  524.610   10.922  211.060   8.7706  195.949   12.072  227.949   12.763  504.941   15.620  544.657   15.310 -39.71609 21.87185 
1 1 1    6   30    3 o  609.532   15.037  285.453   14.029   0.0000   0.0000  285.453   14.029  ?   ?   609.532   15.037 0.000000 15.03693 
1 1 1    6   30    4 o  578.638   10.891  256.778   9.6456  240.842   13.443  273.689   13.848  559.770   15.690  596.807   15.159 -37.03687 21.81673 
1 1 1    6   30    5 o  847.269   16.288  551.990   21.123  551.990   21.123   0.0000   0.0000  847.269   16.288  ?   ?  0.000000 16.28818 
1 1 1    6   30    6 o  249.848   22.243   48.573   8.4173   48.573   8.4173   0.0000   0.0000  249.848   22.243  ?   ?  0.000000 22.24306 
1 1 1    6   30    7 o  492.135   16.187  186.255   12.193  186.255   12.193   0.0000   0.0000  492.135   16.187  ?   ?  0.000000 16.18680 
1 1 1    6   30    8 o   95.164   36.693   4.7999   7.5594   4.7999   7.5594   0.0000   0.0000   95.164   36.693  ?   ?  0.000000 36.69278 
1 1 1    6   30    9 o  325.221   13.797   81.246   6.8682   76.224   9.7000   86.295   9.7264  313.696   20.311  334.076   19.100 -20.37988 27.88124 
1 1 1    6   30   10 f  663.195   11.137  337.442   11.305  323.194   15.830  352.276   16.151  648.197   15.955  676.810   15.591 -28.61255 22.30779 
1 1 1    6   30   11 o  311.690   14.041   74.654   6.6987   73.570   9.6553   75.660   9.3015  308.030   20.597  312.594   19.538 -4.563690 28.39011 
1 1 1    6   30   12 o  164.687   18.682   21.174   4.6260   26.751   5.6666   10.033   8.0095  185.058   20.341  115.512   38.584 69.54595 43.61748 
1 1 1    6   30   13 o  567.790   9.2355  247.192   8.0263  246.373   9.8187  248.842   13.935  566.580   11.322  568.609   16.011 -2.029053 19.60953 
1 1 1    6   30   14 o  988.561   9.9449  749.605   15.048  761.192   18.766  728.739   25.184  995.570   12.315  972.619   16.916 22.95050 20.92435 
1 1 1    6   30   15 o  571.385   9.3502  250.380   8.1774  265.440   10.368  225.596   13.301  588.002   11.520  541.275   16.055 46.72675 19.76044 
1 1 1    6   30   16 o  363.167   10.815  101.230   6.0117  105.252   7.5216   94.116   10.003  370.041   13.280  348.663   18.813 21.37833 23.02792 
1 1 1    6   30   17 o  125.419   25.987   12.684   4.8247   10.659   5.8865   16.828   8.4217  114.836   32.193  143.103   37.862 -28.26798 49.69810 
1 1 1    6   30   18 o   59.851   25.164   0.4149   3.9122  -4.6677   5.6256   5.1749   5.4441   57.694   26.745   87.924   31.668 -30.23024 41.45023 
1 1 1    6   30   19 o  296.923   10.832   67.696   4.9230   76.784   7.1029   59.294   6.8296  315.788   14.695  276.862   16.187 38.92584 21.86207 
1 1 1    6   30   20 o  168.027   16.877   22.002   4.2818   18.153   5.8603   26.411   6.2712  150.385   26.424  182.999   22.889 -32.61433 34.95923 
1 1 1    6   30   21 o  263.948   14.156   53.802   5.6981   57.382   10.008   52.084   6.9312  270.278   24.457  259.052   17.585 11.22586 30.12223 
1 1 1    6   30   22 o  263.077   13.948   53.451   5.5964   62.531   10.078   49.402   6.7294  282.371   23.532  252.212   17.541 30.15854 29.34993 
1 1 1    6   30   23 o  555.646   8.5253  236.876   7.2506  237.697   10.148  236.020   10.363  555.944   11.926  553.911   12.223 2.032776 17.07708 
1 1 1    6   30   24 o  208.434   14.653   33.670   4.6450   30.699   6.5064   36.759   6.6336  197.416   21.901  216.647   20.239 -19.23099 29.82086 
1 1 1    6   30   25 o  434.913   10.732  145.404   7.1444  126.303   11.193  158.535   9.2807  403.690   18.115  453.571   13.368 -49.88190 22.51362 
1 1 1    6   30   26 o  534.968   10.204  219.958   8.3551  224.466   14.117  217.528   10.365  538.352   17.132  531.375   12.744 6.977478 21.35242 
1 1 1    6   30   27 o  100.009   28.318   8.1385   4.5312   9.2732   6.4323   7.0206   6.3841  107.886   34.483   98.012   34.395 9.874878 48.70408 
1 1 1    6   30   28 o  363.738   10.624  101.783   5.9151  109.771   8.4854   94.233   8.2499  376.846   14.711  348.982   15.445 27.86395 21.32949 
1 1 1    6   30   29 o  335.587   12.707   86.868   6.5270   79.903   8.0499  100.233   11.152  320.601   16.460  357.716   20.452 -37.11551 26.25281 
1 1 1    6   30   30 o  267.413   14.757   55.496   6.0166   57.889   7.5373   51.293   9.9889  272.167   18.198  253.318   26.138 18.84915 31.84892 
1 1 1    6   30   31 o  187.059   20.538   27.681   5.7836   24.790   7.2298   32.818   9.6384  174.475   28.021  199.340   32.725 -24.86565 43.08246 
1 1 1    6   30   32 o  336.517   13.439   87.537   6.9222   86.000   8.8454   89.965   11.119  331.980   17.469  337.867   21.614 -5.886902 27.79062 
1 1 1    6   30   33 o  373.323   12.860  107.689   7.3484  100.983   9.2802  118.963   12.032  360.289   16.828  389.142   20.270 -28.85297 26.34525 
1 1 1    6   30   34 o  125.074   29.283   13.061   5.5071   12.619   7.5566   13.562   8.0424  122.279   37.119  126.370   38.279 -4.090889 53.32070 
1 1 1    6   30   35 o   68.168   29.119   0.3593   5.3802   7.4311   7.6771  -6.4662   7.5421  101.740   37.459   64.974   30.401 36.76562 48.24302 
1 1 1    6   30   36 o   68.865   30.968  -2.4502   6.8317   3.1683   7.6417 -24.8184   15.247   87.456   35.821   77.893   38.128 9.563240 52.31536 
1 1 1    6   30   37 o   75.349   32.760  -0.1742   7.0454   5.7819   8.0620 -19.4255   14.494   96.770   37.730   79.652   38.575 17.11817 53.95897 
1 1 1    6   30   38 o  320.695   17.299   80.681   8.4601   91.076   16.810   77.156   9.7902  329.958   33.760  311.993   20.617 17.96448 39.55809 
1 1 1    6   30   39 o  264.193   17.170   54.865   6.9054   48.690   10.061   60.365   9.4948  243.881   27.428  274.474   22.807 -30.59389 35.67166 
1 1 1    6   30   40 o  342.257   10.539   90.479   5.5209  102.141   6.5817   62.789   10.141  363.211   11.839  278.942   23.986 84.26938 26.74840 
1 1 1    6   30   41 o   68.836   25.089   3.2631   3.4315   4.6273   3.7466  -3.8390   8.5484   77.506   26.387   73.887   33.781 3.618996 42.86535 
1 1 1    6   30   42 o  267.024   9.9323   55.087   4.0595   54.858   5.8378   55.302   5.6489  264.706   14.463  265.995   13.923 -1.288788 20.07558 
1 1 1    6   30   43 o  185.110   13.004   26.811   3.6610   33.053   5.3200   21.195   5.0459  204.037   17.195  161.626   20.885 42.41151 27.05261 
1 1 1    6   30   44 o  189.370   14.243   28.224   4.0983   32.931   6.1119   24.378   5.5242  202.032   20.029  172.974   21.316 29.05739 29.24901 
1 1 1    6   30   45 o  250.931   16.286   49.927   6.2215   0.0000   0.0000   49.927   6.2215  ?   ?   250.931   16.286 0.000000 16.28635 
1 1 1    6   30   46 o  108.816   22.128   9.9382   3.5601   13.401   5.4800   7.4095   4.6830  123.324   29.439   92.805   29.398 30.51862 41.60372 
1 1 1    6   30   47 o   55.245   24.663  -0.9762   4.2488  -7.5070   9.7570   0.5521   4.7199   70.750   33.551   62.850   27.069 7.900280 43.10944 
1 1 1    6   30   48 o  141.053   18.065   16.251   3.8105   6.5599   5.3377   26.323   5.4417   88.061   31.395  178.663   20.257 -90.60191 37.36266 
1 1 1    6   30   49 o  287.540   16.316   66.457   7.1513   58.322   10.336   73.927   9.9044  259.580   26.382  297.748   21.886 -38.16837 34.27801 
1 1 1    6   30   50 o   63.218   25.250   2.3224   3.6892   2.1358   5.1699   2.5159   5.2661   69.112   28.986   70.801   29.439 -1.688423 41.31368 
1 1 1    6   31    3 o  374.062   17.540  107.763   10.043  107.763   10.043   0.0000   0.0000  374.062   17.540  ?   ?  0.000000 17.54016 
1 1 1    6   31    4 o  209.124   18.555   33.968   5.8775   29.054   8.5076   38.456   8.1295  190.860   30.121  221.510   24.381 -30.64978 38.75200 
1 1 1    6   31    5 o  441.179   11.828  149.399   7.9874  149.644   11.544  149.174   11.063  440.835   17.108  440.248   16.418 0.5870667 23.71137 
1 1 1    6   31    6 o  608.169   11.047  283.805   10.284  287.618   14.835  280.277   14.268  611.399   15.852  603.629   15.443 7.770813 22.13073 
1 1 1    6   31    7 o  807.484   11.518  500.450   14.235  504.555   20.403  496.555   19.872  809.574   16.465  803.216   16.163 6.358154 23.07273 
1 1 1    6   31    8 o  607.552   11.307  283.296   10.515  281.312   14.897  285.265   14.844  604.541   16.099  608.810   15.929 -4.269165 22.64779 
1 1 1    6   31    9 o  469.409   11.785  169.166   8.4673  163.009   11.922  175.432   12.027  460.018   16.932  477.310   16.463 -17.29224 23.61618 
1 1 1    6   31   10 o  235.992   17.173   43.137   6.1606   35.736   8.5389   51.171   8.8969  212.723   26.821  256.026   22.946 -43.30318 35.29770 
1 1 1    6   31   11 o  435.831   12.255  145.892   8.1754  137.033   11.633  154.538   11.492  421.516   18.030  447.864   16.765 -26.34833 24.61965 
1 1 1    6   31   12 f  571.828   16.164  251.854   14.147   0.0000   0.0000  251.854   14.147  ?   ?   571.828   16.164 0.000000 16.16376 
1 1 1    6   31   13 o  385.360   10.545  113.971   6.2196  118.496   7.7663  105.880   10.386  392.658   12.922  370.381   18.319 22.27692 22.41823 
1 1 1    6   31   14 o  315.785   11.710   76.592   5.6601   73.879   6.9767   81.815   9.6810  309.822   14.712  324.763   19.567 -14.94131 24.48048 
1 1 1    6   31   15 o  345.446   11.258   91.642   5.9528   88.860   7.3516   96.939   10.144  339.825   14.134  353.718   18.804 -13.89264 23.52363 
1 1 1    6   31   16 f  288.722   12.562   64.081   5.5513   65.531   6.7854   61.147   9.6538  291.269   15.273  279.742   22.743 11.52689 27.39543 
1 1 1    6   31   17 o  330.591   11.606   83.974   5.8728   83.270   7.2323   85.335   10.063  328.858   14.368  331.409   19.930 -2.550690 24.56904 
1 1 1    6   31   18 o  292.184   12.662   65.657   5.6628   63.860   6.9862   69.100   9.6696  287.313   15.949  297.670   21.365 -10.35699 26.66124 
1 1 1    6   31   19 o  113.464   27.369   10.481   4.6982   4.7143   8.4202   13.089   5.6615   97.372   38.381  126.551   29.732 -29.17904 48.55038 
1 1 1    6   31   20 o  377.644   11.481  109.628   6.6366  133.174   12.552  100.490   7.8191  414.436   19.787  361.152   14.145 53.28439 24.32241 
1 1 1    6   31   21 o  189.072   15.693   27.780   4.5006   27.084   6.4960   28.423   6.2413  184.945   23.476  189.934   21.868 -4.989670 32.08304 
1 1 1    6   31   22 o  150.865   19.824   17.961   4.4669   21.419   6.5937   15.029   6.0728  163.001   27.400  135.375   30.088 27.62616 40.69467 
1 1 1    6   31   23 o  260.113   13.904   52.316   5.5157   49.448   9.0263   54.025   6.9681  250.370   23.842  263.593   17.368 -13.22284 29.49687 
1 1 1    6   31   24 o  352.188   12.063   95.494   6.5029  105.598   11.039   90.124   8.0475  368.044   19.667  341.505   15.395 26.53903 24.97612 
1 1 1    6   31   25 o  297.982   11.605   68.353   5.2930   67.944   7.3377   68.796   7.6425  295.828   16.268  297.530   16.851 -1.702820 23.42207 
1 1 1    6   31   26 o  420.692   9.7983  136.044   6.3094  129.067   8.8053  143.405   9.0451  408.810   14.072  431.018   13.710 -22.20804 19.64663 
1 1 1    6   31   27 o   97.175   30.626   7.5217   5.0876   5.2359   6.2661   11.943   8.7149   90.186   33.718  121.687   40.230 -31.50106 52.49144 
1 1 1    6   31   28 o  157.809   23.376   19.966   5.4757   18.434   6.9437   22.484   8.9047  149.029   31.430  163.156   36.563 -14.12666 48.21469 
1 1 1    6   31   29 o  182.242   18.576   26.126   5.1092   29.898   7.1888   22.277   7.2626  193.127   24.899  164.587   29.932 28.54051 38.93395 
1 1 1    6   31   30 o  182.170   19.033   26.161   5.2287   23.821   7.1691   28.821   7.6426  170.721   28.436  188.577   27.270 -17.85602 39.39844 
1 1 1    6   31   31 o  159.751   22.455   20.447   5.3390   15.631   7.3814   25.730   7.7317  135.691   35.229  176.961   29.590 -41.26968 46.00706 
1 1 1    6   31   32 o   55.623   25.661  -3.6381   5.0883  -5.1674   7.0512  -1.9764   7.3500   64.720   29.981   73.029   32.532 -8.309036 44.23999 
1 1 1    6   31   33 o  179.559   22.196   25.777   5.9704   19.463   7.5623   36.225   9.7277  151.662   33.473  209.390   31.313 -57.72791 45.83651 
1 1 1    6   31   34 o   73.053   32.721  -2.3174   7.5452  -2.3174   7.5452   0.0000   0.0000   73.053   32.721  ?   ?  0.000000 32.72108 
1 1 1    6   31   35 o  159.285   35.415   21.774   8.4108   21.774   8.4108   0.0000   0.0000  159.285   35.415  ?   ?  0.000000 35.41473 
1 1 1    6   31   36 o  347.307   13.199   93.470   7.0165   82.987   10.093  103.275   9.7610  323.868   20.466  363.347   17.551 -39.47891 26.96063 
1 1 1    6   31   37 o  205.142   24.309   34.042   7.4846   15.802   14.346   40.863   8.7732  136.861   51.048  224.127   26.060 -87.26613 57.31487 
1 1 1    6   31   38 o  315.005   20.928   78.888   10.033   0.0000   0.0000   78.888   10.033  ?   ?   315.005   20.928 0.000000 20.92834 
1 1 1    6   31   39 o  250.522   17.975   49.579   6.8468   49.729   9.9069   49.443   9.4734  246.391   26.696  246.379   25.489 0.1210022E-01 36.91045 
1 1 1    6   31   40 f   77.758   32.209   2.2571   6.2698   0.9226   9.0862   3.4701   8.6627   85.991   37.295   90.698   37.738 -4.706543 53.05774 
1 1 1    6   31   41 o  165.036   17.147   21.654   4.2681   21.523   4.8016   22.147   9.3174  163.631   19.559  156.033   39.094 7.598114 43.71326 
1 1 1    6   31   42 o  274.624   12.338   58.655   5.1864   62.355   6.2076   50.100   9.4385  281.986   14.431  246.511   25.377 35.47423 29.19348 
1 1 1    6   31   43 o  200.653   12.976   31.529   3.9638   27.783   5.1906   36.770   6.1394  186.131   18.463  214.114   18.928 -27.98317 26.44137 
1 1 1    6   31   44 o   67.832   24.209   3.3858   3.1747   0.6536   4.4645   6.1808   4.5154   62.314   26.570   86.548   28.970 -24.23390 39.30912 
1 1 1    6   31   45 o  189.193   16.403   28.566   4.7031   32.281   5.4514   17.749   9.3010  200.406   17.962  135.052   41.222 65.35425 44.96583 
1 1 1    6   31   46 o  270.770   18.222   59.113   7.5083   58.801   11.222   59.365   10.103  260.754   28.586  265.395   25.171 -4.640381 38.08856 
1 1 1    6   31   47 o  125.701   20.863   13.222   3.8734   15.302   5.8531   11.602   5.1665  130.035   30.016  113.198   29.515 16.83736 42.09593 
1 1 1    6   31   48 o  185.275   31.811   31.428   8.6962   0.0000   0.0000   31.428   8.6962  ?   ?   185.275   31.811 0.000000 31.81104 
1 1 1    6   31   49 o   74.952   26.598   4.5980   3.8269   5.1848   5.3161   3.9669   5.5133   81.029   30.886   76.840   30.805 4.188766 43.62219 
1 1 1    6   32    0 o  247.022   23.697   48.272   8.7703   48.272   8.7703   48.272   8.7703  247.022   23.697  247.022   23.697 0.000000 0.000000 
1 1 1    6   32    1 o  828.484   11.446  526.923   14.515  510.484   20.074  544.931   21.011  814.231   16.107  841.186   16.319 -26.95532 22.92920 
1 1 1    6   32    2 o  215.110   17.747   35.914   5.7910   40.056   8.2928   31.971   8.0904  225.941   24.365  200.966   26.983 24.97496 36.35534 
1 1 1    6   32    3 o  343.501   10.914   90.558   5.7384   93.300   7.1830   85.721   9.5404  348.405   13.469  332.759   18.808 15.64639 23.13396 
1 1 1    6   32    4 o  645.244   11.418  319.628   11.277  335.052   16.775  306.912   15.232  659.479   16.619  631.387   15.761 28.09247 22.90372 
1 1 1    6   32    5 o  542.902   11.496  226.295   9.5532  227.855   13.759  224.843   13.275  543.843   16.529  540.338   16.050 3.504517 23.03954 
1 1 1    6   32    6 o   92.459   31.130   6.3035   5.2141   8.9739   7.6279   3.9613   7.1437  110.267   37.650   90.286   35.427 19.98001 51.69719 
1 1 1    6   32    7 o   98.892   31.511   7.5498   5.3744   9.9292   7.8074   5.4070   7.4092  114.395   38.090   96.293   36.520 18.10151 52.76936 
1 1 1    6   32    8 o   62.560   27.593  -1.4089   5.1600   4.7472   7.5985  -6.6775   7.0294   94.737   36.715   62.811   29.376 31.92619 47.02048 
1 1 1    6   32    9 o  175.501   22.314   24.245   5.8587   28.131   8.3515   20.480   8.2209  187.328   30.150  158.177   34.892 29.15112 46.11339 
1 1 1    6   32   10 o  647.274   11.415  321.754   11.309  304.182   15.720  340.605   16.282  628.207   16.348  664.854   15.999 -36.64709 22.87448 
1 1 1    6   32   11 o  349.088   13.539   93.731   7.2340   86.784   10.187  100.798   10.275  334.340   19.998  360.728   18.673 -26.38828 27.36012 
1 1 1    6   32   12 o  717.501   11.648  395.496   12.792  392.275   18.150  398.675   18.032  713.167   16.627  719.041   16.384 -5.874390 23.34286 
1 1 1    6   32   13 o  232.437   14.828   41.777   5.2481   45.905   6.5215   34.192   8.8407  243.192   17.640  207.096   28.658 36.09593 33.65148 
1 1 1    6   32   14 o  377.589   10.881  109.501   6.2885  102.311   7.6171  124.892   11.144  364.611   13.649  401.994   18.111 -37.38330 22.67836 
1 1 1    6   32   15 o  443.713   10.104  151.154   6.8623  149.591   8.4158  154.256   11.854  441.048   12.466  446.872   17.330 -5.823395 21.34846 
1 1 1    6   32   16 o  212.119   19.131   35.113   6.1446   31.359   8.9260   38.493   8.4713  197.386   30.529  220.583   25.564 -23.19637 39.81928 
1 1 1    6   32   17 o  572.666   12.098  252.211   10.604  238.584   14.935  266.066   15.059  555.482   17.566  586.870   16.765 -31.38794 24.28219 
1 1 1    6   32   18 o   67.206   27.873   1.0314   4.7035   3.4868   5.5764  -5.0220   8.7558   81.164   31.453   75.188   34.303 5.975540 46.54025 
1 1 1    6   32   19 o  730.681   11.930  410.720   13.343  411.945   18.540  409.404   19.218  730.010   16.592  727.458   17.260 2.552124 23.94176 
1 1 1    6   32   20 f  211.230   16.490   34.704   5.2892   33.995   8.7910   35.106   6.6217  205.767   28.693  211.488   20.722 -5.721268 35.39334 
1 1 1    6   32   21 o  183.716   18.562   26.440   5.1481   17.430   8.2138   32.269   6.6067  144.335   37.005  202.366   21.666 -58.03090 42.88135 
1 1 1    6   32   22 o  454.703   9.4671  158.827   6.5889  160.379   9.3581  157.301   9.2788  456.063   13.406  451.660   13.422 4.402710 18.96994 
1 1 1    6   32   23 o  375.053   10.277  108.154   5.8998  109.637   8.4467  106.742   8.2443  376.715   14.649  371.746   14.489 4.968872 20.60382 
1 1 1    6   32   24 o  241.148   13.755   45.036   5.0559   48.053   7.1440   42.008   7.1564  247.833   18.977  231.217   20.431 16.61635 27.88470 
1 1 1    6   32   25 o  254.806   13.513   50.262   5.2516   50.735   7.3065   49.756   7.5533  254.639   18.881  251.897   19.749 2.741745 27.32202 
1 1 1    6   32   26 o  392.640   11.847  118.810   7.1198  114.152   8.7865  127.715   12.150  384.079   14.946  404.652   19.617 -20.57220 24.66153 
1 1 1    6   32   27 o  220.938   15.273   37.980   5.1333   35.254   7.0704   41.018   7.4649  210.879   22.240  227.819   21.668 -16.93980 31.05079 
1 1 1    6   32   28 o   72.875   29.275   2.2569   4.9901   12.982   6.8771  -9.6703   7.2521  124.300   34.779   58.526   28.075 65.77388 44.69606 
1 1 1    6   32   29 o  120.794   27.845   12.083   5.0428   13.613   7.1118   10.536   7.1515  126.941   35.314  113.509   36.368 13.43229 50.69265 
1 1 1    6   32   30 o  267.371   14.395   55.526   5.8694   57.698   8.3425   53.397   8.2592  270.638   20.287  260.063   20.926 10.57535 29.14509 
1 1 1    6   32   31 o  204.904   17.992   33.002   5.5857   40.477   8.0225   25.969   7.7818  225.061   23.642  177.476   29.696 47.58470 37.95748 
1 1 1    6   32   32 o  236.525   19.661   44.146   7.0533   46.176   8.1119   37.853   14.280  240.941   22.247  205.497   46.487 35.44432 51.53585 
1 1 1    6   32   33 o   55.977   26.820  -8.5000   6.5753  -7.7503   7.7490 -10.4280   12.426   63.890   30.179   81.835   38.522 -17.94493 48.93580 
1 1 1    6   32   34 o  287.310   14.483   64.256   6.3487   59.627   9.2192   68.430   8.7557  273.645   22.202  294.524   19.533 -20.87924 29.57153 
1 1 1    6   32   35 o   77.789   34.190  -0.7551   7.8582   2.9515   14.538  -2.2851   9.3403  109.393   47.310   81.280   36.406 28.11227 59.69589 
1 1 1    6   32   36 o  313.441   20.403   77.878   9.7351   74.662   16.279   79.669   12.146  295.882   36.735  314.048   25.489 -18.16635 44.71173 
1 1 1    6   32   37 o  120.008   44.169   11.661   10.672   0.0000   0.0000   11.661   10.672  ?   ?   120.008   44.169 0.000000 44.16871 
1 1 1    6   32   38 o  241.918   19.461   46.524   7.1453   43.743   10.078   49.335   10.132  229.208   29.405  244.766   27.521 -15.55818 40.27452 
1 1 1    6   32   39 o  193.588   22.512   30.374   6.5460   24.037   9.4050   36.328   9.1167  163.727   38.224  208.087   29.446 -44.36041 48.25042 
1 1 1    6   32   40 o   71.059   31.586  -1.1321   6.8905   5.6488   11.460  -4.9718   8.6234  103.619   43.284   71.731   33.202 31.88761 54.55209 
1 1 1    6   32   41 o  126.919   21.279   13.230   3.9874   12.637   4.4514   15.637   8.9703  122.689   24.561  129.933   40.622 -7.244568 47.46993 
1 1 1    6   32   42 o  350.143   16.194   96.677   8.6788   94.842   11.091   99.575   13.938  342.626   21.254  346.127   26.510 -3.500977 33.97821 
1 1 1    6   32   43 o  143.294   20.056   16.764   4.2784   21.429   4.8829   1.3428   8.8776  162.275   20.088   84.160   36.681 78.11538 41.82091 
1 1 1    6   32   44 o  175.238   18.116   24.781   4.7889   20.565   9.9604   26.049   5.4616  144.044   42.357  178.537   20.349 -34.49205 46.99183 
1 1 1    6   32   45 o  171.102   26.196   25.119   6.6423   43.836   10.161   11.150   8.7777  222.794   30.603  109.582   40.098 113.2119 50.44216 
1 1 1    6   32   46 o  136.869   18.270   15.347   3.7319   12.464   5.0668   18.766   5.5175  117.923   28.408  147.458   25.360 -29.53490 38.08107 
1 1 1    6   32   47 o  244.278   14.644   47.571   5.4499   65.197   7.1333   22.855   8.4469  284.652   16.442  153.158   36.542 131.4939 40.07066 
1 1 1    6   33    0 o  162.323   36.134   23.190   7.8445   23.190   7.8445   23.190   7.8445  162.323   36.134  162.323   36.134 0.000000 0.000000 
1 1 1    6   33    1 o  268.455   14.862   55.652   6.0830   40.206   8.2181   74.370   9.0467  226.210   24.106  309.611   19.184 -83.40080 30.80843 
1 1 1    6   33    2 o  381.215   12.241  111.673   7.1426  113.692   9.9771  109.551   10.230  383.924   16.978  376.732   17.741 7.191742 24.55577 
1 1 1    6   33    3 f  429.025   9.8525  141.241   6.4699  139.856   8.0801  143.715   10.800  426.589   12.375  431.763   16.343 -5.173981 20.49933 
1 1 1    6   33    4 o  381.746   12.791  112.034   7.4737  121.315   11.231  104.657   10.013  396.267   18.516  368.193   17.767 28.07385 25.66132 
1 1 1    6   33    5 o  151.263   24.083   18.213   5.3889   8.6210   7.8195   26.889   7.4370  109.124   38.078  183.670   27.283 -74.54589 46.84335 
1 1 1    6   33    6 o  617.703   11.413  293.091   10.790  294.112   15.524  292.136   15.009  617.561   16.423  615.621   15.928 1.939514 22.87822 
1 1 1    6   33    7 o  312.672   14.343   75.264   6.8642   79.744   10.453   71.867   9.1013  319.988   21.467  304.138   19.656 15.85034 29.10653 
1 1 1    6   33    8 o  471.378   12.069  170.777   8.7080  169.785   12.662  171.667   11.995  468.874   17.643  471.708   16.613 -2.833801 24.23402 
1 1 1    6   33    9 o  459.099   12.170  162.021   8.5520  166.020   12.489  158.491   11.735  463.615   17.600  453.138   16.919 10.47690 24.41322 
1 1 1    6   33   10 o  116.218   31.010   11.012   5.6186   2.5637   7.9125   19.604   7.9798   88.955   36.445  154.378   34.624 -65.42297 50.26973 
1 1 1    6   33   11 o  276.620   15.915   59.216   6.7101   51.538   9.3533   67.359   9.6318  256.102   24.146  293.782   21.571 -37.68030 32.37748 
1 1 1    6   33   12 o  258.765   17.233   51.957   6.7865   46.427   9.6606   57.345   9.5358  242.240   26.486  270.440   23.263 -28.20091 35.25183 
1 1 1    6   33   13 o  191.098   21.756   28.735   6.2501   20.226   8.7706   37.515   8.9091  156.056   37.237  217.124   27.419 -61.06825 46.24259 
1 1 1    6   33   14 o  181.371   22.774   26.000   6.1828   35.293   8.9836   17.637   8.5223  210.034   28.695  145.592   37.881 64.44196 47.52193 
1 1 1    6   33   15 o  539.523   12.290  223.966   10.149  205.267   14.137  243.854   14.580  514.961   17.936  561.616   16.961 -46.65527 24.68517 
1 1 1    6   33   16 o  754.104   11.865  437.469   13.696  439.898   19.296  435.004   19.442  754.284   16.714  749.974   16.936 4.309875 23.79460 
1 1 1    6   33   17 o  180.692   23.725   25.929   6.4031   16.131   8.5298   38.578   9.6920  139.058   38.671  219.088   29.665 -80.02980 48.73851 
1 1 1    6   33   18 f  456.421   10.843  160.173   7.5752  149.298   9.0770  185.126   13.750  440.099   13.475  488.566   18.386 -48.46692 22.79542 
1 1 1    6   33   19 o  294.853   13.191   67.014   5.9534   64.797   7.1218   72.159   10.848  288.979   16.166  302.737   23.597 -13.75714 28.60321 
1 1 1    6   33   20 o  532.942   10.324  218.372   8.4213  219.842   10.210  215.243   14.896  534.166   12.487  526.451   18.486 7.714600 22.30789 
1 1 1    6   33   21 o  168.923   18.213   22.409   4.6346   14.069   6.4756   31.167   6.6359  130.044   32.596  198.453   22.228 -68.40877 39.45343 
1 1 1    6   33   22 o   92.169   29.332   6.6901   4.6579  -5.1263   6.5089   19.093   6.6685   61.956   28.737  152.505   29.635 -90.54858 41.28029 
1 1 1    6   33   23 o  127.312   27.615   13.319   5.2264   13.097   6.6258   13.684   8.5030  125.240   33.786  128.219   39.462 -2.978844 51.94962 
1 1 1    6   33   24 o  196.631   18.526   30.346   5.5102   29.699   6.8553   31.529   9.2619  192.992   23.705  195.895   31.994 -2.902954 39.81890 
1 1 1    6   33   25 o   87.885   29.461   5.8927   4.6699   9.3992   6.5282   2.2179   6.6830  108.095   34.759   81.216   33.409 26.87893 48.21195 
1 1 1    6   33   26 o  311.594   12.327   74.912   5.8794   76.702   8.3501   73.152   8.2798  313.556   17.468  306.098   17.748 7.458069 24.90215 
1 1 1    6   33   27 f   80.631   30.499   4.0036   5.1587   17.674   7.2343 -10.1392   7.3582  144.931   33.309   58.415   28.089 86.51614 43.57158 
1 1 1    6   33   28 o  349.422   12.046   94.225   6.4427   96.598   8.9832   91.713   9.2451  352.461   16.651  342.658   17.687 9.803741 24.29226 
1 1 1    6   33   29 o  576.145   9.7757  255.503   8.6209  255.467   12.143  255.540   12.241  574.469   13.810  574.499   13.920 -0.2990723E-01 19.60861 
1 1 1    6   33   30 f  226.989   20.388   40.756   7.0081   49.799   8.2376   17.063   13.334  250.566   21.693  141.555   49.706 109.0117 54.23302 
1 1 1    6   33   31 o  267.592   17.882   56.183   7.2819   57.439   8.5462   52.855   13.912  269.386   20.890  249.486   37.597 19.89922 43.01104 
1 1 1    6   33   32 o  171.150   22.535   23.549   5.7599   36.960   8.5425   12.368   7.7996  213.176   26.771  120.739   37.900 92.43775 46.40149 
1 1 1    6   33   33 o   73.394   30.427   1.6760   5.6016 -10.8155   7.9516   13.983   7.8926   60.361   29.068  127.202   37.784 -66.84126 47.67174 
1 1 1    6   33   34 o  240.727   20.641   46.059   7.5318   61.844   14.767   40.509   8.7564  269.283   36.790  223.174   26.128 46.10847 45.12449 
1 1 1    6   33   35 o  275.966   15.850   59.621   6.6669   62.796   9.7787   56.863   9.1132  279.829   23.035  266.454   22.557 13.37463 32.24024 
1 1 1    6   33   36 o  159.535   27.061   21.131   6.3719   36.240   9.6036   9.2495   8.5165  207.598   31.187  108.516   39.529 99.08186 50.35049 
1 1 1    6   33   37 o  265.852   19.092   56.107   7.7172   58.560   10.089   52.648   11.980  268.366   24.844  249.582   32.105 18.78389 40.59484 
1 1 1    6   33   38 o  199.316   26.327   32.857   7.8352   15.322   11.309   49.044   10.866  130.146   45.772  241.555   30.036 -111.4094 54.74691 
1 1 1    6   33   39 o  119.967   37.417   12.871   7.6157   8.7227   11.354   16.263   10.268  110.472   44.235  132.192   43.667 -21.72028 62.15749 
1 1 1    6   33   40 o   74.992   32.423   0.7143   6.8237   7.2128   8.9921  -8.1090   10.478  100.773   39.682   74.539   35.174 26.23362 53.02698 
1 1 1    6   33   41 o  208.819   24.271   36.046   7.6129   30.433   9.8035   44.573   12.083  183.753   36.144  222.734   36.722 -38.98096 51.52557 
1 1 1    6   33   42 o  139.320   20.385   15.912   4.2184   14.211   4.7687   22.030   9.0457  129.457   24.971  153.031   38.618 -23.57445 45.98775 
1 1 1    6   33   43 o   69.511   30.430   0.2266   6.1699   7.4833   9.0460  -6.0857   8.4369   99.267   39.574   67.423   31.738 31.84441 50.72903 
1 1 1    6   33   44 o  177.626   17.089   25.439   4.5889   32.128   5.3680   7.2804   8.8443  199.381   17.776   97.265   39.008 102.1156 42.86764 
1 1 1    6   33   45 o  234.873   18.457   44.863   6.5821   40.912   9.3675   48.716   9.2505  215.173   29.196  238.410   25.759 -23.23698 38.93528 
1 1 1    6   33   46 o  149.857   17.066   18.280   3.8448   18.670   5.1275   17.778   5.8111  147.762   23.455  141.182   27.881 6.580032 36.43435 
1 1 1    6   34    0 o   41.533   29.266  -8.3876   7.3572  -8.3876   7.3572  -8.3876   7.3572   41.533   29.266   41.533   29.266 0.000000 0.000000 
1 1 1    6   34    1 o   95.743   30.329   7.1360   4.9843   9.3466   6.9653   4.8159   7.1356  109.900   35.948   92.802   35.686 17.09809 50.65296 
1 1 1    6   34    2 o  342.749   13.010   90.383   6.8251   84.234   9.3755   97.316   9.9549  329.455   18.669  354.250   18.423 -24.79556 26.22851 
1 1 1    6   34    3 o  192.494   16.482   28.804   4.8094   26.375   5.8878   33.675   8.3371  183.135   21.409  205.743   27.136 -22.60789 34.56445 
1 1 1    6   34    4 o  450.634   12.352  156.166   8.5201  153.315   12.576  158.585   11.584  445.180   18.456  453.207   16.699 -8.027222 24.88890 
1 1 1    6   34    5 f  188.461   20.629   27.867   5.8535   33.468   8.7456   23.322   7.8784  204.599   28.718  169.389   31.547 35.21051 42.66073 
1 1 1    6   34    6 o  328.213   13.840   82.956   6.9526   92.685   10.297   74.803   9.4258  345.330   19.561  310.014   19.970 35.31528 27.95419 
1 1 1    6   34    7 f  486.578   12.110  182.072   9.0194  184.091   13.242  180.326   12.319  487.924   17.731  483.202   16.656 4.722717 24.32691 
1 1 1    6   34    8 o  194.675   20.888   29.751   6.1268   24.762   8.8979   34.249   8.4487  173.610   34.698  207.321   27.287 -33.71066 44.14206 
1 1 1    6   34    9 o  530.891   12.188  216.800   9.9042  199.808   13.859  234.537   14.159  508.198   17.817  550.927   16.791 -42.72873 24.48204 
1 1 1    6   34   10 o  190.868   31.174   29.496   8.7929   0.0000   0.0000   29.496   8.7929  ?   ?   190.868   31.174 0.000000 31.17394 
1 1 1    6   34   11 o  189.195   31.103   29.007   8.6939   0.0000   0.0000   29.007   8.6939  ?   ?   189.195   31.103 0.000000 31.10301 
1 1 1    6   34   12 o  225.558   28.122   40.630   9.4981   0.0000   0.0000   40.630   9.4981  ?   ?   225.558   28.122 0.000000 28.12188 
1 1 1    6   34   13 o  220.685   29.010   39.049   9.5618   0.0000   0.0000   39.049   9.5618  ?   ?   220.685   29.010 0.000000 29.01027 
1 1 1    6   34   14 o  721.462   12.476  400.776   13.777  366.299   18.918  439.709   20.104  687.498   17.978  753.528   17.430 -66.02936 25.04040 
1 1 1    6   34   15 o  274.524   14.023   58.284   5.8728   61.144   7.2254   52.714   10.082  280.547   16.905  257.786   25.901 22.76062 30.92942 
1 1 1    6   34   16 o  528.225   10.330  214.494   8.3522  226.640   10.372  192.090   14.087  542.416   12.493  497.440   18.501 44.97672 22.32428 
1 1 1    6   34   17 o  307.746   13.226   73.030   6.2299   76.206   7.7580   67.265   10.454  313.365   16.230  292.083   23.584 21.28143 28.62878 
1 1 1    6   34   18 o  364.549   12.050  102.369   6.7240   98.630   8.1408  110.398   11.928  357.220   14.889  375.624   20.828 -18.40408 25.60222 
1 1 1    6   34   19 o  646.277   10.293  321.215   10.182  315.211   12.341  334.017   18.020  639.430   12.609  655.779   17.952 -16.34869 21.93785 
1 1 1    6   34   20 f  321.076   13.160   79.545   6.4676   78.690   7.8678   81.326   11.358  318.282   16.204  321.107   23.267 -2.824524 28.35291 
1 1 1    6   34   21 o  350.127   15.271   94.885   8.1840   94.885   8.1840   0.0000   0.0000  350.127   15.271  ?   ?  0.000000 15.27107 
1 1 1    6   34   22 o  154.032   23.753   19.065   5.4202   24.639   6.7167   8.6605   9.1775  174.824   25.883  110.821   40.929 64.00367 48.42643 
1 1 1    6   34   23 o  121.498   26.673   12.138   4.8245   12.597   6.8244   11.680   6.8213  122.671   34.759  118.524   35.108 4.147339 49.40409 
1 1 1    6   34   24 o  281.365   12.996   61.138   5.5968   57.475   7.7331   65.167   8.1106  270.876   18.767  288.614   18.456 -17.73779 26.32192 
1 1 1    6   34   25 o  296.210   12.825   67.763   5.8145   72.074   8.2222   63.449   8.2236  303.738   17.763  284.500   18.994 19.23740 26.00568 
1 1 1    6   34   26 o  146.956   23.647   17.445   5.1385   17.243   7.1695   17.658   7.3685  142.956   33.372  144.532   33.895 -1.575302 47.56661 
1 1 1    6   34   27 o  391.513   11.606  118.256   6.9552  130.467   9.8603  106.163   9.8122  409.865   15.717  369.131   17.367 40.73428 23.42296 
1 1 1    6   34   28 f   60.801   28.242  -4.9199   6.3203  -6.7756   7.2335   1.0692   12.995   62.769   29.498  102.489   44.526 -39.71953 53.41060 
1 1 1    6   34   29 o  135.143   28.053   15.168   5.6129   16.495   7.7014   13.666   8.1974  138.544   35.992  126.486   38.716 12.05812 52.86184 
1 1 1    6   34   30 o  170.477   21.965   23.302   5.5980   19.939   7.7677   26.937   8.0749  152.925   34.059  180.063   30.379 -27.13771 45.63897 
1 1 1    6   34   31 o  243.617   16.400   46.475   6.0796   46.865   8.6154   46.088   8.5805  241.771   23.581  239.690   23.699 2.081009 33.43190 
1 1 1    6   34   32 o  303.731   17.105   72.326   7.9195   76.422   15.351   70.840   9.2447  302.250   33.758  299.133   20.311 3.117706 39.39781 
1 1 1    6   34   33 o  443.093   11.734  151.849   7.9583  152.482   11.378  151.243   11.135  441.570   16.834  439.938   16.536 1.632385 23.59764 
1 1 1    6   34   34 o  235.238   18.062   43.709   6.4537   50.930   9.2815   36.950   8.9798  250.899   24.481  211.340   28.486 39.55922 37.55958 
1 1 1    6   34   35 o  426.073   12.161  140.714   7.9309  146.637   11.489  135.322   10.961  432.114   17.371  415.182   17.248 16.93192 24.47997 
1 1 1    6   34   36 o  147.401   31.424   18.698   6.8732   22.908   11.026   16.022   8.7898  156.474   44.129  133.168   39.946 23.30626 59.52349 
1 1 1    6   34   37 o  237.398   20.174   45.161   7.2612   56.884   12.228   38.775   9.0248  258.784   31.521  215.441   28.032 43.34273 42.18253 
1 1 1    6   34   38 o  182.502   23.619   27.363   6.4431   34.516   9.1888   20.444   9.0370  200.790   30.888  148.968   39.129 51.82175 49.85104 
1 1 1    6   34   39 o  132.596   34.356   15.781   7.0294   24.629   9.3464   4.2587   10.666  163.974   37.985   97.208   41.246 66.76622 56.07190 
1 1 1    6   34   40 o  154.206   31.015   20.830   7.0667   19.421   9.3158   22.738   10.845  142.843   40.659  152.230   44.039 -9.386673 59.93788 
1 1 1    6   34   41 o  132.897   34.738   16.233   7.1454   15.445   9.3560   17.336   11.069  126.457   41.677  131.749   45.342 -5.291534 61.58669 
1 1 1    6   34   42 o   98.446   34.320   8.5023   6.3515   8.4035   9.2522   8.5903   8.7349  101.901   40.212  101.679   39.376 0.2218552 56.28002 
1 1 1    6   34   43 o  290.997   12.959   66.536   5.7719   80.134   7.2386   42.798   9.5642  318.044   14.870  221.083   28.960 96.96167 32.55416 
1 1 1    6   34   44 f  110.174   25.955   10.701   4.3050   13.650   5.0184   2.4834   8.3773  124.067   27.178   82.499   35.796 41.56834 44.94410 
1 1 1    6   35    0 o   72.155   41.589   5.2535   7.3902   5.2535   7.3902   5.2535   7.3902   72.155   41.589   72.155   41.589 0.000000 0.000000 
1 1 1    6   35    1 o  201.161   19.441   31.669   5.9114   34.418   8.4985   29.091   8.2281  207.639   27.410  190.080   29.216 17.55856 40.06114 
1 1 1    6   35    2 o  476.278   11.967  174.500   8.7243  173.267   12.387  175.714   12.290  473.329   17.097  476.733   16.843 -3.403992 23.99956 
1 1 1    6   35    3 o  523.543   11.759  210.821   9.4229  213.173   13.607  208.655   13.062  525.052   16.932  519.617   16.423 5.435120 23.58775 
1 1 1    6   35    4 o  413.647   12.691  131.718   8.0353  138.915   11.688  125.268   11.065  423.539   18.029  402.212   17.973 21.32703 25.45739 
1 1 1    6   35    5 o  609.374   16.256  286.959   15.162   0.0000   0.0000  286.959   15.162  ?   ?   609.374   16.256 0.000000 16.25562 
1 1 1    6   35    6 o  462.068   17.058  165.173   12.064   0.0000   0.0000  165.173   12.064  ?   ?   462.068   17.058 0.000000 17.05809 
1 1 1    6   35    7 o  268.977   23.021   56.865   9.3866   0.0000   0.0000   56.865   9.3866  ?   ?   268.977   23.021 0.000000 23.02131 
1 1 1    6   35    8 o  219.185   20.273   37.651   6.7245   32.574   9.5009   42.747   9.5188  200.171   32.094  231.550   27.388 -31.37885 42.19148 
1 1 1    6   35    9 o  145.724   28.396   17.294   6.1061   11.012   8.7935   23.143   8.4854  119.176   40.425  167.331   34.283 -48.15558 53.00475 
1 1 1    6   35   10 o   96.899   34.001   6.8085   6.2387   11.237   9.3764   3.2903   8.3570  120.946   41.726   92.346   37.601 28.59997 56.16788 
1 1 1    6   35   11 f  210.795   21.226   34.965   6.7555   29.759   9.4870   40.319   9.6219  190.302   33.809  224.127   28.707 -33.82545 44.35241 
1 1 1    6   35   12 o  193.469   22.543   29.626   6.5504   25.760   9.4230   33.242   9.1122  175.829   36.218  202.560   30.322 -26.73091 47.23579 
1 1 1    6   35   13 o  121.759   32.366   12.276   6.1357   0.1652   8.9759   22.898   8.4064   86.707   37.337  166.120   34.201 -79.41343 50.63329 
1 1 1    6   35   14 o   72.988   31.012   0.5032   6.0438   1.9237   8.5716  -0.9013   8.5230   89.224   37.367   82.071   35.851 7.152779 51.78385 
1 1 1    6   35   15 f  153.496   28.279   19.212   6.3992   14.964   9.1964   23.200   8.9100  133.902   41.011  166.437   36.020 -32.53551 54.58384 
1 1 1    6   35   16 o  139.449   25.457   15.765   5.2335   18.502   6.3820   10.146   9.1446  150.361   28.778  116.108   41.125 34.25211 50.19389 
1 1 1    6   35   17 f  120.228   29.700   11.959   5.4335   10.864   6.7063   14.052   9.2698  115.104   34.975  130.289   41.370 -15.18470 54.17302 
1 1 1    6   35   18 o  291.185   14.816   65.743   6.5818   64.004   7.6864   70.521   12.743  286.534   17.611  296.627   28.414 -10.09286 33.42916 
1 1 1    6   35   19 o  276.398   17.955   59.641   7.5547   59.641   7.5547   0.0000   0.0000  276.398   17.955  ?   ?  0.000000 17.95457 
1 1 1    6   35   20 o   89.906   34.173   4.9856   6.4964   4.9856   6.4964   0.0000   0.0000   89.906   34.173  ?   ?  0.000000 34.17324 
1 1 1    6   35   21 f  545.554   10.833  229.191   9.0457  238.923   11.198  210.914   15.346  556.204   13.153  519.886   19.285 36.31781 23.34318 
1 1 1    6   35   22 o  143.508   24.175   16.661   5.1214   8.2240   7.1177   25.718   7.3747  104.062   36.328  177.678   28.048 -73.61664 45.89565 
1 1 1    6   35   23 o  301.293   12.612   70.094   5.8161   76.282   8.1639   63.716   8.2880  312.704   17.122  285.030   19.108 27.67316 25.65662 
1 1 1    6   35   24 o  272.168   13.513   57.292   5.6295   57.564   7.8343   57.002   8.0948  270.801   19.021  269.195   19.784 1.605865 27.44513 
1 1 1    6   35   25 o  249.146   17.894   48.651   6.7785   45.720   7.8459   57.279   13.461  240.206   21.570  262.740   34.289 -22.53380 40.50898 
1 1 1    6   35   26 o  199.735   22.163   31.812   6.6613   34.284   7.9558   26.014   12.184  206.027   25.794  170.445   45.745 35.58278 52.51567 
1 1 1    6   35   27 o  231.602   16.740   42.000   5.8942   33.954   8.1519   50.814   8.5324  204.501   26.679  252.761   22.282 -48.25975 34.75985 
1 1 1    6   35   28 f   71.585   29.990   1.2079   5.5246  -1.1179   7.6134   3.7947   8.0292   76.037   33.528   90.814   36.902 -14.77753 49.85904 
1 1 1    6   35   29 o  303.491   14.198   71.481   6.5957   81.445   9.4132   61.871   9.2444  321.582   19.212  278.973   21.823 42.60883 29.07491 
1 1 1    6   35   30 o  239.019   20.850   45.402   7.5515   46.634   14.121   44.909   8.9368  230.532   41.546  235.760   25.154 -5.227661 48.56693 
1 1 1    6   35   31 o   63.788   29.523  -4.6950   6.8164 -14.4280   13.566  -1.4078   7.8839   80.923   38.707   76.288   33.854 4.635605 51.42299 
1 1 1    6   35   32 f  502.759   11.160  195.378   8.5884  192.234   12.229  198.437   12.064  496.049   16.107  504.289   15.629 -8.239838 22.44349 
1 1 1    6   35   33 o  231.859   18.588   42.595   6.5411   50.212   9.4682   35.640   9.0472  248.435   25.250  206.736   29.421 41.69870 38.77063 
1 1 1    6   35   34 o  231.497   21.062   42.965   7.3814   48.818   11.930   39.335   9.3959  239.093   33.520  217.129   28.996 21.96388 44.32109 
1 1 1    6   35   35 o  133.160   33.159   15.543   6.7325   22.437   10.956   11.360   8.5338  154.298   44.154  114.931   39.798 39.36686 59.44301 
1 1 1    6   35   36 o   62.203   28.360  -2.7673   5.9717   0.1105   8.5840  -5.4662   8.3130   81.427   35.763   69.283   32.250 12.14387 48.15678 
1 1 1    6   35   37 o  103.212   35.225   9.0500   6.6772   10.401   8.8493   7.2639   10.175  110.788   40.303  103.674   41.747 7.114319 58.02764 
1 1 1    6   35   38 o  209.534   22.817   35.969   7.1995   37.590   9.2217   33.439   11.521  209.824   29.531  188.970   41.011 20.85365 50.53650 
1 1 1    6   35   39 o  159.456   26.842   21.647   6.3185   21.456   9.1290   21.822   8.7541  150.626   39.213  153.077   37.628 -2.450760 54.34637 
1 1 1    6   35   40 o  316.604   14.573   78.981   7.0623   69.233   9.9706   88.796   10.005  289.904   22.650  331.188   19.827 -41.28455 30.10184 
1 1 1    6   35   41 o  122.742   31.893   13.767   6.0464   7.8065   8.6913   19.356   8.4171   98.845   38.984  141.549   38.036 -42.70412 54.46526 
1 1 1    6   35   42 o   85.038   34.343   4.8403   6.9077  -4.0458   8.8887   18.390   10.976   71.794   33.395  131.417   45.156 -59.62299 56.16330 
1 1 1    6   35   43 o  109.088   39.866   11.536   8.6726   11.536   8.6726   0.0000   0.0000  109.088   39.866  ?   ?  0.000000 39.86618 
1 1 1    6   36    0 o  278.297   21.744   60.912   9.1322   60.912   9.1322   60.912   9.1322  278.297   21.744  278.297   21.744 0.000000 0.000000 
1 1 1    6   36    1 o  192.444   19.966   29.101   5.7956   24.988   8.0977   33.421   8.2985  174.814   31.418  204.252   27.222 -29.43771 41.57059 
1 1 1    6   36    2 o  168.217   19.466   22.273   4.9194   18.562   5.9979   29.901   8.5990  151.431   26.860  192.001   30.262 -40.57024 40.46328 
1 1 1    6   36    3 o  396.670   11.115  121.037   6.7488  120.220   8.3856  122.539   11.371  394.767   13.878  397.273   18.699 -2.506500 23.28634 
1 1 1    6   36    4 o  324.156   11.958   80.897   5.9330   81.172   7.4036   80.403   9.9186  324.171   14.921  320.768   20.306 3.402863 25.19901 
1 1 1    6   36    5 o  257.996   17.042   51.780   6.6919   66.361   10.437   41.599   8.7206  290.154   23.707  228.790   25.327 61.36378 34.69102 
1 1 1    6   36    6 o  544.895   12.324  228.700   10.279  224.372   14.875  232.654   14.219  537.730   18.073  548.016   16.952 -10.28674 24.77870 
1 1 1    6   36    7 o  254.610   17.365   50.481   6.7270   56.827   10.485   46.041   8.7701  267.498   25.934  241.170   24.080 26.32780 35.38920 
1 1 1    6   36    8 o  257.428   17.835   51.656   6.9841   50.343   10.562   52.677   9.3101  250.831   27.987  258.158   23.830 -7.326660 36.75830 
1 1 1    6   36    9 o  261.774   17.932   53.427   7.1418   50.841   10.113   55.999   10.087  252.577   26.558  265.745   25.095 -13.16821 36.53856 
1 1 1    6   36   10 o  304.646   16.148   72.052   7.5029   79.650   10.921   65.260   10.325  318.250   22.566  287.525   23.672 30.72537 32.70465 
1 1 1    6   36   11 o  453.880   13.328  158.934   9.2589  156.515   13.429  161.126   12.783  448.341   19.568  455.372   18.341 -7.031158 26.81961 
1 1 1    6   36   12 o   94.203   34.121   6.1653   6.3328   15.717   9.2903  -2.1251   8.6551  136.735   41.080   79.904   35.464 56.83163 54.27022 
1 1 1    6   36   13 o  361.395   14.850  100.988   8.2145  104.751   12.022   97.692   11.251  365.396   21.591  353.100   20.910 12.29630 30.05633 
1 1 1    6   36   14 o  272.986   17.861   58.136   7.4219   66.738   10.911   50.728   10.125  290.104   24.811  251.960   26.659 38.14398 36.41864 
1 1 1    6   36   15 o  512.145   19.125  204.326   14.992  204.326   14.992   0.0000   0.0000  512.145   19.125  ?   ?  0.000000 19.12487 
1 1 1    6   36   16 f  188.566   24.244   28.428   6.8354   28.428   6.8354   0.0000   0.0000  188.566   24.244  ?   ?  0.000000 24.24433 
1 1 1    6   36   17 o  779.767   12.708  469.200   15.168  469.200   15.168   0.0000   0.0000  779.767   12.708  ?   ?  0.000000 12.70814 
1 1 1    6   36   18 o  573.446   10.582  253.145   9.2878  253.326   11.435  252.795   15.922  572.782   13.043  569.768   18.257 3.013550 22.43740 
1 1 1    6   36   19 o  230.992   17.028   41.687   5.9780   39.707   7.1815   46.154   10.788  224.160   21.182  238.149   30.279 -13.98911 36.95284 
1 1 1    6   36   20 o  341.491   13.416   90.139   7.0123   91.683   8.4771   86.794   12.479  343.651   16.116  330.306   24.866 13.34488 29.63189 
1 1 1    6   36   21 o  430.553   11.757  142.990   7.7481  137.484   9.3331  155.197   13.897  421.334   14.472  445.067   20.400 -23.73251 25.01239 
1 1 1    6   36   22 o  270.298   15.931   56.935   6.5620   60.878   7.9791   48.696   11.534  278.562   18.824  243.499   31.699 35.06317 36.86679 
1 1 1    6   36   23 o  118.851   32.354   11.884   6.0436   13.233   7.1610   8.5429   11.267  124.897   35.681  114.534   44.618 10.36280 57.13077 
1 1 1    6   36   24 o   70.168   29.114   1.3767   5.1349   4.7365   7.0631  -2.3897   7.4784   90.468   35.303   72.643   32.554 17.82507 48.02163 
1 1 1    6   36   25 o  463.811   10.885  165.900   7.7273  173.676   10.981  158.272   10.876  472.860   15.172  451.146   15.750 21.71402 21.86870 
1 1 1    6   36   26 o  622.159   9.8672  298.174   9.3965  312.354   13.252  283.834   13.326  634.909   13.636  604.804   14.395 30.10553 19.82825 
1 1 1    6   36   27 o  349.164   12.669   94.344   6.7710   97.134   9.5216   91.490   9.6305  352.019   17.728  341.251   18.507 10.76779 25.62808 
1 1 1    6   36   28 o  210.191   22.854   35.447   7.2342   42.239   13.805   32.875   8.4937  218.294   42.847  199.799   28.589 18.49574 51.50876 
1 1 1    6   36   29 o  363.039   15.348  102.669   8.5286  112.280   15.866   98.764   10.114  371.168   28.137  354.099   18.727 17.06876 33.79974 
1 1 1    6   36   30 o  158.483   26.311   20.725   6.1586   17.111   8.8448   24.125   8.5802  138.762   39.660  167.263   34.653 -28.50124 52.66647 
1 1 1    6   36   31 o  235.746   18.246   43.963   6.5325   47.522   9.1348   40.237   9.3456  241.799   25.045  220.526   28.343 21.27226 37.82293 
1 1 1    6   36   32 o  147.604   31.987   18.763   7.0182   17.327   11.482   19.620   8.8675  137.448   46.195  147.774   38.733 -10.32552 60.28489 
1 1 1    6   36   33 o  136.899   33.105   16.389   6.8607   22.202   10.869   12.539   8.8454  153.796   43.968  119.607   40.544 34.18884 59.80815 
1 1 1    6   36   34 o   41.601   20.906 -16.8318   5.9182 -13.6108   8.4712 -19.9026   8.2715   58.776   28.695   51.574   25.740 7.202080 38.54784 
1 1 1    6   36   35 o  151.572   28.642   19.596   6.4014   26.362   8.9706   12.576   9.1375  172.290   35.206  118.812   41.179 53.47887 54.17711 
1 1 1    6   36   36 o  106.368   35.377   9.8390   6.7354   2.8951   8.5886   20.931   10.855   87.536   37.070  146.862   44.468 -59.32580 57.89294 
1 1 1    6   36   37 o  110.091   33.200   10.799   6.0596   8.8930   8.7276   12.572   8.4199  104.540   39.639  117.170   39.558 -12.62963 56.00114 
1 1 1    6   36   38 o   81.569   32.106   4.3381   5.8839   5.3158   8.5411   3.4550   8.1173   92.510   37.879   86.184   36.242 6.326111 52.42420 
1 1 1    6   36   39 o  166.751   25.198   23.606   6.2309   23.192   9.2171   23.954   8.4557  155.179   38.884  160.753   35.329 -5.573471 52.53685 
1 1 1    6   36   40 o  113.413   32.471   11.861   5.9239   16.787   8.7894   7.7600   8.0188  129.860   40.147   97.229   37.706 32.63126 55.07759 
1 1 1    6   36   41 o  168.339   30.300   25.434   7.5201   36.477   9.5316   7.2272   12.239  200.464   32.151  102.055   43.765 98.40894 54.30495 
1 1 1    6   37    0 o  542.345   16.846  227.196   13.954  227.196   13.954  227.196   13.954  542.345   16.846  542.345   16.846 0.000000 0.000000 
1 1 1    6   37    1 o  472.972   12.498  172.411   9.0475  177.879   13.105  167.432   12.506  478.657   17.887  464.497   17.590 14.15942 25.08730 
1 1 1    6   37    2 o  268.647   14.003   55.871   5.7381   54.184   7.1183   59.001   9.6967  263.639   17.743  273.363   23.400 -9.723724 29.36651 
1 1 1    6   37    3 o  543.594   10.136  227.201   8.4332  230.848   10.652  221.078   13.804  547.209   12.718  534.020   16.887 13.18878 21.14083 
1 1 1    6   37    4 o  296.950   13.255   68.026   6.0244   65.080   7.4508   73.589   10.238  289.255   16.902  305.987   22.007 -16.73166 27.74916 
1 1 1    6   37    5 o  307.897   15.707   73.557   7.3779   73.599   10.971   73.523   9.9686  305.367   23.657  306.045   21.415 -0.6782532 31.91058 
1 1 1    6   37    6 o  285.831   16.904   63.564   7.3628   60.234   10.772   66.483   10.086  275.215   25.876  290.410   22.876 -15.19473 34.53842 
1 1 1    6   37    7 o  373.150   14.311  107.581   8.1738  102.210   12.316  111.810   10.927  360.596   22.424  379.103   18.832 -18.50650 29.28287 
1 1 1    6   37    8 o  581.084   12.651  260.366   11.252  261.266   16.431  259.572   15.442  579.610   18.520  578.246   17.447 1.363831 25.44417 
1 1 1    6   37    9 o  259.626   18.306   52.660   7.2279   53.618   10.638   51.839   9.8511  258.850   27.259  255.145   25.569 3.705276 37.37437 
1 1 1    6   37   10 o  521.118   13.009  209.541   10.377  210.820   15.014  208.373   14.358  520.376   18.850  517.681   18.120 2.694824 26.14642 
1 1 1    6   37   11 o  290.747   17.037   65.839   7.5490   75.170   11.541   58.860   9.9803  307.889   24.696  272.431   24.186 35.45844 34.56680 
1 1 1    6   37   12 o  309.649   24.360   75.989   11.452   75.989   11.452   0.0000   0.0000  309.649   24.360  ?   ?  0.000000 24.35977 
1 1 1    6   37   13 o  333.411   23.258   87.810   11.795   87.810   11.795   0.0000   0.0000  333.411   23.258  ?   ?  0.000000 23.25797 
1 1 1    6   37   14 o  196.795   35.259   32.319   10.231   32.319   10.231   0.0000   0.0000  196.795   35.259  ?   ?  0.000000 35.25854 
1 1 1    6   37   15 o  437.762   13.659  148.113   9.1521  144.939   13.427  150.868   12.508  430.467   20.379  439.988   18.572 -9.521088 27.57232 
1 1 1    6   37   16 o  118.872   33.119   11.815   6.2503   13.440   9.4876   10.569   8.3079  127.486   41.967  115.380   39.292 12.10595 57.49048 
1 1 1    6   37   17 o   79.570   31.026   3.4280   5.4517   4.2885   6.8607   1.9538   8.9800   88.561   34.729   90.291   38.052 -1.730476 51.51760 
1 1 1    6   37   18 o  301.301   14.401   70.296   6.6415   71.124   8.2482   68.770   11.200  301.595   17.949  293.563   25.168 8.031952 30.91286 
1 1 1    6   37   19 o  278.074   15.213   60.149   6.4505   59.988   7.9107   60.469   11.143  276.530   18.801  274.213   26.895 2.316772 32.81554 
1 1 1    6   37   20 o  433.956   12.328  145.440   8.1888  148.973   10.093  138.633   14.009  438.224   15.047  419.076   21.915 19.14822 26.58351 
1 1 1    6   37   21 o  280.583   15.721   61.355   6.7246   58.632   8.1277   67.265   11.973  272.911   19.587  288.703   27.423 -15.79129 33.69998 
1 1 1    6   37   22 o  345.101   13.948   92.273   7.3675   98.121   8.9295   79.801   13.039  355.029   16.432  314.492   27.361 40.53696 31.91590 
1 1 1    6   37   23 o  311.261   15.735   75.532   7.4721   69.145   8.8366   91.556   13.997  296.275   19.597  336.746   27.394 -40.47107 33.68135 
1 1 1    6   37   24 o  118.812   38.388   11.850   7.9553   0.0000   0.0000   11.850   7.9553  ?   ?   118.812   38.388 0.000000 38.38833 
1 1 1    6   37   25 f  354.990   12.437   97.484   6.7576   98.893   9.4831   96.030   9.6319  355.726   17.417  349.841   18.049 5.885132 25.08209 
1 1 1    6   37   26 o  223.498   21.243   39.803   7.1797   38.983   13.521   40.125   8.4730  208.804   43.708  222.603   25.318 -13.79826 50.51110 
1 1 1    6   37   27 o  170.530   27.650   24.039   6.9701   24.310   13.426   23.939   8.1551  161.153   49.585  167.721   32.942 -6.567383 59.53065 
1 1 1    6   37   28 o  397.340   12.574  122.354   7.6475  124.237   10.899  120.529   10.733  397.844   17.898  391.865   17.894 5.978668 25.30931 
1 1 1    6   37   29 o  111.099   34.188   10.543   6.3824   10.899   10.101   10.307   8.2346  116.474   42.954  111.780   39.072 4.693558 58.06597 
1 1 1    6   37   30 o  190.128   24.612   29.553   6.9943   34.804   11.530   26.496   8.7978  197.537   39.515  174.976   34.075 22.56104 52.17775 
1 1 1    6   37   31 o  242.599   18.464   46.740   6.8049   43.619   9.8086   49.637   9.4486  228.632   28.658  246.149   25.446 -17.51759 38.32455 
1 1 1    6   37   32 o  377.977   13.503  111.336   7.8119  125.261   11.089   97.618   11.007  398.009   18.203  349.200   20.685 48.80856 27.55360 
1 1 1    6   37   33 o  187.966   23.191   28.917   6.5307   33.127   9.0303   24.301   9.4561  196.657   31.029  163.268   38.471 33.38841 49.42441 
1 1 1    6   37   34 o  214.127   23.180   37.532   7.4760   32.149   9.4077   46.757   12.316  191.683   33.271  229.348   36.290 -37.66463 49.23367 
1 1 1    6   37   35 o  166.277   26.418   23.338   6.4987   22.319   9.4196   24.263   8.9776  154.042   39.701  162.844   36.875 -8.802612 54.18396 
1 1 1    6   37   36 o  120.066   32.937   13.034   6.2352   16.778   9.0483   9.6479   8.6044  132.023   40.720  106.181   39.548 25.84177 56.76436 
1 1 1    6   37   37 o   79.345   32.061   3.6639   6.0236   1.7450   8.4877   5.6111   8.5500   82.735   35.965   92.861   37.946 -10.12621 52.28171 
1 1 1    6   37   38 o   76.593   31.330   3.1741   5.8358   8.2992   8.7534  -0.9263   7.8296  100.414   39.269   73.772   33.166 26.64278 51.40057 
1 1 1    6   37   39 o   94.390   33.388   7.8000   6.0256  -3.0722   8.9353   16.868   8.1603   73.691   34.000  131.002   38.287 -57.31081 51.20443 
1 1 1    6   38    0 o  139.357   47.950   20.009   9.2018   20.009   9.2018   20.009   9.2018  139.357   47.950  139.357   47.950 0.000000 0.000000 
1 1 1    6   38    1 o  401.008   13.565  124.186   8.3262  130.539   11.775  117.833   11.775  409.449   18.788  388.137   19.887 21.31174 27.35864 
1 1 1    6   38    2 o   92.138   30.951   6.4879   5.1543   10.817   6.3468  -1.8983   8.8335  114.491   33.853   81.071   35.913 33.41991 49.35330 
1 1 1    6   38    3 f  225.501   15.974   39.598   5.4780   35.448   6.6645   48.244   9.6183  212.002   20.806  245.774   25.961 -33.77223 33.26922 
1 1 1    6   38    4 o  165.146   20.807   21.634   5.1428   24.123   6.3890   17.054   8.6675  173.324   24.789  141.637   38.824 31.68605 46.06297 
1 1 1    6   38    5 o  369.595   14.682  105.671   8.3056  107.010   11.840  104.374   11.654  369.302   21.033  364.742   20.963 4.559631 29.69564 
1 1 1    6   38    6 o  229.133   20.601   41.347   7.1478   34.776   10.345   47.350   9.8873  204.941   34.184  242.968   27.045 -38.02667 43.58893 
1 1 1    6   38    7 f  118.721   41.985   10.823   9.5276   10.823   9.5276   0.0000   0.0000  118.721   41.985  ?   ?  0.000000 41.98470 
1 1 1    6   38    8 o  272.239   26.197   59.199   10.782   59.199   10.782   0.0000   0.0000  272.239   26.197  ?   ?  0.000000 26.19723 
1 1 1    6   38    9 o  232.830   30.942   44.187   10.754   44.187   10.754   0.0000   0.0000  232.830   30.942  ?   ?  0.000000 30.94200 
1 1 1    6   38   10 o  511.706   19.039  204.232   14.912  204.232   14.912   0.0000   0.0000  511.706   19.039  ?   ?  0.000000 19.03910 
1 1 1    6   38   11 o  218.640   21.778   37.855   7.1910   29.590   10.059   46.493   10.284  187.447   36.372  239.813   28.580 -52.36537 46.25698 
1 1 1    6   38   12 o  364.154   15.479  102.812   8.6277  106.257   12.810   99.951   11.672  366.739   22.935  356.328   21.502 10.41156 31.43791 
1 1 1    6   38   13 o   74.622   31.390   1.0863   6.0924  -1.2329   9.4340   2.7454   7.9793   84.877   37.380   88.289   36.434 -3.412064 52.19862 
1 1 1    6   38   14 o  261.512   19.039   53.672   7.5686   53.787   11.046   53.571   10.392  257.938   28.451  258.234   26.675 -0.2957764 38.99985 
1 1 1    6   38   15 o  341.270   16.099   90.466   8.4095   94.050   12.159   87.180   11.643  344.544   23.192  331.724   23.075 12.82010 32.71544 
1 1 1    6   38   16 o  239.327   20.550   45.231   7.4547   39.265   10.732   50.794   10.363  217.500   33.295  250.819   27.441 -33.31902 43.14608 
1 1 1    6   38   17 o  395.491   15.159  121.367   9.1765  111.715   13.569  129.503   12.458  375.047   23.759  406.465   20.024 -31.41827 31.07141 
1 1 1    6   38   18 o  639.272   10.911  315.061   10.676  308.132   13.073  328.935   18.500  630.963   13.537  648.673   18.633 -17.71027 23.03078 
1 1 1    6   38   19 o  291.671   15.293   66.243   6.8037   72.004   8.4579   55.679   11.453  303.011   18.322  261.459   29.112 41.55206 34.39818 
1 1 1    6   38   20 o  365.932   13.391  103.674   7.5006   95.261   8.9593  123.386   13.714  349.638   16.741  394.318   22.819 -44.67917 28.30188 
1 1 1    6   38   21 o  133.966   31.120   15.144   6.2593   17.667   7.5098   9.4050   11.328  143.680   34.568  116.343   44.901 27.33659 56.66607 
1 1 1    6   38   22 o  348.634   14.127   94.296   7.5387  101.457   9.2728   80.337   12.947  360.621   16.799  315.153   27.104 45.46808 31.88762 
1 1 1    6   38   23 o   89.554   34.189   5.1457   6.5204   4.9404   7.7965   5.6234   11.894   93.204   36.871  107.669   44.461 -14.46486 57.76018 
1 1 1    6   38   24 o  328.323   20.754   85.442   10.376   88.704   14.853   82.333   14.502  328.656   29.851  316.206   30.335 12.44983 42.55972 
1 1 1    6   38   25 o   81.263   31.476   3.9377   5.5827  -3.8307   7.7713   12.221   8.0249   70.586   32.248  119.528   38.549 -48.94180 50.25894 
1 1 1    6   38   26 o   91.639   32.281   6.4341   5.6271   6.2794   7.9068   6.5929   8.0100   97.225   37.516   98.544   37.829 -1.319160 53.27711 
1 1 1    6   38   27 o  166.375   27.108   22.976   6.6655   30.832   10.928   18.321   8.4111  186.016   39.597  143.570   37.768 42.44556 54.72082 
1 1 1    6   38   28 o  202.711   22.813   33.273   6.9552   33.844   11.455   32.939   8.7532  194.359   39.845  198.017   29.804 -3.658401 49.75803 
1 1 1    6   38   29 o  228.107   19.386   41.514   6.7046   44.186   9.6068   38.976   9.3613  230.648   27.770  215.651   29.104 14.99715 40.22725 
1 1 1    6   38   30 o   84.564   32.905   4.5317   6.1223  -1.1878   8.7844   9.9343   8.5375   79.655   35.518  109.587   39.630 -29.93228 53.21693 
1 1 1    6   38   31 o  264.815   16.706   55.431   6.7366   60.384   9.6010   50.628   9.4546  272.486   23.242  248.049   25.254 24.43686 34.32175 
1 1 1    6   38   32 f  109.173   35.950   10.433   6.9617   13.062   9.0505   6.6239   10.895  120.146   41.010  103.560   42.635 16.58565 59.15759 
1 1 1    6   38   33 o   88.437   33.117   5.8367   6.0493   2.0579   8.2371   10.261   8.9128   83.834   35.926  109.542   40.356 -25.70792 54.03082 
1 1 1    6   38   34 o  308.692   14.667   74.951   6.9299   76.673   10.050   73.391   9.5682  306.853   21.534  300.693   20.919 6.160950 30.02258 
1 1 1    6   38   35 o  245.939   17.395   48.444   6.5060   46.139   9.4096   50.555   9.0053  233.053   26.871  246.297   24.200 -13.24413 36.16166 
1 1 1    6   38   36 o   96.914   33.327   8.2393   5.9795  -8.4959   8.7501   22.902   8.1903   65.059   31.110  157.151   34.953 -92.09218 46.79234 
1 1 1    6   38   37 o  178.699   26.675   27.553   7.0728   26.237   9.1954   29.458   11.068  165.839   37.148  170.608   42.531 -4.768127 56.47036 
1 1 1    6   38   38 o  104.830   36.041   10.253   6.9926   22.775   9.3096  -5.9566   10.592  151.075   39.730   75.216   35.454 75.85938 53.24889 
1 1 1    6   39    1 o  193.913   33.536   31.218   9.5936   31.218   9.5936   0.0000   0.0000  193.913   33.536  ?   ?  0.000000 33.53608 
1 1 1    6   39    2 o  466.144   19.764  169.785   14.101  169.785   14.101   0.0000   0.0000  466.144   19.764  ?   ?  0.000000 19.76354 
1 1 1    6   39    3 o  464.129   14.034  166.610   9.9696  166.610   9.9696   0.0000   0.0000  464.129   14.034  ?   ?  0.000000 14.03356 
1 1 1    6   39    4 o  171.180   28.087   23.908   7.1039   23.908   7.1039   0.0000   0.0000  171.180   28.087  ?   ?  0.000000 28.08708 
1 1 1    6   39    5 o  680.555   10.470  356.574   10.906  369.810   13.759  334.206   17.888  691.963   12.991  655.174   17.838 36.78827 22.06690 
1 1 1    6   39    6 o  620.664   12.590  297.380   11.960  311.147   17.630  285.642   16.279  631.889   18.228  605.830   17.556 26.05957 25.30746 
1 1 1    6   39    8 o  400.671   14.669  124.343   8.9961  119.245   12.997  129.033   12.465  388.958   21.920  406.060   20.055 -17.10101 29.71007 
1 1 1    6   39    9 o  344.746   15.791   92.246   8.3324   95.810   12.102   89.034   11.489  348.020   22.846  335.603   22.496 12.41702 32.06299 
1 1 1    6   39   10 o  409.018   15.118  129.718   9.4645  120.186   13.507  138.915   13.266  389.924   22.729  420.938   20.591 -31.01465 30.66888 
1 1 1    6   39   11 o  195.558   25.423   30.816   7.4298   23.463   10.702   37.656   10.323  163.697   42.381  213.285   32.660 -49.58798 53.50559 
1 1 1    6   39   12 o  259.342   20.188   53.012   7.9507   52.018   11.330   53.975   11.160  252.633   29.879  257.962   28.752 -5.329483 41.46666 
1 1 1    6   39   13 o  191.303   25.823   29.587   7.3680   28.602   11.186   30.343   9.7926  181.195   41.256  189.812   34.995 -8.616257 54.09932 
1 1 1    6   39   14 o  399.967   15.586  124.254   9.5417  114.445   13.575  133.833   13.415  379.688   23.473  411.953   21.348 -32.26538 31.72887 
1 1 1    6   39   15 o  236.110   22.926   44.435   8.1808   52.714   12.216   37.703   11.016  252.684   32.325  211.701   35.234 40.98375 47.81590 
1 1 1    6   39   16 o  287.209   19.353   64.910   8.4580   73.834   12.551   57.486   11.448  302.367   27.418  265.937   28.572 36.43011 39.59885 
1 1 1    6   39   17 o  346.438   17.697   93.958   9.3531   97.504   14.137   91.198   12.473  348.021   26.744  337.993   24.271 10.02786 36.11571 
1 1 1    6   39   18 o  192.092   29.160   30.386   8.3041   28.084   12.341   32.291   11.226  176.565   45.409  192.974   39.339 -16.40927 60.07924 
1 1 1    6   39   19 o  135.085   31.513   15.452   6.3964   13.865   7.8853   18.503   10.938  126.926   37.781  144.281   44.815 -17.35495 58.61563 
1 1 1    6   39   20 o  341.030   14.223   90.291   7.4241   90.083   8.9974   90.737   13.141  339.027   17.397  335.618   25.779 3.409271 31.09982 
1 1 1    6   39   22 o  253.645   24.682   51.942   9.4611   33.938   13.147   71.283   13.626  192.855   45.306  293.475   30.793 -100.6209 54.78016 
1 1 1    6   39   23 o  476.875   13.127  176.437   9.5819  157.842   11.401  221.172   17.683  449.233   16.580  527.567   21.898 -78.33453 27.46702 
1 1 1    6   39   24 o  271.192   21.408   58.757   8.8140   45.091   11.155   81.467   14.380  231.156   32.419  313.291   30.369 -82.13474 44.42204 
1 1 1    6   39   25 o  120.467   39.534   12.634   8.4217   22.098   10.495  -4.4799   14.113  155.033   42.815   94.474   43.272 60.55869 60.87349 
1 1 1    6   39   26 o  357.880   13.369   99.638   7.3234  105.771   10.437   93.691   10.278  365.459   18.722  343.322   19.641 22.13675 27.13387 
1 1 1    6   39   27 o  220.390   19.178   38.745   6.4050   44.591   9.0734   32.938   9.0429  232.832   25.899  196.797   31.050 36.03503 40.43332 
1 1 1    6   39   28 o   87.915   32.989   5.5111   6.0088   4.4258   8.5902   6.5510   8.4083   92.416   37.931   98.118   38.455 -5.701691 54.01410 
1 1 1    6   39   29 o  280.147   16.614   61.999   7.0923   68.267   9.9047   55.404   10.160  290.349   22.462  259.029   25.976 31.32007 34.34063 
1 1 1    6   39   30 o  106.028   36.012   9.6862   6.9785  -0.3304   8.7503   27.190   11.567   80.725   35.752  167.842   44.357 -87.11665 56.97121 
1 1 1    6   39   31 o   93.413   33.695   7.0175   6.1661   8.7261   8.4664   5.0875   8.9984  103.749   39.113   94.074   38.741 9.674904 55.05169 
1 1 1    6   39   32 o   87.923   32.757   5.9148   5.9040   17.169   8.5604  -4.2953   8.1536  134.447   39.192   69.583   32.235 64.86390 50.74573 
1 1 1    6   39   33 o  173.770   23.765   25.249   6.1552   26.049   9.1557   24.589   8.3144  167.320   36.755  164.454   34.148 2.866364 50.16938 
1 1 1    6   39   34 f  145.160   28.571   18.488   6.1220   17.510   8.9858   19.335   8.3633  133.298   40.481  142.050   37.801 -8.751709 55.38572 
1 1 1    6   39   35 o   95.621   34.981   7.8342   6.6798  -5.4953   8.6137   27.943   10.580   68.632   32.232  167.330   41.508 -98.69720 52.55352 
1 1 1    6   40    0 o  138.491   49.363   20.235   9.5439   20.235   9.5439   20.235   9.5439  138.491   49.363  138.491   49.363 0.000000 0.000000 
1 1 1    6   40    1 o  325.345   13.285   81.845   6.6156   72.235   8.1490  100.422   11.330  304.002   17.588  357.177   20.815 -53.17413 27.25047 
1 1 1    6   40    2 o  224.762   16.990   39.528   5.8017   34.427   7.1891   49.053   9.8245  207.751   22.993  246.947   26.401 -39.19534 35.01003 
1 1 1    6   40    3 o  189.367   19.821   28.360   5.6600   33.292   7.3027   20.941   8.9573  203.943   23.844  156.098   37.875 47.84502 44.75555 
1 1 1    6   40    4 o  281.710   14.686   61.669   6.3104   60.488   7.7790   63.942   10.792  277.799   18.399  282.805   25.194 -5.005585 31.19699 
1 1 1    6   40    5 o  352.550   12.878   96.059   6.9491   90.649   8.5308  106.727   11.980  341.471   16.322  367.913   21.366 -26.44244 26.88717 
1 1 1    6   40    6 f  370.195   15.720  106.431   8.9074   95.528   12.882  116.421   12.330  346.393   24.453  384.448   21.034 -38.05515 32.25484 
1 1 1    6   40    7 o  241.011   20.852   45.931   7.6165   55.641   11.274   37.778   10.330  261.942   28.584  213.449   32.658 48.49272 43.39988 
1 1 1    6   40    8 o  502.688   14.035  195.713   10.799  191.432   15.536  199.714   15.020  493.817   20.555  505.062   19.429 -11.24493 28.28406 
1 1 1    6   40    9 o  426.922   15.217  141.479   9.9436  134.398   13.948  148.797   14.180  412.310   22.183  434.899   21.301 -22.58887 30.75443 
1 1 1    6   40   10 o  593.293   13.859  272.619   12.585  268.418   17.825  276.795   17.771  585.030   19.906  594.354   19.535 -9.323486 27.89020 
1 1 1    6   40   11 o  236.579   22.448   44.554   8.0315   37.383   11.296   51.886   11.422  210.052   36.455  251.712   30.252 -41.66000 47.37241 
1 1 1    6   40   12 o  275.966   20.092   60.084   8.4284   62.022   12.184   58.305   11.672  275.886   29.301  267.601   28.958 8.285492 41.19592 
1 1 1    6   40   13 o  264.426   21.219   55.403   8.5159   53.768   12.176   56.968   11.915  255.166   31.870  263.777   30.047 -8.611313 43.80097 
1 1 1    6   40   14 o   95.543   36.116   6.0984   7.2310   1.5670   10.433   10.287   10.031   94.187   40.400  116.272   42.816 -22.08505 58.86744 
1 1 1    6   40   15 o  198.967   26.646   32.241   7.9112   43.397   12.185   24.112   10.402  225.954   36.475  165.120   41.269 60.83459 55.07800 
1 1 1    6   40   16 o  336.317   17.721   88.705   9.0902   86.549   13.316   90.587   12.440  327.173   26.827  336.340   24.327 -9.166962 36.21467 
1 1 1    6   40   17 f  299.025   19.311   70.542   8.7912   66.785   13.082   73.636   11.871  284.697   30.496  301.983   25.934 -17.28699 40.03233 
1 1 1    6   40   18 o  118.060   38.820   11.772   8.1188   33.533   12.582  -3.7533   10.627  193.099   43.602   83.949   38.103 109.1499 57.90465 
1 1 1    6   40   19 o  336.267   19.007   89.209   9.7429   79.923   13.694   98.728   13.865  312.108   28.997  349.263   26.124 -37.15509 39.02935 
1 1 1    6   40   20 o  227.193   24.960   41.888   8.5368   34.409   10.888   53.825   13.755  199.046   37.101  249.992   37.070 -50.94656 52.44678 
1 1 1    6   40   21 o  225.859   25.618   41.600   8.6998   43.340   11.193   38.945   13.827  226.003   33.360  205.991   45.103 20.01151 56.09953 
1 1 1    6   40   22 o  141.469   36.715   17.716   8.0193   32.997   10.403  -4.6634   12.589  194.591   36.261   89.096   40.831 105.4951 54.60783 
1 1 1    6   40   23 o  188.094   26.143   29.195   7.3230   26.715   8.4824   36.451   14.511  176.383   32.620  194.794   48.777 -18.41110 58.67989 
1 1 1    6   40   24 o  489.836   13.372  186.725   10.026  177.235   11.726  212.514   19.330  475.447   16.113  512.485   24.642 -37.03745 29.44285 
1 1 1    6   40   25 o  165.321   31.329   23.479   7.6375   30.063   9.1520   8.3735   13.862  186.351   33.308  115.230   47.825 71.12083 58.28071 
1 1 1    6   40   26 o  104.789   37.136   9.0732   7.4576   9.8605   9.0088   7.3589   13.294  109.858   40.556  111.454   46.594 -1.596176 61.77160 
1 1 1    6   40   27 o  332.305   14.573   86.433   7.4122   94.337   10.648   79.002   10.325  343.027   20.371  312.865   21.694 30.16168 29.75924 
1 1 1    6   40   28 o  128.480   35.015   14.906   7.0741   12.397   8.8416   19.369   11.792  117.338   40.516  140.370   46.816 -23.03183 61.91357 
1 1 1    6   40   29 o   74.761   31.401   1.9606   6.0814   3.6830   8.6135   0.2486   8.5874   89.061   37.387   80.735   35.604 8.325790 51.62723 
1 1 1    6   40   30 o  215.015   19.940   37.483   6.4878   41.929   9.1780   33.043   9.1724  222.092   27.594  193.596   32.077 28.49585 42.31239 
1 1 1    6   40   31 o   80.111   32.093   3.8940   5.9793   13.206   8.5580  -4.9868   8.3576  118.106   39.881   68.962   32.180 49.14469 51.24470 
1 1 1    6   40   32 o   94.133   32.860   7.6155   5.8235   7.5350   8.5590   7.6848   7.9465   98.164   38.695   97.550   37.618 0.6141434 53.96733 
1 1 1    6   40   33 o  220.450   21.948   40.240   7.3074   37.937   9.0848   44.460   12.299  208.100   29.336  216.260   38.570 -8.160446 48.45822 
1 1 1    6   41    0 o   86.885   49.097   8.6144   10.017   8.6144   10.017   8.6144   10.017   86.885   49.097   86.885   49.097 0.000000 0.000000 
1 1 1    6   41    1 o  586.866   11.006  265.607   9.8864  267.033   12.120  262.772   17.092  587.320   13.482  579.179   19.280 8.141846 23.52597 
1 1 1    6   41    2 o  348.823   13.382   94.181   7.1451   86.681   8.5105  112.092   13.152  333.614   16.666  375.827   22.974 -42.21301 28.38238 
1 1 1    6   41    3 o  529.755   11.074  216.458   8.9794  213.524   10.976  222.396   15.615  525.093   13.656  532.878   19.144 -7.784485 23.51567 
1 1 1    6   41    4 o  116.105   30.873   11.332   5.5814   10.991   6.7980   12.037   9.7766  114.615   35.286  121.861   42.574 -7.246208 55.29655 
1 1 1    6   41    5 o  352.471   13.452   96.192   7.2572  105.434   9.2149   81.100   11.776  367.996   16.360  318.664   24.328 49.33191 29.31687 
1 1 1    6   41    6 o  283.438   19.795   63.337   8.5341   42.220   11.800   86.492   12.357  223.690   35.662  328.858   24.730 -105.1677 43.39803 
1 1 1    6   41    7 o  418.160   15.077  135.830   9.6502  135.339   13.955  136.280   13.359  413.355   22.137  415.446   21.078 -2.091309 30.56663 
1 1 1    6   41    8 o  201.373   25.755   32.858   7.7566   39.595   11.445   27.134   10.549  216.203   35.839  176.151   40.034 40.05263 53.73215 
1 1 1    6   41    9 o  402.408   16.207  126.141   9.9824  111.245   14.221  140.609   14.016  372.646   25.078  421.373   21.806 -48.72653 33.23273 
1 1 1    6   41   10 o  196.575   26.565   31.480   7.7883   43.049   11.520   21.741   10.570  226.218   34.351  156.105   42.908 70.11244 54.96384 
1 1 1    6   41   11 f  211.015   25.313   36.039   8.0126   39.764   12.001   33.044   10.763  215.111   37.832  196.022   37.232 19.08838 53.07963 
1 1 1    6   41   12 o  278.412   20.073   61.317   8.4964   53.091   12.323   68.770   11.730  252.328   32.674  291.466   26.586 -39.13821 42.12425 
1 1 1    6   41   13 o  109.889   37.403   9.8360   7.5281   7.5641   11.010   11.830   10.316  109.947   43.714  120.953   43.589 -11.00584 61.73294 
1 1 1    6   41   14 o  201.382   27.471   33.281   8.2467   40.253   12.244   27.491   11.157  215.365   38.559  175.203   42.122 40.16180 57.10615 
1 1 1    6   41   15 o  117.466   43.979   10.663   10.667   0.0000   0.0000   10.663   10.667  ?   ?   117.466   43.979 0.000000 43.97866 
1 1 1    6   41   16 o  203.209   37.913   35.980   11.359   0.0000   0.0000   35.980   11.359  ?   ?   203.209   37.913 0.000000 37.91323 
1 1 1    6   41   17 f  324.725   28.531   86.596   14.037   0.0000   0.0000   86.596   14.037  ?   ?   324.725   28.531 0.000000 28.53133 
1 1 1    6   41   18 o  240.277   35.544   49.608   12.678   0.0000   0.0000   49.608   12.678  ?   ?   240.277   35.544 0.000000 35.54425 
1 1 1    6   41   19 o  226.790   27.231   42.406   9.2636   51.453   13.503   34.362   12.733  242.833   37.539  193.101   44.053 49.73141 57.87786 
1 1 1    6   41   20 o  127.988   40.507   14.658   8.8927   25.995   12.613   3.4531   12.540  164.921   47.428  102.747   44.187 62.17355 64.82231 
1 1 1    6   41   21 o  335.328   16.067   88.141   8.2468   89.610   9.8691   84.742   15.013  335.879   19.277  317.357   31.315 18.52249 36.77279 
1 1 1    6   41   22 o   94.709   35.852   6.4499   7.1322  -6.4269   8.4356   38.729   13.356   68.528   32.092  203.973   44.066 -135.4453 54.51342 
1 1 1    6   41   23 o  104.278   36.688   8.9943   7.2664   2.6542   8.8120   22.465   12.845   88.486   37.515  151.507   48.761 -63.02140 61.52224 
1 1 1    6   41   24 o  116.928   36.879   12.167   7.3759   16.195   8.7270   2.0960   13.800  132.649   39.806  102.143   45.085 30.50683 60.14281 
1 1 1    6   41   25 o   98.168   38.728   6.6950   8.5796   6.6950   8.5796   0.0000   0.0000   98.168   38.728  ?   ?  0.000000 38.72775 
1 1 1    6   41   26 o  110.018   39.384   10.544   8.4084   10.544   8.4084   0.0000   0.0000  110.018   39.384  ?   ?  0.000000 39.38438 
1 1 1    6   41   27 o  333.533   17.133   88.495   8.7173   89.417   10.649   86.624   15.176  332.086   21.060  315.854   31.824 16.23193 38.16180 
1 1 1    6   41   28 o  158.786   26.833   21.551   6.2891   32.246   9.1618   12.021   8.6487  190.626   32.570  114.221   40.036 76.40498 51.61052 
1 1 1    6   41   29 o  233.353   19.134   44.056   6.7740   40.328   9.6355   47.699   9.5251  215.024   30.101  237.027   26.721 -22.00275 40.25040 
1 1 1    6   41   30 o  241.246   21.192   47.765   7.7458   54.899   9.6426   34.785   13.006  255.495   24.976  183.139   46.354 72.35660 52.65485 
1 1 1    6   41   31 o   53.941   26.243 -10.0044   6.9138 -13.3613   8.3890  -2.8959   12.207   57.329   28.108   85.564   39.570 -28.23543 48.53661 
1 1 1    6   42    0 o  240.031   21.791   45.891   7.8544   45.891   7.8544   45.891   7.8544  240.031   21.791  240.031   21.791 0.000000 0.000000 
1 1 1    6   42    1 o  428.060   12.549  141.804   8.2223  139.888   10.175  145.409   13.958  423.841   15.685  429.047   21.254 -5.207001 26.41466 
1 1 1    6   42    2 o   85.546   32.307   4.7701   5.7827   1.3765   6.9743   12.235   10.344   79.179   33.461  122.500   43.701 -43.32123 55.03978 
1 1 1    6   42    3 o  270.912   16.030   57.391   6.6173   60.753   8.1524   50.898   11.330  277.446   19.318  248.295   30.449 29.15109 36.05999 
1 1 1    6   42    4 o  295.314   15.456   68.069   6.9619   64.864   8.5487   74.380   11.996  286.565   19.608  303.439   26.083 -16.87418 32.63075 
1 1 1    6   42    5 o  487.684   11.824  183.870   8.8262  184.852   10.830  181.926   15.230  487.746   14.507  480.117   20.725 7.628967 25.29750 
1 1 1    6   42    6 o  502.322   11.489  194.984   8.8331  191.622   10.798  201.784   15.357  496.712   14.203  506.219   19.820 -9.506226 24.38364 
1 1 1    6   42    7 o  259.919   21.844   53.874   8.6096   59.924   12.747   48.799   11.675  268.571   31.614  241.622   32.383 26.94975 45.25630 
1 1 1    6   42    8 o  161.472   32.368   22.144   7.7214   20.498   11.670   23.425   10.298  149.930   46.245  161.812   41.407 -11.88206 62.07345 
1 1 1    6   42    9 f  227.604   34.367   43.914   11.600   0.0000   0.0000   43.914   11.600  ?   ?   227.604   34.367 0.000000 34.36666 
1 1 1    6   42   10 o  243.497   32.296   49.693   11.740   0.0000   0.0000   49.693   11.740  ?   ?   243.497   32.296 0.000000 32.29628 
1 1 1    6   42   11 o  273.642   29.324   61.768   12.091   0.0000   0.0000   61.768   12.091  ?   ?   273.642   29.324 0.000000 29.32444 
1 1 1    6   42   12 o   78.165   35.978  -5.1500   9.9210   0.0000   0.0000  -5.1500   9.9210  ?   ?    78.165   35.978 0.000000 35.97786 
1 1 1    6   42   13 o  153.812   44.534   21.825   11.086   0.0000   0.0000   21.825   11.086  ?   ?   153.812   44.534 0.000000 44.53350 
1 1 1    6   42   14 o  329.777   19.413   86.197   9.7556   90.634   14.243   82.276   13.390  331.911   28.306  316.438   27.931 15.47296 39.76659 
1 1 1    6   42   15 o  520.719   15.395  211.847   12.270  229.078   17.712  195.949   17.013  536.214   21.581  495.127   22.449 41.08743 31.14012 
1 1 1    6   42   16 o  305.217   20.164   74.193   9.3669   76.017   13.534   72.516   12.977  302.313   29.630  295.673   29.049 6.640106 41.49426 
1 1 1    6   42   17 o  316.838   20.543   80.117   9.9087   80.413   13.884   79.810   14.145  310.781   29.543  308.973   30.300 1.807770 42.31922 
1 1 1    6   42   18 f   78.393   34.989  -1.4245   8.5463   15.567   11.807 -20.1220   12.386  131.261   46.704   69.695   34.167 61.56603 57.86797 
1 1 1    6   42   19 o  145.140   40.193   19.323   9.2346   14.607   12.414   25.167   13.819  128.427   47.568  159.368   50.501 -30.94044 69.37579 
1 1 1    6   42   20 o  274.758   24.050   61.547   10.013   57.081   13.305   67.378   15.204  256.309   34.816  276.872   36.786 -20.56400 50.64971 
1 1 1    6   42   21 o  129.233   41.391   15.431   9.2637   16.066   12.297   14.597   14.087  131.294   47.548  128.470   49.934 2.823578 68.95053 
1 1 1    6   42   22 o  107.224   39.422   9.5628   8.4985   9.5628   8.4985   0.0000   0.0000  107.224   39.422  ?   ?  0.000000 39.42174 
1 1 1    6   42   23 o  148.995   38.552   20.662   8.8591   20.662   8.8591   0.0000   0.0000  148.995   38.552  ?   ?  0.000000 38.55187 
1 1 1    6   42   24 o   68.103   31.142  -2.9387   7.2690   2.3446   8.6706 -15.4350   13.335   85.754   36.807   76.081   36.883 9.672928 52.10682 
1 1 1    6   42   25 o  387.789   15.048  118.491   8.9319  123.375   10.805  107.951   15.872  393.322   17.948  355.169   29.463 38.15286 34.49908 
1 1 1    6   42   26 o  182.941   26.845   28.537   7.2934   32.187   8.8143   20.611   12.988  191.233   31.188  139.708   49.057 51.52495 58.13181 
1 1 1    6   42   27 o  156.261   31.469   21.824   7.2664   19.613   8.5690   27.482   13.710  143.026   38.354  158.141   50.321 -15.11450 63.27135 
1 1 1    6   42   28 o  299.804   18.626   72.553   8.5048   89.436   10.622   42.399   14.196  330.582   21.102  202.506   46.746 128.0760 51.28868 
1 1 1    6   43    0 o  331.438   25.533   87.735   12.776   87.735   12.776   87.735   12.776  331.438   25.533  331.438   25.533 0.000000 0.000000 
1 1 1    6   43    1 o  218.037   23.347   38.371   7.6707   37.063   10.737   39.736   10.963  207.888   34.986  215.798   34.340 -7.910461 49.02244 
1 1 1    6   43    2 o   98.367   36.880   6.9438   7.5070   24.461   10.877  -8.9899   10.374  163.825   42.878   74.284   35.037 89.54135 55.37205 
1 1 1    6   43    3 o  103.004   36.200   8.4439   7.0733   18.729   9.8427  -2.5402   10.172  143.914   42.046   83.761   37.716 60.15337 56.48307 
1 1 1    6   43    4 o  135.078   35.531   15.972   7.4448   19.426   10.640   12.659   10.421  145.778   43.999  122.636   43.851 23.14184 62.11918 
1 1 1    6   43    5 o  184.548   23.154   27.595   6.3963   22.560   8.0267   36.357   10.588  161.857   33.503  205.714   34.871 -43.85733 48.35724 
1 1 1    6   43    6 o  158.567   27.001   20.888   6.3185   20.691   7.9190   21.233   10.482  154.344   34.399  152.254   43.057 2.089828 55.11091 
1 1 1    6   43    7 o  224.163   23.757   40.689   8.0271   47.971   12.681   35.820   10.369  235.602   36.332  204.285   34.383 31.31717 50.02200 
1 1 1    6   43    8 o  196.134   27.945   31.912   8.1522   16.094   12.039   45.307   11.079  134.141   47.221  231.611   32.114 -97.46976 57.10660 
1 1 1    6   43    9 o  258.624   22.815   53.873   8.9388   53.590   13.289   54.107   12.080  249.288   35.860  253.441   31.843 -4.152985 47.95741 
1 1 1    6   43   10 o   71.187   32.299  -2.9473   7.6275  -8.5485   11.423   1.5595   10.246   78.944   37.089   91.824   39.715 -12.88058 54.34032 
1 1 1    6   43   11 o  214.567   25.603   37.740   8.2425   48.423   11.981   28.141   11.357  237.910   33.857  174.858   42.784 63.05203 54.55960 
1 1 1    6   43   12 o  155.965   34.844   21.328   8.1083   35.453   11.794   8.6662   11.166  198.604   40.176  111.237   44.086 87.36685 59.64686 
1 1 1    6   43   13 o  404.544   16.814  128.556   10.411  145.221   15.138  113.598   14.342  424.342   23.397  373.622   25.226 50.72012 34.40644 
1 1 1    6   43   14 o  130.339   38.532   15.290   8.2232   13.289   11.566   17.336   11.694  124.210   45.933  136.595   46.616 -12.38478 65.44370 
1 1 1    6   43   15 f  346.481   18.999   95.394   10.037   98.257   13.989   92.356   14.410  345.612   26.649  333.361   28.516 12.25107 39.03018 
1 1 1    6   43   16 o  207.082   29.889   36.311   9.1996   39.218   12.356   32.696   13.781  207.677   40.324  182.499   48.504 25.17744 63.07656 
1 1 1    6   43   17 o  180.777   34.212   28.723   9.1200   12.640   12.153   49.458   13.799  121.672   46.622  233.365   40.075 -111.6924 61.47834 
1 1 1    6   43   18 o  203.527   31.121   35.622   9.3869   35.519   12.689   35.745   13.951  193.145   43.914  190.002   47.965 3.142395 65.03166 
1 1 1    6   43   19 o   80.278   37.525  -6.4968   11.442  -6.4968   11.442   0.0000   0.0000   80.278   37.525  ?   ?  0.000000 37.52452 
1 1 1    6   43   20 o  129.693   49.010   16.131   13.313   16.131   13.313   0.0000   0.0000  129.693   49.010  ?   ?  0.000000 49.01001 
1 1 1    6   43   21 o  128.687   48.150   16.075   12.783   16.075   12.783   0.0000   0.0000  128.687   48.150  ?   ?  0.000000 48.15010 
1 1 1    6   43   22 o  308.986   21.426   77.743   10.071   70.455   14.040   85.467   14.454  282.814   33.056  314.821   30.372 -32.00638 44.89108 
1 1 1    6   43   23 o   51.586   25.335 -12.1459   6.9070 -12.3420   8.1856 -11.6610   12.870   57.936   28.268   77.743   37.321 -19.80648 46.81831 
1 1 1    6   43   24 o  165.202   29.741   23.942   7.2440   19.927   8.6306   33.515   13.326  144.335   38.396  178.925   47.763 -34.59059 61.28269 
1 1 1    6   43   25 o  115.490   36.136   12.479   7.0966   17.043   8.4837   1.8437   12.951  132.524   39.126   95.616   42.845 36.90817 58.02213 
1 1 1    6   44    0 o   69.790   40.563   5.2294   7.1217   5.2294   7.1217   5.2294   7.1217   69.790   40.563   69.790   40.563 0.000000 0.000000 
1 1 1    6   44    1 o   85.044   32.643   4.7050   5.9640   0.1651   7.2201   14.456   10.582   76.195   33.146  127.614   44.309 -51.41927 55.33499 
1 1 1    6   44    2 o  103.856   32.152   9.1556   5.6352   10.483   6.7924   6.2248   10.093  110.562   35.446  102.300   41.444 8.262466 54.53433 
1 1 1    6   44    3 o  200.353   20.536   32.202   6.2086   26.519   7.6167   43.453   10.718  177.624   29.018  226.409   31.805 -48.78513 43.05306 
1 1 1    6   44    4 o  409.366   12.846  130.212   8.0492  136.504   10.114  119.339   13.294  417.517   15.826  385.273   22.643 32.24457 27.62536 
1 1 1    6   44    5 o  107.144   32.908   9.8367   5.9167   20.229   7.3850  -8.7904   9.8869  152.845   32.564   71.867   33.991 80.97807 47.07189 
1 1 1    6   44    6 o  377.575   13.418  110.961   7.7545  120.648   9.8259   94.963   12.626  392.115   16.372  342.152   24.267 49.96338 29.27330 
1 1 1    6   44    7 o  140.309   28.767   16.736   5.9706   20.309   7.8814   11.924   9.1467  151.896   34.664  117.597   41.175 34.29855 53.82320 
1 1 1    6   44    8 o  174.548   32.471   26.287   8.3560   10.870   12.452   38.917   11.271  118.609   46.699  210.518   36.288 -91.90968 59.14050 
1 1 1    6   44    9 o  357.629   18.043  101.260   9.8450  115.668   14.990   90.332   13.055  375.461   26.250  331.925   25.901 43.53607 36.87718 
1 1 1    6   44   10 o  107.426   38.832   9.4905   8.1958   36.780   12.691 -10.0328   10.734  198.908   42.943   73.489   34.949 125.4198 55.36702 
1 1 1    6   44   11 o  225.890   25.354   42.062   8.6147   46.531   12.541   38.070   11.854  229.090   37.029  205.176   39.175 23.91397 53.90517 
1 1 1    6   44   12 o  350.259   18.605   97.606   9.9385  102.869   14.452   92.883   13.690  352.351   27.002  334.793   26.942 17.55850 38.14444 
1 1 1    6   44   13 o  130.635   38.248   15.656   8.1372   25.797   11.577   5.7533   11.440  163.106   44.936  102.855   43.127 60.25072 62.28281 
1 1 1    6   44   14 o  283.430   21.316   64.953   9.1798   54.352   12.767   76.300   13.208  248.872   34.439  300.661   29.064 -51.78885 45.06370 
1 1 1    6   44   15 o  176.236   32.973   27.359   8.5677   14.108   11.956   41.345   12.283  124.074   46.539  212.193   39.266 -88.11935 60.89050 
1 1 1    6   44   16 o  180.412   46.121   32.319   12.785   32.319   12.785   0.0000   0.0000  180.412   46.121  ?   ?  0.000000 46.12072 
1 1 1    6   44   17 o  238.635   35.642   51.030   12.620   51.030   12.620   0.0000   0.0000  238.635   35.642  ?   ?  0.000000 35.64215 
1 1 1    6   44   18 o  103.892   39.373   8.9071   8.6079   6.9382   11.499   11.416   12.982  103.866   43.371  116.594   47.083 -12.72897 64.01457 
1 1 1    6   44   19 o   60.575   29.324 -10.8943   8.3534  -1.4757   12.240 -19.1055   11.429   89.325   40.677   65.307   32.174 24.01732 51.86363 
1 1 1    6   44   20 f  250.515   24.683   52.396   9.3417   55.152   13.275   49.693   13.148  245.884   36.370  231.066   38.534 14.81816 52.98655 
1 1 1    6   44   21 o   56.033   27.576 -14.5540   8.3203  -8.5373   11.419 -21.3643   12.148   76.048   36.131   65.832   32.570 10.21671 48.64469 
1 1 1    6   45    0 o   67.049   40.693   4.1785   7.7593   4.1785   7.7593   4.1785   7.7593   67.049   40.693   67.049   40.693 0.000000 0.000000 
1 1 1    6   45    1 o  115.656   38.181   11.901   7.8507   11.901   7.8507   0.0000   0.0000  115.656   38.181  ?   ?  0.000000 38.18086 
1 1 1    6   45    2 o  216.378   20.395   37.732   6.6750   39.861   8.3001   33.835   11.231  219.674   25.138  192.340   39.471 27.33485 46.79549 
1 1 1    6   45    3 o  166.756   25.866   23.243   6.3881   18.616   7.9004   31.981   10.857  143.541   36.017  186.996   39.186 -43.45451 53.22387 
1 1 1    6   45    4 o  220.708   20.608   39.310   6.8815   35.758   8.4888   46.117   11.752  206.343   27.567  229.313   34.556 -22.97047 44.20470 
1 1 1    6   45    5 o   96.807   34.512   7.6041   6.4502   6.4837   8.1464   9.4869   10.560   96.485   37.841  110.292   43.132 -13.80666 57.37843 
1 1 1    6   45    6 o  187.990   24.267   29.209   6.8196   38.140   8.7735   15.576   10.839  213.014   27.555  128.729   44.837 84.28502 52.62732 
1 1 1    6   45    7 o  150.149   29.120   19.401   6.4509   31.463   8.2693   0.6485   10.311  192.205   29.011   88.313   38.976 103.8925 48.58773 
1 1 1    6   45    8 o  110.061   37.753   10.653   7.6707   11.313   11.252   10.080   10.485  115.821   44.736  111.360   43.136 4.460968 62.14473 
1 1 1    6   45    9 o  104.921   38.674   9.1502   8.1868   12.706   12.113   6.1608   11.108  120.279   46.428  102.260   42.657 18.01833 63.04885 
1 1 1    6   45   10 o  190.851   30.494   31.481   8.6080   24.291   11.992   39.124   12.364  155.492   46.662  204.420   40.942 -48.92804 62.07735 
1 1 1    6   45   11 f   80.224   35.063   0.7534   8.1624  -4.3482   10.974   7.0719   12.212   81.327   37.577  106.251   44.555 -24.92374 58.28578 
1 1 1    6   45   12 o  152.228   45.548   23.237   11.438   23.237   11.438   0.0000   0.0000  152.228   45.548  ?   ?  0.000000 45.54766 
1 1 1    6   45   13 o  174.330   43.278   29.694   11.494   29.694   11.494   0.0000   0.0000  174.330   43.278  ?   ?  0.000000 43.27757 
1 1 1    6   45   14 o  286.058   29.456   70.182   12.713   70.182   12.713   0.0000   0.0000  286.058   29.456  ?   ?  0.000000 29.45555 
1 1 1    6   45   16 o  144.406   38.195   19.798   8.5722   36.715   12.215   3.3816   12.033  194.477   42.244   96.937   42.464 97.53993 59.89826 
1 1 1    6   45   17 o  166.894   34.439   25.391   8.5057   35.501   12.575   16.866   11.548  188.603   44.313  129.250   46.167 59.35307 63.99274 
1 1 1    6   46    0 o  108.235   45.999   13.946   7.7384   13.946   7.7384   13.946   7.7384  108.235   45.999  108.235   45.999 0.000000 0.000000 
1 1 1    6   46    1 o  143.699   26.597   17.614   5.6346   11.463   7.7743   24.420   8.1781  112.549   38.011  165.313   33.468 -52.76381 50.64562 
1 1 1    6   46    2 o   81.420   32.700   3.8710   6.2245  -1.7618   7.6779   14.673   10.632   72.422   32.674  124.231   44.307 -51.80910 55.05186 
1 1 1    6   46    3 o  126.959   31.927   14.406   6.1981   9.1156   7.6219   24.734   10.650  103.435   37.438  159.185   42.788 -55.75014 56.85462 
1 1 1    6   46    4 o  115.136   32.850   11.915   6.0735   3.1613   7.6580   26.757   9.9714   84.219   35.298  168.574   39.360 -84.35529 52.86884 
1 1 1    6   46    5 o  171.292   25.096   24.638   6.3845   32.117   8.0540   11.990   10.473  194.023   27.924  115.646   43.522 78.37747 51.71007 
1 1 1    6   46    6 o   77.159   33.941   0.2807   7.7577   0.2807   7.7577   0.0000   0.0000   77.159   33.941  ?   ?  0.000000 33.94078 
1 1 1    6   46    7 o   92.393   36.814   5.8295   7.8245   5.8295   7.8245   0.0000   0.0000   92.393   36.814  ?   ?  0.000000 36.81410 
1 1 1    6   46    8 o   99.360   42.510   5.0183   11.499   5.0183   11.499   0.0000   0.0000   99.360   42.510  ?   ?  0.000000 42.50994 
1 1 1    6   46    9 o  247.918   33.945   54.757   12.543   54.757   12.543   0.0000   0.0000  247.918   33.945  ?   ?  0.000000 33.94533 
1 1 1    6   46   10 o  322.842   19.487   84.096   9.5843   83.556   13.536   84.638   13.572  312.786   28.590  314.961   28.460 -2.174469 40.34067 
1 1 1    7    0    2 o  1893.57   23.964  2749.12   69.432  2749.12   69.432  2749.12   69.432  1893.57   23.964  1893.57   23.964 0.000000 0.000000 
1 1 1    7    0    4 o  723.103   8.0426  400.376   8.8991  400.376   8.8991  400.376   8.8991  723.103   8.0426  723.103   8.0426 0.000000 0.000000 
1 1 1    7    0    5 o  1044.70   7.2223  835.490   11.548  835.490   11.548  835.490   11.548  1044.70   7.2223  1044.70   7.2223 0.000000 0.000000 
1 1 1    7    0    6 o  2040.12   18.158  3188.71   56.690  3188.71   56.690  3188.71   56.690  2040.12   18.158  2040.12   18.158 0.000000 0.000000 
1 1 1    7    0    7 o  737.509   8.1365  416.493   9.1824  416.493   9.1824  416.493   9.1824  737.509   8.1365  737.509   8.1365 0.000000 0.000000 
1 1 1    7    0    8 o  222.756   4.7422   38.029   1.6152   38.029   1.6152   38.029   1.6152  222.756   4.7422  222.756   4.7422 0.000000 0.000000 
1 1 1    7    0    9 o  544.122   5.8610  226.686   4.8801  226.686   4.8801  226.686   4.8801  544.122   5.8610  544.122   5.8610 0.000000 0.000000 
1 1 1    7    0   10 o  705.133   5.7709  380.638   6.2275  380.638   6.2275  380.638   6.2275  705.133   5.7709  705.133   5.7709 0.000000 0.000000 
1 1 1    7    0   11 o  440.188   4.9743  148.360   3.3505  148.360   3.3505  148.360   3.3505  440.188   4.9743  440.188   4.9743 0.000000 0.000000 
1 1 1    7    0   12 o  508.369   7.4012  197.951   5.7563  197.951   5.7563  197.951   5.7563  508.369   7.4012  508.369   7.4012 0.000000 0.000000 
1 1 1    7    0   13 o  992.885   8.3026  754.816   12.616  754.816   12.616  754.816   12.616  992.885   8.3026  992.885   8.3026 0.000000 0.000000 
1 1 1    7    0   14 o  141.423   7.7465   15.448   1.6653   15.448   1.6653   15.448   1.6653  141.423   7.7465  141.423   7.7465 0.000000 0.000000 
1 1 1    7    0   15 o  692.574   5.9962  367.232   6.3553  367.232   6.3553  367.232   6.3553  692.574   5.9962  692.574   5.9962 0.000000 0.000000 
1 1 1    7    0   16 o  113.496   10.121   10.096   1.7260   10.096   1.7260   10.096   1.7260  113.496   10.121  113.496   10.121 0.000000 0.000000 
1 1 1    7    0   17 o  491.878   6.5371  185.301   4.9197  185.301   4.9197  185.301   4.9197  491.878   6.5371  491.878   6.5371 0.000000 0.000000 
1 1 1    7    0   18 o  577.536   8.3541  255.516   7.3815  255.516   7.3815  255.516   7.3815  577.536   8.3541  577.536   8.3541 0.000000 0.000000 
1 1 1    7    0   19 o  713.353   7.2851  389.667   7.9526  389.667   7.9526  389.667   7.9526  713.353   7.2851  713.353   7.2851 0.000000 0.000000 
1 1 1    7    0   20 o  606.612   6.9571  281.790   6.4577  281.790   6.4577  281.790   6.4577  606.612   6.9571  606.612   6.9571 0.000000 0.000000 
1 1 1    7    0   21 o  195.921   8.2993   29.542   2.4787   29.542   2.4787   29.542   2.4787  195.921   8.2993  195.921   8.2993 0.000000 0.000000 
1 1 1    7    0   22 o  620.580   6.2643  294.869   5.9490  294.869   5.9490  294.869   5.9490  620.580   6.2643  620.580   6.2643 0.000000 0.000000 
1 1 1    7    0   23 o  1043.86   7.8631  834.225   12.562  834.225   12.562  834.225   12.562  1043.86   7.8631  1043.86   7.8631 0.000000 0.000000 
1 1 1    7    0   24 o  1411.60   9.7048  1525.61   20.966  1525.61   20.966  1525.61   20.966  1411.60   9.7048  1411.60   9.7048 0.000000 0.000000 
1 1 1    7    0   25 o  1725.42   16.109  2280.61   42.535  2280.61   42.535  2280.61   42.535  1725.42   16.109  1725.42   16.109 0.000000 0.000000 
1 1 1    7    0   26 o  317.083   7.7179   77.095   3.7407   77.095   3.7407   77.095   3.7407  317.083   7.7179  317.083   7.7179 0.000000 0.000000 
1 1 1    7    0   27 o  349.604   7.5554   93.684   4.0388   93.684   4.0388   93.684   4.0388  349.604   7.5554  349.604   7.5554 0.000000 0.000000 
1 1 1    7    0   28 o  600.090   7.0300  275.747   6.4552  275.747   6.4552  275.747   6.4552  600.090   7.0300  600.090   7.0300 0.000000 0.000000 
1 1 1    7    0   29 o  786.961   7.3997  474.166   8.9115  474.166   8.9115  474.166   8.9115  786.961   7.3997  786.961   7.3997 0.000000 0.000000 
1 1 1    7    0   30 o  652.701   7.3253  326.216   7.3162  326.216   7.3162  326.216   7.3162  652.701   7.3253  652.701   7.3253 0.000000 0.000000 
1 1 1    7    0   31 o  1580.19   12.533  1912.36   30.310  1912.36   30.310  1912.36   30.310  1580.19   12.533  1580.19   12.533 0.000000 0.000000 
1 1 1    7    0   32 o  141.822   25.195   16.804   4.9546   16.804   4.9546   16.804   4.9546  141.822   25.195  141.822   25.195 0.000000 0.000000 
1 1 1    7    0   33 o  365.673   9.5635  102.582   5.3445  102.582   5.3445  102.582   5.3445  365.673   9.5635  365.673   9.5635 0.000000 0.000000 
1 1 1    7    0   34 o  138.441   24.024   15.958   4.6312   15.958   4.6312   15.958   4.6312  138.441   24.024  138.441   24.024 0.000000 0.000000 
1 1 1    7    0   35 o  594.421   8.2607  270.655   7.5126  270.655   7.5126  270.655   7.5126  594.421   8.2607  594.421   8.2607 0.000000 0.000000 
1 1 1    7    0   36 o  514.091   9.0004  202.533   7.0774  202.533   7.0774  202.533   7.0774  514.091   9.0004  514.091   9.0004 0.000000 0.000000 
1 1 1    7    0   37 o  425.133   13.726  138.900   8.9107  138.900   8.9107  138.900   8.9107  425.133   13.726  425.133   13.726 0.000000 0.000000 
1 1 1    7    0   38 o  486.564   9.2286  181.480   6.8674  181.480   6.8674  181.480   6.8674  486.564   9.2286  486.564   9.2286 0.000000 0.000000 
1 1 1    7    0   39 o  703.716   8.3959  379.359   9.0406  379.359   9.0406  379.359   9.0406  703.716   8.3959  703.716   8.3959 0.000000 0.000000 
1 1 1    7    0   40 o  172.126   21.511   23.800   5.4280   23.800   5.4280   23.800   5.4280  172.126   21.511  172.126   21.511 0.000000 0.000000 
1 1 1    7    0   41 o  1026.39   8.9810  807.086   14.107  807.086   14.107  807.086   14.107  1026.39   8.9810  1026.39   8.9810 0.000000 0.000000 
1 1 1    7    0   42 o   37.252   25.674  -3.6290   4.8629  -3.6290   4.8629  -3.6290   4.8629   37.252   25.674   37.252   25.674 0.000000 0.000000 
1 1 1    7    0   43 o  677.963   9.7941  352.431   10.159  352.431   10.159  352.431   10.159  677.963   9.7941  677.963   9.7941 0.000000 0.000000 
1 1 1    7    0   44 o   64.239   36.507   4.2354   5.5804   4.2354   5.5804   4.2354   5.5804   64.239   36.507   64.239   36.507 0.000000 0.000000 
1 1 1    7    0   45 o  136.597   27.756   16.069   5.1362   16.069   5.1362   16.069   5.1362  136.597   27.756  136.597   27.756 0.000000 0.000000 
1 1 1    7    0   46 o   72.438   35.982   6.0470   4.8250   6.0470   4.8250   6.0470   4.8250   72.438   35.982   72.438   35.982 0.000000 0.000000 
1 1 1    7    0   47 o   36.788   25.327  -3.3667   4.7026  -3.3667   4.7026  -3.3667   4.7026   36.788   25.327   36.788   25.327 0.000000 0.000000 
1 1 1    7    0   48 o  543.111   9.0409  226.364   7.5110  226.364   7.5110  226.364   7.5110  543.111   9.0409  543.111   9.0409 0.000000 0.000000 
1 1 1    7    0   49 o  320.689   16.753   79.921   8.1720   79.921   8.1720   79.921   8.1720  320.689   16.753  320.689   16.753 0.000000 0.000000 
1 1 1    7    0   50 o  311.385   12.245   74.873   5.8157   74.873   5.8157   74.873   5.8157  311.385   12.245  311.385   12.245 0.000000 0.000000 
1 1 1    7    0   51 o  315.124   12.222   76.705   5.8752   76.705   5.8752   76.705   5.8752  315.124   12.222  315.124   12.222 0.000000 0.000000 
1 1 1    7    0   52 o  252.309   14.558   49.557   5.5795   49.557   5.5795   49.557   5.5795  252.309   14.558  252.309   14.558 0.000000 0.000000 
1 1 1    7    0   53 o   58.231   34.068   3.3472   5.0753   3.3472   5.0753   3.3472   5.0753   58.231   34.068   58.231   34.068 0.000000 0.000000 
1 1 1    7    0   54 o  142.928   33.159   18.464   6.3102   18.464   6.3102   18.464   6.3102  142.928   33.159  142.928   33.159 0.000000 0.000000 
1 1 1    7    0   55 o   86.813   41.371   9.0246   6.2870   9.0246   6.2870   9.0246   6.2870   86.813   41.371   86.813   41.371 0.000000 0.000000 
1 1 1    7    0   56 o   41.887   28.453  -2.5981   5.5126  -2.5981   5.5126  -2.5981   5.5126   41.887   28.453   41.887   28.453 0.000000 0.000000 
1 1 1    7    0   57 o   72.079   38.366   6.2444   5.7332   6.2444   5.7332   6.2444   5.7332   72.079   38.366   72.079   38.366 0.000000 0.000000 
1 1 1    7    0   58 o   47.013   31.209  -1.0633   5.9651  -1.0633   5.9651  -1.0633   5.9651   47.013   31.209   47.013   31.209 0.000000 0.000000 
1 1 1    7    0   59 f  289.232   15.360   65.478   6.7561   65.478   6.7561   65.478   6.7561  289.232   15.360  289.232   15.360 0.000000 0.000000 
1 1 1    7    0   60 o  171.046   35.442   26.577   8.1874   26.577   8.1874   26.577   8.1874  171.046   35.442  171.046   35.442 0.000000 0.000000 
1 1 1    7    0   61 o  225.714   16.426   40.394   5.6060   40.394   5.6060   40.394   5.6060  225.714   16.426  225.714   16.426 0.000000 0.000000 
1 1 1    7    0   62 o  115.076   34.972   13.382   5.3777   13.382   5.3777   13.382   5.3777  115.076   34.972  115.076   34.972 0.000000 0.000000 
1 1 1    7    0   63 o   75.304   37.143   7.2252   5.1267   7.2252   5.1267   7.2252   5.1267   75.304   37.143   75.304   37.143 0.000000 0.000000 
1 1 1    7    0   64 o  255.918   16.024   52.123   6.2203   52.123   6.2203   52.123   6.2203  255.918   16.024  255.918   16.024 0.000000 0.000000 
1 1 1    7    0   65 o   48.582   32.608  -0.8945   6.8300  -0.8945   6.8300  -0.8945   6.8300   48.582   32.608   48.582   32.608 0.000000 0.000000 
1 1 1    7    1    0 o  161.832   7.6043   20.178   1.8741   20.178   1.8741   20.178   1.8741  161.832   7.6043  161.832   7.6043 0.000000 0.000000 
1 1 1    7    1    1 o  843.162   12.229  544.460   15.783  544.460   15.783   0.0000   0.0000  843.162   12.229  ?   ?  0.000000 12.22939 
1 1 1    7    1    2 o  1443.80   13.279  1596.66   29.346  1535.03   39.517  1672.44   43.818  1415.14   18.244  1476.97   19.382 -61.83228 26.61795 
1 1 1    7    1    3 o  657.977   7.5523  331.420   7.6061  340.982   11.052  322.818   10.484  667.305   10.821  649.297   10.549 18.00824 15.11156 
1 1 1    7    1    4 o  627.508   5.2345  301.395   5.0277  302.593   7.0875  300.182   7.1332  628.713   7.3649  626.201   7.4421 2.511841 10.47032 
1 1 1    7    1    5 o  1375.64   9.0330  1448.86   19.020  1443.03   26.790  1454.79   27.008  1372.60   12.752  1378.18   12.803 -5.577515 18.06979 
1 1 1    7    1    6 o  228.724   3.7634   40.040   1.3175   42.940   1.7538   36.283   1.9962  236.856   4.8376  217.718   5.9901 19.13800 7.699585 
1 1 1    7    1    7 o  1468.41   7.2372  1650.65   16.266  1681.06   25.383  1629.45   21.189  1481.60   11.193  1458.81   9.4893 22.78625 14.67406 
1 1 1    7    1    8 o  769.257   4.5055  452.930   5.3050  454.308   8.1351  451.910   6.9976  770.370   6.8991  768.360   5.9500 2.009888 9.110434 
1 1 1    7    1    9 o  376.888   3.5579  108.716   2.0525  106.599   3.1144  110.342   2.7289  373.181   5.4523  379.686   4.6957 -6.504913 7.195657 
1 1 1    7    1   10 o  544.132   3.6555  226.612   3.0446  226.975   4.3126  226.252   4.2987  544.546   5.1742  543.677   5.1657 0.8684082 7.311353 
1 1 1    7    1   11 o  581.337   4.0631  258.667   3.6154  259.897   4.7889  257.038   5.5133  582.693   5.3694  579.462   6.2161 3.231628 8.214017 
1 1 1    7    1   12 o  1264.83   7.0075  1224.76   13.566  1272.55   24.546  1203.74   16.279  1288.79   12.443  1253.83   8.4823 34.96619 15.05932 
1 1 1    7    1   13 o   85.252   9.0365   5.6282   1.1612   7.5513   1.7121   3.9902   1.5801   98.609   11.563   70.807   15.044 27.80190 18.97424 
1 1 1    7    1   14 o  802.723   4.5006  493.225   5.5297  490.600   7.8043  495.871   7.8362  800.516   6.3693  804.805   6.3613 -4.289368 9.001897 
1 1 1    7    1   15 o   94.992   8.4622   6.9651   1.2175   4.0736   1.8591   9.1365   1.6110   71.438   17.207  108.776   9.7807 -37.33845 19.79231 
1 1 1    7    1   16 f  244.668   4.6312   45.823   1.7344   45.986   2.6952   45.707   2.2658  245.069   7.1852  244.341   6.0584 0.7276306 9.398500 
1 1 1    7    1   17 o  638.210   4.8406  311.794   4.7286  316.823   8.3516  309.421   5.7368  643.182   8.4833  635.741   5.8954 7.440552 10.33067 
1 1 1    7    1   18 o  628.024   5.3501  301.935   5.1429  298.764   6.5801  306.913   8.2447  624.662   6.8820  633.046   8.5089 -8.384460 10.94361 
1 1 1    7    1   19 o  1037.67   6.2554  824.365   9.9353  840.419   12.429  795.945   16.536  1047.62   7.7508  1019.28   10.599 28.34631 13.13093 
1 1 1    7    1   20 o  383.506   4.8252  112.583   2.8324  114.586   4.0495  110.664   3.9631  386.864   6.8388  380.186   6.8104 6.677185 9.651439 
1 1 1    7    1   21 o  1518.27   7.2018  1764.90   16.736  1782.20   23.952  1748.39   23.395  1525.37   10.259  1510.85   10.117 14.52039 14.40793 
1 1 1    7    1   22 o  769.138   4.7414  452.812   5.5819  450.280   7.8715  455.374   7.9167  766.923   6.7056  771.249   6.7063 -4.325684 9.483612 
1 1 1    7    1   23 o  746.035   4.7309  426.010   5.4022  418.426   7.5602  433.924   7.7223  739.311   6.6809  752.878   6.7012 -13.56683 9.462550 
1 1 1    7    1   24 o  1447.33   7.4787  1603.67   16.568  1602.41   21.916  1605.35   25.309  1446.58   9.8982  1447.77   11.421 -1.189697 15.11327 
1 1 1    7    1   25 o  479.717   9.3116  176.204   6.8372  176.204   6.8372   0.0000   0.0000  479.717   9.3116  ?   ?  0.000000 9.311600 
1 1 1    7    1   26 o  413.746   4.8506  131.027   3.0718  131.367   4.3442  130.687   4.3443  414.257   6.8512  413.183   6.8692 1.073944 9.701791 
1 1 1    7    1   27 o  761.041   4.9845  443.315   5.8063  447.828   8.2760  438.940   8.1483  764.854   7.0692  757.227   7.0303 7.626831 9.969883 
1 1 1    7    1   28 f  1054.92   5.8132  851.837   9.3865  856.132   13.342  847.627   13.208  1057.47   8.2429  1052.21   8.2011 5.263916 11.62769 
1 1 1    7    1   29 f  420.282   5.3835  135.206   3.4632  135.502   4.8861  134.906   4.9093  420.708   7.5878  419.780   7.6406 0.9274292 10.76812 
1 1 1    7    1   30 o  428.830   5.8766  140.768   3.8573  139.327   5.8315  141.889   5.1432  426.570   8.9315  430.498   7.8053 -3.928253 11.86148 
1 1 1    7    1   31 o  1376.37   7.4295  1450.34   15.652  1434.22   20.430  1473.23   24.352  1368.51   9.7534  1386.83   11.472 -18.31641 15.05798 
1 1 1    7    1   32 o  519.101   6.4210  206.288   5.1018  211.351   7.2257  201.255   7.2044  525.357   8.9858  512.649   9.1814 12.70801 12.84687 
1 1 1    7    1   33 o  331.158   7.3717   83.964   3.7366   82.048   5.3085   85.846   5.2605  327.283   10.597  334.781   10.266 -7.498871 14.75401 
1 1 1    7    1   34 o  1108.08   6.3134  940.000   10.708  934.062   15.092  946.019   15.195  1104.39   8.9280  1111.43   8.9321 -7.045776 12.62904 
1 1 1    7    1   35 o  753.922   5.8071  435.140   6.7013  441.681   9.5789  428.869   9.3784  759.448   8.2404  748.355   8.1875 11.09363 11.61631 
1 1 1    7    1   36 o  336.911   8.0912   86.928   4.1725   87.874   5.9764   86.029   5.8280  338.622   11.531  335.056   11.364 3.567047 16.18949 
1 1 1    7    1   37 o  880.678   8.4503  594.055   11.391  581.755   16.100  606.383   16.118  871.145   12.075  889.422   11.840 -18.27722 16.91078 
1 1 1    7    1   38 o  390.640   7.4840  116.871   4.4748  121.903   6.4267  112.137   6.2345  398.817   10.528  382.502   10.649 16.31528 14.97436 
1 1 1    7    1   39 o  117.788   20.589   10.993   3.5768   14.149   5.1931   8.1436   4.9335  132.990   26.442  101.585   29.793 31.40535 39.83506 
1 1 1    7    1   40 o  304.341   8.5844   70.978   3.9989   72.707   5.8255   69.437   5.4992  307.812   12.365  300.838   11.942 6.974426 17.19024 
1 1 1    7    1   41 o  317.206   8.3427   77.114   4.0506   78.509   5.8200   75.804   5.6409  319.829   11.889  314.284   11.726 5.545929 16.69872 
1 1 1    7    1   42 o  256.010   10.417   50.286   4.0819   53.917   6.2968   47.655   5.3608  264.220   15.639  248.559   14.149 15.66031 21.09010 
1 1 1    7    1   43 o  389.121   7.8671  116.070   4.6857  120.763   6.3412  110.426   6.9542  396.661   10.444  379.131   11.984 17.52969 15.89627 
1 1 1    7    1   44 o  169.540   15.376   22.332   3.9467   20.158   5.6449   24.411   5.5200  159.266   23.893  176.268   20.864 -17.00175 31.72083 
1 1 1    7    1   45 o  285.152   8.8345   62.392   3.8559   60.159   5.4236   64.674   5.4831  279.618   12.672  289.959   12.354 -10.34061 17.69786 
1 1 1    7    1   46 o  222.149   10.612   37.928   3.6083   40.916   5.1209   34.982   5.0852  229.844   14.632  212.239   15.766 17.60503 21.50983 
1 1 1    7    1   47 f  314.645   8.2350   75.983   3.9660   80.856   5.7212   71.476   5.5027  324.134   11.532  304.714   11.798 19.42053 16.49777 
1 1 1    7    1   48 o  276.080   9.2427   58.566   3.9057   60.311   5.6040   56.918   5.4465  279.600   13.094  271.620   13.100 7.980133 18.52261 
1 1 1    7    1   49 o  447.420   9.7594  153.971   6.6836  152.439   9.7083  155.352   9.2150  443.926   14.288  448.427   13.426 -4.500671 19.60576 
1 1 1    7    1   50 o  304.852   8.8622   71.453   4.1353   68.162   5.9032   74.625   5.7946  296.965   12.987  310.910   12.176 -13.94513 17.80247 
1 1 1    7    1   51 o  337.065   8.3897   87.346   4.3284   89.006   6.1188   85.683   6.1239  339.507   11.775  333.049   12.013 6.457825 16.82122 
1 1 1    7    1   52 o  201.200   12.411   31.427   3.8036   29.897   5.3866   32.948   5.3715  194.605   18.299  204.689   17.307 -10.08475 25.18694 
1 1 1    7    1   53 o  188.870   13.581   27.815   3.9000   23.661   5.4659   32.124   5.5665  171.776   21.242  201.610   18.236 -29.83459 27.99546 
1 1 1    7    1   54 o  137.140   22.151   15.295   4.4912   16.562   6.2576   13.948   6.4497  139.750   30.140  127.199   32.886 12.55178 44.60800 
1 1 1    7    1   55 o   93.741   27.786   7.3297   4.2716   11.447   5.9623   2.9876   6.1228  115.247   32.432   79.648   32.275 35.59920 45.75464 
1 1 1    7    1   56 o  109.158   24.254   9.9615   3.9472   3.9709   5.4500   16.571   5.7245   80.211   31.091  140.139   27.670 -59.92773 41.62076 
1 1 1    7    1   57 o   58.631   25.166   0.2093   4.0537   1.3309   5.6623  -0.9699   5.8059   71.562   30.191   65.690   29.106 5.872292 41.93641 
1 1 1    7    1   58 o  171.213   17.178   23.377   4.4410   26.889   6.1641   19.586   6.4039  181.145   22.732  151.264   28.709 29.88075 36.61956 
1 1 1    7    1   59 o   83.652   27.816   5.7468   4.1642   4.2196   5.9332   7.2295   5.8460   81.759   32.221   93.598   32.909 -11.83965 46.05673 
1 1 1    7    1   60 o   89.407   31.784   6.5753   5.4674   7.0073   7.7781   6.1534   7.6867   95.558   37.114   92.596   36.617 2.961876 52.13692 
1 1 1    7    1   61 o  144.673   17.742   17.001   3.8465   19.302   5.5631   14.894   5.3242  150.274   25.069  130.215   27.572 20.05917 37.26486 
1 1 1    7    1   62 o  139.804   18.075   16.001   3.7772   11.651   5.2625   20.622   5.4247  112.971   29.948  155.774   23.481 -42.80282 38.05589 
1 1 1    7    1   63 o  197.094   12.824   30.808   3.8476   37.766   5.6539   24.805   5.2511  215.316   17.301  172.287   20.302 43.02882 26.67444 
1 1 1    7    1   64 o   45.420   20.970  -1.9582   3.4072   1.8331   4.8116  -5.7713   4.8254   65.671   27.775   46.994   22.635 18.67672 35.82947 
1 1 1    7    1   65 o  103.436   29.850   10.371   4.9883   5.2548   6.8305   16.218   7.3020   82.040   33.765  123.699   36.236 -41.65869 49.52960 
1 1 1    7    2    0 o   95.211   9.1924   7.1312   1.3110   7.1312   1.3110   7.1312   1.3110   95.211   9.1924   95.211   9.1924 0.000000 0.000000 
1 1 1    7    2    1 o  1814.81   16.259  2523.74   45.163  2413.13   60.185  2666.30   68.327  1773.64   22.169  1864.00   23.949 -90.35840 32.63459 
1 1 1    7    2    2 o  914.840   9.2102  640.775   12.897  633.964   18.040  647.894   18.444  909.785   12.955  919.717   13.102 -9.931946 18.42527 
1 1 1    7    2    3 o  1717.81   15.506  2260.96   40.770  2293.60   58.709  2230.55   56.662  1729.12   22.183  1705.27   21.708 23.84937 31.03735 
1 1 1    7    2    4 o  1012.57   8.1839  784.937   12.684  804.126   15.930  751.704   20.965  1024.78   10.156  990.604   13.827 34.18018 17.15593 
1 1 1    7    2    5 o  115.280   5.5742   10.172   0.9836   9.5169   1.4435   10.740   1.3438  111.165   8.5494  118.211   7.4650 -7.045708 11.34978 
1 1 1    7    2    6 o  1192.79   7.2198  1089.14   13.181  1114.71   21.379  1073.46   16.742  1206.46   11.577  1184.07   9.2378 22.38696 14.81112 
1 1 1    7    2    7 o  740.723   4.6968  419.955   5.3251  411.897   8.9606  424.354   6.6211  733.502   7.9812  744.570   5.8097 -11.06757 9.871741 
1 1 1    7    2    8 o  626.174   4.0239  300.102   3.8567  289.902   5.7207  308.600   5.2218  615.406   6.0732  634.956   5.3729 -19.55023 8.108744 
1 1 1    7    2    9 o  963.556   5.2391  710.661   7.7269  708.359   11.786  712.397   10.233  961.892   8.0049  964.675   6.9303 -2.782837 10.58809 
1 1 1    7    2   10 o  1915.63   9.9471  2810.13   29.166  2792.58   40.928  2828.24   41.573  1909.07   14.007  1921.20   14.137 -12.12952 19.90106 
1 1 1    7    2   11 o  1058.75   5.2919  858.043   8.5759  842.296   11.920  874.943   12.348  1048.90   7.4244  1069.03   7.5463 -20.12793 10.58627 
1 1 1    7    2   12 o  178.272   4.5707   24.326   1.2472   22.845   1.9747   25.309   1.6086  172.737   7.4688  181.830   5.7799 -9.093216 9.444108 
1 1 1    7    2   13 o  1145.05   6.5102  1003.76   11.410  1006.30   16.240  1001.28   16.035  1146.30   9.2559  1143.45   9.1616 2.851685 13.02327 
1 1 1    7    2   14 o  665.722   4.4134  339.233   4.4971  334.733   6.8589  342.627   5.9561  661.216   6.7771  669.002   5.8165 -7.785889 8.930887 
1 1 1    7    2   15 o  348.681   4.0666   93.060   2.1704   93.195   3.3892   92.966   2.8258  348.896   6.3464  348.487   5.2976 0.4087524 8.266916 
1 1 1    7    2   16 o  616.825   4.1069  291.228   3.8774  283.167   5.4110  299.736   5.5590  608.179   5.8127  625.719   5.8043 -17.54034 8.214439 
1 1 1    7    2   17 o  819.762   4.9726  514.424   6.2394  514.969   9.5607  514.019   8.2347  820.062   7.6168  819.365   6.5660 0.6965942 10.05625 
1 1 1    7    2   18 o  499.161   4.2940  190.721   3.2807  201.024   4.4707  178.699   4.8293  512.432   5.7000  483.116   6.5307 29.31625 8.668351 
1 1 1    7    2   19 o  844.056   5.5575  545.389   7.1799  539.687   8.7146  557.439   12.669  839.573   6.7814  853.079   9.7023 -13.50580 11.83728 
1 1 1    7    2   20 o  527.398   4.5005  212.908   3.6330  212.876   5.5297  212.933   4.8191  527.297   6.8514  527.394   5.9698 -0.9686279E-01 9.087326 
1 1 1    7    2   21 o  1246.11   6.6242  1188.79   12.635  1194.95   16.819  1180.81   19.142  1249.18   8.7964  1241.65   10.072 7.530151 13.37238 
1 1 1    7    2   22 o  817.635   5.1939  511.730   6.5002  515.149   8.6672  507.334   9.8270  820.303   6.9029  814.015   7.8872 6.287903 10.48130 
1 1 1    7    2   23 o  838.825   4.9557  538.580   6.3627  547.135   9.1682  530.630   8.8374  845.393   7.0853  832.549   6.9349 12.84381 9.914367 
1 1 1    7    2   24 o  1187.82   6.4849  1080.05   11.790  1085.10   15.706  1073.54   17.846  1190.48   8.6192  1184.04   9.8471 6.437622 13.08649 
1 1 1    7    2   25 o  343.676   6.2973   90.413   3.3127   90.521   5.5444   90.353   4.1311  343.814   10.536  343.542   7.8562 0.2718506 13.14228 
1 1 1    7    2   26 o   70.295   17.917   3.9338   1.9335   4.8866   2.8177   3.0859   2.6581   78.817   22.336   65.826   22.226 12.99046 31.51026 
1 1 1    7    2   27 o  479.710   4.8867  176.138   3.5881  181.348   5.1963  171.390   4.9606  486.721   6.9750  473.171   6.8493 13.54935 9.775599 
1 1 1    7    2   28 o  287.258   6.2523   63.165   2.7490   65.971   3.9942   60.639   3.7893  293.537   8.8899  281.426   8.7968 12.11111 12.50658 
1 1 1    7    2   29 o  468.679   5.2713  168.136   3.7815  168.473   5.4045  167.814   5.2928  469.108   7.5269  468.192   7.3857 0.9160156 10.54529 
1 1 1    7    2   30 o  706.188   5.5004  381.736   5.9454  378.461   9.0266  384.246   7.9015  703.064   8.3880  708.455   7.2867 -5.390747 11.11100 
1 1 1    7    2   31 o  276.809   7.8688   58.666   3.3340   62.255   4.4675   54.153   5.0087  285.110   10.237  265.870   12.308 19.24020 16.00887 
1 1 1    7    2   32 o  432.002   6.9168  142.877   4.5736  145.255   6.5651  140.635   6.3752  435.504   9.8487  428.525   9.7197 6.978821 13.83724 
1 1 1    7    2   33 o  709.303   5.5483  385.131   6.0237  392.067   8.7437  378.866   8.3103  715.568   7.9832  703.430   7.7184 12.13849 11.10424 
1 1 1    7    2   34 o  346.121   7.2888   91.726   3.8615   97.248   5.5083   86.389   5.4149  356.313   10.100  335.818   10.535 20.49487 14.59396 
1 1 1    7    2   35 o  286.648   8.6184   62.927   3.7813   60.876   5.5024   64.762   5.2052  281.822   12.756  290.713   11.698 -8.891083 17.30753 
1 1 1    7    2   36 o  828.623   5.8841  525.664   7.4629  527.803   10.721  523.653   10.395  830.152   8.4371  826.898   8.2131 3.254578 11.77452 
1 1 1    7    2   37 o  728.015   7.4453  405.879   8.2965  398.856   10.947  415.357   12.718  721.512   9.9121  736.163   11.287 -14.65051 15.02120 
1 1 1    7    2   38 o  336.641   8.4170   86.812   4.3371   87.260   6.6385   86.478   5.7286  337.299   12.858  335.877   11.143 1.422455 17.01486 
1 1 1    7    2   39 o  364.968   7.6650  102.032   4.2819  110.874   6.1263   93.588   5.9871  380.302   10.524  349.361   11.196 30.94113 15.36624 
1 1 1    7    2   40 o  744.796   5.9853  424.806   6.8233  423.869   9.6917  425.726   9.6081  743.733   8.5136  745.370   8.4216 -1.637451 11.97516 
1 1 1    7    2   41 o  469.009   6.6597  168.498   4.7809  168.962   6.8705  168.063   6.6569  469.427   9.5621  468.202   9.2890 1.225891 13.33108 
1 1 1    7    2   42 o   94.741   24.827   7.2219   3.6437   11.518   5.4986   3.8581   4.8653  119.143   30.132   79.876   29.741 39.26743 42.33758 
1 1 1    7    2   43 o  199.602   12.822   30.750   3.8967   26.692   5.0633   36.645   6.1028  185.084   18.105  217.051   18.548 -31.96742 25.91896 
1 1 1    7    2   44 o  517.327   7.3122  205.150   5.7900  203.854   8.0743  206.522   8.3073  515.291   10.237  518.616   10.465 -3.324402 14.63971 
1 1 1    7    2   45 o  309.653   8.4364   73.558   3.9986   71.570   5.6283   75.584   5.6817  305.059   12.054  313.525   11.840 -8.465302 16.89587 
1 1 1    7    2   46 o  470.973   6.5733  170.036   4.7386  164.846   6.7141  175.186   6.6887  463.324   9.4674  477.687   9.1480 -14.36282 13.16506 
1 1 1    7    2   47 f  559.202   6.2551  239.715   5.3539  238.676   7.6233  240.728   7.5210  557.509   8.9334  559.933   8.7755 -2.424561 12.52260 
1 1 1    7    2   48 o  219.009   11.243   37.023   3.7561   29.924   5.0517   45.800   5.6170  195.690   17.035  242.851   15.187 -47.16055 22.82234 
1 1 1    7    2   49 o  458.926   9.6033  161.971   6.7458  159.894   10.048  163.676   9.1017  454.585   14.441  460.432   12.915 -5.846741 19.37388 
1 1 1    7    2   50 o  110.413   21.675   9.8975   3.5324   12.932   5.0355   6.9577   4.9565  125.089   27.084   93.632   30.306 31.45766 40.64521 
1 1 1    7    2   51 o   57.528   23.823   0.8522   3.4288   1.9182   4.9233  -0.1519   4.7780   70.900   28.863   62.883   27.159 8.016659 39.63194 
1 1 1    7    2   52 o  193.127   12.697   28.985   3.7323   34.097   5.4345   24.420   5.1347  208.279   17.201  175.348   19.459 32.93045 25.97182 
1 1 1    7    2   53 o  278.980   10.575   60.067   4.5158   50.573   5.9229   73.247   6.9787  254.398   15.281  306.823   14.860 -52.42448 21.31534 
1 1 1    7    2   54 o   83.158   28.495   5.3220   4.3697   8.7242   6.0835   1.6958   6.2805  102.757   33.595   76.434   31.996 26.32276 46.39346 
1 1 1    7    2   55 o   96.753   27.341   7.8590   4.2282   7.7110   5.8423   8.0219   6.1271   97.493   32.951   99.334   33.744 -1.840759 47.16390 
1 1 1    7    2   56 o  385.171   8.3270  114.285   4.9092  108.320   6.9356  120.275   6.9498  373.620   12.128  393.962   11.525 -20.34180 16.73072 
1 1 1    7    2   57 o   74.788   27.036   4.0488   3.9731   6.2502   5.7227   2.0003   5.5203   90.116   32.467   73.043   30.237 17.07365 44.36606 
1 1 1    7    2   58 o  200.110   14.407   31.507   4.3833   28.931   6.1765   34.120   6.2217  188.431   21.819  205.755   20.008 -17.32373 29.60394 
1 1 1    7    2   59 o  156.069   18.068   19.617   4.2362   25.829   6.1537   14.021   5.8404  176.648   23.330  126.018   30.588 50.63088 38.46957 
1 1 1    7    2   60 o  180.309   20.054   26.532   5.4409   25.313   8.0729   27.547   7.3650  168.054   32.560  178.939   27.792 -10.88498 42.80851 
1 1 1    7    2   61 f  129.660   19.956   13.907   3.8334   14.987   5.3044   12.726   5.5462  130.718   27.388  118.612   30.407 12.10611 40.92307 
1 1 1    7    2   62 o   83.426   25.884   6.0323   3.6498   7.9888   5.2057   4.1408   5.1185   94.329   31.088   76.966   30.048 17.36309 43.23608 
1 1 1    7    2   63 f  168.348   15.075   22.819   3.8433   23.681   5.4978   21.996   5.3749  167.040   22.041  160.610   22.480 6.429535 31.48276 
1 1 1    7    2   64 o   73.575   26.316   4.5290   3.7532   7.3956   5.5390   2.0955   5.1035   89.315   31.966   67.748   28.626 21.56709 42.91053 
1 1 1    7    2   65 o   47.670   22.600  -3.8652   4.4210   0.7951   5.4836 -12.5201   7.4730   64.726   28.502   51.897   25.652 12.82870 38.34596 
1 1 1    7    3    1 o  749.081   8.0139  429.568   9.1884  413.545   12.534  448.180   13.509  734.871   11.144  765.009   11.537 -30.13776 16.03986 
1 1 1    7    3    2 o  838.582   8.6920  538.382   11.157  527.143   15.465  550.578   16.110  829.636   12.179  847.865   12.414 -18.22882 17.39034 
1 1 1    7    3    3 o  1032.54   10.150  816.352   16.041  832.078   23.167  801.867   22.232  1042.17   14.523  1023.09   14.197 19.07092 20.30942 
1 1 1    7    3    4 o  400.800   5.2817  122.958   3.2402  122.098   3.9583  124.703   5.6410  399.383   6.4752  403.579   9.1318 -4.196716 11.19461 
1 1 1    7    3    5 o  477.948   4.7886  174.844   3.5031  174.846   4.9961  174.843   4.9133  477.921   6.8297  477.919   6.7166 0.2655029E-02 9.579062 
1 1 1    7    3    6 o  361.527   6.5511  100.051   3.6251  100.051   3.6251   0.0000   0.0000  361.527   6.5511  ?   ?  0.000000 6.551101 
1 1 1    7    3    7 o  689.174   4.9201  363.542   5.1900  368.251   8.2378  360.442   6.6832  693.556   7.7600  686.199   6.3631 7.356384 10.03525 
1 1 1    7    3    8 o  619.226   4.3470  293.484   4.1201  293.439   5.8042  293.530   5.8493  619.146   6.1247  619.241   6.1713 -0.9454346E-01 8.694616 
1 1 1    7    3    9 o  611.148   4.3689  285.879   4.0869  280.142   5.6621  292.118   5.9050  604.953   6.1149  617.744   6.2451 -12.79150 8.740288 
1 1 1    7    3   10 o  853.371   4.5565  557.407   5.9516  542.776   8.2237  573.499   8.6244  842.043   6.3806  865.543   6.5098 -23.49945 9.115358 
1 1 1    7    3   11 o  1029.93   5.9785  812.014   9.4248  772.625   15.489  835.171   11.876  1004.42   10.075  1044.45   7.4289 -40.02789 12.51779 
1 1 1    7    3   12 o  653.086   4.6441  326.474   4.6424  319.421   8.0455  329.994   5.6840  645.887   8.1382  656.572   5.6559 -10.68506 9.910597 
1 1 1    7    3   13 o  176.656   4.9720   23.888   1.3444   21.335   1.9832   26.059   1.8287  166.925   7.7620  184.495   6.4758 -17.56990 10.10861 
1 1 1    7    3   14 o  270.978   3.8772   56.204   1.6081   57.498   2.3269   55.021   2.2250  274.060   5.5472  268.095   5.4222 5.965240 7.756988 
1 1 1    7    3   15 o  363.508   3.7609  101.140   2.0926  103.283   3.0031   99.118   2.9174  367.313   5.3415  359.832   5.2970 7.481079 7.522609 
1 1 1    7    3   16 o  333.734   4.1394   85.254   2.1145   87.578   3.2535   83.554   2.7823  338.216   6.2847  330.369   5.5021 7.846771 8.352891 
1 1 1    7    3   17 o  284.549   4.4710   61.978   1.9473   68.534   3.1697   58.004   2.4680  299.179   6.9218  275.256   5.8578 23.92355 9.067825 
1 1 1    7    3   18 o  290.911   4.2866   64.779   1.9087   64.634   2.7256   64.919   2.6738  290.557   6.1285  291.201   5.9988 -0.6439514 8.575825 
1 1 1    7    3   19 o  426.840   5.1681  139.468   3.3765  142.855   4.3658  134.428   5.3263  431.958   6.6032  418.976   8.3056 12.98184 10.61058 
1 1 1    7    3   20 o  479.623   4.4102  176.080   3.2377  174.095   4.9634  177.551   4.2716  476.857   6.8001  481.593   5.7948 -4.735352 8.934334 
1 1 1    7    3   21 o  316.225   4.5592   76.542   2.2068   77.661   3.1652   75.484   3.0783  318.502   6.4925  314.008   6.4048 4.493927 9.119986 
1 1 1    7    3   22 o  738.790   4.9779  417.787   5.6291  417.905   7.4664  417.632   8.5682  738.846   6.6022  738.570   7.5793 0.2761230 10.05162 
1 1 1    7    3   23 o  456.206   4.7014  159.302   3.2829  159.408   4.3989  159.168   4.9322  456.334   6.2978  455.975   7.0669 0.3585205 9.465933 
1 1 1    7    3   24 o  627.302   5.2678  301.205   5.0580  301.545   7.2518  300.882   7.0583  627.604   7.5490  626.919   7.3556 0.6845703 10.54002 
1 1 1    7    3   25 o  326.049   6.4850   81.377   3.2364   75.182   5.4377   84.776   4.0274  313.319   11.338  332.770   7.9070 -19.45032 13.82323 
1 1 1    7    3   26 o  627.458   5.0731  301.348   4.8722  288.908   7.3652  311.027   6.4969  614.313   7.8330  637.424   6.6590 -23.11084 10.28092 
1 1 1    7    3   27 o  794.461   5.0739  483.108   6.1700  482.163   8.7190  484.057   8.7324  793.629   7.1776  795.186   7.1745 -1.556946 10.14849 
1 1 1    7    3   28 o  1006.12   5.6782  774.853   8.7444  767.882   12.293  781.993   12.441  1001.50   8.0194  1010.66   8.0425 -9.159058 11.35749 
1 1 1    7    3   29 o  923.553   5.8663  652.908   8.2927  646.916   12.533  657.573   11.060  919.183   8.9081  926.775   7.7967 -7.591492 11.83818 
1 1 1    7    3   30 o  709.763   5.5161  385.612   5.9926  380.190   9.0119  389.910   8.0236  704.667   8.3553  713.654   7.3454 -8.986755 11.12499 
1 1 1    7    3   31 f  675.295   6.2091  349.094   6.4179  348.592   7.8048  350.140   11.278  674.767   7.5568  676.121   10.898 -1.353333 13.26153 
1 1 1    7    3   32 o  330.736   8.0015   83.754   4.0506   80.989   5.6826   86.610   5.7754  325.151   11.418  336.250   11.222 -11.09976 16.00920 
1 1 1    7    3   33 o  590.571   5.6393  266.990   5.0976  263.320   7.2243  270.629   7.1940  586.421   8.0485  594.510   7.9058 -8.089111 11.28182 
1 1 1    7    3   34 o  538.576   6.4780  222.070   5.3402  214.020   8.5492  227.222   6.8385  528.563   10.567  544.727   8.2018 -16.16345 13.37661 
1 1 1    7    3   35 o  295.761   8.4745   66.991   3.8364   65.022   5.6700   68.653   5.2101  291.259   12.719  299.327   11.372 -8.068420 17.06109 
1 1 1    7    3   36 o  318.789   8.6676   77.837   4.2294   71.692   5.8774   84.436   6.0908  305.815   12.556  331.910   11.989 -26.09479 17.36059 
1 1 1    7    3   37 o  1289.74   8.0090  1274.01   15.811  1269.32   22.463  1278.60   22.258  1286.88   11.404  1291.60   11.259 -4.720947 16.02535 
1 1 1    7    3   38 o  925.120   6.5015  655.362   9.2062  656.023   14.243  654.887   12.065  925.222   10.058  924.596   8.5253 0.6258545 13.18474 
1 1 1    7    3   39 o  262.990   9.6018   53.008   3.8651   48.313   5.5485   57.434   5.3872  250.424   14.538  273.594   12.864 -23.17026 19.41250 
1 1 1    7    3   40 o  623.489   6.0513  297.704   5.7749  301.279   8.3897  294.485   7.9610  626.996   8.7421  619.920   8.3900 7.075806 12.11674 
1 1 1    7    3   41 o  231.152   10.489   40.985   3.7110   47.549   5.4722   35.396   5.0496  248.303   14.461  213.970   15.524 34.33363 21.21580 
1 1 1    7    3   42 o  476.094   6.8861  173.666   5.0180  166.672   7.6222  179.015   6.6665  466.039   10.685  483.177   9.0141 -17.13705 13.97968 
1 1 1    7    3   43 o  107.720   23.558   9.3555   3.7761   12.685   5.0406   5.0968   5.7005  125.183   27.093   88.546   32.327 36.63787 42.17886 
1 1 1    7    3   44 f  308.684   9.4620   73.123   4.4706   69.460   6.1968   77.099   6.4560  300.433   13.476  316.541   13.325 -16.10809 18.95114 
1 1 1    7    3   45 o  515.235   6.5259  203.461   5.1466  199.528   7.3159  207.313   7.2413  509.838   9.3749  519.734   9.1026 -9.895538 13.06699 
1 1 1    7    3   46 o  227.375   10.402   39.730   3.6201   43.790   5.2615   36.080   4.9885  237.812   14.524  215.655   15.210 22.15773 21.03099 
1 1 1    7    3   47 o  144.165   15.861   16.264   3.4421   18.894   4.9744   13.848   4.7678  154.171   21.679  130.813   24.718 23.35802 32.87765 
1 1 1    7    3   48 o  155.593   15.367   18.912   3.6120   17.302   5.1210   20.506   5.0954  146.723   23.603  160.667   21.240 -13.94417 31.75285 
1 1 1    7    3   49 o  303.412   11.157   70.922   5.1812   79.117   8.8614   66.665   6.3867  318.207   18.270  293.563   14.214 24.64474 23.14813 
1 1 1    7    3   50 o   78.299   25.282   4.7740   3.4508   6.8975   5.0254   2.8794   4.7470   93.440   30.533   73.933   28.917 19.50685 42.05272 
1 1 1    7    3   51 o  155.260   15.565   18.918   3.6492   20.521   5.2518   17.422   5.0742  159.877   22.047  146.658   23.390 13.21919 32.14330 
1 1 1    7    3   52 f  228.280   11.253   40.235   3.9319   34.776   5.6018   45.536   5.5201  210.225   17.570  241.589   15.002 -31.36360 23.10347 
1 1 1    7    3   53 o  288.037   10.231   63.998   4.5106   67.844   7.0618   61.348   5.8622  294.599   15.718  281.157   13.622 13.44278 20.79913 
1 1 1    7    3   54 o  280.703   11.049   60.904   4.7474   61.724   6.2486   59.785   7.3012  281.207   14.567  275.602   17.397 5.605408 22.69074 
1 1 1    7    3   55 o   56.432   24.886  -0.8125   4.1956  -5.4234   5.6999   4.6399   6.1983   55.371   26.072   85.760   33.181 -30.38950 42.19849 
1 1 1    7    3   56 o  316.846   9.6156   77.507   4.6633   78.980   6.5863   76.025   6.6036  318.494   13.511  312.359   13.812 6.134857 19.32112 
1 1 1    7    3   57 o  101.949   26.176   8.8215   4.1056   19.810   5.8076  -2.1563   5.8048  154.191   25.499   62.683   28.334 91.50780 38.11775 
1 1 1    7    3   58 o   63.727   26.405   1.3777   4.2157   6.2539   6.0924  -3.1021   5.8395   90.521   33.363   60.456   27.743 30.06542 43.39117 
1 1 1    7    3   59 o  265.724   11.746   54.969   4.7772   58.268   6.5140   51.129   7.0271  271.344   15.752  252.671   18.294 18.67340 24.14079 
1 1 1    7    3   60 o  158.696   19.729   20.578   4.6889   16.932   8.1707   22.369   5.7256  133.161   38.138  163.446   23.567 -30.28522 44.83223 
1 1 1    7    3   61 f  144.889   17.731   17.058   3.8502   21.955   5.5240   12.431   5.3692  161.693   22.965  117.475   29.811 44.21850 37.63130 
1 1 1    7    3   62 o   48.843   22.207  -1.5544   3.6297  -6.0921   5.1394   2.9615   5.1270   49.147   23.591   72.424   29.466 -23.27747 37.74585 
1 1 1    7    3   63 o   67.278   25.629   3.2437   3.6592   4.1966   5.2559   2.3474   5.0976   76.598   30.282   69.291   28.900 7.307388 41.85951 
1 1 1    7    3   64 o   69.391   26.084   3.7241   3.7599   2.8677   5.6323   4.4125   5.0498   72.180   30.263   75.967   29.793 -3.787102 42.46729 
1 1 1    7    3   65 o   76.030   28.623   4.8700   4.5306   12.260   5.7975  -6.7229   7.2615  110.557   32.260   57.963   27.879 52.59457 42.63767 
1 1 1    7    4    0 o  2308.65   28.818  4089.33  101.799  4089.33  101.799  4089.33  101.799  2308.65   28.818  2308.65   28.818 0.000000 0.000000 
1 1 1    7    4    1 o  398.838   8.7387  121.786   5.3347   0.0000   0.0000  121.786   5.3347  ?   ?   398.838   8.7387 0.000000 8.738702 
1 1 1    7    4    2 o  797.446   8.4703  486.853   10.339  468.979   14.126  507.473   15.172  782.538   11.794  814.001   12.178 -31.46295 16.95241 
1 1 1    7    4    3 o  904.766   9.2407  626.759   12.797  627.941   18.140  625.588   18.056  905.422   13.089  903.726   13.053 1.695740 18.48557 
1 1 1    7    4    4 o  276.274   5.3473   58.423   2.2612   59.125   2.7687   57.015   3.9187  277.920   6.5086  272.884   9.3820 5.036346 11.41853 
1 1 1    7    4    5 f  981.602   8.0770  737.667   12.135  749.106   15.098  716.787   20.398  989.094   9.9726  967.292   13.777 21.80225 17.00783 
1 1 1    7    4    6 o  506.336   5.8222  196.245   4.5123  198.736   5.5589  191.432   7.7259  509.517   7.1278  499.997   10.095 9.520264 12.35792 
1 1 1    7    4    7 o  520.107   10.270  207.149   8.1759   0.0000   0.0000  207.149   8.1759  ?   ?   520.107   10.270 0.000000 10.27012 
1 1 1    7    4    8 o  928.254   5.4861  659.554   7.7947  660.432   11.047  658.684   11.000  928.789   7.7709  927.560   7.7475 1.228333 10.97317 
1 1 1    7    4    9 o  1740.77   8.4407  2320.13   22.490  2249.66   33.018  2381.12   30.718  1713.66   12.588  1763.18   11.382 -49.51880 16.97079 
1 1 1    7    4   10 o  880.480   5.3896  593.420   7.2635  585.552   12.543  597.390   8.9095  874.454   9.3709  883.378   6.5892 -8.924072 11.45565 
1 1 1    7    4   11 o  1093.32   6.2722  915.072   10.496  913.509   18.265  915.843   12.825  1092.08   10.927  1093.70   7.6613 -1.629395 13.34521 
1 1 1    7    4   12 o  685.577   5.2006  359.785   5.4573  365.013   8.9531  356.694   6.8840  690.422   8.4721  682.583   6.5889 7.838989 10.73266 
1 1 1    7    4   13 o  572.159   4.8935  250.589   4.2856  248.430   6.9357  251.922   5.4506  569.594   7.9553  573.644   6.2077 -4.050110 10.09068 
1 1 1    7    4   14 o  720.406   4.5604  397.262   5.0287  404.125   7.8005  392.382   6.5780  726.508   7.0148  715.918   6.0029 10.59009 9.232635 
1 1 1    7    4   15 o  585.079   4.6006  262.033   4.1200  261.953   7.1684  262.072   5.0347  584.871   8.0074  585.094   5.6219 -0.2227783 9.783833 
1 1 1    7    4   16 o  1109.97   5.5916  943.181   9.4999  940.816   13.420  945.557   13.449  1108.41   7.9104  1111.19   7.9076 -2.789307 11.18500 
1 1 1    7    4   17 o  618.684   4.1550  292.988   3.9347  289.935   5.5625  296.047   5.5665  615.399   5.9053  621.854   5.8482 -6.454773 8.311086 
1 1 1    7    4   18 o  377.775   4.3053  109.240   2.4895  110.763   3.3553  107.376   3.7131  380.372   5.7631  374.496   6.4776 5.875549 8.670233 
1 1 1    7    4   19 o  885.528   5.7004  600.300   7.7264  604.399   10.933  596.211   10.920  888.420   8.0402  882.379   8.0855 6.041382 11.40261 
1 1 1    7    4   20 o  566.369   4.5506  245.534   3.9449  240.529   5.1889  252.389   6.0725  560.531   6.0480  574.157   6.9098 -13.62634 9.182802 
1 1 1    7    4   21 o  208.628   5.4699   33.318   1.7467   32.995   2.5023   33.625   2.4393  207.589   7.8752  209.566   7.6047 -1.976624 10.94762 
1 1 1    7    4   22 o  341.307   4.9600   89.166   2.5912   95.407   4.1460   85.166   3.3193  353.009   7.6732  333.544   6.5017 19.46494 10.05735 
1 1 1    7    4   23 o  264.761   5.4488   53.657   2.2081   53.872   2.9944   53.400   3.2692  265.272   7.3748  264.099   8.0872 1.173492 10.94492 
1 1 1    7    4   24 o  1343.27   7.6419  1381.37   15.712  1391.36   22.444  1371.76   22.003  1347.90   10.879  1338.38   10.741 9.519165 15.28746 
1 1 1    7    4   25 f  626.274   5.8637  300.226   5.6209  300.404   7.4765  299.994   8.5244  626.416   7.7976  625.958   8.8971 0.4586182 11.83056 
1 1 1    7    4   26 o  310.828   5.8944   73.954   2.8043   78.718   4.5210   70.974   3.5753  320.641   9.2118  304.483   7.6715 16.15799 11.98784 
1 1 1    7    4   27 o  807.873   5.1237  499.560   6.3357  489.587   8.8890  509.858   9.0329  799.712   7.2619  816.100   7.2313 -16.38800 10.24823 
1 1 1    7    4   28 o  182.055   8.6336   25.376   2.4058   30.465   3.4932   20.784   3.3182  199.112   11.511  164.174   13.320 34.93784 17.60441 
1 1 1    7    4   29 o  812.908   5.5866  505.830   6.9512  512.154   10.698  501.207   9.1451  817.872   8.5453  809.129   7.3841 8.742554 11.29371 
1 1 1    7    4   30 o  1038.04   5.8578  824.828   9.3072  830.298   13.304  819.585   13.026  1041.36   8.3465  1034.62   8.2251 6.732910 11.71822 
1 1 1    7    4   31 o  856.675   6.4411  561.821   8.4459  562.066   10.285  561.312   14.801  856.803   7.8423  856.031   11.296 0.7720337 13.75162 
1 1 1    7    4   32 o  497.415   5.9146  189.405   4.5031  195.810   6.9290  184.721   5.9250  505.670   8.9523  491.176   7.8811 14.49356 11.92704 
1 1 1    7    4   33 o  292.307   7.7591   65.423   3.4715   65.557   5.0778   65.306   4.7568  292.524   11.341  291.983   10.644 0.5411377 15.55319 
1 1 1    7    4   34 o  697.738   5.6284  372.688   6.0111  374.903   8.6891  370.654   8.3245  699.704   8.1132  695.742   7.8170 3.962280 11.26624 
1 1 1    7    4   35 o  400.509   6.9553  122.819   4.2638  122.215   6.2033  123.360   5.8703  399.419   10.147  401.307   9.5568 -1.888123 13.93871 
1 1 1    7    4   36 o  367.504   7.7816  103.429   4.3772  101.521   6.0997  105.454   6.2851  363.985   10.949  370.963   11.069 -6.978455 15.56902 
1 1 1    7    4   37 o  416.318   8.2582  132.753   5.2623  124.320   8.2650  138.502   6.8244  402.610   13.412  425.132   10.487 -22.52158 17.02535 
1 1 1    7    4   38 o   96.665   24.676   7.4861   3.6634   14.717   5.7137   2.4385   4.7738  135.437   28.466   73.659   28.942 61.77802 40.59521 
1 1 1    7    4   39 o  491.509   6.3960  185.006   4.8118  179.454   6.8916  190.287   6.7215  483.902   9.3045  498.329   8.8122 -14.42697 12.81512 
1 1 1    7    4   40 o  157.495   14.826   19.227   3.5320   7.1364   5.0310   30.977   4.9596   96.376   30.464  200.037   16.341 -103.6612 34.57026 
1 1 1    7    4   41 o  462.620   6.8556  163.954   4.8544  165.089   7.4782  163.127   6.3819  463.904   10.532  461.282   9.0388 2.621674 13.87861 
1 1 1    7    4   42 o  237.087   9.9136   43.121   3.5976   51.226   5.2995   36.194   4.8995  257.801   13.477  216.384   14.883 41.41710 20.07840 
1 1 1    7    4   43 o  252.402   11.273   48.927   4.3552   51.826   5.2338   42.401   7.8532  259.268   13.233  232.760   22.316 26.50816 25.94477 
1 1 1    7    4   44 o  472.059   6.8522  170.790   4.9511  165.929   7.4681  174.602   6.6133  464.838   10.496  477.039   9.0572 -12.20111 13.86382 
1 1 1    7    4   45 o  310.847   8.1417   74.119   3.8738   75.773   5.5181   72.512   5.4394  313.940   11.483  307.100   11.572 6.840698 16.30266 
1 1 1    7    4   46 o  597.678   6.1713  273.789   5.6456  267.601   7.9331  280.138   8.0362  590.440   8.7781  604.130   8.6906 -13.69055 12.35234 
1 1 1    7    4   47 o  192.628   11.921   28.679   3.4975   27.515   5.0656   29.740   4.8348  187.505   17.866  195.349   16.319 -7.844131 24.19746 
1 1 1    7    4   48 o  200.249   12.316   31.029   3.7568   26.359   5.2752   35.834   5.3514  183.031   19.111  214.382   16.433 -31.35110 25.20524 
1 1 1    7    4   49 o  245.496   11.794   46.471   4.4318   43.042   6.4302   49.574   6.1166  234.435   18.059  252.309   15.920 -17.87328 24.07412 
1 1 1    7    4   50 o  290.921   9.1046   65.097   4.0542   63.595   5.7574   66.573   5.7099  286.779   13.116  293.508   12.710 -6.729431 18.26396 
1 1 1    7    4   51 o  234.172   10.843   42.292   3.8865   38.756   5.5360   45.728   5.4574  222.512   16.369  242.270   14.788 -19.75781 22.05981 
1 1 1    7    4   52 o  120.178   20.393   11.663   3.6171   13.279   5.2039   10.152   5.0312  126.134   27.711  109.932   29.350 16.20183 40.36488 
1 1 1    7    4   53 o  229.087   11.854   40.700   4.1423   37.479   6.2047   43.289   5.5637  217.633   18.811  235.189   15.543 -17.55635 24.40183 
1 1 1    7    4   54 o   68.388   26.845   2.4834   4.1033   2.5323   5.1810   2.4012   6.7209   73.963   29.788   80.557   33.356 -6.593605 44.72088 
1 1 1    7    4   55 o   54.266   24.346  -1.5211   4.1952  -7.1466   5.5887   5.7408   6.3497   51.562   24.711   90.362   33.911 -38.79981 41.95910 
1 1 1    7    4   56 o  212.383   12.822   35.185   4.1488   33.261   5.7942   37.209   5.9431  204.295   18.738  216.443   18.105 -12.14848 26.05637 
1 1 1    7    4   57 o   49.651   22.798  -2.4491   3.9510  -2.6536   5.5822  -2.2439   5.5929   60.165   27.426   61.201   27.724 -1.035809 38.99760 
1 1 1    7    4   58 o  160.809   17.579   20.699   4.2564   21.080   6.1324   20.344   5.9126  158.281   26.231  155.709   25.705 2.572174 36.72615 
1 1 1    7    4   59 o   74.033   29.699   2.9960   5.1282   7.3352   7.4674  -0.8772   7.0550   96.802   36.675   71.488   31.857 25.31368 48.57940 
1 1 1    7    4   60 o  158.301   17.719   20.243   4.2196   25.334   6.5721   16.673   5.5038  172.731   25.636  138.893   26.860 33.83806 37.13036 
1 1 1    7    4   61 o   79.881   26.584   5.3399   3.8032   7.0918   5.3958   3.6102   5.3614   90.839   31.635   76.225   30.442 14.61403 43.90290 
1 1 1    7    4   62 o   48.733   22.230  -1.6991   3.6755  -3.1299   5.1393  -0.2012   5.2587   54.884   25.484   62.839   27.779 -7.954830 37.69769 
1 1 1    7    4   63 f   55.835   23.961   0.5945   3.6731  -2.1759   5.1763   3.4044   5.2130   56.711   26.060   73.389   29.766 -16.67843 39.56188 
1 1 1    7    4   64 o   70.563   26.223   3.9571   3.7789   4.6076   5.4916   3.3721   5.2079   77.739   30.884   72.414   29.606 5.325745 42.78223 
1 1 1    7    4   65 f  122.125   25.643   13.614   4.6408   18.134   5.8093   5.6415   7.7154  139.175   28.236   84.603   35.443 54.57159 45.31496 
1 1 1    7    5    0 o  315.944   5.7489   76.476   2.7780   76.476   2.7780   76.476   2.7780  315.944   5.7489  315.944   5.7489 0.000000 0.000000 
1 1 1    7    5    1 o  488.422   6.4286  182.610   4.8060  182.610   4.8060   0.0000   0.0000  488.422   6.4286  ?   ?  0.000000 6.428631 
1 1 1    7    5    2 o  884.834   12.865  599.706   17.424   0.0000   0.0000  599.706   17.424  ?   ?   884.834   12.865 0.000000 12.86518 
1 1 1    7    5    3 o  720.996   11.401  398.110   12.581   0.0000   0.0000  398.110   12.581  ?   ?   720.996   11.401 0.000000 11.40063 
1 1 1    7    5    4 f  2125.20   15.431  3460.95   50.196  3511.40   62.625  3370.29   83.947  2139.90   19.120  2094.67   26.183 45.23633 32.42106 
1 1 1    7    5    5 o  633.619   6.2889  307.320   6.0992  302.986   7.3865  316.606   10.813  629.102   7.6710  642.977   10.987 -13.87445 13.39958 
1 1 1    7    5    6 o  860.853   7.4459  567.329   9.8110  600.648   17.914  553.054   11.726  885.471   13.218  849.891   9.0139 35.57971 15.99866 
1 1 1    7    5    7 o  419.361   4.9016  134.610   3.1463  135.037   4.4609  134.187   4.4383  419.996   6.9392  418.672   6.9258 1.324463 9.804001 
1 1 1    7    5    8 o  1090.23   7.6442  909.985   12.756  930.667   18.479  891.158   17.630  1102.34   10.952  1078.71   10.678 23.63220 15.29603 
1 1 1    7    5    9 o  749.629   6.0622  430.167   6.9558  435.668   9.9539  424.917   9.7242  754.314   8.6213  744.953   8.5281 9.361084 12.12666 
1 1 1    7    5   10 o  1124.79   7.8680  968.656   13.546  979.920   19.431  958.005   18.894  1131.06   11.224  1118.35   11.038 12.70300 15.74167 
1 1 1    7    5   11 o  541.701   3.9811  224.600   3.3009  222.467   5.0308  226.213   4.3742  539.079   6.0970  543.618   5.2570 -4.539246 8.050393 
1 1 1    7    5   12 o  770.399   5.5222  454.338   6.5118  452.844   10.460  455.284   8.3208  768.978   8.8869  771.139   7.0496 -2.160706 11.34340 
1 1 1    7    5   13 o  440.416   4.2757  148.469   2.8823  150.260   5.2939  147.715   3.4363  442.979   7.8077  439.280   5.1107 3.699341 9.331651 
1 1 1    7    5   14 o  152.842   5.6392   17.884   1.3193   18.059   2.3781   17.805   1.5856  153.201   10.200  152.498   6.7930 0.7028046 12.25490 
1 1 1    7    5   15 o  466.163   4.3866  166.340   3.1299  167.790   5.5048  165.647   3.8048  468.100   7.6831  465.170   5.3438 2.929657 9.358718 
1 1 1    7    5   16 o  195.165   4.7417   29.157   1.4165   29.479   2.0917   28.884   1.9251  196.214   6.9645  194.233   6.4753 1.981125 9.509644 
1 1 1    7    5   17 o  708.749   4.3999  384.508   4.7731  385.185   6.7472  383.829   6.7532  709.308   6.2147  708.058   6.2312 1.250366 8.800588 
1 1 1    7    5   18 o  320.411   4.8799   78.587   2.3932   77.494   2.8770   81.040   4.3120  318.160   5.9079  325.298   8.6601 -7.137939 10.48335 
1 1 1    7    5   19 o  743.947   5.2505  423.668   5.9787  423.896   8.3923  423.432   8.5195  744.063   7.3689  743.650   7.4848 0.4124146 10.50342 
1 1 1    7    5   20 o  471.796   4.1436  170.375   2.9923  171.982   4.2777  168.835   4.1872  473.983   5.8963  469.629   5.8250 4.354584 8.288374 
1 1 1    7    5   21 o  328.875   4.4375   82.787   2.2338   80.806   3.1833   84.708   3.1353  324.893   6.4013  332.648   6.1579 -7.754761 8.882333 
1 1 1    7    5   22 o  220.000   5.8713   37.049   1.9771   38.241   2.6656   35.591   2.9478  223.493   7.7921  215.596   8.9327 7.896515 11.85371 
1 1 1    7    5   23 o  802.379   4.8664  492.786   5.9766  493.862   8.5212  491.743   8.3849  803.198   6.9312  801.476   6.8350 1.721741 9.734426 
1 1 1    7    5   24 o  484.071   4.8115  179.355   3.5650  176.124   5.5413  181.636   4.6567  479.647   7.5477  487.119   6.2456 -7.471619 9.796758 
1 1 1    7    5   25 o  745.103   6.1482  424.970   7.0119  424.188   9.2649  426.018   10.728  744.362   8.1318  745.922   9.3961 -1.560364 12.42630 
1 1 1    7    5   26 f  854.010   5.5322  558.258   7.2315  552.854   9.5676  565.460   11.044  849.814   7.3554  859.411   8.3960 -9.596619 11.16225 
1 1 1    7    5   27 o  402.058   5.4979  123.734   3.3834  125.143   4.6210  122.106   4.9676  404.313   7.4671  399.366   8.1265 4.947052 11.03621 
1 1 1    7    5   28 o  1530.31   7.9231  1792.90   18.558  1798.78   28.461  1788.54   24.478  1532.45   12.134  1528.25   10.464 4.200806 16.02287 
1 1 1    7    5   29 o  381.527   5.9137  111.425   3.4535  116.516   5.4068  107.916   4.4883  390.089   9.0554  375.442   7.8103 14.64731 11.95831 
1 1 1    7    5   30 o  976.011   5.6971  729.192   8.5109  738.439   12.262  720.595   11.823  982.070   8.1572  970.141   7.9618 11.92841 11.39870 
1 1 1    7    5   31 o  417.450   7.5787  133.421   4.8425  134.295   5.9973  131.784   8.2082  418.770   9.3565  414.720   12.931 4.050446 15.96081 
1 1 1    7    5   32 o  842.297   5.9370  543.109   7.6542  532.692   11.533  551.308   10.232  834.032   9.0344  848.545   7.8783 -14.51227 11.98703 
1 1 1    7    5   33 f  459.459   6.0028  161.608   4.2215  159.917   6.0372  163.225   5.9052  456.977   8.6312  461.688   8.3564 -4.710724 12.01358 
1 1 1    7    5   34 o  960.985   5.9763  706.987   8.7907  706.348   12.571  707.599   12.297  960.389   8.5516  961.254   8.3581 -0.8643188 11.95772 
1 1 1    7    5   35 o  196.634   11.858   29.739   3.5522   31.677   4.9654   27.707   5.0839  202.550   16.150  189.154   17.768 13.39619 24.01095 
1 1 1    7    5   36 o  337.796   8.4123   87.394   4.3495   91.521   7.2892   85.112   5.4202  345.456   13.785  333.280   10.625 12.17581 17.40482 
1 1 1    7    5   37 o  156.014   19.414   18.999   4.5359  -2.8572   9.1063   26.211   5.2310   82.453   36.497  183.710   18.871 -101.2575 41.08691 
1 1 1    7    5   38 o  367.919   7.8341  103.686   4.4117  101.208   6.9821  105.334   5.6920  363.247   12.558  370.727   10.031 -7.479736 16.07224 
1 1 1    7    5   39 f  379.418   7.2493  110.268   4.2100  113.644   6.1454  107.283   5.7791  385.003   10.428  374.095   10.093 10.90823 14.51256 
1 1 1    7    5   40 o  295.511   8.5825   66.926   3.8820   70.919   5.6517   63.359   5.3414  303.987   12.147  287.327   12.145 16.65964 17.17703 
1 1 1    7    5   41 o  229.212   10.507   40.305   3.6861   41.797   5.5535   39.130   4.9281  232.550   15.694  225.160   14.375 7.390335 21.28206 
1 1 1    7    5   42 o  330.401   7.7832   83.671   3.9361   96.006   5.7897   73.071   5.3674  353.681   10.695  308.499   11.367 45.18198 15.60713 
1 1 1    7    5   43 o   84.220   27.817   5.3123   4.1669   4.4828   4.9529   7.3214   7.7084   82.891   30.152  103.950   37.646 -21.05875 48.23280 
1 1 1    7    5   44 o  507.382   6.3445  197.270   4.9272  190.435   7.0035  203.969   6.9333  498.168   9.1848  515.625   8.7849 -17.45706 12.70968 
1 1 1    7    5   45 o  262.478   9.1182   52.881   3.6633   49.960   5.2265   55.702   5.1360  254.335   13.474  269.045   12.472 -14.71042 18.35999 
1 1 1    7    5   46 o  139.752   15.457   15.267   3.2511   19.988   4.7221   11.012   4.4827  159.214   19.805  116.247   25.861 42.96702 32.57304 
1 1 1    7    5   47 o  182.054   12.813   25.672   3.5477   26.726   4.9868   24.592   5.0482  184.756   17.857  176.905   18.938 7.851532 26.02881 
1 1 1    7    5   48 o  122.984   23.266   12.247   4.2192   14.741   6.4407   10.373   5.5843  132.942   32.031  112.023   31.338 20.91956 44.81145 
1 1 1    7    5   49 o  269.828   9.7760   56.013   4.0375   51.264   6.1700   59.570   5.3395  256.594   15.786  277.792   12.558 -21.19751 20.17190 
1 1 1    7    5   50 o   95.593   23.055   7.4983   3.3342   4.3981   4.7843   10.426   4.6493   80.674   29.591  112.042   27.350 -31.36733 40.29409 
1 1 1    7    5   51 o  270.586   9.4548   56.367   3.9159   52.403   5.6199   60.107   5.4593  259.568   14.199  278.735   12.796 -19.16763 19.11419 
1 1 1    7    5   52 o   99.839   22.938   8.2104   3.4316   7.9820   4.9726   8.4181   4.7417   98.411   30.160  100.578   29.125 -2.166435 41.92713 
1 1 1    7    5   53 o  307.016   9.4418   72.632   4.4369   75.101   6.7389   70.743   5.8950  310.871   14.162  302.152   12.747 8.719452 19.05382 
1 1 1    7    5   54 o   75.617   27.602   3.9775   4.1557   6.9131   5.2538  -0.9294   6.7924   92.967   31.248   71.692   31.638 21.27473 44.46811 
1 1 1    7    5   55 o  269.456   11.424   56.218   4.7116   57.719   6.4729   54.527   6.8713  271.230   15.658  262.949   17.167 8.281311 23.23527 
1 1 1    7    5   56 o  128.504   20.429   13.428   3.8837   11.956   5.5052   14.887   5.4796  117.680   30.362  132.461   27.907 -14.78005 41.23894 
1 1 1    7    5   57 o  188.813   14.408   28.024   4.1325   21.988   5.8775   33.925   5.8115  163.125   24.280  206.105   18.623 -42.98007 30.59946 
1 1 1    7    5   58 o  102.043   26.075   8.9018   4.0878   2.1358   5.9657   14.891   5.6126   75.084   31.286  131.284   28.729 -56.19994 42.47525 
1 1 1    7    5   59 o   68.150   28.599   1.4912   5.0375   4.1971   7.2267  -1.0664   7.0258   85.759   34.947   70.856   31.667 14.90285 47.16068 
1 1 1    7    5   60 o  210.843   13.413   35.032   4.3061   32.511   6.3630   37.163   5.8489  198.844   21.235  214.785   17.956 -15.94031 27.80856 
1 1 1    7    5   61 o   95.140   25.579   7.9091   3.8054   6.4943   5.3082   9.4052   5.4583   87.940   31.312  101.816   31.664 -13.87548 44.53176 
1 1 1    7    5   62 o   52.895   23.313  -0.3509   3.6769   1.7477   5.0707  -2.6780   5.3396   67.772   28.580   57.003   26.294 10.76920 38.83524 
1 1 1    7    5   63 o  215.081   12.112   36.578   3.9711   35.850   5.5557   37.339   5.6782  209.332   17.500  213.647   17.518 -4.314713 24.76134 
1 1 1    7    5   64 o  115.440   21.917   11.593   3.7310   16.215   5.5483   7.7785   5.0410  132.169   28.281   90.773   30.608 41.39563 41.67347 
1 1 1    7    6    0 o  2222.34   19.636  3784.58   66.781  3784.58   66.781  3784.58   66.781  2222.34   19.636  2222.34   19.636 0.000000 0.000000 
1 1 1    7    6    1 o  255.902   4.1424   50.122   1.6225   50.021   2.2798   50.226   2.3097  255.632   5.8265  256.154   5.8910 -0.5225830 8.285620 
1 1 1    7    6    2 o  1605.78   11.910  1974.92   29.273  1961.76   35.521  2002.79   51.677  1600.12   14.503  1615.76   20.895 -15.64172 25.43552 
1 1 1    7    6    3 o  1445.46   13.385  1600.61   29.615  1578.32   41.196  1624.44   42.602  1434.67   18.760  1455.42   19.124 -20.75305 26.78912 
1 1 1    7    6    4 o  614.342   10.687  289.030   10.049   0.0000   0.0000  289.030   10.049  ?   ?   614.342   10.687 0.000000 10.68666 
1 1 1    7    6    5 o  1109.80   10.902  943.254   18.519  992.922   27.686  903.042   24.912  1138.20   15.892  1085.55   14.993 52.64905 21.84816 
1 1 1    7    6    6 o  1106.26   8.8989  937.049   15.068  912.077   25.310  950.759   18.754  1090.92   15.158  1114.18   10.997 -23.26025 18.72662 
1 1 1    7    6    7 f  1440.18   9.5101  1588.25   20.964  1595.24   29.781  1581.38   29.516  1442.93   13.484  1436.65   13.422 6.274536 19.02592 
1 1 1    7    6    8 o  949.833   6.9593  690.676   10.118  702.668   14.555  679.462   14.075  957.884   9.9270  941.944   9.7621 15.94031 13.92275 
1 1 1    7    6    9 o  814.904   5.6450  508.335   7.0411  507.947   9.0258  508.938   11.254  814.534   7.2394  815.245   9.0190 -0.7116089 11.56509 
1 1 1    7    6   10 f  1159.57   7.1807  1029.44   12.745  1023.69   16.303  1038.48   20.437  1156.18   9.2125  1164.30   11.468 -8.118286 14.71006 
1 1 1    7    6   11 o  448.634   4.6255  154.064   3.1763  160.806   4.1340  144.348   4.9625  458.321   5.8930  434.198   7.4670 24.12311 9.512281 
1 1 1    7    6   12 o  571.390   7.8883  250.002   6.8990  251.572   10.149  248.654   9.4066  572.998   11.572  569.710   10.787 3.288025 15.81992 
1 1 1    7    6   13 o  579.064   4.5176  256.670   4.0041  261.596   7.0742  254.347   4.8570  584.482   7.9074  576.412   5.5051 8.069641 9.635001 
1 1 1    7    6   14 o  389.973   3.9612  116.406   2.3645  120.134   3.7126  113.862   3.0669  396.128   6.1231  385.667   5.1954 10.46063 8.030209 
1 1 1    7    6   15 o  1220.83   6.3986  1141.10   11.957  1134.30   18.167  1146.30   15.881  1216.87   9.7536  1223.43   8.4808 -6.557129 12.92505 
1 1 1    7    6   16 o  467.257   4.5025  167.123   3.2202  169.132   5.6700  166.166   3.9124  469.963   7.8822  465.896   5.4864 4.066467 9.603659 
1 1 1    7    6   17 o  474.520   4.9820  172.365   3.6185  175.836   5.8384  170.201   4.6109  479.188   7.9601  471.496   6.3890 7.692444 10.20699 
1 1 1    7    6   18 o  445.816   4.3540  152.133   2.9711  150.978   3.9107  153.710   4.5693  444.093   5.7532  448.071   6.6625 -3.978180 8.802693 
1 1 1    7    6   19 o  348.189   4.7501   92.800   2.5315   88.986   3.4928   97.021   3.6744  340.928   6.6934  355.987   6.7434 -15.05875 9.501281 
1 1 1    7    6   20 o  948.652   5.1763  688.872   7.5161  686.536   10.611  691.225   10.648  946.949   7.3208  950.178   7.3213 -3.228638 10.35354 
1 1 1    7    6   21 o  935.660   5.5254  670.137   7.9132  672.234   10.509  667.390   12.026  937.051   7.3268  933.616   8.4155 3.435120 11.15811 
1 1 1    7    6   22 o  303.330   4.6980   70.425   2.1812   70.686   3.1120   70.174   3.0581  303.869   6.6909  302.769   6.5988 1.100281 9.397471 
1 1 1    7    6   23 o  1126.04   6.2412  970.610   10.757  952.895   16.172  984.667   14.406  1115.56   9.4714  1134.07   8.2990 -18.51172 12.59288 
1 1 1    7    6   24 o  228.972   6.0991   40.132   2.1375   37.549   2.9288   43.075   3.1268  221.461   8.6402  237.197   8.6124 -15.73643 12.19940 
1 1 1    7    6   25 o   83.460   16.585   5.5272   2.0440   6.5966   3.2337   4.8156   2.6378   90.977   23.161   78.031   21.430 12.94685 31.55420 
1 1 1    7    6   26 o  995.669   5.5599  758.823   8.4732  760.453   12.043  757.226   11.924  996.654   7.8942  994.540   7.8331 2.114075 11.12099 
1 1 1    7    6   27 o  1094.52   6.3159  917.022   10.581  904.396   13.880  934.539   16.349  1086.87   8.3434  1104.76   9.6684 -17.89075 12.77068 
1 1 1    7    6   28 o  584.981   5.6187  261.941   5.0309  261.240   7.1363  262.634   7.0934  584.143   7.9816  585.701   7.9124 -1.558167 11.23885 
1 1 1    7    6   29 o  302.030   6.3436   69.831   2.9326   68.339   4.2300   71.212   4.0693  298.743   9.2506  304.967   8.7177 -6.223389 12.71106 
1 1 1    7    6   30 o  905.076   5.9606  627.067   8.2575  628.165   11.010  625.655   12.485  905.784   7.9410  903.916   9.0236 1.867920 12.02022 
1 1 1    7    6   31 o  899.521   7.1333  619.474   9.8214  629.672   12.673  604.140   15.540  906.789   9.1309  888.062   11.433 18.72687 14.63139 
1 1 1    7    6   32 o  931.946   5.7562  664.866   8.2110  670.796   11.814  659.325   11.420  935.966   8.2467  927.941   8.0402 8.025269 11.51752 
1 1 1    7    6   33 o  436.428   6.0835  145.814   4.0639  155.580   5.9458  137.252   5.5672  450.735   8.6182  423.355   8.5914 27.38007 12.16906 
1 1 1    7    6   34 o  819.184   5.7401  513.729   7.1973  520.645   10.371  507.304   9.9961  824.549   8.2177  813.928   8.0237 10.62054 11.48523 
1 1 1    7    6   35 o  1038.36   6.5946  825.521   10.481  818.509   13.908  834.738   15.945  1033.77   8.7898  1043.85   9.9794 -10.08167 13.29847 
1 1 1    7    6   36 o  460.475   7.0164  162.365   4.9453  168.874   8.2396  158.699   6.1827  469.400   11.468  455.173   8.8743 14.22672 14.50077 
1 1 1    7    6   37 o  521.118   6.5465  207.945   5.2217  211.052   7.2500  204.596   7.5270  524.867   9.0244  516.748   9.5164 8.119568 13.11496 
1 1 1    7    6   38 o  437.500   7.1199  146.595   4.7678  153.363   7.6610  142.317   6.0912  447.240   11.191  430.959   9.2342 16.28098 14.50906 
1 1 1    7    6   39 o  526.778   6.2080  212.511   5.0056  208.799   7.2471  215.898   6.9219  521.962   9.0710  530.805   8.5197 -8.842834 12.44461 
1 1 1    7    6   40 o  466.993   6.6841  167.049   4.7778  163.302   7.1709  170.039   6.4070  461.462   10.152  470.996   8.8872 -9.534027 13.49274 
1 1 1    7    6   41 o  197.942   11.643   30.181   3.5119   28.656   5.2436   31.421   4.7294  191.971   18.057  201.499   15.452 -9.527588 23.76613 
1 1 1    7    6   42 o  404.842   6.7716  125.580   4.1961  130.857   6.0836  120.792   5.7954  413.013   9.6233  396.819   9.5416 16.19312 13.55175 
1 1 1    7    6   43 o  277.189   11.394   59.024   4.8341   58.423   5.8081   60.379   8.7207  275.536   13.772  278.435   20.609 -2.898712 24.78682 
1 1 1    7    6   44 o  214.733   11.090   35.523   3.6327   31.947   4.8988   39.892   5.4148  202.876   15.903  226.877   15.689 -24.00151 22.33942 
1 1 1    7    6   45 f  533.688   6.2685  218.289   5.1206  224.290   7.4469  212.908   7.0525  540.566   9.0003  526.714   8.7478 13.85217 12.55105 
1 1 1    7    6   46 o  276.283   8.8407   58.603   3.7386   57.651   5.4188   59.467   5.1648  273.539   12.942  277.926   12.141 -4.386810 17.74570 
1 1 1    7    6   47 f  558.256   6.6451  238.985   5.6781  247.062   7.8960  230.335   8.1713  567.119   9.0963  547.432   9.7520 19.68695 13.33576 
1 1 1    7    6   48 o   47.346   22.585  -5.7991   4.5544  -5.0368   6.6253  -6.4819   6.2710   62.738   29.062   57.837   27.268 4.900234 39.85122 
1 1 1    7    6   49 o  286.019   9.4903   62.926   4.1548   60.827   6.5419   64.344   5.3788  279.672   15.341  288.756   12.170 -9.083954 19.58173 
1 1 1    7    6   50 o  302.502   8.6613   70.360   4.0103   74.286   5.9069   67.002   5.4621  310.059   12.447  294.540   12.116 15.51920 17.36967 
1 1 1    7    6   51 o  185.760   12.651   26.812   3.5755   27.261   5.2350   26.419   4.8951  185.706   18.670  183.085   17.688 2.620453 25.71857 
1 1 1    7    6   52 o  192.384   12.977   28.796   3.7989   23.820   5.6784   32.827   5.1111  172.166   22.055  204.487   16.469 -32.32106 27.52580 
1 1 1    7    6   53 o  252.600   10.344   49.239   3.9993   48.749   5.7194   49.707   5.5945  249.770   15.030  252.385   14.544 -2.614914 20.91467 
1 1 1    7    6   54 o  136.781   23.674   15.357   4.7769   16.351   5.6920   12.989   8.7846  139.701   27.598  122.322   40.388 17.37889 48.91695 
1 1 1    7    6   55 o   76.923   26.238   4.5526   3.7046   4.3633   5.2117   4.7460   5.2670   81.046   30.655   82.860   30.926 -1.813858 43.54508 
1 1 1    7    6   56 f  162.559   15.981   20.912   3.9250   17.422   5.5380   24.433   5.5635  144.367   26.019  173.714   21.375 -29.34729 33.67331 
1 1 1    7    6   57 o  159.530   16.965   20.273   4.0791   16.101   5.9136   24.060   5.6339  136.894   29.118  171.824   21.921 -34.92982 36.44713 
1 1 1    7    6   58 o   65.002   26.453   1.8384   4.1335  -0.2597   5.8363   3.9500   5.8551   67.314   29.529   80.771   31.952 -13.45736 43.50719 
1 1 1    7    6   59 o  100.409   29.148   8.8190   4.7439   13.498   7.2651   5.3409   6.2636  120.830   36.333   86.582   33.396 34.24739 49.34927 
1 1 1    7    6   60 o   57.395   24.770   0.2484   3.9687  -1.5401   5.9537   1.6786   5.3240   63.804   28.781   69.634   29.321 -5.829697 41.08554 
1 1 1    7    6   61 o   76.318   26.377   4.7375   3.7478   12.553   5.2429  -3.4292   5.3593  118.193   29.161   55.843   25.961 62.35025 39.04254 
1 1 1    7    6   62 o  187.187   16.715   28.366   4.7388   20.428   6.6643   36.486   6.7397  149.764   30.116  209.009   21.368 -59.24527 36.92636 
1 1 1    7    6   63 o   60.294   25.066   1.5705   3.8168   5.3634   5.6554  -1.6024   5.1726   81.707   31.672   57.900   26.396 23.80673 41.22931 
1 1 1    7    6   64 o  133.598   17.985   14.894   3.5842   14.826   4.8687   14.974   5.2959  128.068   25.730  126.942   28.007 1.125458 38.03221 
1 1 1    7    7    0 o  1768.59   15.917  2396.18   43.080  2396.18   43.080  2396.18   43.080  1768.59   15.917  1768.59   15.917 0.000000 0.000000 
1 1 1    7    7    1 o  746.807   6.6427  426.942   7.5932  424.778   9.2453  431.427   13.310  744.865   8.1091  750.521   11.586 -5.656616 14.14217 
1 1 1    7    7    2 o  712.490   6.4831  388.602   7.0702  388.282   8.6152  389.263   12.373  712.153   7.9036  712.913   11.339 -0.7598877 13.82175 
1 1 1    7    7    3 o  410.783   6.6351  129.175   4.1719  135.715   5.9887  123.009   5.8149  420.999   9.2935  400.804   9.4786 20.19537 13.27453 
1 1 1    7    7    4 o  1575.26   20.457  1903.96   49.324   0.0000   0.0000  1903.96   49.324  ?   ?   1575.26   20.457 0.000000 20.45693 
1 1 1    7    7    5 f  641.164   7.8706  314.737   7.7241  318.206   11.055  311.429   10.797  644.557   11.205  637.664   11.062 6.893494 15.74554 
1 1 1    7    7    6 o  851.851   9.1665  555.657   11.952  559.895   17.005  551.519   16.802  854.856   12.996  848.441   12.938 6.414490 18.33832 
1 1 1    7    7    7 o  241.841   6.1339   44.773   2.2706   47.077   3.8163   43.510   2.8250  247.932   10.056  238.389   7.7422 9.543518 12.69138 
1 1 1    7    7    8 o  1083.28   7.6489  898.472   12.683  883.401   17.620  914.673   18.269  1073.94   10.719  1092.76   10.923 -18.82568 15.30373 
1 1 1    7    7    9 o  745.134   8.6293  425.164   9.8419   0.0000   0.0000  425.164   9.8419  ?   ?   745.134   8.6293 0.000000 8.629325 
1 1 1    7    7   10 o  260.565   6.5257   51.978   2.6026   50.747   4.6600   52.537   3.1376  257.357   11.830  261.940   7.8257 -4.582825 14.18402 
1 1 1    7    7   11 o  534.080   7.6983  218.415   6.2932  225.031   9.2867  212.796   8.5577  541.951   11.195  527.042   10.608 14.90912 15.42290 
1 1 1    7    7   12 o  974.010   6.4134  726.325   9.5614  734.132   12.433  715.024   14.958  979.107   8.2962  966.133   10.115 12.97382 13.08215 
1 1 1    7    7   13 o  137.169   7.1168   14.445   1.4891   16.049   1.8505   11.499   2.5080  144.520   8.4019  121.704   13.702 22.81644 16.07268 
1 1 1    7    7   14 o  816.396   5.3485  510.226   6.6835  509.667   9.3999  510.797   9.5048  815.838   7.5275  816.737   7.6031 -0.8995361 10.69908 
1 1 1    7    7   15 o  271.123   5.4873   56.273   2.2772   49.748   3.6970   60.262   2.8906  254.847   9.4778  280.547   6.7315 -25.70039 11.62499 
1 1 1    7    7   16 o  718.480   5.0711  395.161   5.5768  400.122   8.0248  390.527   7.7556  722.885   7.2527  714.172   7.0949 8.712463 10.14583 
1 1 1    7    7   17 o  222.516   4.9668   37.902   1.6916   38.179   2.7516   37.733   2.1448  223.290   8.0511  222.006   6.3118 1.283493 10.23030 
1 1 1    7    7   18 o  355.844   5.7564   96.935   3.1353   93.175   5.5847   98.665   3.7887  348.765   10.462  358.985   6.8952 -10.22043 12.52951 
1 1 1    7    7   19 o  940.269   7.2358  676.885   10.414   0.0000   0.0000  676.885   10.414  ?   ?   940.269   7.2358 0.000000 7.235810 
1 1 1    7    7   20 o  644.155   5.0788  317.612   5.0075  317.978   7.1152  317.253   7.0486  644.468   7.2130  643.735   7.1536 0.7335815 10.15881 
1 1 1    7    7   21 o  1001.97   6.2128  768.509   9.5282  756.082   13.274  781.718   13.685  993.715   8.7271  1010.41   8.8488 -16.69946 12.42834 
1 1 1    7    7   22 o  390.391   4.6858  116.652   2.8000  118.018   3.7871  115.006   4.1585  392.650   6.3012  387.595   7.0096 5.054352 9.425489 
1 1 1    7    7   23 o  260.842   5.7090   52.080   2.2793   52.374   3.6833   51.897   2.9017  261.541   9.2009  260.370   7.2809 1.170471 11.73323 
1 1 1    7    7   24 o  779.843   5.1866  465.496   6.1910  464.054   8.2702  467.333   9.3375  778.591   6.9397  781.312   7.8079 -2.720642 10.44617 
1 1 1    7    7   25 o  805.404   5.9015  496.530   7.2753  500.218   10.368  492.952   10.212  808.315   8.3797  802.425   8.3143 5.889893 11.80451 
1 1 1    7    7   26 o  2001.15   9.1866  3066.17   28.139  3046.24   39.488  3086.73   40.108  1994.19   12.937  2007.39   13.054 -13.19312 18.37812 
1 1 1    7    7   27 o  289.490   6.1715   64.150   2.7346   60.974   4.1561   66.575   3.6314  282.189   9.6224  294.888   8.0453 -12.69922 12.54260 
1 1 1    7    7   28 o  1091.37   5.9604  911.757   9.9567  924.251   14.300  900.001   13.872  1098.70   8.5033  1084.20   8.3588 14.50134 11.92377 
1 1 1    7    7   29 o  838.448   5.7230  538.125   7.3447  541.265   9.8704  534.231   10.994  840.819   7.6694  835.297   8.5989 5.522400 11.52224 
1 1 1    7    7   30 o  1065.54   6.9170  869.211   11.281  868.552   13.889  870.487   19.339  1065.05   8.5201  1065.98   11.853 -0.9344482 14.59715 
1 1 1    7    7   31 o  823.909   6.3528  519.672   8.0115  528.704   11.327  510.632   11.332  830.918   8.9064  816.585   9.0668 14.33337 12.70946 
1 1 1    7    7   32 o  494.920   5.7163  187.510   4.3303  192.436   6.3293  183.174   5.9375  501.308   8.2486  489.105   7.9311 12.20337 11.44296 
1 1 1    7    7   33 o  125.473   16.004   12.270   3.0036   17.394   4.4248   7.8916   4.0903  149.203   19.869   99.501   26.416 49.70273 33.05410 
1 1 1    7    7   34 o  804.178   6.0788  495.103   7.4824  492.522   10.088  498.260   11.156  801.963   8.2181  806.567   9.0365 -4.604370 12.21456 
1 1 1    7    7   35 o  370.730   6.8700  105.237   3.8984  102.415   5.6206  107.853   5.4116  365.624   10.043  375.229   9.4223 -9.604218 13.77130 
1 1 1    7    7   36 o  447.418   7.5274  153.304   5.1550  163.307   8.3217  147.075   6.5667  461.564   11.779  438.135   9.7920 23.42935 15.31760 
1 1 1    7    7   37 o  671.825   6.3216  345.607   6.5006  350.133   10.350  342.658   8.3542  675.939   10.003  668.834   8.1605 7.105225 12.90971 
1 1 1    7    7   38 o  618.642   5.9604  293.060   5.6439  291.234   8.1886  294.712   7.7897  616.523   8.6774  620.232   8.2054 -3.708557 11.94264 
1 1 1    7    7   39 o  739.794   5.8883  419.112   6.6676  408.908   9.4324  429.303   9.4264  730.495   8.4360  748.514   8.2277 -18.01886 11.78390 
1 1 1    7    7   40 o  345.586   7.7751   91.515   4.1128   90.022   6.1151   92.747   5.5575  342.492   11.665  347.734   10.441 -5.242004 15.65550 
1 1 1    7    7   41 o  651.487   5.9632  325.096   5.9464  307.034   8.3782  343.430   8.4411  632.840   8.6494  669.352   8.2390 -36.51208 11.94545 
1 1 1    7    7   42 f  543.616   6.1184  226.389   5.0910  232.525   7.3070  220.601   7.0970  550.657   8.6693  536.356   8.6448 14.30127 12.24294 
1 1 1    7    7   43 f  472.805   8.1755  171.424   5.9165  171.867   7.1628  170.472   10.497  473.197   9.8894  470.469   14.576 2.728210 17.61452 
1 1 1    7    7   44 o  105.154   20.020   8.8507   3.1045   6.8494   4.4585   10.734   4.3254   93.149   28.560  115.061   25.253 -21.91210 38.12324 
1 1 1    7    7   45 o  210.780   10.358   34.137   3.3418   31.747   4.7790   36.425   4.6747  202.179   15.563  216.902   14.158 -14.72282 21.03922 
1 1 1    7    7   46 o  420.245   6.8128  135.420   4.3823  133.994   6.3309  136.732   6.0722  417.579   9.9050  421.909   9.4028 -4.329346 13.65732 
1 1 1    7    7   47 o  140.489   15.701   15.461   3.3185   19.442   4.6038   11.155   4.7877  156.843   19.605  116.503   27.322 40.34036 33.62801 
1 1 1    7    7   48 f  125.828   21.286   12.718   3.9535   8.5081   6.6203   15.051   4.9288  104.361   35.078  136.228   24.541 -31.86668 42.80976 
1 1 1    7    7   49 o  161.693   14.813   20.425   3.6253   19.153   5.6736   21.303   4.7128  153.695   24.975  164.077   19.125 -10.38280 31.45618 
1 1 1    7    7   50 o  307.437   8.5017   72.668   4.0007   81.839   5.9717   65.200   5.3887  325.527   11.985  290.527   12.118 35.00003 17.04369 
1 1 1    7    7   51 o  101.670   22.332   8.4761   3.3802   9.3719   4.9607   7.6996   4.6184  105.894   29.506   96.731   28.942 9.162636 41.33094 
1 1 1    7    7   52 o  154.273   16.040   18.747   3.7322   17.182   5.6650   19.948   4.9611  144.135   26.660  157.629   21.091 -13.49367 33.99401 
1 1 1    7    7   53 o  259.612   10.132   52.000   4.0260   54.311   5.8673   49.943   5.5346  263.800   14.588  253.018   14.350 10.78203 20.46270 
1 1 1    7    7   54 o   64.281   27.199   0.7122   4.6175  -0.5586   5.3063   4.6759   9.3714   64.395   28.204   96.646   39.637 -32.25095 48.64746 
1 1 1    7    7   55 o  126.156   20.140   12.911   3.7583   17.997   5.4046   8.1479   5.2298  147.540   24.813   98.582   31.049 48.95848 39.74572 
1 1 1    7    7   56 o   60.355   24.836   1.2450   3.6948   8.1037   5.3540  -4.9910   5.1052   98.161   31.469   52.126   24.584 46.03489 39.93350 
1 1 1    7    7   57 o  101.004   25.248   8.6491   3.8927   11.580   5.6422   5.9868   5.3776  115.045   31.237   87.898   31.493 27.14756 44.35733 
1 1 1    7    7   58 o  234.516   12.512   42.989   4.4752   39.301   6.3084   46.724   6.3496  221.312   18.801  242.300   17.233 -20.98767 25.50393 
1 1 1    7    7   59 o   80.818   28.981   5.0925   4.5549  -2.8985   7.0530   10.810   5.9657   66.849   30.608  109.612   32.916 -42.76328 44.94801 
1 1 1    7    7   60 o  124.372   22.049   12.986   4.0437   11.246   6.1119   14.341   5.3927  110.670   33.335  127.482   28.368 -16.81204 43.77210 
1 1 1    7    7   61 o   55.858   23.969   0.4228   3.6750  -4.5180   5.0512   5.9798   5.3569   51.644   24.386   85.542   31.321 -33.89869 39.69496 
1 1 1    7    7   62 o  105.278   24.253   9.7214   3.8277   6.1692   5.4161   13.266   5.4103   85.459   31.463  120.072   29.622 -34.61246 43.21296 
1 1 1    7    7   63 o  124.772   21.149   13.309   3.8947   15.393   5.6905   11.472   5.3419  128.396   29.566  109.729   30.635 18.66724 42.57497 
1 1 1    7    7   64 o   65.683   25.748   3.0031   3.7702  -1.9861   5.6942   6.8976   5.0308   59.096   27.221   86.287   30.509 -27.19103 40.88778 
1 1 1    7    8    0 o  971.129   9.7402  722.198   14.475  722.198   14.475  722.198   14.475  971.129   9.7402  971.129   9.7402 0.000000 0.000000 
1 1 1    7    8    1 o  1024.99   8.2842  804.402   12.997  798.573   15.791  816.643   22.883  1021.16   10.103  1032.30   14.482 -11.13263 17.65798 
1 1 1    7    8    2 o  727.432   6.6261  405.087   7.3777  403.325   8.9811  408.745   12.938  725.797   8.0843  730.496   11.571 -4.698669 14.11534 
1 1 1    7    8    3 o  134.947   12.486   14.070   2.5498   0.0000   0.0000   14.070   2.5498  ?   ?   134.947   12.486 0.000000 12.48585 
1 1 1    7    8    4 o  927.675   9.6018  659.026   13.634  671.234   19.699  647.800   18.889  935.922   13.751  919.467   13.422 16.45520 19.21524 
1 1 1    7    8    5 o  216.942   11.369   36.150   3.7622   0.0000   0.0000   36.150   3.7622  ?   ?   216.942   11.369 0.000000 11.36948 
1 1 1    7    8    6 o  1084.89   10.783  901.516   17.906  879.231   24.570  926.759   26.150  1070.97   14.989  1099.47   15.539 -28.49902 21.58969 
1 1 1    7    8    7 f  1106.37   11.001  937.652   18.629   0.0000   0.0000  937.652   18.629  ?   ?   1106.37   11.001 0.000000 11.00077 
1 1 1    7    8    8 o  284.279   7.5488   61.877   3.2847   0.0000   0.0000   61.877   3.2847  ?   ?   284.279   7.5488 0.000000 7.548769 
1 1 1    7    8    9 o  876.752   7.7499  588.595   10.400  557.166   17.079  607.119   13.112  852.616   13.087  890.317   9.6215 -37.70093 16.24305 
1 1 1    7    8   10 o  599.532   6.4739  275.187   5.9409  274.221   7.3024  277.077   10.216  598.421   7.9724  601.369   11.099 -2.947876 13.66569 
1 1 1    7    8   11 o  339.871   5.5059   88.428   2.8642   86.516   3.9799   90.481   4.1253  336.131   7.7356  343.745   7.8406 -7.613800 11.01427 
1 1 1    7    8   12 o  446.398   4.7755  152.538   3.2630  156.480   4.1881  146.449   5.2050  452.100   6.0522  437.319   7.7759 14.78061 9.853589 
1 1 1    7    8   13 o  425.372   4.8217  138.508   3.1393  141.105   3.9981  134.333   5.0696  429.312   6.0844  418.831   7.9079 10.48083 9.977692 
1 1 1    7    8   14 f  248.720   5.4121   47.357   2.0604   49.794   2.5855   43.115   3.4107  255.023   6.6235  237.253   9.3920 17.76990 11.49263 
1 1 1    7    8   15 o  487.356   5.0390  181.817   3.7589  181.558   4.7756  182.240   6.0939  486.972   6.4071  487.828   8.1613 -0.8562927 10.37576 
1 1 1    7    8   16 o  801.779   5.3895  492.108   6.6141  493.188   9.3364  491.019   9.3712  802.556   7.6004  800.787   7.6455 1.769409 10.78055 
1 1 1    7    8   17 o  664.335   5.0217  337.835   5.1063  329.887   7.0479  346.618   7.4086  656.408   7.0148  672.841   7.1937 -16.43280 10.04770 
1 1 1    7    8   18 o  228.503   6.0819   39.971   2.1272   41.388   3.2622   38.922   2.8057  232.477   9.1676  225.460   8.1302 7.016434 12.25340 
1 1 1    7    8   19 o  844.309   6.1254  545.702   7.9160  543.798   12.439  546.998   10.262  842.672   9.6438  845.236   7.9324 -2.564026 12.48703 
1 1 1    7    8   20 o   73.494   12.970   4.2611   1.4057   4.9963   2.4656   3.9070   1.7110   79.195   20.259   69.994   16.278 9.200729 25.98820 
1 1 1    7    8   21 o  937.425   5.5606  672.652   7.9787  691.613   12.608  659.986   10.305  950.422   8.6665  928.498   7.2508 21.92444 11.29962 
1 1 1    7    8   22 o  1045.54   5.9449  836.772   9.5139  839.015   14.623  835.126   12.528  1046.81   9.1262  1044.44   7.8367 2.366577 12.02921 
1 1 1    7    8   23 o  861.125   5.4249  567.596   7.1504  573.383   11.055  563.432   9.3757  865.414   8.3455  857.913   7.1399 7.500793 10.98300 
1 1 1    7    8   24 o  846.595   5.8429  548.615   7.5713  567.377   11.283  533.245   10.212  860.862   8.5626  834.587   7.9942 26.27521 11.71434 
1 1 1    7    8   25 o  262.490   6.1384   52.741   2.4663   58.086   4.1199   49.756   3.0789  275.427   9.7727  254.938   7.8902 20.48933 12.56025 
1 1 1    7    8   26 o  840.324   5.4931  540.512   7.0653  543.583   10.872  538.267   9.2957  842.614   8.4298  838.526   7.2427 4.087524 11.11385 
1 1 1    7    8   27 o  1012.56   6.0623  784.825   9.3956  796.186   12.660  770.895   14.018  1019.78   8.1108  1003.40   9.1274 16.37805 12.21045 
1 1 1    7    8   28 o  777.086   5.1746  462.221   6.1548  468.475   8.8995  456.487   8.5211  782.256   7.4327  772.190   7.2095 10.06592 10.35478 
1 1 1    7    8   29 o  1442.41   7.6521  1592.90   16.894  1595.93   22.469  1588.95   25.625  1443.57   10.169  1440.26   11.624 3.314819 15.44425 
1 1 1    7    8   30 o  289.010   9.1575   63.962   4.0510   63.801   4.3676   64.959   10.837  288.629   9.8862  289.671   24.678 -1.041962 26.58438 
1 1 1    7    8   31 o  436.850   7.0771  146.107   4.7321  142.146   5.9708  152.799   7.7600  430.834   9.0542  446.607   11.352 -15.77237 14.52048 
1 1 1    7    8   32 o  333.181   6.7887   84.989   3.4621   84.942   5.0197   85.032   4.7812  333.017   9.8478  333.207   9.3747 -0.1893616 13.59644 
1 1 1    7    8   33 o  795.724   6.0041  484.736   7.3127  482.726   9.8337  487.223   10.938  793.968   8.0918  797.605   8.9592 -3.636780 12.07246 
1 1 1    7    8   34 o  542.953   6.1575  225.696   5.1172  226.064   7.0319  225.282   7.4608  543.306   8.4558  542.341   8.9876 0.9649048 12.34012 
1 1 1    7    8   35 o  255.902   9.8991   50.170   3.8774   53.430   6.6873   48.519   4.7590  263.305   16.679  251.582   12.358 11.72319 20.75857 
1 1 1    7    8   36 o  285.734   8.7003   62.541   3.8051   59.816   5.4347   65.162   5.3292  279.293   12.713  291.539   11.943 -12.24686 17.44264 
1 1 1    7    8   37 o  331.593   8.3346   84.232   4.2302   90.714   7.4157   81.105   5.1504  343.804   14.092  325.295   10.344 18.50955 17.48086 
1 1 1    7    8   38 f  292.483   8.0307   65.539   3.5952   63.276   5.1984   67.614   4.9776  287.213   11.825  296.943   10.952 -9.729675 16.11721 
1 1 1    7    8   39 o  484.018   6.4260  179.431   4.7607  174.734   7.0715  183.325   6.4382  477.406   9.6773  489.091   8.6001 -11.68555 12.94652 
1 1 1    7    8   40 f  454.164   6.3800  157.996   4.4351  161.053   6.4837  155.307   6.0800  458.319   9.2425  450.104   8.8251 8.214722 12.77912 
1 1 1    7    8   41 o  250.658   8.9995   48.179   3.4528   46.838   5.0520   49.355   4.7299  246.484   13.441  253.488   12.191 -7.004166 18.14612 
1 1 1    7    8   42 o  266.236   9.5853   54.384   3.9061   52.175   5.1444   57.392   6.0025  260.503   12.902  272.688   14.433 -12.18442 19.35857 
1 1 1    7    8   43 o  278.696   9.7010   59.616   4.1383   63.741   5.6159   54.715   6.1216  287.874   12.745  266.028   15.096 21.84567 19.75664 
1 1 1    7    8   44 o  181.797   11.540   25.510   3.1945   21.422   4.6035   29.308   4.4365  165.340   18.508  194.369   15.029 -29.02956 23.84114 
1 1 1    7    8   45 o  220.779   9.9713   37.447   3.3696   39.736   5.0204   35.570   4.5457  226.483   14.559  214.345   13.931 12.13846 20.15037 
1 1 1    7    8   46 o  154.372   13.507   18.517   3.1593   18.313   4.4377   18.727   4.4988  152.279   19.486  154.013   19.522 -1.734283 27.58300 
1 1 1    7    8   47 o  112.208   19.021   10.059   3.1502   9.6007   4.7856   10.410   4.1846  107.983   28.528  112.879   24.889 -4.895393 37.85898 
1 1 1    7    8   48 f  172.519   14.937   23.214   3.9053   21.751   6.4144   24.075   4.9229  163.704   26.505  174.811   18.688 -11.10715 32.43124 
1 1 1    7    8   49 o  170.665   13.529   22.669   3.5051   24.875   5.6079   21.256   4.4902  176.800   21.142  164.108   18.181 12.69206 27.88459 
1 1 1    7    8   50 o  298.613   8.5467   68.565   3.9064   69.264   5.8406   67.999   5.2547  299.270   12.750  296.799   11.567 2.471222 17.21522 
1 1 1    7    8   51 o  210.429   11.373   34.288   3.6494   30.490   5.4125   37.454   4.9417  196.584   18.194  219.087   14.824 -22.50305 23.46833 
1 1 1    7    8   52 o  184.421   12.632   26.458   3.5442   30.921   5.0710   22.196   4.9555  198.236   16.873  166.815   19.794 31.42117 26.00987 
1 1 1    7    8   53 o  100.475   22.741   8.3425   3.4158   7.3331   4.9537   9.2575   4.7165   94.670   30.262  104.799   28.603 -10.12892 41.64047 
1 1 1    7    8   54 o  243.083   13.658   46.091   5.0610   46.189   5.8582   45.801   10.049  242.551   15.867  235.146   28.501 7.404327 32.62004 
1 1 1    7    8   55 o  129.209   19.249   13.474   3.6907   10.208   5.2857   16.581   5.1556  109.056   30.482  141.488   24.705 -32.43221 39.23653 
1 1 1    7    8   56 o   86.441   26.029   6.2128   3.7267   7.5714   5.5724   5.1135   5.0127   95.804   32.182   83.298   30.329 12.50611 44.22111 
1 1 1    7    8   57 o   77.151   26.368   4.6623   3.7415   3.7506   5.4531   5.4732   5.1431   78.772   30.939   84.921   30.751 -6.148804 43.62167 
1 1 1    7    8   58 o  193.662   14.244   29.558   4.1927   39.775   6.0208   19.939   5.8419  223.094   17.779  153.739   25.735 69.35480 31.27949 
1 1 1    7    8   59 o  121.469   25.168   12.626   4.5256   16.706   7.2433   10.013   5.7961  134.527   34.884  105.696   32.589 28.83128 47.73851 
1 1 1    7    8   60 o  194.660   14.048   30.004   4.1576   33.245   6.2539   27.438   5.5654  201.227   20.595  182.877   20.221 18.34981 28.86236 
1 1 1    7    8   61 o   46.816   21.651  -2.3660   3.6547  -1.1790   5.0435  -3.6786   5.3033   59.168   26.608   54.836   25.604 4.331219 36.92577 
1 1 1    7    8   62 o  192.437   14.941   29.715   4.3662   21.272   6.7201   35.884   5.7438  152.513   29.856  209.378   18.101 -56.86528 34.91409 
1 1 1    7    8   63 o   66.418   25.334   3.2122   3.5783   4.0454   5.1224   2.4179   5.0009   74.969   29.813   68.587   28.617 6.382088 41.32531 
1 1 1    7    8   64 o   70.316   26.655   3.8842   3.9456   3.2073   5.3884   4.6669   5.7935   71.977   29.841   78.149   31.490 -6.172264 43.38334 
1 1 1    7    9    0 o  992.956   14.098  755.562   21.416  755.562   21.416  755.562   21.416  992.956   14.098  992.956   14.098 0.000000 0.000000 
1 1 1    7    9    1 o  339.243   9.2062   88.130   4.7804   0.0000   0.0000   88.130   4.7804  ?   ?   339.243   9.2062 0.000000 9.206203 
1 1 1    7    9    2 o  271.549   9.4246   56.470   3.9172   0.0000   0.0000   56.470   3.9172  ?   ?   271.549   9.4246 0.000000 9.424568 
1 1 1    7    9    3 o  134.713   9.3794   13.965   1.9219   16.235   2.7801   11.887   2.6600  145.013   12.652  123.711   14.312 21.30172 19.10212 
1 1 1    7    9    4 o  849.443   9.0935  552.561   11.823  556.695   16.804  548.507   16.638  852.348   12.881  846.059   12.848 6.288818 18.19276 
1 1 1    7    9    5 o  584.449   6.2783  261.497   5.6164  263.904   6.9177  256.842   9.6205  587.087   7.6982  579.046   10.855 8.040344 13.30727 
1 1 1    7    9    6 o  849.287   7.5283  552.267   9.7864  545.859   11.837  566.107   17.396  844.252   9.1601  859.448   13.224 -15.19690 16.08684 
1 1 1    7    9    7 f  766.483   6.1855  449.767   7.2568  444.253   10.136  455.565   10.394  761.648   8.6948  771.277   8.8042 -9.629456 12.37391 
1 1 1    7    9    8 o  299.303   5.3497   68.576   2.4508   69.624   3.4354   67.490   3.4975  301.545   7.4430  296.883   7.6966 4.662262 10.70682 
1 1 1    7    9    9 o  1399.02   13.265  1500.31   28.405  1524.68   40.902  1477.62   39.476  1409.16   18.963  1387.33   18.590 21.82861 26.55566 
1 1 1    7    9   10 o  277.507   7.6949   58.970   3.2685   58.361   4.6836   59.547   4.5635  275.990   11.087  278.791   10.694 -2.801025 15.40415 
1 1 1    7    9   11 o  261.957   6.8063   52.540   2.7291   58.578   4.7919   49.642   3.3201  276.489   11.323  254.597   8.5198 21.89178 14.17020 
1 1 1    7    9   12 f  261.611   6.0052   52.396   2.4046   50.966   3.3766   53.868   3.4252  257.969   8.5516  265.215   8.4377 -7.246124 12.01351 
1 1 1    7    9   13 o  407.173   5.6197  126.920   3.5024  127.017   4.9641  126.823   4.9422  407.269   7.9632  406.958   7.9341 0.3112793 11.24110 
1 1 1    7    9   14 o  751.645   5.6714  432.509   6.5249  434.175   8.3749  429.936   10.408  753.019   7.2662  749.231   9.0757 3.787903 11.62611 
1 1 1    7    9   15 o  234.513   6.3733   42.104   2.2877   49.389   3.1308   33.758   3.3511  253.964   8.0539  209.924   10.429 44.03993 13.17713 
1 1 1    7    9   16 o  525.817   5.1702  211.644   4.1612  213.665   5.3150  208.443   6.6885  528.286   6.5730  521.732   8.3755 6.553833 10.64677 
1 1 1    7    9   17 o  498.154   5.7824  189.967   4.4090  182.301   5.8747  199.853   6.6717  487.947   7.8658  510.875   8.5320 -22.92825 11.60456 
1 1 1    7    9   18 o  552.761   5.3997  233.885   4.5685  236.329   5.8648  230.115   7.2857  555.605   6.8963  548.199   8.6829 7.406250 11.08834 
1 1 1    7    9   19 o  649.103   5.1214  322.507   5.0883  328.743   7.2384  316.415   7.1544  655.294   7.2166  642.888   7.2705 12.40631 10.24404 
1 1 1    7    9   20 o  463.698   4.9862  164.579   3.5389  161.439   4.9328  167.909   5.0801  459.221   7.0178  468.331   7.0868 -9.109680 9.973559 
1 1 1    7    9   21 o  483.575   5.5043  178.995   4.0741  179.000   6.2403  178.990   5.3786  483.528   8.4317  483.539   7.2672 -0.1101685E-01 11.13130 
1 1 1    7    9   22 o  616.540   5.1119  290.952   4.8241  294.047   8.3640  289.409   5.9053  619.727   8.8174  614.882   6.2745 4.845276 10.82202 
1 1 1    7    9   23 o  421.810   5.0909  136.186   3.2868  137.285   4.9475  135.317   4.3975  423.474   7.6330  420.440   6.8333 3.033295 10.24483 
1 1 1    7    9   24 o  503.690   5.3900  194.192   4.1555  196.748   7.7470  193.160   4.9237  506.900   9.9849  502.333   6.4037 4.566956 11.86194 
1 1 1    7    9   25 o  443.114   5.4276  150.293   3.6812  150.221   6.4165  150.329   4.4945  442.936   9.4642  443.150   6.6262 -0.2139587 11.55325 
1 1 1    7    9   26 o  1092.51   6.3189  913.667   10.567  928.761   16.548  903.276   13.730  1101.32   9.8169  1086.19   8.2583 15.12817 12.82852 
1 1 1    7    9   27 o  613.401   4.9464  288.000   4.6441  286.796   6.7003  289.113   6.4428  612.068   7.1520  614.544   6.8494 -2.475891 9.902781 
1 1 1    7    9   28 o  318.600   6.0007   77.702   2.9263   80.239   4.2425   75.399   4.0416  323.720   8.5621  313.809   8.4144 9.911926 12.00466 
1 1 1    7    9   29 o  429.402   5.9062  141.147   3.8818  144.738   5.1667  136.493   5.8821  434.792   7.7636  422.194   9.1023 12.59772 11.96351 
1 1 1    7    9   30 o  324.258   7.2895   80.499   3.6179   84.121   4.9180   76.228   5.3411  331.421   9.6949  315.457   11.062 15.96429 14.70884 
1 1 1    7    9   31 o  261.285   7.4809   52.271   2.9918   47.132   4.1997   57.567   4.2632  248.044   11.062  274.149   10.160 -26.10544 15.01931 
1 1 1    7    9   32 o  335.741   6.9968   86.304   3.5956   84.392   4.9522   88.435   5.2290  331.936   9.7471  339.785   10.054 -7.849182 14.00324 
1 1 1    7    9   33 o  933.704   6.2423  667.445   8.9213  662.269   11.860  674.192   13.539  929.945   8.3322  938.193   9.4282 -8.248413 12.58242 
1 1 1    7    9   34 o  522.203   5.8238  208.770   4.6549  213.909   6.8082  204.259   6.3789  528.491   8.4164  516.448   8.0695 12.04297 11.65986 
1 1 1    7    9   35 o  369.542   7.6111  104.581   4.3051   97.531   7.3795  108.218   5.3005  356.616   13.519  375.855   9.2136 -19.23938 16.36040 
1 1 1    7    9   36 o  877.715   6.2131  589.880   8.3470  600.724   11.440  577.535   12.206  885.558   8.4398  868.224   9.1850 17.33459 12.47377 
1 1 1    7    9   37 o  167.671   13.038   21.700   3.3197   22.438   5.4099   21.254   4.2044  169.340   21.346  165.453   16.836 3.887009 27.18693 
1 1 1    7    9   38 o  352.115   7.1276   94.971   3.8415   91.473   5.5357   98.219   5.3352  345.395   10.471  357.951   9.7377 -12.55569 14.29904 
1 1 1    7    9   39 f  167.058   12.790   21.552   3.2456   18.093   4.8330   24.394   4.3803  151.616   21.422  177.327   16.322 -25.71147 26.93154 
1 1 1    7    9   40 o  233.953   9.2061   41.969   3.2967   37.838   4.6569   46.118   4.6675  221.454   13.808  244.733   12.502 -23.27820 18.62636 
1 1 1    7    9   41 o  148.384   13.654   17.072   3.0664   18.133   4.5151   16.164   4.1777  151.906   19.897  143.347   19.550 8.558319 27.89459 
1 1 1    7    9   42 o  277.875   9.5630   59.249   4.0673   59.956   5.4311   58.346   6.1377  279.247   12.707  274.882   14.641 4.365631 19.38564 
1 1 1    7    9   43 o  456.986   7.2499  160.094   5.0711  166.103   6.9245  153.144   7.4472  465.170   9.7254  446.484   10.897 18.68610 14.60598 
1 1 1    7    9   44 o  188.941   11.013   27.531   3.1712   28.024   4.4594   27.027   4.5106  189.933   15.474  186.410   15.963 3.523148 22.23158 
1 1 1    7    9   45 o  233.288   9.5644   41.803   3.4152   40.903   4.7767   42.743   4.8848  229.940   13.633  235.072   13.635 -5.132050 19.28105 
1 1 1    7    9   46 o  152.004   13.814   17.975   3.1790   23.302   4.4841   12.593   4.5076  172.540   17.209  124.603   24.507 47.93726 29.94584 
1 1 1    7    9   47 o  202.796   12.985   31.864   4.0095   32.208   6.8486   31.684   4.9456  201.451   22.600  201.546   16.168 -0.9465027E-01 27.78794 
1 1 1    7    9   48 o  104.057   19.878   8.7331   3.0506   9.6168   4.3546   7.8815   4.2748  107.954   26.540   97.998   27.420 9.955467 38.16084 
1 1 1    7    9   49 o  204.738   11.457   32.436   3.5761   35.332   5.6592   30.511   4.6141  212.184   17.583  197.676   15.371 14.50835 23.35451 
1 1 1    7    9   50 o  254.014   9.2951   49.661   3.6139   56.746   5.3610   43.759   4.8928  270.816   12.933  237.323   13.525 33.49265 18.71360 
1 1 1    7    9   51 o  191.303   12.273   28.418   3.5747   29.357   5.4430   27.707   4.7403  192.654   18.693  187.741   16.669 4.912460 25.04610 
1 1 1    7    9   52 o  153.868   14.555   18.566   3.3873   17.748   4.8115   19.370   4.7693  148.204   21.868  155.404   20.555 -7.199310 30.01169 
1 1 1    7    9   53 o  142.065   16.420   15.982   3.5047   21.620   5.0231   10.633   4.8924  164.163   20.433  112.112   28.460 52.05106 35.03532 
1 1 1    7    9   54 o  243.008   14.080   46.132   5.2148   42.158   6.0520   57.590   10.276  231.094   17.233  265.718   25.581 -34.62346 30.84479 
1 1 1    7    9   55 o   90.701   24.326   6.8801   3.4468   13.921   5.0469   0.7253   4.7187  128.616   26.518   64.675   27.438 63.94064 38.15777 
1 1 1    7    9   56 o  155.227   16.140   19.117   3.7787   22.695   5.5627   16.052   5.1491  166.751   22.358  138.621   25.196 28.12993 33.68516 
1 1 1    7    9   57 o   68.551   26.161   2.9742   3.8168   5.4004   5.4172   0.5824   5.3787   85.240   31.453   67.426   28.966 17.81333 42.75886 
1 1 1    7    9   58 f   83.776   29.071   5.6429   4.5547   11.738   7.7721   2.4549   5.6210  113.656   38.008   74.240   30.602 39.41582 48.79585 
1 1 1    7    9   59 o  136.058   18.936   15.117   3.8365   12.741   5.4543   17.443   5.3975  119.582   29.883  142.901   25.618 -23.31910 39.36076 
1 1 1    7    9   60 o  137.068   19.606   15.476   3.9961   21.197   6.1787   11.362   5.2395  156.498   26.755  112.255   29.942 44.24361 40.15458 
1 1 1    7    9   61 o  160.601   15.747   20.751   3.8211   17.797   5.2173   24.170   5.6121  143.762   24.594  169.635   22.143 -25.87263 33.09311 
1 1 1    7    9   62 o   73.299   26.346   4.3561   3.7662   4.2932   5.3780   4.4167   5.2759   77.326   30.612   77.511   30.436 -0.1847153 43.16759 
1 1 1    7    9   63 o  111.668   22.230   10.870   3.6660   15.672   5.2476   6.2933   5.1237  131.130   27.043   84.132   30.658 46.99850 40.88110 
1 1 1    7    9   64 o   94.850   26.348   8.3482   3.9619   6.7495   5.3291   10.324   5.9241   85.472   31.248  101.217   33.155 -15.74427 45.55982 
1 1 1    7   10    1 o  882.714   13.145  597.165   17.761  597.165   17.761   0.0000   0.0000  882.714   13.145  ?   ?  0.000000 13.14541 
1 1 1    7   10    2 o  299.398   5.5171   68.620   2.5283   68.312   3.0615   69.279   4.4833  298.709   6.6961  300.753   9.7392 -2.043243 11.81903 
1 1 1    7   10    3 o  441.754   7.0152  149.410   4.7434  150.021   6.7004  148.797   6.7161  442.564   9.8913  440.753   9.9552 1.810730 14.03369 
1 1 1    7   10    4 o  432.407   7.0748  143.157   4.6825  143.715   6.5804  142.586   6.6644  433.157   9.9252  431.445   10.092 1.711578 14.15464 
1 1 1    7   10    5 o  600.279   6.3917  275.869   5.8727  279.888   7.2706  268.324   9.9617  604.580   7.8568  591.805   10.997 12.77460 13.51550 
1 1 1    7   10    6 o  594.035   6.3966  270.161   5.8161  268.164   7.0684  274.348   10.235  591.783   7.8035  598.396   11.174 -6.613098 13.62925 
1 1 1    7   10    7 o  115.746   9.8918   10.337   1.7357   10.255   2.0556   10.541   3.2395  115.078   11.839  115.678   18.952 -0.5993881 22.34627 
1 1 1    7   10    8 o  589.380   6.4940  265.950   5.8584  265.892   7.1769  266.066   10.142  589.257   7.9572  589.276   11.244 -0.1867676E-01 13.77486 
1 1 1    7   10    9 o  116.916   10.094   10.549   1.7886   10.158   2.2515   11.219   2.9448  114.372   13.098  119.802   16.497 -5.429428 21.06375 
1 1 1    7   10   10 o  433.700   5.4445  143.993   3.6142  143.142   5.0608  144.880   5.1634  432.357   7.6473  434.969   7.7554 -2.612854 10.89163 
1 1 1    7   10   11 o  948.564   8.2641  689.054   11.999  692.411   20.857  687.393   14.669  950.256   14.340  947.268   10.117 2.987854 17.54964 
1 1 1    7   10   12 o  106.770   12.880   8.8644   2.0625   7.1660   3.2898   9.9643   2.6473   94.655   22.946  112.892   15.750 -18.23662 27.83076 
1 1 1    7   10   13 o  557.454   6.7059  237.922   5.7219  228.513   9.5662  243.163   7.1399  546.109   11.444  563.500   8.2780 -17.39154 14.12436 
1 1 1    7   10   14 o  706.622   6.2727  382.262   6.7844  384.510   9.6488  380.063   9.5412  708.576   8.8965  704.470   8.8485 4.106323 12.54768 
1 1 1    7   10   15 o  611.396   6.0998  286.165   5.7084  294.827   8.1818  277.950   7.9681  620.487   8.6148  602.465   8.6408 18.02161 12.20157 
1 1 1    7   10   16 o  455.341   12.664  158.868   8.8262   0.0000   0.0000  158.868   8.8262  ?   ?   455.341   12.664 0.000000 12.66382 
1 1 1    7   10   17 o  688.502   6.2497  362.883   6.5862  380.301   9.4084  346.146   9.2229  704.742   8.7220  672.341   8.9621 32.40039 12.50571 
1 1 1    7   10   18 o  241.971   6.3023   44.820   2.3342   45.696   2.8785   43.138   3.9888  244.309   7.6975  237.325   10.981 6.983963 13.41001 
1 1 1    7   10   19 o  521.021   5.4665  207.791   4.3595  220.671   5.6920  189.515   6.7801  536.899   6.9264  497.509   8.9036 39.38992 11.28050 
1 1 1    7   10   20 o  1292.72   7.3943  1279.31   14.631  1286.74   20.769  1271.99   20.615  1296.27   10.467  1288.82   10.450 7.447144 14.79093 
1 1 1    7   10   21 o  770.246   5.5493  454.118   6.5424  455.276   9.2415  452.954   9.2632  771.166   7.8293  769.196   7.8678 1.970093 11.09958 
1 1 1    7   10   22 o  1791.96   11.797  2459.29   32.356  2560.82   47.674  2372.57   44.056  1827.88   17.040  1759.51   16.359 68.36475 23.62108 
1 1 1    7   10   23 o  1718.14   13.156  2261.23   34.599  2296.43   61.423  2244.86   41.874  1729.84   23.198  1711.55   15.984 18.29163 28.17149 
1 1 1    7   10   24 o  930.650   7.7008  663.054   10.970  672.646   22.590  660.095   12.548  936.890   15.753  928.525   8.8293 8.364807 18.05870 
1 1 1    7   10   25 o  1581.03   8.0952  1913.72   19.590  1916.44   30.075  1911.72   25.819  1581.77   12.422  1579.99   10.676 1.773560 16.37949 
1 1 1    7   10   26 o  178.347   8.7185   24.354   2.3800   22.532   3.7880   25.542   3.0592  170.855   14.626  182.288   11.016 -11.43326 18.31043 
1 1 1    7   10   27 o  341.816   6.0525   89.438   3.1666   86.181   5.0088   91.607   4.0870  335.472   9.7546  345.911   7.7192 -10.43945 12.43943 
1 1 1    7   10   28 o  590.639   5.9093  267.046   5.3423  277.628   7.8238  257.802   7.3126  602.153   8.4887  580.263   8.2333 21.88983 11.82560 
1 1 1    7   10   29 o  484.971   6.0672  180.047   4.5038  190.689   8.2085  175.463   5.3870  498.957   10.748  478.728   7.3517 20.22891 13.02190 
1 1 1    7   10   30 o  459.134   9.2296  161.437   6.4862   0.0000   0.0000  161.437   6.4862  ?   ?   459.134   9.2296 0.000000 9.229567 
1 1 1    7   10   31 o  632.968   5.3746  306.695   5.2071  312.867   7.5427  301.076   7.1973  639.224   7.7091  627.071   7.4987 12.15338 10.75457 
1 1 1    7   10   32 o  145.521   13.053   16.361   2.8766   14.435   3.9984   18.428   4.1416  135.683   19.839  153.923   17.914 -18.23920 26.73003 
1 1 1    7   10   33 o  654.322   5.6230  327.760   5.6315  331.724   8.0185  323.902   7.9109  658.165   7.9596  650.360   7.9470 7.804871 11.24765 
1 1 1    7   10   34 o  457.545   7.1103  160.303   4.9795  161.543   7.7018  159.413   6.5273  459.139   10.959  456.182   9.3482 2.957367 14.40454 
1 1 1    7   10   35 o  382.794   7.1924  112.213   4.2142  110.249   5.5580  114.869   6.4633  379.338   9.5725  387.140   10.907 -7.802368 14.51214 
1 1 1    7   10   36 o  444.940   6.2143  151.592   4.2322  149.711   6.0536  153.390   5.9190  442.044   8.9470  447.459   8.6423 -5.415100 12.43933 
1 1 1    7   10   37 o  383.374   7.1956  112.576   4.2224  114.056   6.8829  111.683   5.3467  385.626   11.661  381.753   9.1503 3.873169 14.82249 
1 1 1    7   10   38 o  240.699   9.0165   44.405   3.3219   43.427   4.8312   45.282   4.5749  237.451   13.347  242.592   12.362 -5.141541 18.19199 
1 1 1    7   10   39 o  644.008   5.8315  317.638   5.7484  309.986   8.1183  325.331   8.1405  635.967   8.3399  651.538   8.1629 -15.57056 11.66992 
1 1 1    7   10   40 o  447.366   6.2202  153.308   4.2593  145.247   6.0402  161.281   6.0072  435.220   9.0671  458.664   8.5567 -23.44370 12.46712 
1 1 1    7   10   41 o  646.718   6.3180  320.432   6.2541  316.311   8.1999  326.163   9.6703  642.291   8.3407  652.003   9.6899 -9.712219 12.78525 
1 1 1    7   10   42 o  208.018   11.520   33.349   3.6538   33.378   4.7635   33.308   5.6948  207.591   15.095  206.823   18.173 0.7679901 23.62480 
1 1 1    7   10   43 f  287.212   7.8091   63.260   3.4330   67.338   4.8994   59.326   4.8118  296.050   10.812  277.828   11.315 18.22186 15.65038 
1 1 1    7   10   44 o  239.279   8.9391   43.948   3.2739   42.972   4.6766   44.885   4.5848  235.867   13.004  241.164   12.463 -5.297546 18.01201 
1 1 1    7   10   45 o   49.710   21.185   0.0302   2.8357   0.5719   3.8415  -0.6184   4.2036   59.680   25.006   57.980   25.256 1.700447 35.54097 
1 1 1    7   10   46 o  349.644   7.1166   93.779   3.8086   94.429   5.5000   93.180   5.2792  350.415   10.254  348.145   9.9069 2.269348 14.25826 
1 1 1    7   10   47 o  280.835   9.7286   60.652   4.1819   62.907   6.9528   59.374   5.2346  284.395   16.038  277.455   12.326 6.940094 20.22720 
1 1 1    7   10   48 o  233.316   9.6437   41.883   3.4440   44.615   5.0802   39.559   4.6848  239.736   13.904  225.761   13.621 13.97559 19.46446 
1 1 1    7   10   49 o  560.502   6.9142  241.154   5.9318  248.630   9.6959  236.681   7.4989  567.766   11.157  554.757   8.8313 13.00903 14.22926 
1 1 1    7   10   50 o  283.944   8.8527   62.026   3.8475   65.373   5.8609   59.492   5.1003  290.583   13.177  277.474   12.009 13.10818 17.82859 
1 1 1    7   10   51 o  357.073   7.8410   98.013   4.2855   99.143   6.3860   97.088   5.7804  358.167   11.649  354.720   10.646 3.447113 15.78078 
1 1 1    7   10   52 o  197.488   11.607   30.261   3.4931   33.688   5.1648   27.372   4.7423  207.037   16.433  186.378   16.804 20.65884 23.50385 
1 1 1    7   10   53 o  169.745   15.451   22.664   3.9705   19.673   5.2099   26.809   6.1324  155.671   22.519  182.166   22.470 -26.49496 31.81212 
1 1 1    7   10   54 o  315.123   9.8954   76.670   4.7729   78.832   6.1836   73.482   7.5069  318.642   12.679  305.914   16.089 12.72800 20.48405 
1 1 1    7   10   55 o  144.277   16.348   16.534   3.5465   19.185   5.2464   14.304   4.8126  152.968   23.130  130.985   24.915 21.98335 33.99594 
1 1 1    7   10   56 o   60.316   24.441   1.5241   3.5111   5.5459   5.1439  -1.9842   4.8042   85.440   30.781   56.871   25.735 28.56919 40.12194 
1 1 1    7   10   57 o   46.760   21.681  -2.7475   3.7000  -1.3313   5.2418  -4.1539   5.2236   61.112   27.330   54.320   25.379 6.791409 37.29597 
1 1 1    7   10   58 o  109.216   27.209   10.354   4.5318   8.4635   7.2798   11.551   5.7907  100.405   36.551  113.606   31.959 -13.20114 48.55204 
1 1 1    7   10   59 f   65.777   25.469   2.6976   3.6541   2.8028   5.1381   2.5899   5.1978   72.769   29.538   72.256   29.564 0.5124512 41.79143 
1 1 1    7   10   60 f  163.598   16.578   21.557   4.0938   23.375   6.1512   20.111   5.4850  165.456   25.075  153.894   24.074 11.56145 34.76094 
1 1 1    7   10   61 o   87.216   25.450   6.6869   3.6082   4.3562   4.9661   9.2931   5.2513   77.085   29.735  100.400   31.031 -23.31469 42.97756 
1 1 1    7   10   62 o  168.358   15.807   22.977   4.0258   17.317   5.8705   28.002   5.5311  137.389   28.835  182.999   20.077 -45.61049 35.13605 
1 1 1    7   10   63 o  216.083   13.043   37.254   4.2938   32.158   6.7171   40.776   5.5835  192.440   23.277  223.468   16.439 -31.02811 28.49718 
1 1 1    7   11    0 o  827.860   12.715  525.261   16.103  525.261   16.103  525.261   16.103  827.860   12.715  827.860   12.715 0.000000 0.000000 
1 1 1    7   11    1 o  549.381   7.4012  231.100   6.2237  231.100   6.2237   0.0000   0.0000  549.381   7.4012  ?   ?  0.000000 7.401197 
1 1 1    7   11    2 o  1108.43   10.934  941.291   18.551  941.291   18.551   0.0000   0.0000  1108.43   10.934  ?   ?  0.000000 10.93427 
1 1 1    7   11    3 o  334.213   7.2764   85.525   3.7223   89.852   5.2184   81.043   5.3110  342.491   9.9545  325.248   10.668 17.24387 14.59123 
1 1 1    7   11    4 o  636.026   7.9676  309.773   7.7566  317.453   11.155  302.583   10.793  643.672   11.322  628.422   11.221 15.24988 15.94041 
1 1 1    7   11    5 o  1218.56   9.6942  1137.40   18.081  1133.44   22.103  1145.39   31.437  1216.17   11.874  1221.76   16.811 -5.588867 20.58116 
1 1 1    7   11    6 f  740.966   7.1273  420.382   8.0834  419.733   9.8364  421.733   14.186  740.307   8.6807  741.786   12.495 -1.479248 15.21416 
1 1 1    7   11    7 o  519.344   7.6862  206.536   6.1100  206.536   6.1100   0.0000   0.0000  519.344   7.6862  ?   ?  0.000000 7.686244 
1 1 1    7   11    8 o  428.357   5.3736  140.466   3.5233  139.129   4.9256  141.867   5.0418  426.257   7.5494  430.427   7.6527 -4.170410 10.74975 
1 1 1    7   11    9 o  814.085   6.5328  507.403   8.1403  499.058   11.305  516.391   11.731  807.207   9.1497  821.092   9.3344 -13.88507 13.07092 
1 1 1    7   11   10 o  277.318   5.8852   58.876   2.4981   60.915   3.5179   56.801   3.5480  282.039   8.1490  272.341   8.5114 9.697418 11.78342 
1 1 1    7   11   11 o  895.455   6.9497  613.929   9.5253  605.435   13.236  623.055   13.719  889.052   9.7263  901.878   9.9382 -12.82690 13.90568 
1 1 1    7   11   12 o  238.507   6.5691   43.552   2.3982   41.029   3.3350   46.253   3.4511  231.451   9.4137  245.748   9.1747 -14.29637 13.14511 
1 1 1    7   11   13 f  584.631   8.4368  261.734   7.5497  250.066   10.218  275.759   11.203  571.297   11.686  599.898   12.201 -28.60162 16.89438 
1 1 1    7   11   14 o  505.730   8.3050  195.845   6.4288  200.090   9.0051  191.432   9.1809  511.055   11.512  499.853   12.000 11.20236 16.62885 
1 1 1    7   11   15 o  527.738   11.817  213.361   9.5453  213.361   9.5453   0.0000   0.0000  527.738   11.817  ?   ?  0.000000 11.81687 
1 1 1    7   11   16 o  414.540   7.0395  131.558   4.4666  145.127   8.1013  125.632   5.3539  435.250   12.160  405.062   8.6353 30.18784 14.91451 
1 1 1    7   11   17 o  928.925   6.4872  660.563   9.2238  677.364   12.093  637.193   14.263  940.580   8.3997  912.168   10.216 28.41229 13.22550 
1 1 1    7   11   18 o  801.621   6.0489  491.892   7.4219  493.137   9.5081  489.950   11.874  802.581   7.7399  799.904   9.6982 2.676453 12.40809 
1 1 1    7   11   19 o  868.962   6.3798  578.013   8.4855  583.558   10.959  569.714   13.408  873.057   8.2011  862.554   10.156 10.50250 13.05382 
1 1 1    7   11   20 o  868.781   5.8299  577.747   7.7525  592.678   11.135  563.702   10.800  879.858   8.2684  858.082   8.2226 21.77557 11.66097 
1 1 1    7   11   21 o  1107.65   6.7055  939.164   11.368  930.825   15.869  947.956   16.294  1102.60   9.4031  1112.69   9.5673 -10.09082 13.41459 
1 1 1    7   11   22 o  597.335   6.2713  273.126   5.7338  263.668   7.9290  283.493   8.3016  586.844   8.8273  608.505   8.9131 -21.66077 12.54446 
1 1 1    7   11   23 o  620.177   6.7924  294.426   6.4477  315.665   13.972  288.679   7.2679  641.894   14.221  614.073   7.7325 27.82117 16.18727 
1 1 1    7   11   24 o  816.836   6.4586  510.750   8.0750  487.060   12.144  529.528   10.812  797.543   9.9478  831.647   8.4934 -34.10394 13.08039 
1 1 1    7   11   25 o  675.652   6.2187  349.448   6.4312  337.797   9.7690  358.360   8.5437  664.190   9.6093  684.158   8.1587 -19.96814 12.60563 
1 1 1    7   11   26 o  576.603   5.8478  254.498   5.1610  247.739   7.2417  261.475   7.3573  568.833   8.3173  584.393   8.2252 -15.56036 11.69750 
1 1 1    7   11   27 o  645.978   6.6587  319.449   6.5838  316.747   8.2710  324.123   10.877  643.185   8.4014  650.526   10.924 -7.341858 13.78104 
1 1 1    7   11   28 o  865.052   6.3902  572.860   8.4611  576.483   12.125  569.420   11.813  867.654   9.1296  862.332   8.9500 5.322144 12.78482 
1 1 1    7   11   29 o  206.424   14.741   32.829   4.6270   0.0000   0.0000   32.829   4.6270  ?   ?   206.424   14.741 0.000000 14.74139 
1 1 1    7   11   30 o  569.978   5.7349  248.697   5.0033  255.152   7.9979  244.547   6.4131  577.213   9.0525  565.152   7.4137 12.06116 11.70089 
1 1 1    7   11   31 o  128.613   15.043   12.856   2.9055   10.149   4.5712   14.692   3.7635  112.570   26.898  137.138   18.393 -24.56843 32.58480 
1 1 1    7   11   32 o  1028.04   6.4969  809.146   10.223  789.329   15.643  823.920   13.507  1015.09   10.068  1037.23   8.5075 -22.14453 13.18113 
1 1 1    7   11   33 o  319.397   7.7503   78.121   3.7890   85.835   6.5250   74.197   4.6540  334.619   12.740  311.215   9.7700 23.40405 16.05476 
1 1 1    7   11   34 o  322.417   10.039   79.648   4.9545   49.051   9.7430   90.320   5.7540  250.929   25.731  343.300   10.950 -92.37103 27.96417 
1 1 1    7   11   35 o  358.302   7.5538   98.324   4.1427   96.229   5.7235  100.630   6.0038  354.338   10.553  362.336   10.825 -7.998077 15.11806 
1 1 1    7   11   36 o  458.424   7.0672  160.952   4.9589  169.890   7.7251  154.689   6.4672  470.751   10.721  449.285   9.4043 21.46585 14.26126 
1 1 1    7   11   37 o  631.327   5.9682  305.221   5.7673  307.847   8.6789  303.143   7.7177  633.796   8.9464  629.021   8.0159 4.775696 12.01218 
1 1 1    7   11   38 o  403.801   6.4411  124.890   3.9810  123.705   5.6968  126.021   5.5656  401.706   9.2651  405.471   8.9677 -3.764709 12.89424 
1 1 1    7   11   39 o  522.619   5.9025  209.193   4.7216  205.327   6.6844  213.042   6.6704  517.559   8.4379  527.208   8.2660 -9.649475 11.81209 
1 1 1    7   11   40 o  421.297   6.3042  135.973   4.0652  135.682   5.7607  136.261   5.7376  420.634   8.9475  421.535   8.8925 -0.9007874 12.61489 
1 1 1    7   11   41 o  547.187   6.7519  229.441   5.6550  227.348   7.5935  232.047   8.4735  544.397   9.1129  549.851   10.068 -5.453796 13.57978 
1 1 1    7   11   42 o  715.286   6.7048  392.114   7.3406  383.772   9.8745  402.419   10.975  707.212   9.1221  724.021   9.9033 -16.80914 13.46438 
1 1 1    7   11   43 o  263.681   8.0526   53.331   3.2500   48.493   4.4885   58.663   4.7121  251.123   11.677  276.263   11.144 -25.13950 16.14121 
1 1 1    7   11   44 o  322.538   7.5722   79.794   3.7383   78.080   5.1124   81.763   5.4802  318.730   10.479  326.095   10.979 -7.364319 15.17777 
1 1 1    7   11   45 o  407.391   6.5079  127.250   4.0581  124.280   5.8653  129.977   5.6206  402.190   9.5277  411.403   8.9258 -9.212250 13.05551 
1 1 1    7   11   46 o  361.275   7.7109  100.174   4.2640  102.225   7.3738   99.145   5.2264  363.943   13.237  359.146   9.5074 4.796234 16.29750 
1 1 1    7   11   47 o  183.681   11.161   26.086   3.1231   26.129   4.4429   26.044   4.3912  182.852   16.036  182.588   15.870 0.2646027 22.56152 
1 1 1    7   11   48 o  430.992   7.2024  142.597   4.7513  146.969   7.8198  140.039   5.9822  436.452   11.706  426.704   9.1594 9.747528 14.86319 
1 1 1    7   11   49 o  344.189   8.0014   91.036   4.2153   88.550   6.7532   92.623   5.3955  338.313   13.041  346.741   10.166 -8.427368 16.53565 
1 1 1    7   11   50 o  174.540   12.000   23.653   3.1864   28.412   4.7681   19.812   4.2832  190.225   16.541  158.193   18.010 32.03177 24.45336 
1 1 1    7   11   51 o  124.801   16.557   12.360   3.0848   5.9281   4.2498   19.522   4.4847   86.335   28.072  156.548   19.113 -70.21261 33.96068 
1 1 1    7   11   52 o  119.649   18.405   11.489   3.2627   5.6337   4.5454   17.713   4.6860   85.262   29.063  148.147   21.276 -62.88513 36.01871 
1 1 1    7   11   53 o   86.459   25.271   6.1718   3.5549   3.5957   4.7708   9.3873   5.3302   76.254   29.213  105.198   31.001 -28.94358 42.59626 
1 1 1    7   11   54 o  118.299   21.505   11.469   3.7505   17.876   4.7830   1.2400   6.0433  148.289   21.716   73.492   31.107 74.79722 37.93774 
1 1 1    7   11   55 o  144.887   16.181   16.669   3.5271   26.144   5.3572   9.4199   4.6859  180.439   19.718  104.971   28.453 75.46759 34.61729 
1 1 1    7   11   56 o  127.410   19.873   13.218   3.7491   16.918   5.3522   9.6547   5.2532  141.989   25.567  105.521   30.685 36.46807 39.94057 
1 1 1    7   11   57 o  312.071   9.2330   75.292   4.4103   78.536   6.5321   72.575   5.9787  316.926   13.466  304.970   12.808 11.95633 18.58397 
1 1 1    7   11   58 f   66.437   26.853   2.1671   4.2269   10.980   7.3268  -2.2295   5.1750  109.955   36.902   58.016   26.431 51.93929 45.39127 
1 1 1    7   11   59 o  364.095   8.9631  102.659   4.9950  111.497   8.0241   97.068   6.3825  376.328   13.930  352.508   11.829 23.82007 18.27518 
1 1 1    7   11   60 o  297.163   12.599   69.331   5.7304   29.355   10.186   87.839   6.9311  173.013   39.354  333.814   13.565 -160.8008 41.62610 
1 1 1    7   11   61 o  218.782   13.369   37.986   4.4555   45.308   6.7118   32.218   5.9575  235.029   18.815  197.111   20.024 37.91800 27.47675 
1 1 1    7   11   62 o  197.630   12.612   31.016   3.7953   26.346   5.2961   35.948   5.4416  177.419   19.842  209.720   17.101 -32.30144 26.19441 
1 1 1    7   11   63 o   91.598   27.279   7.7954   4.1100   5.3693   5.7204   10.384   5.9089   80.788   31.702  102.040   33.097 -21.25267 45.83003 
1 1 1    7   12    0 o  626.344   11.140  300.700   10.672  300.700   10.672  300.700   10.672  626.344   11.140  626.344   11.140 0.000000 0.000000 
1 1 1    7   12    1 o  200.324   6.7411   30.725   2.0670   29.067   2.5221   34.117   3.6071  194.818   8.4579  210.713   11.224 -15.89442 14.05436 
1 1 1    7   12    2 o  1205.93   9.5880  1113.94   17.698  1165.75   22.738  1034.33   28.188  1233.34   12.045  1161.16   15.860 72.18115 19.91523 
1 1 1    7   12    3 o  395.003   10.191  119.527   6.1612  119.527   6.1612   0.0000   0.0000  395.003   10.191  ?   ?  0.000000 10.19055 
1 1 1    7   12    4 o  536.833   10.741  220.796   8.8261  220.796   8.8261   0.0000   0.0000  536.833   10.741  ?   ?  0.000000 10.74131 
1 1 1    7   12    5 o  389.113   7.4696  115.936   4.4488  115.936   4.4488   0.0000   0.0000  389.113   7.4696  ?   ?  0.000000 7.469610 
1 1 1    7   12    6 o  230.551   7.0474   40.698   2.4869   38.831   2.9012   45.872   4.8296  225.178   8.4173  244.291   12.963 -19.11255 15.45572 
1 1 1    7   12    7 o  997.528   8.4793  762.042   12.946  763.324   15.897  759.515   22.310  998.200   10.405  995.218   14.646 2.981750 17.96544 
1 1 1    7   12    8 o  310.281   6.4472   73.708   3.0619   74.210   3.7119   72.639   5.4165  311.309   7.7900  307.894   11.493 3.414734 13.88462 
1 1 1    7   12    9 o  611.545   5.8378  286.306   5.4645  292.239   7.7941  280.569   7.6633  617.757   8.2429  605.295   8.2714 12.46173 11.67742 
1 1 1    7   12   10 o  329.605   5.7679   83.167   2.9099   85.247   4.0303   80.902   4.2059  333.660   7.8915  325.032   8.4539 8.628082 11.56483 
1 1 1    7   12   11 o  915.974   8.1715  642.459   11.457  642.517   13.976  642.341   20.004  915.892   9.9692  915.371   14.277 0.5203857 17.41352 
1 1 1    7   12   12 o  447.544   6.6096  153.342   4.5277  153.785   5.4654  152.374   8.0838  448.155   7.9676  445.958   11.843 2.196838 14.27349 
1 1 1    7   12   13 o  576.946   5.9663  254.815   5.2688  255.808   7.4229  253.806   7.4798  577.995   8.3903  575.726   8.4880 2.269470 11.93499 
1 1 1    7   12   14 o  816.237   7.8255  510.100   9.7769  517.543   17.107  506.491   11.914  821.820   13.600  813.259   9.5713 8.561401 16.63023 
1 1 1    7   12   15 o  590.573   7.0394  267.009   6.3632  268.795   11.039  266.120   7.7870  592.357   12.176  589.542   8.6295 2.814697 14.92360 
1 1 1    7   12   16 o  525.736   7.0595  211.595   5.6808  223.337   10.149  206.237   6.8553  539.963   12.280  518.999   8.6296 20.96362 15.00899 
1 1 1    7   12   17 o  1003.48   7.7355  770.907   11.881  774.852   16.993  767.133   16.619  1005.87   11.037  1000.86   10.848 5.011536 15.47584 
1 1 1    7   12   18 o  480.046   5.4550  176.390   4.0082  176.919   5.0368  175.477   6.6188  480.744   6.8450  478.735   9.0326 2.008881 11.33322 
1 1 1    7   12   19 o  1659.62   9.8440  2108.99   25.006  2097.27   31.983  2127.42   40.110  1654.74   12.627  1666.22   15.727 -11.47461 20.16929 
1 1 1    7   12   20 o  778.432   6.1271  463.836   7.3004  460.392   9.2411  469.553   11.907  775.492   7.7853  783.094   9.9338 -7.602112 12.62112 
1 1 1    7   12   21 o  1656.31   12.686  2101.25   32.161  2068.68   38.612  2175.02   58.115  1643.11   15.353  1683.65   22.551 -40.53894 27.28108 
1 1 1    7   12   22 o  963.450   6.9605  710.571   10.265  708.886   16.386  711.660   13.168  962.118   11.127  964.109   8.9234 -1.991394 14.26322 
1 1 1    7   12   23 o  791.015   7.3426  479.000   8.8900  473.269   12.436  484.989   12.713  786.156   10.335  795.826   10.437 -9.670349 14.68803 
1 1 1    7   12   24 o  902.247   6.1927  623.140   8.5521  630.679   12.190  615.833   12.001  907.588   8.7753  896.844   8.7423 10.74414 12.38679 
1 1 1    7   12   25 o  389.389   6.0433  116.065   3.6018  116.670   5.1310  115.479   5.0573  390.357   8.5876  388.361   8.5078 1.995972 12.08838 
1 1 1    7   12   26 o  289.777   7.7136   64.289   3.4213   64.755   5.0736   63.900   4.6333  290.760   11.400  288.853   10.480 1.907074 15.48494 
1 1 1    7   12   27 o  864.600   7.7891  572.337   10.308  566.006   14.072  579.667   15.142  859.647   10.694  869.914   11.372 -10.26709 15.61083 
1 1 1    7   12   28 o  978.763   7.3127  733.442   10.955  724.536   17.016  739.746   14.317  972.529   11.431  982.828   9.5173 -10.29901 14.87453 
1 1 1    7   12   29 o  994.885   7.4293  757.833   11.313  786.192   18.224  740.052   14.431  1013.00   11.753  983.002   9.5909 29.99658 15.17001 
1 1 1    7   12   30 o  759.291   7.0502  441.406   8.1937  442.558   10.574  439.677   12.962  760.175   9.0880  757.562   11.179 2.613586 14.40668 
1 1 1    7   12   31 o   87.934   24.147   6.1338   3.3494   1.2401   4.8377   10.639   4.6418   69.504   28.489  115.244   26.818 -45.74007 39.12587 
1 1 1    7   12   32 o  328.662   7.4633   82.714   3.7545   91.903   6.3512   77.777   4.6549  346.288   11.982  318.647   9.5439 27.64029 15.31880 
1 1 1    7   12   33 o  715.585   6.0447  392.045   6.6207  376.521   10.318  402.912   8.6324  701.059   9.6151  725.340   7.7754 -24.28064 12.36553 
1 1 1    7   12   34 o  561.080   6.4684  241.054   5.5551  233.221   8.6075  246.645   7.2724  551.678   10.193  567.451   8.3730 -15.77338 13.19138 
1 1 1    7   12   35 o  566.479   6.1739  245.721   5.3532  243.653   8.7022  246.980   6.7898  563.837   10.083  567.837   7.8120 -3.999268 12.75548 
1 1 1    7   12   36 o  771.524   8.0362  456.030   9.4901  452.227   21.361  456.966   10.593  766.641   18.204  772.216   8.9620 -5.574524 20.29026 
1 1 1    7   12   37 o  312.398   8.6331   74.792   4.1281   69.145   6.5706   78.475   5.3060  300.011   14.309  319.870   10.837 -19.85867 17.94944 
1 1 1    7   12   38 f  361.156   7.8568   99.953   4.3432   95.987   6.8290  102.646   5.6281  353.557   12.619  365.840   10.051 -12.28250 16.13260 
1 1 1    7   12   39 o  232.940   8.6059   41.600   3.0684   43.486   4.3451   39.724   4.3336  237.667   11.983  227.062   12.517 10.60512 17.32849 
1 1 1    7   12   40 o  505.192   6.4373  195.539   4.9777  195.143   6.5509  196.080   7.6569  504.474   8.4838  505.509   9.8959 -1.034668 13.03470 
1 1 1    7   12   41 o  267.894   8.0132   55.030   3.2858   58.504   4.8238   52.022   4.4880  275.950   11.421  260.229   11.267 15.72113 16.04328 
1 1 1    7   12   42 o  395.531   7.1001  119.929   4.2985  118.587   5.4538  122.129   6.9842  393.106   9.0640  398.613   11.447 -5.506622 14.60105 
1 1 1    7   12   43 o  189.829   10.471   27.772   3.0306   29.613   4.1944   25.762   4.3836  195.497   14.112  181.953   15.899 13.54398 21.25896 
1 1 1    7   12   44 o  447.108   6.4625  153.251   4.4227  154.008   6.1069  152.416   6.4136  447.868   8.9085  445.465   9.4062 2.403778 12.95523 
1 1 1    7   12   45 o  312.428   7.3370   74.885   3.5087   71.151   4.9665   78.606   4.9575  304.126   10.669  319.744   10.129 -15.61746 14.71176 
1 1 1    7   12   46 o  286.117   9.1973   62.917   4.0278   54.883   6.5556   67.790   5.1051  265.570   16.205  296.678   11.242 -31.10837 19.72268 
1 1 1    7   12   47 o  197.147   10.034   29.989   3.0179   27.915   4.2375   32.124   4.2991  189.284   14.742  203.324   13.897 -14.03941 20.25999 
1 1 1    7   12   48 o  202.125   10.925   31.586   3.3674   43.804   5.5678   24.539   4.2284  237.035   15.430  177.047   15.768 59.98764 22.06227 
1 1 1    7   12   49 o  219.559   9.6765   37.120   3.2519   32.978   4.7790   40.691   4.4377  205.469   15.305  229.030   12.709 -23.56149 19.89401 
1 1 1    7   12   50 o  112.233   17.857   10.083   2.9648   10.335   4.1913   9.8312   4.1946  111.691   25.125  108.790   25.614 2.900894 35.87977 
1 1 1    7   12   51 o  244.859   9.3056   46.186   3.4876   43.655   4.9752   48.632   4.8904  236.749   13.789  250.214   12.812 -13.46429 18.82261 
1 1 1    7   12   52 o  309.237   9.1584   73.685   4.3349   79.917   5.7848   65.705   6.5465  321.340   11.761  290.075   14.794 31.26486 18.89926 
1 1 1    7   12   53 o  186.569   14.332   27.270   4.0614   30.013   5.2295   23.102   6.4472  194.613   17.751  167.208   26.038 27.40465 31.51348 
1 1 1    7   12   54 o  257.140   9.5639   51.040   3.7642   49.799   5.5164   52.121   5.1493  252.266   14.346  258.583   13.052 -6.316986 19.39487 
1 1 1    7   12   55 o   99.571   22.327   8.2558   3.3188   8.1723   4.6364   8.3436   4.7528   98.031   28.919   98.971   29.303 -0.9403076 41.17011 
1 1 1    7   12   56 o  278.817   9.9029   60.146   4.2262   65.393   5.9974   54.971   5.9563  289.365   13.541  264.421   14.776 24.94370 20.04196 
1 1 1    7   12   57 o   54.406   24.342  -1.1986   4.1633  -0.2009   7.1619  -1.7078   5.1167   73.668   32.500   59.177   26.688 14.49110 42.05338 
1 1 1    7   12   58 o  371.548   11.296  107.525   6.4242   70.531   11.566  124.030   7.7255  288.993   26.441  398.148   12.677 -109.1544 29.32253 
1 1 1    7   12   59 o  337.387   11.443   88.850   5.9091   89.283   8.7453   88.486   8.0157  333.771   17.176  333.843   15.687 -0.7229614E-01 23.26148 
1 1 1    7   12   60 o  118.653   21.790   11.923   3.8115   19.487   5.6748   5.7063   5.1446  149.973   25.643   83.660   30.685 66.31364 39.98877 
1 1 1    7   12   61 o  136.201   18.183   15.326   3.6961   14.258   5.2659   16.363   5.1890  125.217   28.158  136.033   25.867 -10.81599 38.23567 
1 1 1    7   12   62 f  175.983   13.407   24.766   3.5843   22.416   4.9690   27.316   5.1752  162.935   20.369  181.132   18.947 -18.19710 27.81891 
1 1 1    7   12   63 o   65.314   25.863   2.8770   3.8396   5.4983   5.3470   0.0865   5.5170   80.425   30.899   63.155   28.155 17.26987 41.80318 
1 1 1    7   13    0 o  450.530   10.417  155.668   7.1749  155.668   7.1749  155.668   7.1749  450.530   10.417  450.530   10.417 0.000000 0.000000 
1 1 1    7   13    1 o  674.087   8.3560  347.976   8.6215  346.346   11.967  349.735   12.431  672.305   11.629  675.557   12.022 -3.251709 16.72656 
1 1 1    7   13    2 o  1107.61   11.051  939.933   18.735  939.933   18.735   0.0000   0.0000  1107.61   11.051  ?   ?  0.000000 11.05067 
1 1 1    7   13    3 o  247.484   11.038   46.926   4.1812   46.926   4.1812   0.0000   0.0000  247.484   11.038  ?   ?  0.000000 11.03776 
1 1 1    7   13    4 o  1365.38   13.054  1428.95   27.282  1553.85   42.200  1339.27   35.760  1422.48   19.382  1320.98   17.686 101.4922 26.23827 
1 1 1    7   13    5 o  253.095   8.2833   49.054   3.2089   49.054   3.2089   0.0000   0.0000  253.095   8.2833  ?   ?  0.000000 8.283349 
1 1 1    7   13    6 o  616.700   8.2354  291.237   7.7737  291.237   7.7737   0.0000   0.0000  616.700   8.2354  ?   ?  0.000000 8.235351 
1 1 1    7   13    7 o  733.377   7.2526  411.803   8.1412  423.708   10.171  390.581   13.581  743.815   8.9340  713.918   12.428 29.89655 15.30620 
1 1 1    7   13    8 o  540.318   6.5933  223.510   5.4528  221.956   6.6411  226.725   9.5527  538.389   8.0588  543.992   11.473 -5.603027 14.02026 
1 1 1    7   13    9 o  400.645   6.5142  122.887   3.9948  119.231   4.7937  131.197   7.2269  394.607   7.9366  413.823   11.410 -19.21640 13.89847 
1 1 1    7   13   10 o  457.658   5.6778  160.335   3.9773  162.618   5.6034  158.017   5.6465  460.849   7.9437  454.278   8.1205 6.570923 11.35985 
1 1 1    7   13   11 o  371.620   5.8205  105.717   3.3108  108.076   4.6689  103.332   4.6955  375.699   8.1190  367.356   8.3508 8.342987 11.64701 
1 1 1    7   13   12 o  585.989   5.9965  262.861   5.3784  267.046   7.6629  258.797   7.5508  590.562   8.4773  581.369   8.4853 9.193237 11.99443 
1 1 1    7   13   13 o  380.896   6.9000  111.067   4.0228  112.751   7.1242  110.280   4.8742  383.648   12.132  379.514   8.3908 4.133087 14.75096 
1 1 1    7   13   14 o  1513.34   11.749  1754.20   27.215  1766.56   47.606  1748.20   33.170  1517.36   20.498  1510.44   14.347 6.916870 25.02009 
1 1 1    7   13   15 o  359.379   6.2847   98.865   3.4570   97.275   4.8108  100.563   4.9711  356.438   8.8179  362.410   8.9615 -5.971497 12.57237 
1 1 1    7   13   16 o  199.018   8.6630   30.325   2.6389   31.044   3.7461   29.617   3.7181  200.950   12.238  196.244   12.443 4.706558 17.45212 
1 1 1    7   13   17 o  779.840   7.9130  465.578   9.4453  461.168   16.145  467.874   11.647  775.891   13.594  781.695   9.7340 -5.803772 16.71987 
1 1 1    7   13   18 o  916.039   8.5428  642.433   11.978  653.258   21.043  637.244   14.568  923.377   14.889  912.249   10.433 11.12775 18.18045 
1 1 1    7   13   19 o  741.151   8.0028  420.526   9.0786  396.604   15.380  433.318   11.247  719.526   13.965  752.280   9.7676 -32.75415 17.04226 
1 1 1    7   13   20 o  710.883   7.5402  386.866   8.2045  386.396   9.9709  387.852   14.437  710.402   9.1699  711.574   13.256 -1.172058 16.11823 
1 1 1    7   13   21 o  131.081   14.646   13.328   2.8884   13.708   4.0922   12.951   4.0773  132.071   20.942  128.199   21.543 3.871536 30.04434 
1 1 1    7   13   22 o  1521.77   9.2834  1773.13   21.623  1753.60   27.444  1805.09   35.116  1513.15   11.849  1534.86   14.947 -21.70972 19.07427 
1 1 1    7   13   23 o  836.967   5.9726  536.221   7.6514  540.296   10.791  532.102   10.850  840.057   8.3926  833.659   8.5033 6.398499 11.94745 
1 1 1    7   13   24 o  783.485   5.9484  469.887   7.1335  465.979   9.9542  474.013   10.228  780.140   8.3361  786.831   8.4925 -6.690796 11.90012 
1 1 1    7   13   25 o  730.143   5.9140  408.087   6.6093  417.294   9.3961  399.069   9.2987  738.253   8.3152  721.948   8.4149 16.30450 11.83013 
1 1 1    7   13   26 o  1104.36   7.7206  933.767   13.051  943.476   16.942  919.598   20.466  1109.94   9.9724  1095.62   12.204 14.31934 15.76039 
1 1 1    7   13   27 o  706.643   6.6334  382.277   7.1747  381.690   11.157  382.691   9.3688  705.941   10.325  706.946   8.6582 -1.005676 13.47510 
1 1 1    7   13   28 o  880.037   7.8243  592.990   10.539  603.283   19.739  588.885   12.465  887.128   14.537  876.901   9.2869 10.22650 17.25037 
1 1 1    7   13   29 o  484.062   7.2194  179.403   5.3490  180.555   6.9466  177.725   8.3836  485.543   9.3470  481.640   11.372 3.902924 14.72043 
1 1 1    7   13   30 o  796.992   7.0491  486.340   8.5992  496.330   13.446  479.427   11.186  804.887   10.914  791.182   9.2368 13.70551 14.29809 
1 1 1    7   13   31 o  269.880   9.3065   55.789   3.8444   57.005   5.6538   54.743   5.2430  272.678   13.546  267.239   12.818 5.439209 18.64924 
1 1 1    7   13   32 o  340.149   8.0732   88.609   4.2033   91.795   6.0677   85.670   5.8282  346.089   11.454  334.345   11.389 11.74377 16.15235 
1 1 1    7   13   33 o  961.802   7.0042  708.376   10.311  720.651   14.848  696.943   14.330  969.805   10.003  953.740   9.8164 16.06482 14.01490 
1 1 1    7   13   34 o  419.493   8.0170  134.793   5.1476  137.367   7.0347  131.826   7.5525  423.328   10.857  414.634   11.900 8.693573 16.10850 
1 1 1    7   13   35 o  309.482   11.530   73.452   5.4620   67.641   13.236   74.644   5.9963  293.827   29.845  311.924   12.559 -18.09714 32.38033 
1 1 1    7   13   36 o  122.098   16.637   11.674   3.0284   9.9720   5.3551   12.474   3.6719  111.462   30.502  125.753   19.725 -14.29096 36.32439 
1 1 1    7   13   37 o  519.476   6.4087  206.694   5.0957  201.818   8.2934  209.651   6.4587  512.951   10.563  523.053   8.0674 -10.10175 13.29128 
1 1 1    7   13   38 o  801.936   6.7677  492.684   8.3072  471.318   11.908  512.936   11.594  783.888   9.9250  817.883   9.2613 -33.99506 13.57491 
1 1 1    7   13   39 o  270.078   10.476   55.979   4.3305   29.094   9.4200   63.184   4.8763  189.658   33.684  286.882   11.105 -97.22398 35.46712 
1 1 1    7   13   40 o   71.935   25.077   3.6159   3.3909   0.9832   5.5580   5.1769   4.2797   72.307   30.169   83.830   28.203 -11.52251 41.29877 
1 1 1    7   13   41 o  493.664   7.8531  186.872   5.9339  189.993   9.1532  184.610   7.7935  497.122   12.029  490.312   10.385 6.809814 15.89163 
1 1 1    7   13   42 o  343.214   7.5202   90.329   3.9506   87.865   6.5773   91.719   4.9412  337.882   12.718  345.660   9.3393 -7.778320 15.77869 
1 1 1    7   13   43 o  259.688   8.9476   51.771   3.5565   56.291   5.8978   49.188   4.4584  269.763   14.335  252.870   11.519 16.89270 18.38959 
1 1 1    7   13   44 f  174.374   10.381   23.460   2.7581   25.370   4.0122   21.748   3.7976  180.667   14.635  167.116   15.006 13.55107 20.96111 
1 1 1    7   13   45 o  289.977   8.4391   64.572   3.7457   55.642   6.2919   69.473   4.6617  267.692   15.421  300.557   10.133 -32.86526 18.45260 
1 1 1    7   13   46 o  243.852   8.7236   45.691   3.2560   41.208   4.5517   50.389   4.6596  230.673   12.944  255.640   11.908 -24.96631 17.58849 
1 1 1    7   13   47 o  153.721   12.079   18.348   2.8193   15.247   3.9710   21.500   4.0033  138.418   19.265  165.642   15.989 -27.22417 25.03578 
1 1 1    7   13   48 o   78.208   23.218   4.9205   2.9808   5.6626   5.0322   4.5195   3.6996   87.312   30.542   77.426   26.221 9.886459 40.25415 
1 1 1    7   13   49 o   97.561   19.717   7.7268   2.8431   9.9084   4.1196   5.7426   3.9287  109.436   25.124   84.875   26.930 24.56123 36.83047 
1 1 1    7   13   50 o  174.433   11.773   23.624   3.1250   27.327   4.5504   20.319   4.2990  186.564   16.093  160.180   17.837 26.38318 24.02387 
1 1 1    7   13   51 o   94.809   20.824   7.3704   2.9393   6.7343   4.1894   7.9870   4.1250   90.599   27.669   97.821   26.771 -7.221771 38.49976 
1 1 1    7   13   52 o   57.429   23.472   1.1444   3.2719   2.4098   4.3370  -0.5272   4.9848   69.243   27.465   62.570   27.372 6.672207 38.77634 
1 1 1    7   13   53 o  193.984   12.839   29.348   3.7907   32.222   4.8549   24.860   6.0671  202.352   15.800  174.715   23.266 27.63698 28.12363 
1 1 1    7   13   54 o  301.531   8.6699   70.089   4.0014   72.679   5.8054   67.746   5.5229  305.899   12.399  295.398   12.215 10.50079 17.40505 
1 1 1    7   13   55 o  274.491   10.993   58.396   4.6185   62.540   5.6738   50.259   7.9510  283.323   13.083  249.774   20.992 33.54855 24.73538 
1 1 1    7   13   56 o  141.242   16.365   15.929   3.4724   16.619   4.9634   15.268   4.8596  141.233   23.807  134.970   24.422 6.262543 34.10561 
1 1 1    7   13   57 o  155.427   18.052   19.486   4.2146   14.805   6.9137   22.255   5.3166  127.239   34.591  164.484   21.643 -37.24462 40.80357 
1 1 1    7   13   58 o  134.655   17.741   14.714   3.5675   16.791   4.9516   12.473   5.1444  141.028   23.785  118.775   28.632 22.25306 37.22263 
1 1 1    7   13   59 o  222.038   12.422   38.756   4.2047   34.196   6.5673   41.924   5.4737  203.301   21.427  229.183   15.698 -25.88251 26.56264 
1 1 1    7   13   60 o  166.010   14.992   22.097   3.7683   21.541   5.3803   22.631   5.2795  159.425   22.689  164.234   21.520 -4.809341 31.27099 
1 1 1    7   13   61 o   94.117   23.152   7.7848   3.3123   6.9768   4.5678   8.6808   4.8101   87.822   29.130   96.622   29.671 -8.799400 41.58038 
1 1 1    7   13   62 o  108.677   21.188   10.213   3.3979   11.974   4.7188   8.3161   4.8968  113.819   27.413   93.702   30.102 20.11667 40.71323 
1 1 1    7   14    1 o  190.486   13.561   27.952   3.9279   0.0000   0.0000   27.952   3.9279  ?   ?   190.486   13.561 0.000000 13.56058 
1 1 1    7   14    2 o  538.496   7.8227  222.037   6.4478  215.902   8.9359  228.702   9.3129  530.871   10.997  546.374   11.136 -15.50281 15.65068 
1 1 1    7   14    3 o  1007.37   10.429  777.340   16.080  779.374   22.799  775.327   22.684  1008.23   14.773  1005.62   14.737 2.616699 20.86713 
1 1 1    7   14    4 o  741.125   8.7771  420.626   9.9566  417.027   13.944  424.368   14.222  737.721   12.349  744.175   12.485 -6.454468 17.56069 
1 1 1    7   14    5 o  553.346   6.5897  234.415   5.5813  231.278   6.8248  240.748   9.6981  549.582   8.1131  560.582   11.303 -10.99927 13.91293 
1 1 1    7   14    6 o  854.174   7.8575  558.655   10.273  565.150   12.714  546.437   17.438  859.018   9.6694  844.381   13.492 14.63623 16.59922 
1 1 1    7   14    7 o  639.373   8.5164  313.032   8.3345  313.032   8.3345   0.0000   0.0000  639.373   8.5164  ?   ?  0.000000 8.516374 
1 1 1    7   14    8 o  702.252   8.7974  377.634   9.4562  377.634   9.4562   0.0000   0.0000  702.252   8.7974  ?   ?  0.000000 8.797439 
1 1 1    7   14    9 o  247.137   7.7546   46.763   2.9334   47.658   3.5731   44.912   5.1375  249.467   9.3575  241.683   13.947 7.784363 16.79536 
1 1 1    7   14   10 o  1042.07   7.7221  831.387   12.317  851.493   17.829  813.032   17.035  1054.37   11.048  1030.30   10.802 24.06934 15.45109 
1 1 1    7   14   11 o  1056.78   7.8111  855.027   12.635  861.555   18.003  848.691   17.736  1060.60   11.090  1052.66   11.008 7.942261 15.62562 
1 1 1    7   14   12 o  567.223   7.0360  246.307   6.1087  237.172   10.566  250.894   7.4869  556.430   12.405  572.440   8.5448 -16.00977 15.06350 
1 1 1    7   14   13 o  982.125   7.5371  738.438   11.330  722.237   15.738  755.869   16.325  971.138   10.588  993.483   10.736 -22.34491 15.07815 
1 1 1    7   14   14 o  351.579   6.3956   94.620   3.4417   92.344   4.7854   97.058   4.9535  347.288   9.0025  356.039   9.0896 -8.751465 12.79321 
1 1 1    7   14   15 o  1672.17   11.073  2141.32   28.341  2148.19   40.211  2134.53   39.951  1674.31   15.690  1668.99   15.639 5.324341 22.15319 
1 1 1    7   14   16 o  618.812   6.4346  293.121   6.0947  286.684   8.4155  300.223   8.8384  611.918   8.9850  626.194   9.2213 -14.27594 12.87489 
1 1 1    7   14   17 o  944.854   8.6921  683.491   12.571  655.611   20.731  699.704   15.809  925.062   14.641  955.896   10.805 -30.83362 18.19632 
1 1 1    7   14   18 o  1548.98   12.115  1837.59   28.723  1746.79   46.908  1892.06   36.331  1509.23   20.306  1571.45   15.104 -62.21948 25.30758 
1 1 1    7   14   19 o  341.016   9.8499   89.043   5.1413   82.784   7.3745   94.963   7.1716  328.714   14.657  352.097   13.307 -23.38327 19.79667 
1 1 1    7   14   20 o  952.120   10.777  694.201   15.706  683.752   22.164  704.740   22.258  944.636   15.329  959.037   15.163 -14.40088 21.56158 
1 1 1    7   14   21 o  1027.69   7.1687  808.515   11.276  794.300   14.214  832.650   18.522  1018.53   9.1177  1042.68   11.606 -24.15210 14.75873 
1 1 1    7   14   22 o  701.382   6.2211  376.569   6.6787  386.720   8.5633  360.806   10.671  710.725   7.8717  686.419   10.157 24.30615 12.84994 
1 1 1    7   14   23 o  524.995   6.1869  210.984   4.9716  215.972   6.2851  202.646   8.1262  531.130   7.7311  514.411   10.321 16.71924 12.89525 
1 1 1    7   14   24 o  2015.19   11.766  3110.69   36.293  3125.79   47.070  3088.54   56.993  2019.48   15.228  2006.69   18.556 12.78650 24.00405 
1 1 1    7   14   25 o  824.662   6.8012  520.628   8.5848  537.804   11.210  496.265   13.350  838.069   8.7386  804.942   10.836 33.12744 13.92040 
1 1 1    7   14   26 f  699.665   5.9844  374.741   6.4088  386.440   9.1713  363.577   8.9593  710.412   8.4343  689.074   8.4945 21.33844 11.97057 
1 1 1    7   14   27 o  605.815   7.2177  280.992   6.6928  278.459   9.1110  283.960   9.8638  602.974   9.8718  608.868   10.584 -5.893433 14.47326 
1 1 1    7   14   28 o  421.640   9.0497  136.149   5.8404  117.247   8.7760  151.175   7.8248  391.065   14.661  444.207   11.508 -53.14127 18.63879 
1 1 1    7   14   29 o  945.419   7.3196  684.373   10.592  699.462   16.697  674.212   13.702  955.463   11.417  938.221   9.5414 17.24286 14.87922 
1 1 1    7   14   30 o  922.285   7.3112  651.312   10.321  644.550   15.914  656.221   13.559  917.159   11.336  925.586   9.5708 -8.427612 14.83626 
1 1 1    7   14   31 o  854.202   7.2918  558.727   9.5338  539.072   14.437  573.926   12.696  838.724   11.246  865.568   9.5825 -26.84460 14.77493 
1 1 1    7   14   32 o  436.260   7.2006  145.744   4.8082  149.076   6.8776  142.559   6.7247  441.087   10.187  431.337   10.186 9.750122 14.40553 
1 1 1    7   14   33 o  288.187   9.3404   63.633   4.1201   76.249   5.9126   51.724   5.7445  315.335   12.250  259.210   14.537 56.12521 19.01045 
1 1 1    7   14   34 o  143.213   15.924   15.948   3.4315   6.8677   5.0009   24.028   4.7173   95.093   30.407  175.894   17.765 -80.80114 35.21584 
1 1 1    7   14   35 o  249.485   13.014   47.901   4.9523   26.249   12.176   52.193   5.4209  178.785   44.632  260.383   13.649 -81.59798 46.67254 
1 1 1    7   14   36 o  205.486   11.605   32.501   3.6352   34.888   5.1105   30.056   5.1721  212.419   15.832  196.857   17.342 15.56300 23.48183 
1 1 1    7   14   37 f  274.435   9.5685   57.754   4.0193   60.231   5.8209   55.496   5.5566  279.977   13.583  268.411   13.569 11.56607 19.19955 
1 1 1    7   14   38 f  373.216   7.9415  106.764   4.5366  105.172   6.4216  108.351   6.4098  370.128   11.335  375.699   11.146 -5.571716 15.89736 
1 1 1    7   14   39 o  684.651   8.0691  359.376   8.4559  369.798   10.603  341.164   14.016  694.183   9.9790  665.956   13.750 28.22754 16.98948 
1 1 1    7   14   40 o  310.584   8.5096   73.985   4.0454   68.455   6.8822   76.905   5.0004  297.669   15.155  316.490   10.322 -18.82166 18.33668 
1 1 1    7   14   41 o  397.421   8.5675  121.173   5.2116  123.486   6.9819  118.262   7.8319  400.822   11.380  391.986   13.053 8.836273 17.31767 
1 1 1    7   14   42 o  132.072   15.251   13.638   3.0264   11.464   4.8237   15.050   3.8866  118.513   27.171  138.098   18.882 -19.58401 33.08773 
1 1 1    7   14   43 o  210.579   9.9373   34.074   3.2030   34.665   5.4178   33.756   3.9713  210.939   16.923  208.989   12.472 1.950256 21.02180 
1 1 1    7   14   44 o  208.964   10.110   33.573   3.2338   43.529   5.5745   28.523   3.9700  236.719   15.470  191.780   13.613 44.93985 20.60682 
1 1 1    7   14   45 o  185.654   11.675   26.662   3.3007   27.203   5.6898   26.387   4.0522  185.571   20.366  184.162   14.493 1.408463 24.99641 
1 1 1    7   14   46 f  438.620   7.2523  147.669   4.8689  141.673   8.5194  150.577   5.9334  428.242   12.997  442.622   8.7579 -14.38062 15.67256 
1 1 1    7   14   47 o  281.971   10.084   61.225   4.3524   56.518   11.566   62.002   4.6977  263.672   29.145  283.622   10.821 -19.94971 31.08946 
1 1 1    7   14   48 o  110.461   19.851   9.8462   3.2329   12.107   6.4286   9.0809   3.7403  119.582   33.684  105.050   23.812 14.53187 41.25085 
1 1 1    7   14   49 o  182.709   10.719   25.840   2.9845   28.236   4.3083   23.629   4.1382  190.046   14.931  173.535   15.751 16.51054 21.70334 
1 1 1    7   14   50 o  350.239   7.3132   94.254   3.9205   98.784   5.7870   90.412   5.3300  357.783   10.567  342.389   10.170 15.39383 14.66644 
1 1 1    7   14   51 o  125.173   15.822   12.413   2.9637   11.375   4.2722   13.375   4.1149  117.126   24.612  128.214   21.745 -11.08847 32.84211 
1 1 1    7   14   52 o  132.415   17.438   13.988   3.4484   16.670   4.6559   10.727   5.1323  143.199   21.941  112.198   29.496 31.00182 36.76171 
1 1 1    7   14   53 o   63.299   24.657   2.1986   3.4408   1.4543   4.3235   3.4843   5.6823   65.088   26.835   79.349   31.449 -14.26141 41.34216 
1 1 1    7   14   54 o  304.797   9.0159   71.674   4.2062   75.009   6.2052   68.839   5.7212  310.443   13.059  297.586   12.560 12.85724 18.11885 
1 1 1    7   14   55 o   56.791   23.128   1.2510   3.1628   2.2084   4.5946   0.3888   4.3602   69.057   27.967   61.057   26.151 7.999153 38.28889 
1 1 1    7   14   56 o  173.235   13.603   23.615   3.5779   25.057   5.3204   22.425   4.8343  175.707   20.147  166.493   19.330 9.213837 27.92027 
1 1 1    7   14   57 o  173.278   16.190   23.976   4.2443   17.327   7.0475   27.760   5.3166  137.876   33.683  185.142   19.032 -47.26637 38.68801 
1 1 1    7   14   58 o  118.990   19.345   11.677   3.4022   11.323   4.7828   12.040   4.8407  113.285   27.792  117.023   27.492 -3.738258 39.09254 
1 1 1    7   14   59 o  177.227   19.260   25.740   5.1405   0.0000   0.0000   25.740   5.1405  ?   ?   177.227   19.260 0.000000 19.25973 
1 1 1    7   14   60 o   54.061   22.798   0.8060   3.2265  -1.1062   4.5745   2.6990   4.5515   56.152   25.288   68.632   27.821 -12.47943 37.59658 
1 1 1    7   14   61 o   72.550   24.449   4.4642   3.2163   1.1791   4.5043   7.8815   4.5940   62.270   26.623   92.263   29.105 -29.99275 39.44484 
1 1 1    7   14   62 o   58.944   24.394   1.6368   3.5916   1.1284   4.8872   2.2338   5.2961   63.431   27.432   68.663   29.095 -5.231899 39.98785 
1 1 1    7   15    0 o  1059.16   15.375  859.843   24.913  859.843   24.913  859.843   24.913  1059.16   15.375  1059.16   15.375 0.000000 0.000000 
1 1 1    7   15    1 o  820.116   9.2861  515.069   11.657  520.273   16.606  510.014   16.367  823.984   13.166  815.825   13.107 8.159363 18.57835 
1 1 1    7   15    2 o  348.543   7.7841   93.013   4.1528   92.318   5.8281   93.730   5.9187  347.163   10.968  349.805   11.054 -2.641937 15.57217 
1 1 1    7   15    3 f  303.522   8.1054   70.539   3.7656   64.206   5.1963   77.542   5.4646  289.503   11.727  318.165   11.221 -28.66211 16.23047 
1 1 1    7   15    4 o  101.401   16.184   8.0795   2.4275   7.8464   3.3910   8.3245   3.4765   99.106   22.825  102.107   22.819 -3.001602 32.27484 
1 1 1    7   15    5 o  1188.55   9.7109  1081.83   17.666  1065.19   21.339  1118.10   31.497  1179.19   11.823  1207.49   17.042 -28.30261 20.74132 
1 1 1    7   15    6 o  1498.93   11.598  1721.06   26.608  1700.42   32.188  1765.61   47.285  1489.59   14.118  1516.78   20.367 -27.19043 24.78154 
1 1 1    7   15    7 o  445.187   6.6421  151.723   4.5260  153.489   5.6077  148.421   7.6662  447.738   8.1825  440.194   11.378 7.544281 14.01469 
1 1 1    7   15    8 o  671.208   7.2216  344.903   7.4193  355.313   9.2738  326.394   12.366  681.204   8.8943  652.742   12.377 28.46191 15.24138 
1 1 1    7   15    9 o  666.045   8.8046  339.664   8.9760  339.664   8.9760   0.0000   0.0000  666.045   8.8046  ?   ?  0.000000 8.804620 
1 1 1    7   15   10 o  768.949   9.4280  452.750   11.096  462.391   16.106  444.039   15.310  776.880   13.545  761.330   13.138 15.54962 18.86958 
1 1 1    7   15   11 o  227.034   8.5332   39.464   2.9653   40.432   5.1647   38.987   3.6218  229.234   14.799  225.636   10.487 3.597687 18.13753 
1 1 1    7   15   12 o  856.147   7.0055  561.113   9.1803  561.946   12.996  560.284   12.970  856.669   9.9113  855.401   9.9059 1.268127 14.01284 
1 1 1    7   15   13 o  1297.55   9.0784  1289.05   18.030  1302.46   25.760  1276.18   25.245  1303.99   12.906  1290.78   12.778 13.21497 18.16157 
1 1 1    7   15   14 o  640.667   6.4006  314.190   6.2766  309.614   8.7362  319.073   9.0236  635.920   8.9753  645.557   9.1322 -9.637207 12.80441 
1 1 1    7   15   15 o  426.511   7.3427  139.257   4.7935  146.068   8.2290  135.759   5.8973  436.711   12.311  421.089   9.1498 15.62222 15.33866 
1 1 1    7   15   16 o  559.806   7.3176  239.900   6.2701  240.842   10.786  239.419   7.7060  560.761   12.566  559.207   9.0030 1.554077 15.45851 
1 1 1    7   15   17 o  746.231   6.8695  426.273   7.8463  424.743   11.029  427.842   11.165  744.804   9.6742  747.513   9.7584 -2.708862 13.74106 
1 1 1    7   15   18 o  612.419   7.6161  287.121   7.1392  285.207   8.7582  290.912   12.325  610.328   9.3752  616.272   13.066 -5.944153 16.08149 
1 1 1    7   15   19 o  739.297   7.0404  418.399   7.9669  416.235   11.036  420.755   11.512  737.294   9.7796  741.271   10.146 -3.977905 14.09222 
1 1 1    7   15   20 o  659.806   6.9843  333.264   7.0536  319.082   9.5710  350.124   10.435  645.534   9.6865  676.192   10.083 -30.65814 13.98169 
1 1 1    7   15   21 o  412.914   8.5787  130.540   5.4219  116.986   9.0367  138.164   6.7773  390.717   15.110  424.758   10.424 -34.04077 18.35734 
1 1 1    7   15   22 f  509.946   8.2663  199.098   6.4522  198.585   10.932  199.373   7.9927  509.089   14.030  510.241   10.234 -1.151855 17.36560 
1 1 1    7   15   23 o  769.742   7.3137  453.607   8.6169  473.563   12.178  433.599   12.194  786.369   10.118  752.434   10.588 33.93524 14.64490 
1 1 1    7   15   24 o  324.308   7.3791   80.522   3.6630   76.881   4.4419   88.260   6.4755  316.858   9.1587  339.417   12.464 -22.55890 15.46745 
1 1 1    7   15   25 o  1400.97   8.9122  1502.96   19.111  1529.61   25.004  1465.51   29.637  1413.07   11.560  1382.83   14.002 30.23767 18.15785 
1 1 1    7   15   26 o  572.897   7.2099  251.284   6.3223  251.771   8.6215  250.719   9.2991  573.354   9.8241  572.120   10.619 1.234253 14.46637 
1 1 1    7   15   27 o  553.675   6.1858  234.685   5.2423  235.154   7.3484  234.199   7.4807  554.145   8.6637  553.012   8.8377 1.133057 12.37595 
1 1 1    7   15   28 o  550.917   6.3471  232.361   5.3521  227.028   7.4509  238.046   7.6931  544.464   8.9406  557.516   9.0152 -13.05231 12.69677 
1 1 1    7   15   29 o  193.295   11.082   28.721   3.2650   29.269   4.5157   28.121   4.7263  194.755   15.271  190.753   16.345 4.002029 22.36880 
1 1 1    7   15   30 o  630.661   6.8305  304.536   6.5936  300.052   10.033  307.946   8.7481  625.800   10.474  634.070   9.0138 -8.269653 13.81862 
1 1 1    7   15   31 o  285.652   9.1949   62.507   4.0203   65.724   6.0824   60.012   5.3574  292.744   13.574  279.779   12.510 12.96509 18.45999 
1 1 1    7   15   32 o  432.363   7.5591  143.170   5.0025  145.413   6.8662  140.633   7.3033  435.601   10.298  428.331   11.140 7.269897 15.17040 
1 1 1    7   15   33 o  294.539   9.3409   66.477   4.2111   67.148   6.0427   65.844   5.8719  295.827   13.345  292.954   13.095 2.873016 18.69689 
1 1 1    7   15   34 o  271.215   11.238   56.411   4.6651   57.446   9.4647   56.080   5.3616  271.853   22.961  270.323   12.958 1.530090 26.36474 
1 1 1    7   15   35 o  511.707   7.1368  200.583   5.5898  194.330   7.9856  206.590   7.8270  503.404   10.364  519.091   9.8510 -15.68716 14.29869 
1 1 1    7   15   36 o  338.713   8.2987   87.929   4.3024   90.192   6.2253   85.859   5.9529  342.787   11.865  334.471   11.628 8.316071 16.61288 
1 1 1    7   15   37 o  233.337   10.511   41.777   3.7541   40.408   5.4225   43.037   5.2024  228.605   15.590  236.120   14.464 -7.514465 21.26649 
1 1 1    7   15   38 o  203.758   13.750   32.075   4.2633   32.913   4.9073   29.495   8.6090  206.130   15.671  191.840   30.327 14.29031 34.13637 
1 1 1    7   15   39 o  303.255   9.3491   70.560   4.3396   78.687   6.6161   64.424   5.7490  319.801   13.516  289.429   12.977 30.37201 18.73746 
1 1 1    7   15   40 o  569.932   7.0635  248.989   6.1618  243.865   8.6223  254.339   8.8090  563.584   9.9952  575.559   9.9993 -11.97498 14.13825 
1 1 1    7   15   41 o  648.990   7.5697  322.997   7.5194  311.518   9.6306  340.923   12.035  636.898   9.8790  665.786   11.810 -28.88818 15.39681 
1 1 1    7   15   42 o  457.117   8.0976  160.329   5.6657  159.097   7.4276  162.045   8.7617  454.927   10.667  458.746   12.478 -3.819244 16.41601 
1 1 1    7   15   43 o  283.179   9.7163   61.622   4.2115   58.693   5.9230   64.618   5.9893  275.393   14.099  289.428   13.520 -14.03458 19.53343 
1 1 1    7   15   44 o  238.655   11.141   43.850   4.0698   44.054   5.6669   43.633   5.8486  238.031   15.641  236.741   16.238 1.289764 22.54618 
1 1 1    7   15   45 o  337.751   7.8988   87.593   4.0834   87.875   6.4959   87.409   5.2506  337.439   12.577  337.028   10.178 0.4109497 16.17938 
1 1 1    7   15   46 o  231.111   9.9024   41.112   3.5029   42.907   6.1615   40.254   4.2580  234.126   17.316  228.025   12.245 6.101059 21.20814 
1 1 1    7   15   47 o  197.024   13.299   30.170   3.9871   24.621   14.214   30.644   4.1538  164.259   51.100  198.467   13.759 -34.20796 52.91953 
1 1 1    7   15   48 o  151.989   13.995   18.057   3.2193   18.257   5.8038   17.967   3.8691  149.082   26.400  150.854   17.056 -1.771729 31.43064 
1 1 1    7   15   49 o  215.846   10.699   35.949   3.5346   28.505   6.2317   39.481   4.2918  188.595   22.001  225.533   12.481 -36.93878 25.29481 
1 1 1    7   15   50 o  422.686   9.7227  137.733   6.2903  102.258   13.424  147.714   7.1204  356.450   24.758  437.422   10.635 -80.97168 26.94579 
1 1 1    7   15   51 o  240.276   12.513   44.874   4.5861   44.581   7.6576   45.038   5.7267  236.039   21.429  239.668   15.698 -3.629517 26.56329 
1 1 1    7   15   52 o  247.391   12.515   47.608   4.7237   57.554   7.1060   39.734   6.3230  270.158   17.275  223.721   18.634 46.43649 25.40994 
1 1 1    7   15   53 o  166.663   14.702   21.853   3.7120   17.070   6.7451   23.931   4.4458  140.213   32.119  173.716   16.936 -33.50249 36.31021 
1 1 1    7   15   54 o  109.247   23.330   9.9703   3.7827   10.919   6.8642   9.5565   4.5331  111.679   35.614  105.683   27.690 5.996040 45.11249 
1 1 1    7   15   55 f  175.432   13.182   24.146   3.5137   29.559   5.2489   19.751   4.7298  192.243   18.049  155.912   20.301 36.33086 27.16440 
1 1 1    7   15   56 o   90.907   25.917   7.0655   3.7820   10.454   6.6156   5.4205   4.6096  108.135   35.014   82.748   29.210 25.38728 45.59817 
1 1 1    7   15   57 o   98.246   22.412   8.1834   3.2958   4.3810   4.6596   11.990   4.6623   77.541   29.059  117.508   26.548 -39.96703 39.36006 
1 1 1    7   15   58 o  159.729   14.630   20.317   3.5370   20.945   5.0966   19.735   4.9127  158.751   21.530  154.102   21.406 4.648376 30.36051 
1 1 1    7   15   59 o  173.052   18.923   24.581   4.9306   0.0000   0.0000   24.581   4.9306  ?   ?   173.052   18.923 0.000000 18.92291 
1 1 1    7   15   60 o  159.569   13.830   20.363   3.3444   21.077   4.8684   19.725   4.6021  158.424   20.562  153.510   20.067 4.913391 28.73084 
1 1 1    7   15   61 o  157.384   15.958   20.196   3.7910   7.0972   6.2743   27.728   4.7577   88.758   33.621  183.818   17.106 -95.05943 37.72215 
1 1 1    7   16    0 o   45.233   26.672   1.7656   3.1547   1.7656   3.1547   1.7656   3.1547   45.233   26.672   45.233   26.672 0.000000 0.000000 
1 1 1    7   16    1 o  403.840   7.9252  124.862   4.8988  125.927   6.8748  123.762   6.9823  405.483   11.077  401.975   11.348 3.507843 15.85820 
1 1 1    7   16    2 o  850.987   9.5346  554.538   12.419  555.943   17.517  553.119   17.610  851.827   13.435  849.654   13.541 2.173401 19.07514 
1 1 1    7   16    3 o  1051.59   10.895  846.932   17.536  831.137   24.306  864.078   25.325  1041.37   15.249  1061.78   15.583 -20.40234 21.80275 
1 1 1    7   16    4 o  503.764   8.0558  194.296   6.2116  196.608   8.7958  191.996   8.7733  506.655   11.342  500.674   11.448 5.981049 16.11538 
1 1 1    7   16    5 o  1217.14   9.9074  1134.41   18.457  1131.29   22.592  1140.68   32.007  1215.28   12.145  1219.79   17.143 -4.509399 21.00948 
1 1 1    7   16    6 o  708.349   7.3204  384.122   7.9370  383.514   9.7557  385.310   13.650  707.732   9.0058  709.230   12.574 -1.497437 15.46639 
1 1 1    7   16    7 o  851.101   7.9446  554.569   10.350  554.158   12.713  555.378   17.822  850.708   9.7632  851.424   13.675 -0.7163696 16.80293 
1 1 1    7   16    8 o  433.600   8.3791  143.941   5.5610  145.221   8.0511  142.774   7.6903  435.433   12.080  431.761   11.637 3.671722 16.77306 
1 1 1    7   16    9 o  725.335   9.1801  402.821   10.192  414.863   14.916  392.275   13.959  735.918   13.242  715.629   12.743 20.28979 18.37774 
1 1 1    7   16   10 o  697.069   9.0691  372.029   9.6763  372.029   9.6763   0.0000   0.0000  697.069   9.0691  ?   ?  0.000000 9.069134 
1 1 1    7   16   11 o  572.370   7.1395  250.787   6.2548  251.015   7.7142  250.348   10.687  572.592   8.8018  571.727   12.212 0.8648071 15.05326 
1 1 1    7   16   12 o  1505.07   14.353  1735.39   33.066  1727.97   46.443  1743.03   47.089  1501.10   20.213  1507.60   20.406 -6.497437 28.72280 
1 1 1    7   16   13 o  705.577   7.6307  381.112   8.2410  411.192   14.894  367.841   9.8933  732.681   13.281  693.134   9.3251 39.54633 16.22808 
1 1 1    7   16   14 o  1224.74   8.7836  1148.39   16.466  1127.27   22.885  1171.06   23.709  1213.20   12.324  1236.53   12.527 -23.32410 17.57279 
1 1 1    7   16   15 o  246.875   8.1732   46.659   3.0885   45.826   4.3833   47.480   4.3523  244.620   11.707  248.999   11.420 -4.379211 16.35421 
1 1 1    7   16   16 o  819.839   7.1401  514.527   8.9599  512.023   12.588  517.099   12.756  817.739   10.057  821.779   10.141 -4.040222 14.28257 
1 1 1    7   16   17 o  613.143   7.5957  287.801   7.1286  277.821   8.6160  309.453   12.692  602.373   9.3449  635.605   13.045 -33.23236 16.04714 
1 1 1    7   16   18 o  1344.50   9.4927  1384.11   19.535  1379.93   27.444  1388.41   27.814  1342.15   13.359  1346.26   13.498 -4.105103 18.99099 
1 1 1    7   16   19 o  831.833   7.3471  529.715   9.3545  523.405   12.982  536.530   13.491  826.745   10.259  837.034   10.530 -10.28815 14.70140 
1 1 1    7   16   20 o  736.754   7.1917  415.543   8.1100  417.020   11.367  414.011   11.574  737.956   10.063  735.279   10.284 2.677002 14.38888 
1 1 1    7   16   21 o  953.375   7.8895  695.878   11.513  698.114   16.231  693.613   16.333  954.726   11.107  951.637   11.213 3.089600 15.78279 
1 1 1    7   16   22 o  900.664   7.7905  621.064   10.740  606.555   14.879  636.844   15.518  889.913   10.924  911.849   11.118 -21.93628 15.58648 
1 1 1    7   16   23 f  119.250   23.848   11.312   4.2009   18.578   7.1954   7.5548   5.1743  152.475   31.858   99.318   30.820 53.15672 44.32568 
1 1 1    7   16   24 o  849.977   8.8717  553.224   11.542  556.651   13.744  545.025   21.258  852.507   10.533  843.070   16.474 9.436768 19.55318 
1 1 1    7   16   25 o  737.041   8.6348  415.979   9.7413  413.553   11.436  422.392   18.594  734.808   10.168  742.152   16.368 -7.343994 19.26944 
1 1 1    7   16   26 o  845.533   7.7379  547.410   10.014  536.171   13.497  561.174   14.937  836.634   10.540  855.853   11.402 -19.21906 15.52742 
1 1 1    7   16   27 o  515.831   6.2797  203.706   4.9581  205.716   6.9426  201.612   7.0833  518.287   8.7515  513.080   9.0194 5.206421 12.56735 
1 1 1    7   16   28 o  532.061   6.3858  216.734   5.2005  217.734   7.3417  215.727   7.3677  533.186   8.9960  530.721   9.0697 2.465759 12.77452 
1 1 1    7   16   29 o  628.648   6.3428  302.574   6.1032  309.361   8.7056  296.015   8.5588  635.530   8.9494  621.668   8.9947 13.86188 12.68840 
1 1 1    7   16   30 o  252.403   8.8721   48.799   3.4276   52.119   4.9169   45.661   4.7807  260.740   12.320  243.695   12.862 17.04500 17.81072 
1 1 1    7   16   31 o  202.626   10.990   31.562   3.3958   28.220   4.5515   35.758   5.0999  191.089   15.700  215.268   15.583 -24.17973 22.12102 
1 1 1    7   16   32 o  511.927   7.5321  200.727   5.9019  204.043   8.5587  197.721   8.1494  515.916   10.838  507.887   10.483 8.028412 15.07862 
1 1 1    7   16   33 o  390.492   9.5139  116.869   5.6864  109.645   12.926  118.603   6.3320  376.307   22.546  393.314   10.518 -17.00702 24.87882 
1 1 1    7   16   34 o  727.412   6.6579  405.276   7.4129  393.319   10.267  418.300   10.715  716.319   9.3637  738.702   9.4763 -22.38324 13.32217 
1 1 1    7   16   35 o  341.835   7.8248   89.540   4.0941   83.198   5.6679   96.459   5.9203  329.288   11.245  354.588   10.908 -25.29990 15.66673 
1 1 1    7   16   36 o  252.900   9.5794   49.051   3.7081   42.347   5.1625   56.197   5.3298  234.226   14.471  270.467   12.874 -36.24049 19.36862 
1 1 1    7   16   37 o  376.858   9.2170  108.928   5.3166  106.985   6.2974  113.750   9.9202  373.308   11.021  384.132   16.872 -10.82382 20.15281 
1 1 1    7   16   38 o  152.435   18.007   18.189   4.1203   18.814   4.7404   16.257   8.3325  154.563   20.546  140.504   37.882 14.05936 43.09509 
1 1 1    7   16   39 o  514.147   7.5803  202.671   5.9654  211.835   9.2836  196.225   7.7855  525.024   11.552  505.562   10.061 19.46170 15.31929 
1 1 1    7   16   40 o  413.155   8.0810  130.930   5.1103  124.330   6.5474  141.219   8.1747  402.278   10.633  428.419   12.466 -26.14105 16.38526 
1 1 1    7   16   41 o  381.367   7.8370  111.567   4.5747  107.356   6.3417  116.137   6.6056  373.664   11.088  388.644   11.104 -14.97968 15.69233 
1 1 1    7   16   42 o  124.848   18.324   12.342   3.3974   11.305   4.8172   13.367   4.7923  117.475   27.309  128.365   25.290 -10.89036 37.22050 
1 1 1    7   16   43 o  455.411   8.3194  159.234   5.7991  146.615   7.6071  176.742   8.9605  436.385   11.389  478.909   12.224 -42.52396 16.70725 
1 1 1    7   16   44 o  209.562   13.027   34.028   4.1580   31.878   5.3115   37.430   6.6823  201.837   17.362  218.003   20.257 -16.16643 26.67946 
1 1 1    7   16   45 o  176.980   13.756   24.368   3.6971   21.335   5.1654   27.554   5.2939  163.676   21.110  187.023   18.745 -23.34741 28.23155 
1 1 1    7   16   46 o   94.775   29.315   7.2734   4.6857   3.6959   13.717   7.7460   4.9856  109.976   46.724   97.643   30.245 12.33289 55.65832 
1 1 1    7   16   47 o  151.983   21.013   18.493   4.7574   18.236   10.923   18.554   5.2851  143.920   44.798  151.408   23.572 -7.487656 50.62129 
1 1 1    7   16   48 f   72.089   26.190   3.5486   3.7349   2.7867   5.3891   4.2527   5.1809   76.318   30.505   81.247   30.604 -4.928123 43.21065 
1 1 1    7   16   49 o   65.869   25.959   2.1816   3.8510  -0.6627   6.0780   4.0894   4.9776   68.851   30.170   79.585   29.993 -10.73357 42.54215 
1 1 1    7   16   50 o  180.754   15.145   25.629   4.1515   23.003   6.1989   27.766   5.5904  167.729   24.901  186.602   19.879 -18.87358 31.86314 
1 1 1    7   16   51 o  204.999   12.106   32.676   3.7817   30.014   7.1523   33.709   4.4554  191.620   24.980  207.650   14.101 -16.02948 28.68505 
1 1 1    7   16   52 o  164.557   17.400   21.515   4.3161   19.620   6.4098   23.088   5.8380  152.532   28.503  168.195   23.303 -15.66284 36.81621 
1 1 1    7   16   53 o  206.534   13.031   33.318   4.0984   34.454   6.8249   32.677   5.1255  206.330   21.947  203.255   16.620 3.074707 27.53042 
1 1 1    7   16   54 o  165.700   15.399   21.721   3.8610   18.550   6.8170   23.219   4.6848  145.831   31.464  170.271   18.260 -24.44032 36.37911 
1 1 1    7   16   55 o  172.851   14.722   23.614   3.8580   35.806   6.9054   18.081   4.6517  209.456   21.861  148.593   21.040 60.86281 30.34148 
1 1 1    7   16   56 o  152.030   17.394   18.611   3.9747   18.995   6.4513   18.376   5.0462  147.175   29.663  148.449   22.948 -1.274460 37.50349 
1 1 1    7   16   57 o  245.881   11.365   47.142   4.2771   38.241   7.3110   51.773   5.2738  214.768   22.578  256.385   13.486 -41.61623 26.29926 
1 1 1    7   16   58 o   64.401   26.681   1.7220   4.3031   9.4088   14.823   1.0146   4.4968  110.363   47.750   62.842   26.727 47.52152 54.72117 
1 1 1    7   16   59 o   93.352   25.532   7.7364   3.7534   6.9320   6.4942   8.1398   4.5994   90.229   34.198   94.665   29.005 -4.436264 44.84177 
1 1 1    7   16   60 o  219.321   11.654   37.957   3.8982   35.537   6.4309   39.362   4.9013  205.691   20.708  221.525   14.536 -15.83478 25.30016 
1 1 1    7   16   61 o  132.806   22.017   15.262   4.3188   17.773   7.1280   13.805   5.4287  132.620   34.711  120.669   29.613 11.95090 45.62644 
1 1 1    7   17    0 o  1515.63   20.248  1760.91   46.954  1760.91   46.954  1760.91   46.954  1515.63   20.248  1515.63   20.248 0.000000 0.000000 
1 1 1    7   17    1 o  1143.47   11.531  1001.39   20.181  1002.33   28.546  1000.45   28.536  1143.60   16.308  1142.53   16.318 1.075317 23.06968 
1 1 1    7   17    2 o  1986.65   18.026  3025.78   54.814  3018.30   77.287  3033.35   77.753  1982.47   25.470  1987.38   25.560 -4.914795 36.08384 
1 1 1    7   17    3 o  772.739   13.040  457.403   15.424   0.0000   0.0000  457.403   15.424  ?   ?   772.739   13.040 0.000000 13.04021 
1 1 1    7   17    4 o  1116.82   11.396  955.214   19.481  960.923   27.702  949.629   27.401  1119.76   16.163  1113.17   16.082 6.592163 22.80066 
1 1 1    7   17    5 f  1268.22   10.254  1231.60   19.904  1205.13   23.858  1292.21   36.102  1254.36   12.426  1298.30   18.167 -43.93567 22.01054 
1 1 1    7   17    6 o  248.704   10.181   47.363   3.8757   36.686   5.5128   57.797   5.4498  218.157   16.635  274.691   12.962 -56.53406 21.08869 
1 1 1    7   17    7 o  829.545   13.675  527.143   17.364   0.0000   0.0000  527.143   17.364  ?   ?   829.545   13.675 0.000000 13.67534 
1 1 1    7   17    8 o  1240.56   12.357  1178.70   23.464  1140.68   31.903  1223.51   34.632  1219.97   17.085  1263.39   17.909 -43.42334 24.75110 
1 1 1    7   17    9 o  381.539   8.7001  111.450   5.0808  114.633   7.0215  107.951   7.3613  386.888   11.857  375.421   12.811 11.46716 17.45559 
1 1 1    7   17   10 o  613.331   8.8479  288.002   8.3063  289.877   11.585  286.018   11.915  615.215   12.303  611.091   12.739 4.124634 17.70998 
1 1 1    7   17   11 o  330.368   6.7565   83.547   3.4166   88.204   4.8805   79.072   4.7844  339.414   9.3943  321.361   9.7267 18.05344 13.52264 
1 1 1    7   17   12 o  974.862   7.6949  727.528   11.482  738.784   16.327  716.515   16.150  982.235   10.860  967.315   10.908 14.91986 15.39218 
1 1 1    7   17   13 o  1064.17   9.2899  867.052   15.132  871.956   18.675  857.678   25.819  1067.06   11.434  1057.97   15.944 9.092407 19.62045 
1 1 1    7   17   14 o  348.632   7.7911   93.048   4.1575   91.429   5.1187   96.186   7.1270  345.557   9.6777  354.365   13.140 -8.807556 16.31897 
1 1 1    7   17   15 o  833.950   8.2605  532.440   10.544  527.399   12.825  542.955   18.523  829.921   10.096  841.847   14.375 -11.92548 17.56628 
1 1 1    7   17   16 f  999.579   9.0381  765.000   13.828  769.736   17.064  755.939   23.601  1002.56   11.120  993.224   15.524 9.333496 19.09578 
1 1 1    7   17   17 o  1344.49   9.4907  1384.10   19.531  1384.69   27.552  1383.51   27.691  1344.45   13.389  1343.87   13.462 0.5804443 18.98644 
1 1 1    7   17   18 o  543.778   6.7886  226.358   5.6503  219.240   7.7935  234.246   8.2039  535.092   9.5155  553.095   9.6906 -18.00336 13.58132 
1 1 1    7   17   19 o  632.998   7.0385  306.742   6.8195  299.166   9.4093  315.124   9.8978  625.044   9.8351  641.489   10.080 -16.44470 14.08346 
1 1 1    7   17   20 f  1003.18   8.0894  770.506   12.421  755.786   17.133  786.813   18.034  993.360   11.269  1013.52   11.625 -20.15942 16.18995 
1 1 1    7   17   21 o  551.424   7.2632  232.789   6.1303  235.030   8.5306  230.396   8.8156  553.984   10.060  548.479   10.501 5.505188 14.54228 
1 1 1    7   17   22 o  154.083   16.521   18.412   3.8355   17.006   5.2110   20.075   5.6662  146.891   24.006  159.906   23.882 -13.01521 33.86211 
1 1 1    7   17   23 o  736.657   8.7962  415.543   9.9181  407.916   11.751  434.439   18.495  729.776   10.520  752.724   16.053 -22.94800 19.19251 
1 1 1    7   17   24 f  466.260   9.8033  166.502   6.9964  171.573   12.032  163.911   8.5998  472.978   16.619  462.526   12.147 10.45181 20.58537 
1 1 1    7   17   25 f  804.578   7.7157  495.665   9.5019  483.300   12.691  511.439   14.334  794.318   10.438  817.040   11.462 -22.72125 15.50277 
1 1 1    7   17   26 o  846.170   7.8941  548.266   10.224  534.959   13.635  565.361   15.453  835.650   10.660  858.975   11.754 -23.32520 15.86787 
1 1 1    7   17   27 o  152.844   15.455   18.101   3.5660   18.749   4.2447   16.547   6.5742  155.224   18.212  143.703   30.813 11.52060 35.79289 
1 1 1    7   17   28 o  244.277   8.5842   45.702   3.2096   44.781   4.5386   46.623   4.5395  241.393   12.325  246.638   12.025 -5.245132 17.21904 
1 1 1    7   17   29 o  173.800   11.823   23.261   3.1266   24.928   4.4849   21.684   4.3610  179.450   16.513  167.160   17.294 12.28966 23.91214 
1 1 1    7   17   30 o   62.121   22.510   2.4468   2.7564  -1.0074   3.8532   6.0671   3.9447   54.557   23.961   88.404   26.815 -33.84699 35.96109 
1 1 1    7   17   31 o  389.207   7.7800  116.031   4.6348  121.332   6.7023  111.172   6.4163  397.828   11.007  380.808   11.008 17.01953 15.56673 
1 1 1    7   17   32 o  694.195   7.5053  369.143   7.9748  387.386   14.078  360.523   9.6771  710.510   12.945  685.885   9.2178 24.62482 15.89166 
1 1 1    7   17   33 o  278.691   11.190   59.575   4.7735   74.784   12.245   56.849   5.1837  309.653   26.077  272.168   12.443 37.48425 28.89375 
1 1 1    7   17   34 o  721.924   7.0848  399.265   7.8287  403.242   12.010  396.327   10.323  725.022   10.823  718.990   9.3804 6.032471 14.32201 
1 1 1    7   17   35 o  386.703   7.7574  114.599   4.5916  114.034   6.8209  115.068   6.2091  385.430   11.562  387.277   10.475 -1.847656 15.60109 
1 1 1    7   17   36 o  500.217   6.9123  191.724   5.2924  190.776   7.3951  192.719   7.5773  498.692   9.6882  501.202   9.8771 -2.509491 13.83541 
1 1 1    7   17   37 o  217.393   12.645   36.450   4.1895   34.012   4.8421   43.711   8.3559  209.602   15.196  236.090   23.433 -26.48773 27.92846 
1 1 1    7   17   38 o  299.740   9.0837   68.931   4.1675   73.664   6.3677   65.385   5.5119  309.399   13.446  291.618   12.349 17.78122 18.25610 
1 1 1    7   17   39 o  481.755   7.7289  177.975   5.6992  175.802   7.4068  181.129   8.9232  478.465   10.114  485.319   12.012 -6.854004 15.70289 
1 1 1    7   17   40 o  277.414   8.9773   59.073   3.8119   53.316   5.1321   66.156   5.6932  263.156   12.741  293.142   12.688 -29.98618 17.98151 
1 1 1    7   17   41 o  164.551   13.415   21.009   3.3493   19.429   4.7324   22.595   4.7408  156.816   20.185  169.677   18.557 -12.86139 27.41860 
1 1 1    7   17   42 o  203.253   11.551   31.906   3.5788   32.543   5.0418   31.260   5.0809  204.381   16.251  200.178   16.736 4.202927 23.32791 
1 1 1    7   17   43 o   66.720   23.760   3.0509   3.0563   2.7426   4.2594   3.3782   4.3881   71.192   27.517   74.700   28.159 -3.508217 39.37154 
1 1 1    7   17   44 o  196.063   12.662   29.796   3.7797   31.000   5.0033   28.196   5.7684  199.123   16.566  188.831   20.275 10.29253 26.18271 
1 1 1    7   17   45 o  416.725   8.9214  133.531   5.6905  126.834   7.6556  141.800   8.5068  405.273   12.341  428.315   12.976 -23.04257 17.90751 
1 1 1    7   17   46 o  198.497   16.102   30.837   4.8500   29.447   10.850   31.184   5.4219  184.386   39.623  199.079   17.987 -14.69266 43.51453 
1 1 1    7   17   47 o  206.855   12.632   33.219   3.9805   34.177   5.7088   32.313   5.5529  208.302   18.085  202.495   18.107 5.806870 25.59127 
1 1 1    7   17   48 o  422.126   8.8771  137.146   5.7357  137.027   8.6058  137.241   7.6936  420.439   13.373  421.315   11.930 -0.8758240 17.92092 
1 1 1    7   17   49 o  189.072   13.824   27.904   3.9729   28.756   5.7403   27.121   5.5041  189.958   20.045  184.514   19.798 5.443390 28.17438 
1 1 1    7   17   50 o  331.931   13.216   85.543   6.7145   86.144   8.4285   84.499   11.109  331.309   16.674  324.861   22.479 6.448181 27.98758 
1 1 1    7   17   51 o  290.866   10.926   65.434   4.8645   60.819   7.0372   69.657   6.7319  278.060   16.610  298.834   14.718 -20.77365 22.19270 
1 1 1    7   17   52 o  260.850   12.728   52.875   5.0819   50.062   6.9869   56.035   7.4050  251.196   18.298  265.819   18.312 -14.62325 25.88679 
1 1 1    7   17   53 o  189.308   16.211   28.361   4.6520   18.579   6.8274   36.837   6.3557  146.252   31.434  214.392   19.584 -68.13985 37.03596 
1 1 1    7   17   54 o  107.396   27.368   9.9236   4.5120   3.4058   6.7165   15.284   6.0910   82.226   33.620  132.151   30.699 -49.92519 45.52747 
1 1 1    7   17   55 o  117.299   26.772   11.865   4.7008   18.241   6.3007   3.8611   7.0596  144.665   29.456   84.259   34.462 60.40602 45.33497 
1 1 1    7   17   56 o  337.090   12.396   88.828   6.3960   82.519   11.193   91.886   7.7937  315.935   23.312  341.240   14.922 -25.30460 27.67826 
1 1 1    7   17   57 o   74.327   26.767   4.2657   3.8895   0.6387   7.6182   5.5444   4.5235   76.381   33.615   82.307   28.948 -5.926407 44.36205 
1 1 1    7   17   58 o  195.440   14.719   30.483   4.3709   16.122   9.7234   34.119   4.8931  124.200   42.507  206.308   15.611 -82.10864 45.28304 
1 1 1    7   17   59 o  201.115   14.283   32.342   4.3683   27.005   8.8128   34.080   5.0296  166.351   35.681  205.275   16.138 -38.92451 39.16071 
1 1 1    7   17   60 o   46.196   21.249  -1.8232   3.4530  -6.1526   5.8609   0.4784   4.2733   52.532   25.210   58.598   25.496 -6.065273 35.85470 
1 1 1    7   18    0 o  151.321   18.568   18.315   4.1272   18.315   4.1272   18.315   4.1272  151.321   18.568  151.321   18.568 0.000000 0.000000 
1 1 1    7   18    1 o  423.250   8.0785  137.142   5.2336  134.680   7.2890  139.762   7.5192  419.368   11.355  427.204   11.499 -7.835938 16.16092 
1 1 1    7   18    2 f  460.352   8.1722  162.241   5.7584  161.409   8.0747  163.103   8.2142  459.097   11.491  461.496   11.629 -2.399384 16.34828 
1 1 1    7   18    3 o  231.366   14.372   41.166   5.0646   0.0000   0.0000   41.166   5.0646  ?   ?   231.366   14.372 0.000000 14.37247 
1 1 1    7   18    4 o  673.379   12.540  347.288   12.925   0.0000   0.0000  347.288   12.925  ?   ?   673.379   12.540 0.000000 12.54002 
1 1 1    7   18    5 f  1230.87   10.096  1160.06   19.021  1136.89   22.858  1212.21   34.299  1218.38   12.257  1257.58   17.818 -39.20581 21.62721 
1 1 1    7   18    6 f  312.534   7.6023   74.775   3.6367   73.580   4.4969   77.034   6.1829  310.002   9.4771  317.140   12.737 -7.138000 15.87611 
1 1 1    7   18    7 o  1086.12   9.3196  903.190   15.493  900.602   18.951  908.406   26.905  1084.45   11.417  1088.80   16.144 -4.348999 19.77312 
1 1 1    7   18    8 o  2079.34   15.433  3312.73   49.119  3301.60   59.954  3335.47   85.663  2075.26   18.874  2084.06   26.854 -8.802002 32.82364 
1 1 1    7   18    9 o  1223.88   10.127  1146.91   18.971  1153.09   23.389  1135.04   32.434  1227.02   12.453  1216.94   17.412 10.07361 21.40745 
1 1 1    7   18   10 o  776.682   7.9096  461.805   9.4030  458.416   11.434  468.885   16.527  773.770   9.6542  782.371   13.801 -8.601440 16.84246 
1 1 1    7   18   11 o  325.714   7.0231   81.212   3.5014   84.946   4.9193   77.377   4.9847  333.083   9.6490  317.888   10.245 15.19513 14.07315 
1 1 1    7   18   12 o  1344.24   9.4317  1383.53   19.406  1356.69   26.863  1412.82   28.065  1330.86   13.187  1358.08   13.501 -27.22510 18.87278 
1 1 1    7   18   13 o  464.233   6.5984  164.971   4.6886  158.892   6.5494  171.363   6.7151  455.546   9.3928  473.089   9.2734 -17.54218 13.19932 
1 1 1    7   18   14 o  1268.53   10.485  1232.23   20.359  1242.75   25.147  1212.21   34.682  1273.74   12.898  1257.47   18.019 16.27319 22.15989 
1 1 1    7   18   15 o  591.198   7.6490  267.574   6.9216  265.177   8.4491  272.466   12.069  588.497   9.3799  596.388   13.221 -7.891418 16.21064 
1 1 1    7   18   16 o  316.996   8.6814   76.936   4.2122   76.156   5.1567   78.502   7.3020  315.349   10.684  320.072   14.905 -4.723358 18.33811 
1 1 1    7   18   17 o  579.553   6.9172  257.127   6.1361  252.972   8.5288  261.587   8.8348  574.772   9.6945  584.471   9.8756 -9.698914 13.83872 
1 1 1    7   18   18 o  674.361   7.0392  348.143   7.2658  336.102   9.9690  361.787   10.612  662.501   9.8309  687.338   10.087 -24.83728 14.08521 
1 1 1    7   18   19 o  1804.35   11.978  2493.93   33.080  2460.61   45.957  2529.74   47.654  1791.47   16.760  1816.38   17.140 -24.91333 23.97264 
1 1 1    7   18   20 o  460.005   7.6477  162.008   5.3847  155.468   7.2547  170.031   8.0352  450.545   10.520  471.153   11.142 -20.60806 15.32362 
1 1 1    7   18   21 o  465.697   9.0887  166.074   6.4785  167.600   7.7211  162.444   11.908  467.776   10.784  460.250   16.904 7.526154 20.05075 
1 1 1    7   18   22 o  437.412   8.1266  146.499   5.4409  153.016   7.6354  139.775   7.7552  446.938   11.161  427.138   11.862 19.79999 16.28738 
1 1 1    7   18   23 o  833.802   9.1759  532.418   11.711  513.684   19.580  542.851   14.612  818.487   15.629  841.784   11.341 -23.29755 19.31033 
1 1 1    7   18   24 o  347.907   9.6414   92.705   5.1342   94.956   7.1773   90.345   7.3473  351.983   13.322  343.304   13.982 8.678925 19.31282 
1 1 1    7   18   25 o  906.233   8.3062  628.905   11.522  634.341   16.280  623.450   16.308  909.869   11.690  902.013   11.812 7.855957 16.61831 
1 1 1    7   18   26 o  393.559   9.7004  118.645   5.8434  124.122   8.3343  113.349   8.1952  402.371   13.532  384.492   13.925 17.87897 19.41741 
1 1 1    7   18   27 o  427.604   8.3617  140.035   5.4728  137.941   7.0083  143.308   8.7612  424.293   10.791  432.337   13.239 -8.044220 17.08036 
1 1 1    7   18   28 o  235.352   11.234   42.452   4.0469   40.099   4.8459   47.877   7.3571  228.223   13.939  248.828   19.472 -20.60423 23.94716 
1 1 1    7   18   29 o  697.638   8.8651  372.850   9.4664  361.499   13.822  382.878   12.992  686.526   13.154  706.663   12.011 -20.13751 17.81244 
1 1 1    7   18   30 o  250.439   9.6058   48.063   3.6822   50.295   5.2813   45.952   5.1365  255.667   13.544  244.319   13.792 11.34743 19.33001 
1 1 1    7   18   31 o  515.736   7.6897  203.754   6.0703  186.328   10.246  213.180   7.5352  492.695   13.586  527.412   9.3342 -34.71747 16.48345 
1 1 1    7   18   32 o  121.938   19.943   11.753   3.5936   15.277   7.8559   10.820   4.0412  137.253   36.689  116.285   23.513 20.96820 43.57647 
1 1 1    7   18   33 o  398.774   7.1003  121.824   4.3339  119.996   6.0467  123.754   6.2148  395.577   9.9866  401.714   10.107 -6.136902 14.20886 
1 1 1    7   18   34 o  352.303   7.5276   95.109   4.0592   93.368   5.6981   96.903   5.7840  348.842   10.672  355.388   10.633 -6.545624 15.06474 
1 1 1    7   18   35 o  515.257   7.1402  203.440   5.6313  208.931   8.4805  199.109   7.5313  521.768   10.619  509.477   9.6578 12.29053 14.35382 
1 1 1    7   18   36 o  170.158   15.243   22.474   3.9279   23.534   4.6079   19.659   7.5131  173.762   17.566  155.288   32.645 18.47379 37.07115 
1 1 1    7   18   37 o  308.565   8.7093   73.033   4.1134   77.166   6.2654   69.901   5.4532  316.748   12.923  301.592   11.813 15.15604 17.50871 
1 1 1    7   18   38 f  150.945   13.900   17.694   3.1755   16.930   4.1862   18.729   4.8732  146.668   19.101  153.912   21.253 -7.243469 28.57483 
1 1 1    7   18   39 o  291.207   8.5693   65.072   3.8196   65.837   5.4217   64.318   5.3820  292.529   12.109  289.128   12.161 3.401031 17.16159 
1 1 1    7   18   40 o  155.174   13.627   18.703   3.2039   16.414   4.4361   21.199   4.6321  143.825   20.752  164.270   18.759 -20.44550 27.97358 
1 1 1    7   18   41 o   61.316   22.911   2.2580   2.8922   5.3421   4.0484  -0.9570   4.1334   83.584   27.409   56.328   24.776 27.25562 36.94763 
1 1 1    7   18   42 o  247.982   9.7582   47.278   3.7039   42.430   5.1163   52.617   5.3691  233.877   14.362  260.730   13.500 -26.85281 19.71043 
1 1 1    7   18   43 o   48.072   21.096  -0.6523   2.9816   1.5333   4.0478  -3.2448   4.4085   64.684   26.231   51.792   23.891 12.89225 35.48024 
1 1 1    7   18   44 o  203.762   11.561   32.121   3.5909   31.245   5.1294   32.963   5.0288  199.726   16.938  205.394   16.126 -5.667862 23.38678 
1 1 1    7   18   45 o  101.524   26.450   8.5263   4.1514   9.7619   9.7800   8.2547   4.5850  114.658   42.269  100.003   28.545 14.65455 51.00481 
1 1 1    7   18   46 o  258.070   10.947   51.371   4.3243   54.136   5.9325   48.236   6.3166  263.692   14.758  248.255   16.721 15.43767 22.30172 
1 1 1    7   18   47 f  250.220   11.359   48.350   4.3504   48.718   5.9432   47.924   6.3854  249.712   15.628  247.208   16.978 2.504578 23.07594 
1 1 1    7   18   48 f  269.589   10.872   56.115   4.4862   51.165   6.4112   60.864   6.2797  255.472   16.483  279.368   14.738 -23.89635 22.11118 
1 1 1    7   18   49 f  123.268   27.418   12.757   5.0395   16.115   5.8905   3.5893   9.7332  138.380   28.750   95.394   39.873 42.98629 49.15714 
1 1 1    7   18   50 o  270.982   11.467   56.834   4.7562   49.292   7.1622   62.784   6.3613  249.329   18.908  283.431   14.714 -34.10161 23.95867 
1 1 1    7   18   51 o  187.603   15.615   27.715   4.4432   26.886   6.0761   28.668   6.5139  182.167   22.254  187.770   23.155 -5.603317 32.11544 
1 1 1    7   18   52 o  235.059   13.032   43.124   4.6705   40.234   6.7008   45.855   6.5133  224.226   19.725  240.413   17.827 -16.18661 26.58708 
1 1 1    7   18   53 o   57.766   25.316  -0.4551   4.2808  -2.6042   6.1167   1.6080   5.9931   63.264   28.789   73.783   31.090 -10.51836 42.37209 
1 1 1    7   18   54 o  122.324   25.587   12.728   4.6368   9.5309   6.3057   16.491   6.8418  104.371   34.207  135.680   33.213 -31.30865 47.67801 
1 1 1    7   18   55 o  113.865   25.979   11.179   4.4277   13.668   6.1618   8.5221   6.3667  123.040   32.306   99.246   34.374 23.79394 47.17296 
1 1 1    7   18   56 o  155.307   19.770   19.761   4.5931   22.182   6.4131   17.210   6.5814  160.374   27.090  137.957   31.817 22.41685 41.78793 
1 1 1    7   18   57 o  127.319   29.992   14.661   5.7485   9.7504   14.468   15.581   6.2641  110.478   47.486  130.224   31.720 -19.74613 57.10593 
1 1 1    7   18   58 o   77.849   27.778   4.9946   4.1797  -5.3597   5.9020   15.413   5.9201   54.726   25.994  129.146   30.445 -74.41990 40.03240 
1 1 1    7   18   59 o   77.760   27.577   5.1245   4.1134   9.5271   5.9996   1.2191   5.6506   99.523   33.393   67.801   29.409 31.72158 44.49665 
1 1 1    7   18   60 o   65.087   28.391   0.9569   5.3282   3.6928   6.9204  -3.0261   8.3499   78.566   33.274   68.812   32.128 9.753662 46.25317 
1 1 1    7   19    0 o  617.958   12.257  292.700   11.583  292.700   11.583  292.700   11.583  617.958   12.257  617.958   12.257 0.000000 0.000000 
1 1 1    7   19    1 o  385.098   8.4251  113.534   4.9661  113.033   6.9140  114.068   7.1376  384.186   11.758  385.934   12.083 -1.748322 16.85932 
1 1 1    7   19    2 o  662.856   8.8454  336.387   8.9744  334.864   12.571  337.970   12.816  661.235   12.420  664.287   12.605 -3.052063 17.69597 
1 1 1    7   19    3 f  1832.82   23.909  2577.83   67.074   0.0000   0.0000  2577.83   67.074  ?   ?   1832.82   23.909 0.000000 23.90910 
1 1 1    7   19    4 o  703.619   12.922  379.193   13.917   0.0000   0.0000  379.193   13.917  ?   ?   703.619   12.922 0.000000 12.92237 
1 1 1    7   19    5 o  794.259   7.9401  482.942   9.6530  487.359   11.992  474.815   16.268  797.819   9.8204  787.322   13.499 10.49646 16.69338 
1 1 1    7   19    6 o  835.176   8.1123  533.991   10.370  533.063   12.756  535.802   17.810  834.381   9.9878  836.333   13.913 -1.951599 17.12663 
1 1 1    7   19    7 o  240.821   9.0201   44.402   3.3249   38.470   4.0051   57.552   5.9636  223.823   11.732  273.719   14.284 -49.89583 18.48384 
1 1 1    7   19    8 o  1274.19   10.437  1243.19   20.355  1228.22   24.651  1275.27   36.085  1266.32   12.718  1289.81   18.278 -23.48230 22.26740 
1 1 1    7   19    9 o  1083.86   9.4044  899.447   15.602  884.640   18.841  931.747   27.828  1074.78   11.453  1102.64   16.488 -27.85864 20.07576 
1 1 1    7   19   10 o  622.407   7.5493  296.561   7.1921  287.513   8.6458  316.888   12.959  612.795   9.2177  643.193   13.163 -30.39874 16.06944 
1 1 1    7   19   11 o  501.019   7.4685  192.165   5.7274  191.786   6.9910  192.938   9.9880  500.489   9.1259  501.877   13.002 -1.387634 15.88505 
1 1 1    7   19   12 o  159.947   12.878   19.723   3.1260   18.401   3.7677   22.644   5.5998  154.103   16.217  170.391   21.984 -16.28851 27.31803 
1 1 1    7   19   13 o  794.962   8.1934  483.831   9.9697  484.191   12.175  483.097   17.368  795.187   10.003  794.060   14.290 1.126892 17.44310 
1 1 1    7   19   14 o  504.676   6.7116  194.974   5.1846  192.271   7.2602  197.787   7.4061  501.102   9.4657  508.238   9.5204 -7.136292 13.42523 
1 1 1    7   19   15 o  625.934   6.8155  299.927   6.5297  291.592   9.0096  309.150   9.4769  617.094   9.5386  635.394   9.7444 -18.30017 13.63591 
1 1 1    7   19   16 o  937.570   8.8943  673.066   12.764  669.304   15.551  680.834   22.345  934.834   10.868  942.500   15.489 -7.666382 18.92166 
1 1 1    7   19   17 o  347.267   8.8671   92.339   4.7132   87.720   5.7281  102.022   8.2936  338.423   11.058  364.856   14.851 -26.43301 18.51564 
1 1 1    7   19   18 o  834.568   10.543  533.439   13.468  533.439   13.468   0.0000   0.0000  834.568   10.543  ?   ?  0.000000 10.54330 
1 1 1    7   19   19 o  1553.96   12.376  1850.04   29.437  1883.86   36.610  1788.20   49.511  1567.67   15.257  1526.20   21.194 41.46179 26.11470 
1 1 1    7   19   20 o  878.915   7.7637  591.458   10.444  604.373   14.929  579.077   14.617  888.265   10.981  869.477   10.983 18.78833 15.53073 
1 1 1    7   19   21 o  549.096   7.5278  230.847   6.3268  224.776   8.8060  237.324   9.0959  541.711   10.620  556.624   10.676 -14.91296 15.05899 
1 1 1    7   19   22 o  965.405   9.5167  713.798   14.063  683.469   23.617  730.458   17.504  944.003   16.345  976.423   11.712 -32.42065 20.10782 
1 1 1    7   19   23 o  1016.69   8.4880  791.560   13.209  774.192   18.198  810.898   19.202  1005.18   11.828  1028.70   12.195 -23.51410 16.98908 
1 1 1    7   19   24 o  692.623   7.9339  367.351   8.4112  362.125   11.555  373.240   12.267  687.499   10.981  697.935   11.483 -10.43616 15.88827 
1 1 1    7   19   25 o  1140.16   9.0641  995.679   15.818  1005.53   22.442  985.957   22.299  1145.33   12.802  1134.12   12.846 11.20593 18.13555 
1 1 1    7   19   26 o  902.039   8.4652  623.190   11.688  601.538   16.009  647.905   17.104  885.914   11.806  919.382   12.154 -33.46875 16.94410 
1 1 1    7   19   27 o  709.835   11.825  386.244   12.848   0.0000   0.0000  386.244   12.848  ?   ?   709.835   11.825 0.000000 11.82533 
1 1 1    7   19   28 o  683.042   7.8836  357.342   8.2422  368.117   11.013  343.624   12.427  693.058   10.382  669.434   12.128 23.62421 15.96449 
1 1 1    7   19   29 o  523.497   8.7133  209.964   6.9818  205.685   8.2567  220.702   13.078  518.012   10.414  536.023   15.941 -18.01160 19.04053 
1 1 1    7   19   30 o  408.560   11.845  128.038   7.4076  128.092   13.752  128.016   8.7920  406.905   22.165  408.335   14.067 -1.430450 26.25160 
1 1 1    7   19   31 o  296.138   10.556   67.251   4.7849   51.557   12.399   69.998   5.1867  255.202   32.478  302.085   11.217 -46.88326 34.36058 
1 1 1    7   19   32 o  866.854   6.7303  575.607   8.9300  558.658   12.367  594.073   12.908  853.617   9.4651  880.238   9.5808 -26.62115 13.46773 
1 1 1    7   19   33 o  281.323   8.2301   60.660   3.5439   58.005   4.9001   63.572   5.1315  274.891   11.646  287.779   11.650 -12.88861 16.47253 
1 1 1    7   19   34 o  608.770   7.5536  284.024   7.0385  288.274   8.7077  276.016   11.955  613.088   9.2792  599.295   13.032 13.79254 15.99827 
1 1 1    7   19   35 o  262.588   10.475   52.927   4.2103   56.427   4.9636   43.951   7.9496  271.008   11.966  237.076   22.164 33.93256 25.18817 
1 1 1    7   19   36 o  514.351   8.5228  202.904   6.7098  193.502   9.8539  211.032   9.1620  501.612   12.834  524.105   11.421 -22.49274 17.18014 
1 1 1    7   19   37 o  304.248   9.0351   71.030   4.2076   65.396   5.6187   78.224   6.3487  291.569   12.590  318.832   13.009 -27.26285 18.10385 
1 1 1    7   19   38 o  233.751   9.6915   41.956   3.4675   40.662   4.9469   43.206   4.8617  229.256   14.167  236.460   13.489 -7.204239 19.56129 
1 1 1    7   19   39 o  183.522   11.485   26.008   3.2100   25.550   4.5555   26.459   4.5239  181.008   16.629  184.312   16.200 -3.304062 23.21548 
1 1 1    7   19   40 o  148.066   14.091   17.070   3.1550   10.709   4.3933   23.844   4.5338  114.529   25.694  174.602   17.187 -60.07250 30.91241 
1 1 1    7   19   41 o  368.640   7.8756  104.305   4.4438   99.869   6.2774  108.762   6.2917  360.146   11.388  375.927   10.934 -15.78116 15.78723 
1 1 1    7   19   42 f  187.444   11.892   27.192   3.3942   27.089   4.5456   27.322   5.1027  186.227   16.106  186.546   18.098 -0.3189240 24.22684 
1 1 1    7   19   43 o  410.079   8.1439  129.180   5.1117  123.080   7.5463  134.352   6.9488  399.315   12.347  417.600   10.871 -18.28549 16.45061 
1 1 1    7   19   44 f   64.406   24.051   2.5650   3.1862   1.6288   4.4901   3.5144   4.5220   67.523   27.535   75.609   28.566 -8.086792 39.67567 
1 1 1    7   19   45 o  132.293   21.962   14.138   4.2911   23.397   10.642   12.340   4.6892  162.776   42.320  122.286   25.861 40.49052 49.59601 
1 1 1    7   19   46 o  174.249   13.582   23.667   3.5939   18.169   5.0155   29.470   5.1524  150.008   22.541  193.445   17.594 -43.43701 28.59414 
1 1 1    7   19   47 o  332.795   9.6258   85.335   4.9033   91.548   6.7507   78.397   7.1337  343.800   12.828  317.567   14.676 26.23276 19.49239 
1 1 1    7   19   48 o  454.743   10.974  159.748   7.6383  167.831   8.3579  118.774   18.817  465.800   11.723  377.246   32.918 88.55396 34.94285 
1 1 1    7   19   49 o  202.968   13.683   32.160   4.2261   36.771   6.3266   28.445   5.6789  215.029   19.432  188.721   19.962 26.30748 27.85876 
1 1 1    7   19   50 o  112.504   24.592   10.561   4.1167   4.2746   5.5790   18.076   6.0994   82.086   31.557  146.523   28.220 -64.43771 42.33452 
1 1 1    7   19   51 o  163.295   17.244   21.200   4.2449   13.054   5.9321   29.748   6.0769  122.652   31.449  192.140   21.005 -69.48785 37.81899 
1 1 1    7   19   52 o  247.025   12.526   47.582   4.7208   50.665   6.8070   44.725   6.5525  252.627   17.716  237.049   18.198 15.57727 25.39746 
1 1 1    7   19   53 o  116.930   24.482   11.536   4.2411   17.957   6.0548   5.3516   5.9425  144.669   28.357   86.412   32.722 58.25677 43.29998 
1 1 1    7   19   54 o  151.167   19.775   18.622   4.4659   20.532   6.0565   16.346   6.6113  155.395   26.408  135.028   32.402 20.36717 41.80043 
1 1 1    7   19   55 o  134.886   21.584   15.122   4.3060   11.164   6.0654   19.143   6.1141  110.817   33.170  148.508   27.923 -37.69105 43.35790 
1 1 1    7   19   56 o  201.480   16.012   32.468   4.8973   34.330   7.6095   31.151   6.3985  201.044   25.288  193.738   21.965 7.306259 33.49551 
1 1 1    7   19   57 f  147.231   23.019   18.433   5.0177   26.002   9.5245   15.526   5.9033  161.622   38.958  130.341   30.184 31.28110 49.28264 
1 1 1    7   19   58 o   85.925   27.534   6.5864   4.0989   0.6024   5.8765   12.256   5.7201   67.371   29.590  113.530   31.702 -46.15906 43.36580 
1 1 1    7   19   59 o  167.225   16.898   22.919   4.2659   31.294   6.1520   15.162   5.9204  192.115   21.278  126.121   30.910 65.99396 37.52557 
1 1 1    7   20    0 o  1594.96   21.304  1950.08   51.987  1950.08   51.987  1950.08   51.987  1594.96   21.304  1594.96   21.304 0.000000 0.000000 
1 1 1    7   20    1 o  940.378   10.421  677.137   14.999  686.105   21.418  668.505   21.013  946.329   14.786  934.119   14.697 12.21021 20.84758 
1 1 1    7   20    2 o  764.486   9.4365  447.476   11.042  442.062   15.486  453.074   15.749  759.682   13.318  769.083   13.378 -9.400452 18.87739 
1 1 1    7   20    3 o  648.072   12.725  321.688   12.623   0.0000   0.0000  321.688   12.623  ?   ?   648.072   12.725 0.000000 12.72506 
1 1 1    7   20    4 o  848.779   14.045  551.896   18.247   0.0000   0.0000  551.896   18.247  ?   ?   848.779   14.045 0.000000 14.04506 
1 1 1    7   20    5 o  1077.84   9.3782  889.485   15.472  882.114   18.921  904.359   26.879  1073.24   11.518  1086.34   16.165 -13.09607 19.84854 
1 1 1    7   20    6 f  496.419   7.4089  188.650   5.6295  182.031   6.8957  201.879   9.7477  487.593   9.2396  513.398   12.404 -25.80545 15.46741 
1 1 1    7   20    7 o  1148.26   9.7635  1009.57   17.160  1000.33   20.898  1028.69   30.066  1142.85   11.947  1158.51   16.955 -15.65234 20.74140 
1 1 1    7   20    8 o  1021.19   9.0930  798.439   14.213  797.896   17.435  799.514   24.539  1020.73   11.160  1021.44   15.695 -0.7072754 19.25824 
1 1 1    7   20    9 o  939.377   8.7777  675.615   12.621  705.083   15.932  625.965   20.680  959.540   10.848  903.846   14.948 55.69373 18.46946 
1 1 1    7   20   10 o  600.910   9.3606  276.483   8.6096  276.483   8.6096   0.0000   0.0000  600.910   9.3606  ?   ?  0.000000 9.360609 
1 1 1    7   20   11 o  316.062   10.526   76.499   5.0924   76.499   5.0924   0.0000   0.0000  316.062   10.526  ?   ?  0.000000 10.52639 
1 1 1    7   20   12 f  935.028   8.7851  669.397   12.573  663.271   15.243  682.434   22.238  930.639   10.701  943.651   15.396 -13.01257 18.74980 
1 1 1    7   20   13 o  548.061   6.7376  229.941   5.6520  225.529   7.7992  234.820   8.2024  542.708   9.3889  553.766   9.6771 -11.05804 13.48323 
1 1 1    7   20   14 o  1127.21   8.5247  972.841   14.708  960.419   20.481  986.070   21.135  1119.74   11.950  1134.58   12.170 -14.83594 17.05605 
1 1 1    7   20   15 o  642.378   8.0329  315.938   7.8983  314.647   9.5797  318.676   13.957  641.002   9.7638  644.877   14.140 -3.875000 17.18376 
1 1 1    7   20   16 o  724.018   8.3542  401.365   9.2581  401.572   11.263  400.934   16.256  724.123   10.162  723.278   14.684 0.8450317 17.85737 
1 1 1    7   20   17 o  548.220   8.3745  230.123   7.0273  234.988   8.5065  219.667   12.470  553.927   10.033  535.322   15.219 18.60461 18.22876 
1 1 1    7   20   18 f  952.763   9.1478  695.138   13.340  695.561   16.337  694.293   23.111  952.909   11.201  951.608   15.867 1.300964 19.42189 
1 1 1    7   20   19 o  153.961   17.757   18.424   4.1078   16.424   5.1121   22.070   6.9011  144.278   23.991  167.106   27.969 -22.82817 36.84940 
1 1 1    7   20   20 o  206.628   18.597   33.028   5.8186   31.246   8.3982   34.672   8.0693  199.485   28.298  210.791   25.531 -11.30562 38.11274 
1 1 1    7   20   21 o  348.284   10.906   92.926   5.8138   81.109   9.9557   99.041   7.1618  324.382   20.151  359.486   13.016 -35.10419 23.98908 
1 1 1    7   20   22 o  307.497   10.277   72.431   4.8371   69.312   6.7035   75.819   6.9867  300.664   14.566  314.462   14.516 -13.79745 20.56412 
1 1 1    7   20   23 o  933.132   8.2377  666.810   11.766  664.872   16.460  668.835   16.825  931.490   11.544  934.240   11.766 -2.749939 16.48362 
1 1 1    7   20   24 o  595.026   8.1001  271.143   7.3773  263.191   10.079  280.322   10.828  586.056   11.236  604.797   11.696 -18.74072 16.21866 
1 1 1    7   20   25 o  552.735   8.4142  233.997   7.1187  220.330   9.7287  249.748   10.444  536.145   11.855  570.809   11.954 -34.66370 16.83553 
1 1 1    7   20   26 o  844.452   9.6615  546.360   12.488  547.754   21.177  545.617   15.463  844.637   16.380  843.622   11.975 1.014526 20.29053 
1 1 1    7   20   27 o  124.218   26.974   12.379   4.9816   11.495   6.9184   13.330   7.1788  120.450   35.268  128.864   35.337 -8.414169 49.92555 
1 1 1    7   20   28 o  438.773   10.469  147.581   7.0307  155.341   9.0420  135.715   11.181  449.950   13.129  420.161   17.386 29.78955 21.78631 
1 1 1    7   20   29 o  461.766   9.5407  163.432   6.7433  161.234   9.5095  165.655   9.5636  458.299   13.556  464.551   13.450 -6.251617 19.09635 
1 1 1    7   20   30 o  363.307   8.3430  101.144   4.6395  102.854   5.5847   97.335   8.3347  366.266   9.9617  355.865   15.301 10.40103 18.25840 
1 1 1    7   20   31 o  344.381   9.1609   90.919   4.8289   98.786   6.0972   77.681   7.9093  358.828   11.101  317.322   16.340 41.50577 19.75403 
1 1 1    7   20   32 o  203.038   10.306   31.706   3.1924   33.898   4.5666   29.610   4.4645  209.495   14.327  195.637   15.024 13.85764 20.76042 
1 1 1    7   20   33 o  192.198   13.349   28.530   3.9028   31.116   4.6541   22.403   7.1638  200.488   15.281  167.093   29.065 33.39514 32.83784 
1 1 1    7   20   34 o  187.981   12.769   27.287   3.6524   25.204   4.1258   34.832   7.8524  180.299   15.089  210.193   24.890 -29.89401 29.10685 
1 1 1    7   20   35 o  395.626   8.1170  120.019   4.9153  121.989   6.8203  117.890   7.0902  398.513   11.181  391.676   11.827 6.836945 16.27545 
1 1 1    7   20   36 o  146.828   13.689   16.740   3.0410   19.222   4.1390   13.829   4.4827  156.757   17.552  131.455   23.123 25.30226 29.02995 
1 1 1    7   20   37 o  408.060   7.1767  127.666   4.4825  132.088   6.3312  123.221   6.3471  414.717   9.9739  400.502   10.354 14.21552 14.37644 
1 1 1    7   20   38 o  140.265   14.335   15.330   3.0344   15.028   4.3531   15.615   4.2321  137.387   21.397  140.357   20.288 -2.970367 29.48676 
1 1 1    7   20   39 o  254.929   9.3883   49.922   3.6633   48.142   5.2485   51.612   5.1155  249.437   13.801  258.782   12.915 -9.345551 18.90088 
1 1 1    7   20   40 o  125.218   15.254   12.302   2.8633   15.830   4.0370   8.7301   4.0616  141.412   19.143  103.252   25.779 38.15997 32.10952 
1 1 1    7   20   41 o  365.822   7.9757  102.748   4.4659  102.564   6.1237  102.957   6.5270  364.973   10.962  365.525   11.666 -0.5519714 16.00813 
1 1 1    7   20   42 o  196.130   11.726   29.767   3.5040   35.340   5.0199   24.471   4.8934  212.934   15.509  176.269   18.409 36.66530 24.07068 
1 1 1    7   20   43 o  212.056   10.776   34.738   3.4861   33.268   4.8771   36.274   4.9850  206.465   15.547  215.729   15.194 -9.263977 21.73849 
1 1 1    7   20   44 o   51.299   23.249  -2.0242   3.9381  -3.6411   10.008  -1.7280   4.2837   82.260   37.191   54.754   24.580 27.50621 44.57986 
1 1 1    7   20   45 o   96.411   22.794   7.6421   3.3107   6.0133   4.7237   9.2147   4.6414   88.060   29.630  105.110   28.245 -17.05002 40.93526 
1 1 1    7   20   46 o  218.209   11.361   36.873   3.7816   39.197   5.4679   34.743   5.2356  223.710   16.076  210.458   16.382 13.25197 22.95202 
1 1 1    7   20   47 o  182.635   13.561   26.021   3.7639   29.862   5.2883   22.077   5.3583  194.388   17.977  165.667   21.649 28.72058 28.13989 
1 1 1    7   20   48 o  197.347   17.322   30.751   5.1793   33.941   5.9732   21.087   10.397  206.738   19.092  152.215   42.824 54.52232 46.88690 
1 1 1    7   20   49 o  139.434   19.000   15.599   3.9494   16.727   5.4845   14.384   5.6919  141.748   26.245  130.055   29.296 11.69295 39.33289 
1 1 1    7   20   50 o  346.278   13.646   93.354   7.2326   93.354   7.2326   0.0000   0.0000  346.278   13.646  ?   ?  0.000000 13.64582 
1 1 1    7   20   51 o   77.250   26.553   4.6127   3.7955   2.6252   5.3270   6.6620   5.4091   74.358   30.114   91.302   31.681 -16.94424 43.70960 
1 1 1    7   20   52 o  180.767   15.713   25.869   4.3042   24.790   6.1521   26.903   6.0241  173.305   23.822  181.502   22.143 -8.197083 32.52397 
1 1 1    7   20   53 o  135.254   21.725   15.111   4.3454   16.915   5.9686   13.077   6.3388  139.680   28.871  120.591   33.262 19.08889 44.04431 
1 1 1    7   20   54 o  151.676   18.453   18.644   4.1957   17.490   5.7873   19.923   6.0916  142.221   27.581  152.289   27.128 -10.06822 38.68614 
1 1 1    7   20   55 o   53.753   24.366  -1.6845   4.3287  -2.0320   6.4779  -1.4041   5.8183   65.363   29.698   63.390   28.536 1.972595 41.18613 
1 1 1    7   20   56 o   78.438   29.888   4.5636   4.9769   12.600   9.5659   1.5808   5.8278  113.254   41.795   70.951   30.307 42.30289 51.62651 
1 1 1    7   20   57 o   91.786   27.507   7.5751   4.1693   10.716   5.9488   4.5422   5.8452  106.092   33.066   79.948   31.830 26.14408 45.89717 
1 1 1    7   20   58 f  105.581   25.297   9.9895   4.0345   10.024   5.6709   9.9537   5.7412  102.093   32.351  101.669   32.587 0.4244080 45.91844 
1 1 1    7   21    0 o  1532.52   20.668  1800.44   48.461  1800.44   48.461  1800.44   48.461  1532.52   20.668  1532.52   20.668 0.000000 0.000000 
1 1 1    7   21    1 o  652.478   9.0792  325.958   9.0675  316.323   12.609  336.276   13.049  642.623   12.819  662.578   12.866 -19.95520 18.16260 
1 1 1    7   21    2 o  403.550   8.8159  124.685   5.4454  119.339   7.4759  130.727   7.9477  394.724   12.374  413.123   12.569 -18.39905 17.63755 
1 1 1    7   21    3 f  299.948   14.329   68.930   6.5785   0.0000   0.0000   68.930   6.5785  ?   ?   299.948   14.329 0.000000 14.32893 
1 1 1    7   21    4 o  837.376   14.081  537.213   18.048   0.0000   0.0000  537.213   18.048  ?   ?   837.376   14.081 0.000000 14.08095 
1 1 1    7   21    5 o  154.630   16.522   18.535   3.8499   18.644   5.6188   18.437   5.2857  153.917   24.684  153.266   23.262 0.6514587 33.91812 
1 1 1    7   21    6 o  647.289   7.7098  320.760   7.6385  335.897   9.6615  295.524   12.475  662.329   9.5302  621.111   13.122 41.21783 16.21759 
1 1 1    7   21    7 o  111.324   22.841   9.8609   3.7615   9.8609   3.7615   0.0000   0.0000  111.324   22.841  ?   ?  0.000000 22.84098 
1 1 1    7   21    8 o  977.809   10.975  732.232   16.425  732.232   16.425   0.0000   0.0000  977.809   10.975  ?   ?  0.000000 10.97453 
1 1 1    7   21    9 o  730.052   7.9685  408.046   8.9043  413.652   11.028  397.546   15.093  734.980   9.8028  720.336   13.689 14.64380 16.83705 
1 1 1    7   21   10 o  184.393   12.351   26.162   3.4657   26.976   4.2375   24.517   6.0229  187.026   14.927  177.273   22.720 9.752899 27.18471 
1 1 1    7   21   11 o  998.572   9.1149  763.521   13.932  748.299   16.733  797.914   25.153  988.449   11.060  1020.26   16.107 -31.81268 19.53812 
1 1 1    7   21   12 o  407.530   8.2263  127.159   5.1314  127.390   6.2475  126.680   8.9956  407.858   10.008  406.581   14.455 1.277344 17.58104 
1 1 1    7   21   13 o  292.749   9.6102   65.628   4.3062   65.428   5.1437   66.098   7.8735  292.264   11.498  293.057   17.635 -0.7932129 21.05239 
1 1 1    7   21   14 o  286.749   10.395   62.974   4.5625   62.365   5.4759   64.356   8.2508  285.312   12.539  289.040   18.751 -3.728088 22.55700 
1 1 1    7   21   15 o  1540.03   10.613  1816.52   25.018  1812.21   35.202  1820.92   35.561  1537.61   14.957  1541.28   15.074 -3.671143 21.23545 
1 1 1    7   21   16 o  724.876   7.3605  402.289   8.1666  400.045   11.449  404.612   11.652  722.714   10.350  726.821   10.474 -4.107117 14.72487 
1 1 1    7   21   17 o  707.596   7.4129  383.345   8.0287  375.931   11.220  391.126   11.494  700.576   10.463  714.592   10.508 -14.01550 14.82903 
1 1 1    7   21   18 o  370.588   12.078  105.225   6.8510   0.0000   0.0000  105.225   6.8510  ?   ?   370.588   12.078 0.000000 12.07796 
1 1 1    7   21   19 o  896.612   16.076  616.553   22.062  616.553   22.062   0.0000   0.0000  896.612   16.076  ?   ?  0.000000 16.07562 
1 1 1    7   21   20 o  913.679   9.3323  639.372   13.051  619.251   15.653  685.258   23.638  899.023   11.375  945.164   16.340 -46.14044 19.90935 
1 1 1    7   21   21 o  868.388   9.1925  577.569   12.219  569.607   14.785  594.718   21.700  862.221   11.203  880.482   16.102 -18.26147 19.61559 
1 1 1    7   21   22 o  226.574   14.158   39.518   4.8855   33.592   6.0204   50.945   8.3604  208.271   19.098  256.540   21.489 -48.26865 28.74931 
1 1 1    7   21   23 o  1047.81   12.257  841.576   19.658  841.576   19.658   0.0000   0.0000  1047.81   12.257  ?   ?  0.000000 12.25716 
1 1 1    7   21   24 o  1105.76   10.324  936.893   17.473  920.265   29.449  945.928   21.706  1094.62   17.576  1110.71   12.768 -16.08777 21.72431 
1 1 1    7   21   25 o   49.557   23.572  -6.2201   4.8876   0.6215   8.0975 -10.1413   6.1303   85.498   36.089   51.773   25.077 33.72428 43.94586 
1 1 1    7   21   26 o  508.919   9.7312  198.478   7.5802  197.769   9.5076  199.714   12.558  507.815   12.232  509.916   16.090 -2.101654 20.21171 
1 1 1    7   21   27 o  431.532   10.456  142.758   6.9063  148.824   8.8086  133.080   11.127  440.396   13.067  416.019   17.474 24.37698 21.81933 
1 1 1    7   21   28 o  486.057   9.1678  181.066   6.8206  183.535   9.5221  178.464   9.7745  489.036   12.721  482.177   13.244 6.858887 18.36372 
1 1 1    7   21   29 o   65.543   27.653   0.3593   4.7511  -0.5167   6.7361   1.2266   6.7023   74.935   32.306   79.740   33.188 -4.804947 46.31534 
1 1 1    7   21   30 o  173.373   13.332   23.224   3.5109   24.926   4.0461   18.034   7.0634  179.455   14.864  149.220   31.893 30.23466 35.18646 
1 1 1    7   21   31 o  422.549   7.8980  136.839   5.1082  139.522   6.1071  130.589   9.3203  426.550   9.3539  412.057   14.778 14.49249 17.48924 
1 1 1    7   21   32 o  318.868   8.7151   77.962   4.2536   80.350   5.0094   71.791   8.0528  323.608   10.113  304.654   17.341 18.95392 20.07454 
1 1 1    7   21   33 o  241.246   11.252   44.694   4.1547   47.335   4.9679   38.550   7.5783  247.772   13.146  221.790   22.641 25.98151 26.18082 
1 1 1    7   21   34 o  276.353   9.3213   58.598   3.9428   58.157   5.3845   59.108   5.7895  275.001   12.792  277.147   13.648 -2.145844 18.70564 
1 1 1    7   21   35 o  158.713   12.136   19.481   2.9260   18.792   4.3269   20.062   3.9717  154.758   18.642  160.396   16.409 -5.638489 24.83458 
1 1 1    7   21   36 o   45.388   19.478  -0.1298   2.4273   2.2274   3.4224  -2.5156   3.4432   64.434   24.729   46.181   21.233 18.25338 32.59424 
1 1 1    7   21   37 o  277.596   8.2349   59.128   3.4990   60.177   4.9098   58.045   4.9877  279.708   11.468  274.660   11.864 5.048126 16.50076 
1 1 1    7   21   38 o  231.548   9.2102   41.178   3.2642   38.678   4.4591   44.064   4.7914  223.632   13.084  238.731   13.163 -15.09929 18.55968 
1 1 1    7   21   39 o  578.428   7.1292  256.654   6.3119  257.127   9.3667  256.261   8.5427  578.154   10.585  577.424   9.6657 0.7300415 14.33384 
1 1 1    7   21   40 o   59.610   22.649   2.0171   2.8528   4.0896   4.0539  -0.0161   4.0153   76.705   27.359   58.545   25.086 18.15966 37.11863 
1 1 1    7   21   41 o  146.903   13.768   16.828   3.0596   16.642   4.3608   17.008   4.2938  144.545   20.268  146.317   19.671 -1.772400 28.24396 
1 1 1    7   21   42 o   94.498   20.451   7.2573   2.8723   8.3966   4.1787   6.2369   3.9546  100.866   26.662   88.051   26.880 12.81435 37.86020 
1 1 1    7   21   43 o  382.250   9.7196  112.474   5.6868  117.296   11.696  110.981   6.5078  386.364   19.844  379.343   11.208 7.020447 22.79087 
1 1 1    7   21   44 o  262.384   9.8458   53.025   3.9542   51.412   5.6860   54.536   5.5026  257.014   14.513  264.992   13.612 -7.978302 19.89787 
1 1 1    7   21   45 o   69.367   24.148   3.4964   3.1439   6.5042   4.4377   0.4656   4.4546   89.939   28.631   62.767   26.645 27.17188 39.11134 
1 1 1    7   21   46 o  322.415   9.2826   80.067   4.5810   74.105   6.5823   85.668   6.3794  308.947   13.919  332.629   12.530 -23.68198 18.72836 
1 1 1    7   21   47 o  177.423   39.006   27.815   10.304   0.0000   0.0000   27.815   10.304  ?   ?   177.423   39.006 0.000000 39.00626 
1 1 1    7   21   48 o  305.630   14.006   72.681   6.5521   72.681   6.5521   0.0000   0.0000  305.630   14.006  ?   ?  0.000000 14.00598 
1 1 1    7   21   49 o  138.830   18.443   15.443   3.8222   6.2985   5.3806   24.759   5.4304   90.031   31.577  175.456   20.614 -85.42507 37.70972 
1 1 1    7   21   50 o  286.719   10.976   63.660   4.8170   60.517   6.4138   67.728   7.2955  277.699   15.147  293.247   16.318 -15.54758 22.26450 
1 1 1    7   21   51 o  340.244   12.929   90.186   6.7330   70.355   12.183   98.907   8.0789  290.448   27.742  355.314   14.855 -64.86554 31.46859 
1 1 1    7   21   52 o   93.918   27.212   7.5436   4.1380   5.1700   5.6991   10.190   6.0179   84.854   32.066  107.456   33.220 -22.60207 46.17118 
1 1 1    7   21   53 o  215.590   13.663   36.575   4.4854   36.967   6.1091   36.115   6.6067  214.157   18.828  210.523   20.774 3.634674 28.03655 
1 1 1    7   21   54 o  175.258   17.408   24.722   4.6080   22.322   6.7110   26.863   6.3383  160.229   28.404  179.194   23.690 -18.96527 36.98611 
1 1 1    7   21   55 o  240.562   13.109   45.618   4.8088   38.677   6.5570   53.695   7.0737  217.329   19.934  257.779   18.042 -40.45097 26.88577 
1 1 1    7   21   56 o   63.949   27.530   0.8875   4.8771  -2.0885   8.9300   2.1525   5.8221   74.518   34.238   72.185   30.542 2.333466 45.88094 
1 1 1    7   21   57 o  109.642   25.035   10.680   4.1091   7.8105   5.8410   13.491   5.7817   92.345   32.850  119.324   31.276 -26.97900 45.35763 
1 1 1    7   21   58 o   70.053   27.191   3.5559   4.1728   12.654   6.4782  -2.8962   5.4552  112.332   34.423   56.320   26.186 56.01207 43.25129 
1 1 1    7   22    0 o  457.148   12.554  160.374   8.7695  160.374   8.7695  160.374   8.7695  457.148   12.554  457.148   12.554 0.000000 0.000000 
1 1 1    7   22    1 o  975.341   10.804  728.531   16.129  740.598   23.158  717.163   22.477  983.041   15.391  967.381   15.180 15.66010 21.61716 
1 1 1    7   22    2 o  555.649   12.771  236.513   10.862  236.513   10.862   0.0000   0.0000  555.649   12.771  ?   ?  0.000000 12.77086 
1 1 1    7   22    5 o  535.674   13.780  219.855   11.299  219.855   11.299   0.0000   0.0000  535.674   13.780  ?   ?  0.000000 13.78028 
1 1 1    7   22    6 o  784.527   8.1784  471.229   9.8207  473.254   12.131  467.379   16.729  786.128   10.082  781.010   13.994 5.117859 17.24733 
1 1 1    7   22    7 o  540.035   13.109  223.431   10.836   0.0000   0.0000  223.431   10.836  ?   ?   540.035   13.109 0.000000 13.10932 
1 1 1    7   22    8 o  1154.01   9.9207  1019.83   17.524  1008.95   21.274  1042.80   30.904  1147.66   12.111  1166.20   17.313 -18.53735 21.12834 
1 1 1    7   22    9 o  411.327   8.1590  129.539   5.1368  125.496   6.2707  137.786   8.9563  404.812   10.120  424.050   13.799 -19.23792 17.11220 
1 1 1    7   22   10 o  478.515   8.0299  175.313   5.8813  171.251   7.1634  183.714   10.302  472.887   9.8967  489.647   13.746 -16.75970 16.93797 
1 1 1    7   22   11 o  817.359   8.5158  511.537   10.654  500.004   12.848  536.931   19.063  807.996   10.388  836.983   14.880 -28.98669 18.14764 
1 1 1    7   22   12 o  351.356   9.2634   94.535   4.9818   94.327   6.0709   94.963   8.7172  350.918   11.303  351.937   16.182 -1.018219 19.73875 
1 1 1    7   22   13 o  1418.29   11.546  1540.94   25.065  1538.27   30.641  1546.32   43.577  1416.73   14.130  1419.41   20.058 -2.678711 24.53518 
1 1 1    7   22   14 o  450.938   7.6349  155.689   5.2697  152.106   7.3256  159.532   7.5863  445.625   10.740  456.369   10.860 -10.74399 15.27394 
1 1 1    7   22   15 o  867.449   7.7740  576.140   10.322  579.090   14.612  573.201   14.583  869.469   10.979  865.034   11.014 4.435242 15.55172 
1 1 1    7   22   16 f  151.243   16.580   17.753   3.7752   23.580   5.4169   12.250   5.2643  174.015   20.746  123.680   28.407 50.33472 35.17588 
1 1 1    7   22   17 o  361.090   10.210   99.872   5.6428   86.954   9.6297  106.627   6.9636  336.062   18.796  373.034   12.196 -36.97141 22.40615 
1 1 1    7   22   18 o  657.570   8.8646  331.145   8.9222  328.370   15.426  332.540   10.937  654.362   15.401  658.842   10.846 -4.480774 18.83706 
1 1 1    7   22   19 o  390.695   8.6269  116.899   5.1589  114.041   7.0847  120.124   7.5271  385.768   11.998  395.905   12.421 -10.13632 17.26993 
1 1 1    7   22   20 o  404.886   8.5795  125.549   5.3170  115.557   7.2674  137.058   7.7994  388.298   12.228  422.890   12.049 -34.59195 17.16690 
1 1 1    7   22   21 o  515.423   8.1914  203.455   6.4624  201.354   9.1898  205.510   9.0895  512.568   11.713  517.846   11.467 -5.278076 16.39229 
1 1 1    7   22   22 o  521.724   9.5183  208.528   7.6010  224.937   12.481  198.853   9.5832  541.450   15.060  509.306   12.293 32.14474 19.44002 
1 1 1    7   22   23 o  330.325   13.311   83.688   6.7301   77.956   9.2313   90.191   9.8327  317.888   19.060  342.033   18.854 -24.14548 26.81010 
1 1 1    7   22   24 o  835.080   9.3778  534.327   11.987  523.731   14.602  556.225   20.991  826.508   11.542  851.041   16.114 -24.53375 19.82123 
1 1 1    7   22   25 o  350.685   11.241   94.294   6.0338  103.920   7.7599   79.575   9.5954  367.978   13.777  320.952   19.627 47.02652 23.97964 
1 1 1    7   22   26 o  769.893   8.3896  454.146   9.8865  443.107   13.546  466.727   14.462  760.078   11.644  780.004   12.113 -19.92548 16.80184 
1 1 1    7   22   27 o  992.312   8.7911  754.626   13.352  717.003   17.978  800.915   19.941  966.657   12.150  1021.52   12.753 -54.86395 17.61489 
1 1 1    7   22   28 o  336.592   10.664   86.898   5.4943   85.726   7.6179   88.167   7.9319  333.965   14.903  338.646   15.302 -4.681549 21.36005 
1 1 1    7   22   29 o  384.576   10.098  113.435   5.9443  115.023   8.3518  111.804   8.4624  386.860   14.104  381.364   14.497 5.496277 20.22641 
1 1 1    7   22   30 o  646.639   8.5610  320.557   8.4734  321.068   11.950  320.040   12.017  646.609   12.074  645.557   12.162 1.051941 17.13720 
1 1 1    7   22   31 f  169.504   13.435   22.226   3.4572   21.421   4.0026   24.592   6.8599  166.014   15.948  175.889   26.287 -9.874329 30.74659 
1 1 1    7   22   32 o  465.786   8.5395  166.373   6.0882  166.596   6.5586  164.985   16.371  466.023   9.1947  460.309   23.311 5.714630 25.05924 
1 1 1    7   22   33 o  288.596   11.052   63.974   4.8820   63.157   5.2275   69.542   13.655  286.665   11.914  295.893   30.592 -9.228516 32.83033 
1 1 1    7   22   34 o  307.980   7.9084   72.739   3.7280   71.039   5.3807   74.308   5.1701  304.010   11.563  311.006   10.861 -6.995361 15.86390 
1 1 1    7   22   35 o  337.214   7.7627   87.211   4.0067   77.165   5.6405   97.444   5.6926  316.779   11.633  356.141   10.443 -39.36261 15.63258 
1 1 1    7   22   36 o  337.119   7.8148   87.181   4.0324   88.821   5.8919   85.736   5.5307  339.838   11.327  333.956   10.820 5.881927 15.66426 
1 1 1    7   22   37 f  283.548   8.4397   61.714   3.6629   58.099   5.2961   65.030   5.0715  274.616   12.600  290.709   11.397 -16.09369 16.98980 
1 1 1    7   22   38 o  151.475   12.118   17.788   2.7862   16.447   3.8168   19.318   4.0765  144.557   17.614  156.908   17.259 -12.35034 24.66027 
1 1 1    7   22   39 o  122.975   15.221   11.879   2.8039   11.645   3.8929   12.131   4.0418  120.159   21.976  122.601   22.363 -2.441704 31.35352 
1 1 1    7   22   40 o  138.460   14.095   14.978   2.9456   12.884   3.9729   17.534   4.3896  126.614   21.253  148.575   19.795 -21.96143 29.04358 
1 1 1    7   22   41 o  450.678   10.383  156.409   7.1624   0.0000   0.0000  156.409   7.1624  ?   ?   450.678   10.383 0.000000 10.38299 
1 1 1    7   22   42 o   93.737   25.928   7.2182   3.8453   2.7049   11.803   7.7542   4.0672  101.973   43.333   97.004   26.597 4.968948 50.84455 
1 1 1    7   22   43 o  252.874   9.7327   49.240   3.7671   48.056   5.3799   50.378   5.2766  248.570   14.199  254.693   13.584 -6.123398 19.65059 
1 1 1    7   22   44 o  370.096   8.2107  105.313   4.6512  103.941   6.6760  106.608   6.4838  366.745   11.893  371.567   11.401 -4.822205 16.47447 
1 1 1    7   22   45 o  177.449   12.839   24.512   3.4637   23.169   5.0076   25.745   4.7960  170.605   19.528  180.579   17.574 -9.973236 26.27177 
1 1 1    7   22   46 o  298.221   11.632   68.787   5.3096   71.212   6.1441   61.632   10.552  302.960   13.250  275.971   25.262 26.98862 28.52554 
1 1 1    7   22   47 o   42.040   19.823  -3.4821   3.3170  -1.7524   4.5301  -5.4812   4.8703   56.061   25.213   49.798   23.641 6.263813 34.56319 
1 1 1    7   22   48 o  287.250   12.816   64.070   5.6350   46.761   11.041   70.167   6.5527  235.562   31.403  300.091   14.266 -64.52905 34.49162 
1 1 1    7   22   49 o  202.160   13.155   31.924   4.0486   27.520   5.4566   37.318   6.0386  185.355   19.527  216.631   18.385 -31.27618 26.81981 
1 1 1    7   22   50 o  217.081   12.807   36.803   4.2365   36.098   6.1025   37.459   5.8860  212.479   18.963  216.982   17.882 -4.502396 26.06448 
1 1 1    7   22   51 o  289.751   13.705   65.639   6.0783   81.515   7.4231   33.334   10.589  322.195   15.052  191.786   37.415 130.4090 40.32881 
1 1 1    7   22   52 o  164.762   18.509   21.914   4.5870   15.949   5.8290   31.614   7.4336  135.225   29.030  194.021   25.661 -58.79591 38.74549 
1 1 1    7   22   53 o  166.667   26.049   23.629   6.4277   23.629   6.4277   0.0000   0.0000  166.667   26.049  ?   ?  0.000000 26.04893 
1 1 1    7   22   54 o  126.352   21.930   13.401   4.0873   11.534   5.6481   15.453   5.9223  112.509   31.532  131.246   30.119 -18.73627 43.60527 
1 1 1    7   22   55 o   56.424   25.619  -1.6550   4.8099   3.0015   8.5197  -3.8335   5.8274   84.036   36.280   57.430   26.823 26.60574 45.11904 
1 1 1    7   22   56 o  117.288   23.910   12.002   4.1469   13.063   5.8345   10.919   5.8953  117.452   31.713  106.870   32.853 10.58248 45.66180 
1 1 1    7   22   57 o  132.928   20.994   15.038   4.1297   15.985   5.7701   14.044   5.9130  131.080   29.475  121.005   31.587 10.07466 43.20296 
1 1 1    7   23    1 o  728.683   13.832  406.863   15.428   0.0000   0.0000  406.863   15.428  ?   ?   728.683   13.832 0.000000 13.83225 
1 1 1    7   23    2 o  648.915   13.247  322.629   13.158   0.0000   0.0000  322.629   13.158  ?   ?   648.915   13.247 0.000000 13.24696 
1 1 1    7   23    3 o  864.027   14.646  572.130   19.369   0.0000   0.0000  572.130   19.369  ?   ?   864.027   14.646 0.000000 14.64553 
1 1 1    7   23    4 o  887.360   14.785  603.471   20.082   0.0000   0.0000  603.471   20.082  ?   ?   887.360   14.785 0.000000 14.78550 
1 1 1    7   23    5 o  270.024   12.374   55.857   5.1144   57.307   7.5922   54.653   6.9202  272.733   18.293  266.434   17.059 6.299347 25.01266 
1 1 1    7   23    6 o  793.594   10.400  482.336   12.633  492.132   18.448  473.685   17.335  801.297   15.041  786.185   14.406 15.11218 20.82714 
1 1 1    7   23    7 o  285.652   9.8780   62.488   4.3189   62.351   5.3149   62.756   7.4106  285.287   12.171  285.572   17.031 -0.2843628 20.93335 
1 1 1    7   23    8 o  739.483   8.3401  418.701   9.4400  418.409   11.562  419.286   16.348  739.136   10.220  739.645   14.440 -0.5093994 17.69093 
1 1 1    7   23    9 o  353.721   9.1017   95.811   4.9278   97.172   6.0466   93.118   8.5036  356.175   11.091  348.505   15.941 7.669769 19.42006 
1 1 1    7   23   10 o  372.900   9.0943  106.484   5.1908   98.959   6.2564  123.104   9.2982  359.423   11.372  400.734   15.159 -41.31097 18.95071 
1 1 1    7   23   11 o  769.694   8.5430  453.639   10.065  446.555   12.229  468.509   17.718  763.558   10.464  781.785   14.807 -18.22705 18.13086 
1 1 1    7   23   12 o  522.878   8.5315  209.354   6.8280  208.036   8.3351  212.043   11.905  521.158   10.449  525.935   14.789 -4.776978 18.10798 
1 1 1    7   23   13 o  1806.86   13.937  2502.34   38.545  2507.07   47.411  2493.13   66.195  1807.86   17.134  1800.83   24.015 7.025757 29.50052 
1 1 1    7   23   14 o  582.447   7.4176  259.744   6.6129  261.079   9.4367  258.457   9.2695  583.808   10.560  580.875   10.426 2.932556 14.83977 
1 1 1    7   23   15 f  671.070   8.7807  344.872   9.0192  350.111   16.063  342.459   10.900  675.683   15.531  668.617   10.650 7.065979 18.83224 
1 1 1    7   23   16 o  484.760   9.1432  179.975   6.7841  183.997   12.053  178.110   8.2077  489.770   16.078  482.158   11.121 7.612793 19.54976 
1 1 1    7   23   17 o  1407.96   10.105  1518.56   21.776  1523.44   30.876  1513.72   30.718  1409.56   14.311  1405.06   14.283 4.497803 20.21913 
1 1 1    7   23   18 o  553.991   7.8105  235.019   6.6229  225.949   9.0691  245.384   9.6946  543.042   10.911  565.898   11.192 -22.85596 15.63069 
1 1 1    7   23   19 o  541.382   9.0527  224.501   7.5016  213.455   12.336  230.983   9.4496  527.480   15.279  549.015   11.245 -21.53528 18.97104 
1 1 1    7   23   20 o  1002.32   9.6937  769.682   14.872  744.174   24.595  784.385   18.672  984.627   16.319  1011.56   12.060 -26.93359 20.29180 
1 1 1    7   23   21 o  341.266   9.7565   89.233   5.0963   84.659   7.2456   93.711   7.1696  332.188   14.250  349.546   13.401 -17.35815 19.56123 
1 1 1    7   23   22 o  167.737   16.647   21.822   4.2176   16.713   5.8174   27.483   6.1236  144.762   27.254  187.689   21.717 -42.92644 34.84843 
1 1 1    7   23   23 o  546.042   8.2309  228.410   6.8792  238.003   9.5727  218.165   9.8926  557.157   11.225  533.351   12.118 23.80615 16.51803 
1 1 1    7   23   24 o  581.339   9.2766  258.991   8.2544  257.882   10.138  261.172   14.219  579.893   11.421  583.017   15.934 -3.124512 19.60419 
1 1 1    7   23   25 o  957.074   9.8761  702.188   14.468  696.680   17.668  713.398   25.204  952.912   12.114  963.084   17.098 -10.17151 20.95413 
1 1 1    7   23   26 o  700.340   9.3050  375.974   9.9746  365.871   12.130  397.075   17.530  690.577   11.475  718.606   15.938 -28.02948 19.63905 
1 1 1    7   23   27 o  238.350   13.821   43.792   5.0205   53.850   7.0131   33.219   7.1903  263.878   17.462  205.956   23.214 57.92236 29.04837 
1 1 1    7   23   28 o  230.345   13.775   40.921   4.8345   39.389   6.7660   42.518   6.9102  225.037   19.846  233.939   19.475 -8.901962 27.80576 
1 1 1    7   23   29 o  202.322   15.907   31.709   4.8862   29.895   6.8038   33.641   7.0217  195.053   23.247  207.229   22.499 -12.17599 32.35152 
1 1 1    7   23   30 o  143.025   23.249   16.266   4.9149   14.725   6.6824   18.082   7.2541  134.242   32.801  148.891   32.723 -14.64890 46.33284 
1 1 1    7   23   31 o  274.597   15.297   58.263   6.4038   53.150   7.3773   73.890   12.898  261.634   18.542  306.238   27.819 -44.60406 33.43219 
1 1 1    7   23   32 o  229.028   10.959   40.290   3.8417   38.165   4.4839   46.155   7.4496  222.334   13.236  243.270   20.189 -20.93596 24.14098 
1 1 1    7   23   33 o  502.940   8.1923  194.013   6.3065  189.046   7.9559  202.411   10.345  496.112   10.477  512.813   13.179 -16.70050 16.83634 
1 1 1    7   23   34 o  327.320   8.7283   82.217   4.3729   86.459   5.1012   70.464   8.4920  335.522   9.9331  301.049   18.519 34.47302 21.01472 
1 1 1    7   23   35 o  398.941   7.2487  122.050   4.4263  114.032   5.7515  133.697   6.9318  385.298   9.7525  417.016   10.860 -31.71722 14.59618 
1 1 1    7   23   36 o  202.191   9.6364   31.409   2.9822   30.132   4.0932   32.854   4.3539  197.191   13.645  205.900   13.896 -8.708939 19.47576 
1 1 1    7   23   37 o  255.578   8.6007   50.159   3.3646   45.084   4.6233   55.873   4.9056  241.527   12.549  269.327   11.900 -27.80069 17.29430 
1 1 1    7   23   38 o  188.643   11.139   27.497   3.2019   28.611   4.6625   26.502   4.4049  191.479   16.057  184.302   15.767 7.176865 22.50345 
1 1 1    7   23   39 o  314.717   8.4935   76.097   4.0914   77.886   5.9087   74.448   5.6709  317.752   12.149  310.706   11.924 7.046692 17.02300 
1 1 1    7   23   40 o   68.554   22.193   3.6068   2.6580   1.1555   3.5391   6.7783   4.0256   59.731   24.412   91.342   26.947 -31.61097 36.36054 
1 1 1    7   23   41 f  131.994   19.690   13.921   3.8564   15.775   9.3537   13.541   4.2329  135.436   41.339  129.454   22.159 5.982010 46.90367 
1 1 1    7   23   42 o  160.993   13.036   20.180   3.1848   14.965   4.4622   25.595   4.5471  136.105   22.184  180.549   16.641 -44.44392 27.73157 
1 1 1    7   23   43 o  188.734   11.918   27.631   3.4253   30.055   4.9852   25.463   4.7143  195.615   16.813  179.788   17.347 15.82735 24.15753 
1 1 1    7   23   44 o  472.829   7.8923  171.872   5.7118  174.356   8.5553  169.874   7.6722  474.930   11.769  469.195   10.683 5.734467 15.89451 
1 1 1    7   23   45 o  499.526   9.1910  192.214   7.0274  189.844   8.3931  197.772   12.852  495.715   11.062  502.955   16.695 -7.240143 20.02701 
1 1 1    7   23   46 o  138.333   17.825   15.253   3.6863   14.972   4.9464   15.605   5.5286  134.621   24.923  136.556   27.403 -1.935104 37.04192 
1 1 1    7   23   47 o  104.182   21.602   8.9339   3.3318   2.5472   4.4607   16.993   5.0108   70.350   27.870  143.959   23.555 -73.60894 36.49111 
1 1 1    7   23   48 o  302.118   9.9648   70.507   4.6080   74.399   6.5843   66.771   6.4512  308.987   13.922  292.531   14.408 16.45551 20.03520 
1 1 1    7   23   49 o  100.233   24.391   8.4561   3.7065   13.315   5.4337   4.2276   5.0688  124.441   29.055   79.557   30.199 44.88453 41.90630 
1 1 1    7   23   50 o   72.433   26.387   3.7651   3.7951   3.1931   5.5230   4.2769   5.2238   76.891   30.830   79.947   30.583 -3.056442 43.42533 
1 1 1    7   23   51 o  140.917   19.416   16.159   4.0766   13.891   5.5713   18.772   5.9810  125.951   29.429  148.085   27.396 -22.13361 40.20724 
1 1 1    7   23   52 o  152.143   23.691   19.389   5.3375   24.475   6.4972   8.8324   9.3605  170.003   25.777  104.343   40.662 65.66026 48.14469 
1 1 1    7   23   53 o   85.130   27.192   6.1796   4.0003   6.9374   5.4425   5.2892   5.8997   90.596   31.759   84.633   32.471 5.962486 45.42033 
1 1 1    7   23   54 o  102.727   30.606   9.6233   5.1728  -3.8765   9.0325   16.212   6.3101   72.460   33.692  132.776   31.520 -60.31605 46.13741 
1 1 1    7   23   55 o  162.306   17.526   21.520   4.2848   26.065   6.0926   17.073   6.0270  174.768   23.360  136.652   29.666 38.11536 37.75934 
1 1 1    7   23   56 o  144.479   19.240   17.417   4.1491   10.282   5.7300   25.282   6.0159  103.418   32.488  171.165   23.589 -67.74704 40.14895 
1 1 1    7   24    0 o  177.713   25.215   25.637   6.4600   25.637   6.4600   25.637   6.4600  177.713   25.215  177.713   25.215 0.000000 0.000000 
1 1 1    7   24    1 o  231.209   12.989   41.090   4.5782   36.253   6.1577   47.067   6.8459  216.573   18.761  247.035   18.234 -30.46205 26.16208 
1 1 1    7   24    2 f  326.951   10.870   81.878   5.4400   94.210   7.8247   70.342   7.5682  350.592   14.581  302.440   16.410 48.15219 21.95249 
1 1 1    7   24    3 o  688.498   13.992  363.287   14.745   0.0000   0.0000  363.287   14.745  ?   ?   688.498   13.992 0.000000 13.99152 
1 1 1    7   24    4 o  744.777   14.107  425.121   16.082   0.0000   0.0000  425.121   16.082  ?   ?   744.777   14.107 0.000000 14.10712 
1 1 1    7   24    5 o  597.991   10.041  273.871   9.1903  272.183   13.371  275.383   12.652  595.898   14.660  599.445   13.790 -3.546448 20.12648 
1 1 1    7   24    6 o  689.885   10.283  364.527   10.858  354.534   15.519  374.111   15.198  680.071   14.909  698.647   14.212 -18.57538 20.59742 
1 1 1    7   24    7 o  346.046   9.4391   91.705   4.9996   95.607   6.0774   83.537   8.7937  353.281   11.239  329.546   17.496 23.73416 20.79500 
1 1 1    7   24    8 o  258.944   11.295   51.366   4.4768   48.758   5.5064   56.451   7.6891  251.804   14.346  270.592   18.679 -18.78821 23.55254 
1 1 1    7   24    9 o  1041.60   9.6418  830.911   15.372  833.453   18.912  825.961   26.388  1043.00   11.846  1037.75   16.613 5.245239 20.40418 
1 1 1    7   24   10 f  427.938   8.8583  140.240   5.8023  140.795   7.1821  139.197   9.8454  428.713   10.945  426.091   15.096 2.622223 18.64624 
1 1 1    7   24   11 o  961.861   9.3109  708.553   13.708  712.220   16.956  701.634   23.290  964.169   11.490  956.503   15.908 7.665161 19.62340 
1 1 1    7   24   12 o  724.234   8.6418  401.671   9.5797  396.300   11.715  412.510   16.643  719.258   10.641  733.492   14.824 -14.23395 18.24768 
1 1 1    7   24   13 o  920.935   11.295  649.803   15.922  661.164   23.154  639.612   21.931  928.392   16.294  913.212   15.690 15.18024 22.61977 
1 1 1    7   24   14 f  669.830   10.703  343.733   10.974  333.641   15.573  353.688   15.466  659.554   15.426  679.130   14.878 -19.57666 21.43178 
1 1 1    7   24   15 o  751.291   7.6989  432.216   8.8533  420.232   12.328  444.980   12.722  740.594   10.875  762.086   10.907 -21.49261 15.40212 
1 1 1    7   24   16 o  782.274   8.9036  468.709   10.661  464.368   17.881  471.103   13.279  778.072   15.015  784.099   11.064 -6.027222 18.65088 
1 1 1    7   24   17 o  837.695   9.1079  537.521   11.678  521.214   19.326  546.901   14.657  824.223   15.319  844.767   11.335 -20.54364 19.05645 
1 1 1    7   24   18 o  570.203   7.8627  249.003   6.8623  252.849   9.7843  245.280   9.6270  574.386   11.129  565.725   11.118 8.660889 15.73088 
1 1 1    7   24   19 o  556.117   7.9426  236.869   6.7608  246.175   9.6341  227.840   9.4900  566.727   11.106  545.194   11.372 21.53351 15.89579 
1 1 1    7   24   20 f  450.591   8.6319  155.536   5.9533  149.503   8.1757  162.346   8.6858  441.555   12.097  460.113   12.333 -18.55862 17.27545 
1 1 1    7   24   21 o  338.150   9.7973   87.630   5.0709   84.521   7.0680   90.929   7.2794  331.864   13.914  344.221   13.816 -12.35703 19.60856 
1 1 1    7   24   22 o  740.586   9.2168  420.302   10.448  418.127   12.796  424.651   18.097  738.421   11.321  743.443   15.903 -5.022217 19.52140 
1 1 1    7   24   23 o  357.216   10.850   97.850   5.9325   94.617   7.3087  104.092   10.157  351.069   13.601  367.796   18.042 -16.72675 22.59462 
1 1 1    7   24   24 o  974.330   8.6650  727.519   12.922  719.165   17.887  736.638   18.689  968.100   12.071  979.705   12.463 -11.60480 17.35069 
1 1 1    7   24   25 o  590.827   8.3096  267.516   7.5146  268.803   10.462  266.145   10.801  591.873   11.548  588.880   11.983 2.993042 16.64179 
1 1 1    7   24   26 o  455.618   9.1208  159.151   6.3607  165.297   8.7759  152.350   9.2321  463.988   12.357  445.303   13.545 18.68570 18.33471 
1 1 1    7   24   27 o  398.499   10.956  121.870   6.6825  127.399   8.2654  111.433   11.355  407.177   13.262  379.405   19.620 27.77197 23.68210 
1 1 1    7   24   28 o  679.103   9.5253  353.747   9.9011  356.728   12.183  347.946   16.993  681.571   11.678  671.990   16.521 9.581604 20.23154 
1 1 1    7   24   29 o   92.734   31.866   6.2252   5.4663   6.1568   6.1592   6.4789   11.862   94.630   33.726  114.684   45.444 -20.05341 56.59115 
1 1 1    7   24   30 o  235.448   14.186   42.824   5.0886   44.664   7.0674   40.843   7.3328  239.514   19.446  228.598   21.198 10.91554 28.76624 
1 1 1    7   24   31 o  429.051   11.639  141.477   7.6435  124.515   13.619  149.276   9.2351  399.669   22.352  440.362   13.701 -40.69376 26.21720 
1 1 1    7   24   32 o  198.843   16.313   30.729   4.9211   30.162   6.8356   31.339   7.0904  195.440   23.310  199.159   23.727 -3.719269 33.26127 
1 1 1    7   24   33 o  284.963   9.0597   62.332   3.9516   63.612   4.5761   58.579   7.8361  287.739   10.390  274.295   18.777 13.44400 21.46027 
1 1 1    7   24   34 o  476.162   7.6150  173.915   5.5500  171.855   6.5726  179.036   10.361  473.107   9.0762  481.808   14.049 -8.700653 16.72578 
1 1 1    7   24   35 o   59.565   22.436   2.0654   2.7844   0.7513   3.0218   9.4550   7.1658   54.429   22.437  109.939   36.486 -55.51095 42.83270 
1 1 1    7   24   36 o  245.695   8.5005   46.353   3.1968   45.822   4.3689   46.965   4.6900  243.922   11.702  246.533   12.469 -2.610382 17.10013 
1 1 1    7   24   37 o  177.624   10.831   24.376   2.9306   23.025   3.9160   26.097   4.4183  171.844   15.040  182.831   15.948 -10.98694 21.92083 
1 1 1    7   24   38 o  232.155   9.2364   41.437   3.2821   41.410   4.4341   41.470   4.8812  231.296   12.572  231.183   13.858 0.1124420 18.71114 
1 1 1    7   24   39 o   65.046   24.522   2.5315   3.3278   5.8955   3.7216 -10.8898   7.4336   85.713   26.056   57.771   27.893 27.94212 38.16969 
1 1 1    7   24   40 o  201.264   13.987   31.511   4.2821   37.223   15.193   31.018   4.4630  202.656   49.423  199.503   14.719 3.153122 51.56821 
1 1 1    7   24   41 o   96.054   19.932   7.4929   2.8344   10.697   4.2190   4.8570   3.8266  113.939   24.888   79.685   26.669 34.25466 36.47803 
1 1 1    7   24   42 o  246.598   9.6580   46.833   3.6454   43.314   5.1456   50.379   5.1652  235.854   14.321  254.714   13.295 -18.86079 19.54105 
1 1 1    7   24   43 o  197.742   11.490   30.308   3.4626   33.514   4.8385   26.942   4.9573  206.971   15.383  184.757   17.748 22.21414 23.48708 
1 1 1    7   24   44 o  347.197   10.481   93.031   5.5697   91.672   6.5176   96.712   10.724  344.086   12.375  349.578   20.128 -5.491913 23.62795 
1 1 1    7   24   45 o   64.780   24.752   2.4739   3.4195   5.0992   4.7798  -0.2782   4.8939   83.237   29.705   62.824   27.309 20.41286 40.35084 
1 1 1    7   24   46 o  249.108   10.310   47.927   3.9312   49.602   5.4258   46.075   5.7037  252.051   14.121  242.422   15.452 9.629471 20.93208 
1 1 1    7   24   47 o  114.458   20.349   10.685   3.4343   9.8072   4.8193   11.591   4.8954  107.253   28.764  116.815   27.784 -9.561729 39.99165 
1 1 1    7   24   48 o  113.099   21.217   10.521   3.5380   9.4162   5.0140   11.616   4.9932  104.722   29.836  116.471   28.290 -11.74946 41.11558 
1 1 1    7   24   49 f   90.844   24.991   6.9707   3.5838   5.4357   4.9701   8.6334   5.1725   84.297   30.269  100.211   30.768 -15.91444 43.16094 
1 1 1    7   24   50 o  274.941   11.775   58.827   4.9555   54.162   6.9236   63.726   7.0958  260.731   17.450  283.526   16.421 -22.79440 23.96125 
1 1 1    7   24   51 o  139.127   19.706   15.824   4.0792   17.987   6.3803   14.330   5.3051  142.968   30.107  128.457   27.789 14.51115 40.97184 
1 1 1    7   24   52 o   99.356   25.223   8.5394   3.8426   11.213   5.5587   6.0928   5.3179  111.466   31.296   86.755   31.292 24.71142 44.25623 
1 1 1    7   24   53 o   83.756   27.369   6.0102   4.0377   9.0014   5.9143   3.3990   5.5259   99.579   33.152   75.842   30.686 23.73680 45.17414 
1 1 1    7   24   54 o   89.025   30.527   7.0098   5.0151   0.8360   8.9232   9.8605   6.0634   80.003   35.726  102.392   33.542 -22.38932 49.00475 
1 1 1    7   24   55 o   78.332   27.717   5.1800   4.1530   5.0274   5.8317   5.3370   5.9158   81.216   31.964   82.553   32.283 -1.336769 45.43016 
1 1 1    7   25    0 o  754.257   14.476  436.227   16.698  436.227   16.698  436.227   16.698  754.257   14.476  754.257   14.476 0.000000 0.000000 
1 1 1    7   25    1 o  1774.78   16.690  2415.87   45.339  2407.48   63.810  2424.43   64.434  1769.79   23.556  1775.95   23.704 -6.167480 33.41755 
1 1 1    7   25    2 o  520.163   9.8714  207.229   7.8594  206.773   10.950  207.714   11.287  519.401   13.774  520.560   14.166 -1.158386 19.75812 
1 1 1    7   25    3 o  505.599   14.188  195.949   10.980   0.0000   0.0000  195.949   10.980  ?   ?   505.599   14.188 0.000000 14.18813 
1 1 1    7   25    4 o  398.087   15.133  121.504   9.2212   0.0000   0.0000  121.504   9.2212  ?   ?   398.087   15.133 0.000000 15.13345 
1 1 1    7   25    5 o  838.675   10.873  538.817   13.958  534.390   19.855  543.143   19.625  834.808   15.539  841.648   15.234 -6.840698 21.76093 
1 1 1    7   25    6 o  721.401   10.436  398.639   11.524  386.252   16.243  411.192   16.351  709.771   14.952  732.360   14.587 -22.58917 20.88822 
1 1 1    7   25    7 o  1501.87   14.855  1729.42   34.150  1723.26   48.446  1735.50   48.145  1497.79   21.132  1503.15   20.926 -5.361816 29.73952 
1 1 1    7   25    8 o  259.618   11.705   51.644   4.6515   48.224   5.7167   58.342   8.0013  250.336   14.988  275.017   19.127 -24.68094 24.29991 
1 1 1    7   25    9 o  911.795   9.1502  636.725   12.770  634.104   15.690  641.870   21.980  909.745   11.268  914.822   15.697 -5.077881 19.32257 
1 1 1    7   25   10 o  875.238   11.176  586.921   14.972  586.530   21.578  587.283   20.790  874.417   16.122  875.053   15.522 -0.6354370 22.37979 
1 1 1    7   25   11 o  110.552   30.525   9.7207   5.3353   1.0325   7.7636   17.496   7.3444   85.113   35.597  147.566   33.306 -62.45293 48.74874 
1 1 1    7   25   12 o  259.507   20.820   52.084   8.2001   0.0000   0.0000   52.084   8.2001  ?   ?   259.507   20.820 0.000000 20.81952 
1 1 1    7   25   13 o  705.668   10.597  381.533   11.446  387.193   16.138  375.805   16.237  710.496   14.839  699.936   15.155 10.55975 21.21083 
1 1 1    7   25   14 o  286.083   13.679   62.760   5.9900   62.502   8.0706   63.076   8.9381  284.652   18.626  285.716   20.576 -1.063965 27.75413 
1 1 1    7   25   15 o  112.022   26.565   10.066   4.4858   12.422   5.4638   5.1943   7.8569  124.350   29.204   98.181   37.519 26.16897 47.54511 
1 1 1    7   25   16 o  563.371   7.8195  243.077   6.7429  247.398   9.6385  238.935   9.4364  568.148   11.084  558.348   11.042 9.799622 15.64484 
1 1 1    7   25   17 o  529.729   8.0001  214.931   6.4866  214.057   9.1078  215.831   9.2405  528.441   11.260  530.617   11.377 -2.176453 16.00753 
1 1 1    7   25   18 o  560.116   7.9655  240.309   6.8290  246.421   9.7586  234.443   9.5598  566.952   11.245  552.998   11.294 13.95422 15.93793 
1 1 1    7   25   19 o  550.166   8.0924  231.868   6.8146  226.038   9.3466  238.484   9.9570  542.964   11.246  557.673   11.665 -14.70831 16.20342 
1 1 1    7   25   20 o  407.442   10.105  127.252   6.3020  125.251   7.6768  131.386   11.036  404.063   12.413  413.356   17.443 -9.293365 21.40842 
1 1 1    7   25   21 o  760.582   9.2196  443.354   10.733  447.279   13.163  435.568   18.540  763.673   11.261  752.777   16.091 10.89618 19.63986 
1 1 1    7   25   22 o  191.609   14.879   28.378   4.3296   26.293   5.8977   30.815   6.3761  183.383   21.415  198.740   21.292 -15.35721 30.19836 
1 1 1    7   25   23 o  339.871   9.8833   88.571   5.1415   86.600   7.2667   90.546   7.2756  335.737   14.141  343.327   13.845 -7.589813 19.78983 
1 1 1    7   25   24 o  493.588   8.5306  186.736   6.4449  185.655   8.8131  187.979   9.4490  491.827   11.707  494.800   12.476 -2.973633 17.10877 
1 1 1    7   25   25 o  104.701   26.544   8.8487   4.2597   4.4433   5.7898   14.047   6.2894   86.408   32.390  131.443   31.642 -45.03457 45.28064 
1 1 1    7   25   26 o  781.573   8.3883  468.293   10.035  466.414   13.978  470.293   14.415  779.372   11.717  782.536   12.035 -3.163391 16.79697 
1 1 1    7   25   27 o  481.351   10.613  177.840   7.8191  179.243   9.2771  174.397   14.529  482.967   12.549  474.913   19.987 8.054626 23.60059 
1 1 1    7   25   28 o  515.643   9.1046  203.956   7.1859  210.896   9.7803  195.814   10.593  523.866   12.197  504.512   13.718 19.35391 18.35604 
1 1 1    7   25   29 o  170.880   19.724   22.895   5.0641   20.276   6.3218   27.585   8.4601  159.002   26.937  184.932   30.984 -25.93011 41.05636 
1 1 1    7   25   30 o  157.369   28.510   20.001   6.6143   26.475   11.087   16.423   8.2417  177.853   41.487  140.849   37.546 37.00371 55.95404 
1 1 1    7   25   31 o   89.943   30.100   6.0667   4.8745   5.2981   6.4883   7.0625   7.3856   91.936   34.323  101.594   36.841 -9.658051 50.35175 
1 1 1    7   25   32 o  251.157   14.011   48.776   5.3648   58.056   7.6874   39.965   7.4904  273.092   18.500  225.493   21.982 47.59880 28.73052 
1 1 1    7   25   33 o  142.573   23.877   16.312   5.0264   20.879   7.3095   12.216   6.9229  159.643   31.031  121.808   35.169 37.83562 46.90228 
1 1 1    7   25   34 o  318.770   8.8849   78.033   4.3351   81.539   5.0084   67.560   8.6569  325.697   10.046  294.137   19.336 31.56079 21.79029 
1 1 1    7   25   35 o  414.993   8.5108  132.249   5.4061  130.040   6.5089  137.163   9.7072  411.181   10.342  421.116   15.060 -9.935425 18.26902 
1 1 1    7   25   36 o  229.560   11.054   40.580   3.8840   38.297   4.2204   53.213   9.9280  222.488   12.443  258.366   25.434 -35.87804 28.31484 
1 1 1    7   25   37 o  219.352   8.9837   36.984   3.0163   36.685   4.0734   37.346   4.4879  217.718   12.273  219.439   13.426 -1.721085 18.19078 
1 1 1    7   25   38 o  192.581   10.151   28.628   2.9818   25.318   3.9964   32.783   4.4782  180.224   14.613  205.289   14.342 -25.06563 20.47532 
1 1 1    7   25   39 o  296.669   10.311   67.788   4.6823   66.795   9.8580   68.077   5.3207  290.317   22.356  297.029   11.703 -6.711426 25.23435 
1 1 1    7   25   40 o  122.204   15.023   11.759   2.7508   13.651   4.0456   10.132   3.7515  130.232   21.010  111.358   22.778 18.87437 30.98786 
1 1 1    7   25   41 o   36.748   17.428  -3.1114   2.6335  -5.1113   3.7542  -1.1739   3.6951   42.237   20.245   51.927   23.104 -9.690208 30.71855 
1 1 1    7   25   42 o  147.112   13.797   16.929   3.0704   19.141   4.5626   15.097   4.1509  154.886   19.691  137.072   20.406 17.81354 28.35746 
1 1 1    7   25   43 o  194.250   14.872   29.525   4.3883   29.429   4.9538   29.875   9.4586  193.318   16.912  187.153   34.282 6.164215 38.22650 
1 1 1    7   25   44 o   45.406   20.642  -1.7215   3.1353  -4.5600   4.3023   1.4930   4.5784   47.574   22.477   66.985   27.616 -19.41132 35.60652 
1 1 1    7   25   45 o  187.162   12.731   27.299   3.6253   28.274   5.1261   26.324   5.1279  188.849   17.950  181.905   18.683 6.944199 25.90800 
1 1 1    7   25   46 o  127.756   18.423   13.116   3.4984   18.329   5.0956   8.4683   4.8116  149.707   22.971  100.051   29.445 49.65598 37.34544 
1 1 1    7   25   47 o   79.851   24.521   5.2200   3.2851   5.6072   4.6193   4.8237   4.6728   84.638   29.282   80.986   29.314 3.651962 41.43334 
1 1 1    7   25   48 o  142.032   17.805   16.189   3.7857   14.631   5.5199   17.573   5.2018  130.537   28.432  145.393   24.227 -14.85582 37.35389 
1 1 1    7   25   49 o   86.404   26.097   6.2910   3.7421   0.6958   5.1191   12.712   5.4838   66.199   28.344  120.419   29.892 -54.21968 41.19336 
1 1 1    7   25   50 o  153.815   17.474   19.030   4.0409   18.461   6.1691   19.458   5.3479  145.867   28.653  152.629   23.657 -6.762115 37.15734 
1 1 1    7   25   51 f  160.146   16.608   20.578   4.0118   16.030   5.7647   24.850   5.5867  135.100   28.760  173.601   21.484 -38.50082 35.89799 
1 1 1    7   25   52 f  187.537   23.800   29.658   6.6780   29.796   9.4447   29.520   9.4435  178.189   35.870  177.176   36.049 1.013824 50.85453 
1 1 1    7   25   53 o  111.752   28.175   11.279   4.8182   7.3303   9.1040   12.816   5.6786   96.198   39.215  117.504   31.091 -21.30593 50.04508 
1 1 1    7   25   54 o  134.483   20.687   15.251   4.1218   20.523   5.9959   10.527   5.6756  152.082   26.734  105.212   32.217 46.87013 41.86442 
1 1 1    7   25   55 o   50.642   23.695  -3.2061   4.5816  -2.1053   5.6924  -5.2308   7.7202   59.486   27.333   63.284   29.963 -3.797546 40.55669 
1 1 1    7   26    0 o  649.066   14.451  323.194   14.340  323.194   14.340  323.194   14.340  649.066   14.451  649.066   14.451 0.000000 0.000000 
1 1 1    7   26    1 o  1201.72   12.648  1106.78   23.264  1112.45   32.978  1101.16   32.822  1203.94   17.896  1197.81   17.902 6.128174 25.31314 
1 1 1    7   26    2 o  325.840   11.668   81.353   5.8195   76.827   8.0965   86.191   8.3703  315.996   16.800  335.194   16.315 -19.19861 23.41807 
1 1 1    7   26    3 o  445.480   15.001  152.185   10.228   0.0000   0.0000  152.185   10.228  ?   ?   445.480   15.001 0.000000 15.00079 
1 1 1    7   26    4 o  855.211   15.298  560.931   20.026   0.0000   0.0000  560.931   20.026  ?   ?   855.211   15.298 0.000000 15.29833 
1 1 1    7   26    5 o  691.078   14.407  366.205   15.240   0.0000   0.0000  366.205   15.240  ?   ?   691.078   14.407 0.000000 14.40739 
1 1 1    7   26    6 o  963.552   16.082  712.269   23.718   0.0000   0.0000  712.269   23.718  ?   ?   963.552   16.082 0.000000 16.08157 
1 1 1    7   26    7 o  1422.54   20.230  1554.79   44.048   0.0000   0.0000  1554.79   44.048  ?   ?   1422.54   20.230 0.000000 20.22960 
1 1 1    7   26    8 o  1013.60   16.570  788.409   25.707   0.0000   0.0000  788.409   25.707  ?   ?   1013.60   16.570 0.000000 16.56976 
1 1 1    7   26    9 o  1235.73   18.386  1172.68   34.777   0.0000   0.0000  1172.68   34.777  ?   ?   1235.73   18.386 0.000000 18.38619 
1 1 1    7   26   10 o  393.021   9.6662  118.331   5.8149  112.374   7.0929  130.539   10.155  382.895   12.103  412.438   16.086 -29.54340 20.13002 
1 1 1    7   26   11 o  338.389   10.462   87.739   5.4187   82.524   6.5802   98.728   9.5513  328.066   13.104  358.574   17.403 -30.50833 21.78465 
1 1 1    7   26   12 o  471.923   9.0571  170.605   6.5423  173.166   8.1100  165.832   11.071  475.338   11.147  464.849   15.559 10.48846 19.13999 
1 1 1    7   26   13 o  1137.71   10.288  991.878   17.916  974.099   21.563  1031.51   32.195  1127.13   12.499  1158.66   18.154 -31.53308 22.04042 
1 1 1    7   26   14 o  176.358   17.409   24.124   4.6381   25.313   5.6216   21.590   8.2085  180.201   20.761  163.853   33.849 16.34782 39.70890 
1 1 1    7   26   15 o  471.263   9.3943  170.169   6.7764  174.149   8.3073  162.256   11.714  476.609   11.388  459.592   16.652 17.01709 20.17365 
1 1 1    7   26   16 o  266.628   11.060   54.501   4.5135   60.654   6.3554   48.240   6.4111  280.691   14.845  249.998   16.853 30.69250 22.45864 
1 1 1    7   26   17 o  978.082   8.4918  732.932   12.713  729.092   17.776  736.952   18.188  975.003   11.912  980.207   12.123 -5.204102 16.99555 
1 1 1    7   26   18 o  649.449   9.0540  323.223   9.0002  322.341   10.933  325.076   15.852  648.357   11.017  650.412   15.923 -2.054382 19.36289 
1 1 1    7   26   19 o  664.556   9.0733  338.466   9.2293  331.246   11.091  354.723   16.642  657.209   11.026  679.318   16.005 -22.10925 19.43545 
1 1 1    7   26   20 o  173.070   15.570   23.209   4.0805   28.299   5.7207   17.938   5.8221  190.590   19.904  150.031   26.312 40.55937 32.99241 
1 1 1    7   26   21 o  329.315   9.8780   83.155   4.9791   79.463   6.8060   87.407   7.3032  321.628   13.825  337.292   14.146 -15.66473 19.77998 
1 1 1    7   26   22 o  329.174   9.9244   83.097   5.0004   80.929   6.8349   85.593   7.3346  324.545   13.759  333.708   14.359 -9.163025 19.88739 
1 1 1    7   26   23 o  585.626   8.1159  262.857   7.2749  262.338   10.126  263.410   10.459  584.643   11.315  585.784   11.665 -1.141174 16.25132 
1 1 1    7   26   24 o  267.171   13.962   55.031   5.6900   68.416   6.8610   25.543   10.183  297.805   15.101  176.332   38.784 121.4734 41.62023 
1 1 1    7   26   25 o  532.617   10.005  217.657   8.1565  213.804   9.6783  227.102   15.153  527.590   11.985  542.449   18.250 -14.85901 21.83349 
1 1 1    7   26   26 o  474.038   9.0991  172.361   6.6021  167.182   9.0039  178.383   9.7095  466.381   12.613  481.659   13.170 -15.27725 18.23569 
1 1 1    7   26   27 o  377.695   10.105  109.498   5.8416  108.977   8.2185  110.029   8.3047  376.244   14.271  378.044   14.352 -1.800049 20.23954 
1 1 1    7   26   28 o  334.794   12.773   86.216   6.5452  108.327   12.307   77.495   7.7289  372.923   21.654  316.562   16.003 56.36133 26.92535 
1 1 1    7   26   29 o  136.714   27.950   15.177   5.6513   16.376   10.089   14.629   6.8220  141.078   42.905  133.260   33.486 7.818344 54.42572 
1 1 1    7   26   30 o  273.710   12.366   57.647   5.1806   53.173   7.0119   63.025   7.6877  261.575   17.616  284.851   17.720 -23.27609 24.98651 
1 1 1    7   26   31 o  305.904   13.214   72.095   6.1869   65.210   7.7852   83.895   10.193  289.664   17.643  327.884   20.410 -38.22067 26.97916 
1 1 1    7   26   32 o  560.619   10.504  241.630   9.0136  243.027   11.434  239.337   14.649  561.469   13.305  555.829   17.219 5.639160 21.76043 
1 1 1    7   26   33 o  357.333   13.120   98.465   7.1761  107.292   11.846   93.348   9.0195  370.270   20.988  347.039   16.980 23.23087 26.99644 
1 1 1    7   26   34 o  149.369   27.532   18.195   6.0627   17.778   10.460   18.406   7.4401  144.493   43.628  148.445   33.536 -3.951904 55.02774 
1 1 1    7   26   35 o  100.774   20.150   8.2014   2.9996   9.4785   3.2144  -0.4042   8.3439  108.536   20.089   81.992   35.650 26.54437 40.92071 
1 1 1    7   26   36 o   58.533   22.522   1.8468   2.8434  -0.2852   3.0884   13.711   7.2855   50.387   21.798  127.486   35.841 -77.09924 41.94953 
1 1 1    7   26   37 f   51.125   21.694   0.1788   2.9507  -0.1217   3.1720   2.1089   8.0399   51.680   22.224   86.690   36.238 -35.01066 42.50981 
1 1 1    7   26   38 o  234.117   11.520   42.284   4.1282   46.429   9.0965   41.209   4.6327  240.631   25.065  230.474   13.187 10.15773 28.32262 
1 1 1    7   26   39 o   93.834   18.920   7.1253   2.6236   8.4020   3.5998   5.6788   3.8317  101.062   23.684   84.428   26.575 16.63409 35.59731 
1 1 1    7   26   40 o  126.613   14.584   12.601   2.7747   13.617   3.9220   11.583   3.9261  130.164   20.352  119.272   22.326 10.89137 30.21036 
1 1 1    7   26   41 o  142.251   17.647   16.054   3.7598   15.580   4.1524   18.206   8.8576  139.408   20.036  143.995   39.155 -4.586777 43.98381 
1 1 1    7   26   42 o  162.874   16.975   20.953   4.1697   20.425   4.2955   29.571   17.360  160.549   17.778  173.666   56.750 -13.11673 59.46936 
1 1 1    7   26   43 o  234.469   11.042   42.484   3.9630   40.602   5.3624   44.750   5.8827  227.662   15.480  238.806   16.190 -11.14397 22.39972 
1 1 1    7   26   44 o  185.175   12.644   26.716   3.5623   19.881   4.9529   34.041   5.1275  156.985   21.151  208.005   16.233 -51.02049 26.66240 
1 1 1    7   26   45 o   79.910   23.932   5.2262   3.1567   6.6806   4.5205   3.8421   4.4099   90.273   28.914   75.724   28.291 14.54942 40.45247 
1 1 1    7   26   46 o  184.055   19.642   27.175   5.4481   40.253   6.6016  -0.7541   9.6474  224.478   19.404   84.120   37.384 140.3579 42.11973 
1 1 1    7   26   47 o  269.786   10.812   56.403   4.4647   56.964   6.5327   55.911   6.1159  268.737   15.953  266.671   15.045 2.065521 21.92850 
1 1 1    7   26   48 o   80.266   25.608   5.3003   3.5486   2.9664   4.9150   7.8417   5.1287   73.261   29.182   95.835   30.808 -22.57468 42.43476 
1 1 1    7   26   49 o   86.694   30.096   6.1239   4.8818   0.0000   0.0000   6.1239   4.8818  ?   ?    86.694   30.096 0.000000 30.09621 
1 1 1    7   26   50 o  163.170   15.527   21.225   3.8311   16.147   5.6124   25.655   5.2425  136.218   27.858  177.516   19.622 -41.29779 34.07487 
1 1 1    7   26   51 o   70.698   26.601   3.5474   3.9124  -2.1650   5.4350   9.6909   5.6363   59.218   27.021  103.221   32.188 -44.00324 42.02642 
1 1 1    7   26   52 o   76.188   28.967   4.3099   4.6685  -2.8857   8.9485   7.0008   5.4722   73.477   33.944   89.723   31.809 -16.24674 46.51897 
1 1 1    7   26   53 o   70.846   26.754   3.7231   3.9657   7.6547   5.8739   0.4299   5.3758   92.145   32.925   64.754   28.374 27.39103 43.46437 
1 1 1    7   26   54 o   62.138   26.809   0.8788   4.6460   1.5582   5.6046  -0.6136   8.3070   68.643   29.531   73.856   33.586 -5.212845 44.72211 
1 1 1    7   27    0 o  1309.54   18.996  1315.74   38.058  1315.74   38.058  1315.74   38.058  1309.54   18.996  1309.54   18.996 0.000000 0.000000 
1 1 1    7   27    1 o  334.212   11.928   85.611   6.1020   89.523   8.4480   81.344   8.8232  341.549   16.160  324.997   17.805 16.55258 24.04442 
1 1 1    7   27    2 o  347.528   11.299   92.556   6.0103   93.918   8.4640   91.170   8.5363  349.851   15.806  344.673   16.181 5.178345 22.61944 
1 1 1    7   27    3 o  1154.53   12.507  1021.83   22.101  1039.04   31.987  1006.10   30.573  1163.19   17.966  1144.71   17.449 18.47534 25.04470 
1 1 1    7   27    4 o  713.566   10.913  390.181   11.919  360.276   17.085  418.533   16.636  685.135   16.292  738.649   14.714 -53.51416 21.95315 
1 1 1    7   27    5 o  727.195   10.700  405.217   11.910  414.298   17.429  397.263   16.312  734.791   15.497  719.609   14.809 15.18286 21.43539 
1 1 1    7   27    6 o  434.808   11.434  144.901   7.6095  132.515   10.766  157.268   10.757  415.446   16.930  452.702   15.524 -37.25610 22.97039 
1 1 1    7   27    7 o  227.303   16.949   39.890   5.8546   52.535   8.7648   29.703   7.8671  260.333   22.208  194.344   27.191 65.98880 35.10807 
1 1 1    7   27    8 o  457.488   11.415  160.424   7.9931  158.115   11.313  162.726   11.295  453.821   16.286  460.414   16.028 -6.593323 22.85007 
1 1 1    7   27    9 o  235.165   13.287   42.550   4.7630   41.436   5.8279   44.790   8.2656  231.714   16.541  240.101   22.763 -8.386734 28.13824 
1 1 1    7   27   10 f  879.253   9.2114  592.292   12.397  583.630   15.043  610.624   21.884  872.567   11.263  891.781   16.033 -19.21393 19.59355 
1 1 1    7   27   11 o  559.171   8.9314  239.545   7.6442  233.314   9.2797  252.701   13.483  551.700   10.989  573.728   15.354 -22.02844 18.88113 
1 1 1    7   27   12 o  488.890   9.2173  183.135   6.8974  179.325   8.4799  190.585   11.857  483.622   11.456  498.193   15.549 -14.57120 19.31294 
1 1 1    7   27   13 o  320.948   11.027   78.972   5.4169   72.538   6.5946   92.318   9.4980  307.431   14.014  346.043   17.994 -38.61194 22.80780 
1 1 1    7   27   14 o  831.483   9.2424  529.798   11.763  516.106   14.121  560.836   21.260  820.412   11.245  854.332   16.258 -33.92017 19.76826 
1 1 1    7   27   15 o  302.103   11.561   69.997   5.3459   66.189   6.3728   79.039   9.8208  293.614   14.180  319.703   20.173 -26.08890 24.65805 
1 1 1    7   27   16 o  631.838   10.981  306.149   10.620  306.149   10.620   0.0000   0.0000  631.838   10.981  ?   ?  0.000000 10.98132 
1 1 1    7   27   17 o  198.123   15.568   30.355   4.6830   30.520   5.7628   30.032   8.0355  198.129   19.246  194.898   27.717 3.230530 33.74365 
1 1 1    7   27   18 o  363.566   9.3530  101.326   5.2048   97.335   7.2135  105.662   7.5174  356.039   13.237  370.956   13.240 -14.91672 18.72152 
1 1 1    7   27   19 o  527.277   8.1029  213.053   6.5396  214.634   9.2482  211.471   9.2485  528.887   11.424  524.966   11.510 3.921265 16.21693 
1 1 1    7   27   20 o  270.405   11.072   56.105   4.5826   59.949   6.5952   52.516   6.3722  278.741   15.520  260.759   16.043 17.98187 22.32137 
1 1 1    7   27   21 o  525.373   8.2790  211.566   6.6576  209.011   9.2393  214.326   9.6017  521.808   11.568  528.358   11.873 -6.549622 16.57650 
1 1 1    7   27   22 o  142.050   22.891   16.016   4.8080   13.534   5.6842   22.258   9.0134  129.163   29.411  164.849   36.669 -35.68590 47.00613 
1 1 1    7   27   23 o   70.956   28.536   1.8851   4.7474   1.8327   5.5581   2.0263   9.1289   75.305   30.663   93.173   38.752 -17.86745 49.41629 
1 1 1    7   27   24 o  322.220   10.576   79.698   5.2160   70.598   7.0762   90.526   7.7187  302.386   15.339  342.933   14.705 -40.54688 21.24893 
1 1 1    7   27   25 o  303.434   11.182   70.716   5.1934   68.606   7.1685   73.046   7.5342  297.941   15.775  307.400   16.069 -9.459106 22.51800 
1 1 1    7   27   26 o  362.395   10.141  100.823   5.6249  100.608   7.7362  101.064   8.1930  361.500   13.981  362.194   14.779 -0.6931763 20.34416 
1 1 1    7   27   27 o  334.943   12.812   86.316   6.5684   73.354   11.434   92.699   8.0244  305.661   24.650  346.747   15.119 -41.08594 28.91706 
1 1 1    7   27   28 o  311.993   11.136   74.815   5.3181   76.053   7.3969   73.490   7.6514  313.954   15.393  308.052   16.285 5.901886 22.40861 
1 1 1    7   27   29 o  170.644   18.351   22.813   4.7178   20.485   6.5003   25.404   6.8579  159.255   27.671  178.283   25.888 -19.02872 37.89271 
1 1 1    7   27   30 f   72.450   28.116   2.7313   4.4607   2.7812   6.1975   2.6776   6.4255   81.293   32.636   82.021   33.124 -0.7277832 46.50031 
1 1 1    7   27   31 o  142.215   25.909   16.374   5.4320   14.343   9.0792   17.507   6.7791  131.737   40.816  145.668   31.334 -13.93089 51.45668 
1 1 1    7   27   32 o  275.904   14.916   59.016   6.2756   68.159   10.200   53.448   7.9604  294.122   22.837  261.150   20.068 32.97229 30.40163 
1 1 1    7   27   33 o  257.958   15.975   51.753   6.2764   48.485   8.1765   56.441   9.7929  247.950   21.764  266.743   24.250 -18.79298 32.58489 
1 1 1    7   27   34 o  230.415   17.109   41.467   5.9907   50.816   7.8213   28.197   9.3183  254.214   20.269  183.867   34.374 70.34734 39.90515 
1 1 1    7   27   35 o  290.595   15.332   65.632   6.7955   68.212   8.7296   61.665   10.826  294.911   19.448  277.809   25.751 17.10162 32.27022 
1 1 1    7   27   36 o  224.511   17.886   39.518   6.0954   36.618   8.7567   42.243   8.4898  212.628   27.554  229.847   24.510 -17.21898 36.87760 
1 1 1    7   27   37 o   89.666   32.186   5.7767   5.6191   7.0607   8.1019   4.5867   7.8000  101.819   38.287   92.768   36.822 9.050842 53.11964 
1 1 1    7   27   38 o  140.267   18.346   15.623   3.8444   15.623   3.8444   0.0000   0.0000  140.267   18.346  ?   ?  0.000000 18.34559 
1 1 1    7   27   39 o   48.506   20.040   0.5926   2.4182   2.7490   3.4203  -1.5626   3.4193   66.476   24.900   48.468   21.842 18.00753 33.12185 
1 1 1    7   27   40 o  183.860   13.320   26.330   3.7232   26.346   4.1486   26.267   8.4406  183.514   14.898  176.521   32.435 6.993454 35.69281 
1 1 1    7   27   41 o  212.636   10.961   35.007   3.5554   35.997   4.6773   33.653   5.4719  214.765   14.311  206.641   17.464 8.123352 22.57814 
1 1 1    7   27   42 o  208.763   11.372   33.795   3.6199   39.894   5.3820   28.756   4.8917  225.599   15.684  190.978   16.909 34.62099 23.06298 
1 1 1    7   27   43 o  175.331   12.323   23.940   3.2861   26.762   4.6698   21.172   4.6249  184.129   16.753  162.902   18.900 21.22733 25.25571 
1 1 1    7   27   44 o  341.652   8.8586   89.969   4.6325   93.731   6.6919   86.508   6.4194  347.472   12.582  333.823   12.563 13.64960 17.78066 
1 1 1    7   27   45 o  135.552   16.729   14.646   3.3972   20.319   4.8647   9.2459   4.7463  158.549   20.528  104.016   28.818 54.53307 35.38218 
1 1 1    7   27   46 o  186.948   19.948   28.155   5.6200   0.0000   0.0000   28.155   5.6200  ?   ?   186.948   19.948 0.000000 19.94820 
1 1 1    7   27   47 o  207.377   14.370   33.860   4.5333   33.769   6.4852   33.947   6.3394  203.880   21.086  204.741   20.505 -0.8613739 29.41201 
1 1 1    7   27   48 o   92.216   27.115   7.2946   4.0819   2.7011   6.3262   10.571   5.3429   77.945   32.326  109.317   30.679 -31.37273 44.56609 
1 1 1    7   27   49 o  240.878   25.942   48.891   9.4139   0.0000   0.0000   48.891   9.4139  ?   ?   240.878   25.942 0.000000 25.94226 
1 1 1    7   27   50 o  250.433   12.832   49.334   4.9024   48.385   6.9199   50.290   6.9463  244.387   18.640  249.404   18.324 -5.016693 26.13861 
1 1 1    7   27   51 o  149.376   21.528   18.714   4.7801   10.537   8.9726   21.955   5.6483  105.984   40.191  160.581   23.692 -54.59747 46.65406 
1 1 1    7   27   52 o  115.961   33.553   12.941   6.2951   10.212   9.0999   15.444   8.7177  103.657   40.176  121.728   40.236 -18.07146 56.86033 
1 1 1    7   27   53 o  113.960   33.271   12.635   6.1651   11.107   8.9263   14.028   8.5252  105.194   40.040  115.451   39.789 -10.25623 56.44795 
1 1 1    7   28    0 o   61.166   36.845   2.8555   6.2670   2.8555   6.2670   2.8555   6.2670   61.166   36.845   61.166   36.845 0.000000 0.000000 
1 1 1    7   28    1 o  627.425   10.356  301.688   9.9455  297.030   13.862  306.629   14.277  622.148   14.557  632.097   14.757 -9.950073 20.72826 
1 1 1    7   28    2 o  689.409   10.458  364.253   11.035  353.593   15.332  375.711   15.895  678.775   14.757  699.670   14.842 -20.89539 20.93027 
1 1 1    7   28    3 o  639.089   10.292  313.011   10.067  327.147   14.473  299.759   14.013  652.922   14.482  624.975   14.649 27.94727 20.59888 
1 1 1    7   28    4 o  744.558   10.818  424.918   12.329  435.286   18.179  416.086   16.777  752.936   15.774  736.275   14.887 16.66144 21.68954 
1 1 1    7   28    5 o  420.043   11.494  135.268   7.3897  124.798   10.638  145.033   10.273  403.014   17.245  434.631   15.442 -31.61682 23.14826 
1 1 1    7   28    6 o  1006.96   11.954  777.513   18.425  759.327   25.907  796.126   26.209  994.115   17.026  1017.97   16.821 -23.85193 23.93370 
1 1 1    7   28    7 o  313.201   13.606   75.268   6.5225   67.839   9.2831   82.511   9.1664  296.145   20.608  327.068   18.385 -30.92267 27.61672 
1 1 1    7   28    8 o  533.018   11.068  217.815   9.0299  220.137   13.102  215.714   12.462  535.342   15.990  530.010   15.362 5.331238 22.17340 
1 1 1    7   28    9 o  633.399   10.967  307.586   10.632  310.488   15.249  304.841   14.832  635.792   15.670  630.025   15.380 5.766357 21.95674 
1 1 1    7   28   10 o  337.185   10.610   87.161   5.4758   82.607   6.5809   97.410   9.8725  328.110   13.104  355.404   18.209 -27.29376 22.43420 
1 1 1    7   28   11 o  1376.72   11.618  1453.65   24.481  1431.32   29.501  1503.03   43.874  1365.41   14.116  1396.74   20.522 -31.33398 24.90795 
1 1 1    7   28   12 o  555.497   9.0044  236.475   7.6561  237.780   9.4436  233.972   13.078  556.836   11.080  551.828   15.483 5.008057 19.03916 
1 1 1    7   28   13 o  606.573   9.0719  281.982   8.4227  307.791   10.641  238.678   13.783  633.516   10.973  557.200   16.161 76.31659 19.53442 
1 1 1    7   28   14 o  1032.27   12.208  817.688   19.289  817.688   19.289   0.0000   0.0000  1032.27   12.208  ?   ?  0.000000 12.20811 
1 1 1    7   28   15 o  338.056   13.465   87.760   6.9671   87.760   6.9671   0.0000   0.0000  338.056   13.465  ?   ?  0.000000 13.46460 
1 1 1    7   28   16 o   98.757   27.945   7.7790   4.4141   7.5957   5.2599   8.2154   8.1171   99.119   31.125  109.046   38.732 -9.926712 49.68877 
1 1 1    7   28   17 o  216.546   14.760   36.215   4.8631   36.643   5.7680   35.162   9.0438  217.437   17.479  210.689   28.798 6.747726 33.68727 
1 1 1    7   28   18 o  502.097   8.2321  193.224   6.3266  191.694   8.7156  194.928   9.1982  499.766   11.394  503.896   11.926 -4.129578 16.49370 
1 1 1    7   28   19 o  166.363   19.408   21.648   4.8492   21.249   5.8614   22.513   8.6324  163.859   24.089  166.224   35.033 -2.365616 42.51608 
1 1 1    7   28   20 o  301.955   12.129   70.029   5.6058   73.047   6.7564   63.359   10.043  308.178   14.323  284.957   23.227 23.22089 27.28836 
1 1 1    7   28   21 o  201.347   14.036   31.332   4.2987   30.824   5.9573   31.884   6.2090  198.731   19.850  202.054   20.354 -3.322754 28.43056 
1 1 1    7   28   22 o  389.062   9.3968  116.121   5.5959  125.052   7.9372  107.295   7.8905  403.329   12.857  373.472   13.803 29.85687 18.86343 
1 1 1    7   28   23 f  291.603   10.969   65.300   4.8960   61.887   6.7571   69.073   7.1039  282.953   15.663  298.991   15.577 -16.03873 22.08979 
1 1 1    7   28   24 o  447.275   12.855  153.870   8.8005   0.0000   0.0000  153.870   8.8005  ?   ?   447.275   12.855 0.000000 12.85479 
1 1 1    7   28   25 o   94.408   31.043   6.7839   5.1917   13.769   9.4860   3.7969   6.2032  131.073   41.874   85.269   33.137 45.80417 53.39961 
1 1 1    7   28   26 o  257.670   14.723   51.351   5.7825   38.945   9.8537   57.867   7.1414  220.402   29.987  273.083   17.173 -52.68150 34.55632 
1 1 1    7   28   27 o  365.099   10.177  102.398   5.6872  102.663   7.8661  102.107   8.2323  364.948   14.082  363.825   14.783 1.123383 20.41652 
1 1 1    7   28   28 o  378.379   10.262  110.018   5.9433  115.071   8.3563  104.845   8.4547  386.267   14.134  368.528   14.988 17.73856 20.60133 
1 1 1    7   28   29 o  314.757   12.969   76.349   6.2479   67.208   9.8209   82.563   8.0980  292.621   22.090  326.686   16.195 -34.06580 27.39033 
1 1 1    7   28   30 o  163.716   22.230   21.315   5.4266   27.077   8.9539   17.971   6.8223  181.149   33.528  147.559   31.182 33.58969 45.78697 
1 1 1    7   28   31 o  133.754   24.854   14.506   4.9010   5.9389   6.8206   23.651   7.0471   94.816   35.231  170.693   27.940 -75.87703 44.96531 
1 1 1    7   28   32 o  193.817   19.561   29.582   5.7236   30.637   7.4170   28.028   8.9993  195.460   25.391  183.942   33.185 11.51826 41.78428 
1 1 1    7   28   33 o  121.925   29.596   12.351   5.4675   8.8148   6.9380   18.146   8.8817  106.187   35.908  145.623   39.046 -39.43627 53.04724 
1 1 1    7   28   34 o  165.771   21.644   21.907   5.3606   22.400   7.4940   21.390   7.6712  164.490   30.900  160.096   32.417 4.393967 44.78439 
1 1 1    7   28   35 o  256.517   16.875   51.403   6.5885   54.096   8.3682   47.011   10.686  261.723   21.068  240.219   29.696 21.50337 36.41036 
1 1 1    7   28   36 o  232.259   18.895   42.444   6.6590   39.417   8.6562   46.832   10.422  221.060   26.085  239.828   28.980 -18.76738 38.99059 
1 1 1    7   28   37 o  179.805   13.401   25.162   3.6616   25.608   3.9593   22.531   9.6252  181.166   14.397  160.794   39.414 20.37274 41.96111 
1 1 1    7   28   38 o  295.025   10.137   67.077   4.5778   71.783   5.3019   53.292   9.0742  304.929   11.360  258.283   23.201 46.64600 25.83241 
1 1 1    7   28   39 o  185.170   14.401   26.785   4.0496   27.098   4.1783   21.929   16.446  186.155   14.786  154.702   55.112 31.45340 57.06117 
1 1 1    7   28   40 o  287.541   11.982   63.964   5.2735   63.964   5.2735   0.0000   0.0000  287.541   11.982  ?   ?  0.000000 11.98211 
1 1 1    7   28   41 o  169.986   12.637   22.515   3.2646   23.834   4.5377   21.100   4.7001  173.608   17.307  162.619   19.257 10.98886 25.89154 
1 1 1    7   28   42 o   98.246   20.222   7.8998   2.9395   4.0185   3.9831   12.542   4.3562   75.124   27.084  123.198   23.964 -48.07310 36.16331 
1 1 1    7   28   43 o  112.329   18.404   10.187   3.0547   16.366   4.4397   4.6329   4.2095  142.052   21.057   78.864   27.905 63.18748 34.95836 
1 1 1    7   28   44 o  161.240   13.945   20.419   3.4077   26.769   4.9205   14.567   4.7239  183.428   17.747  132.452   24.192 50.97578 30.00408 
1 1 1    7   28   45 f  119.133   18.969   11.523   3.3429   11.911   4.8050   11.159   4.6538  118.098   27.150  114.295   27.027 3.802826 38.30875 
1 1 1    7   28   46 o  259.773   11.457   52.439   4.5553   55.301   6.5313   49.729   6.3566  264.315   16.222  250.356   16.684 13.95900 23.27038 
1 1 1    7   28   47 o  145.111   17.267   16.924   3.7600   17.334   5.4587   16.554   5.1865  142.884   25.914  139.956   25.135 2.928024 36.10107 
1 1 1    7   28   48 o  122.083   20.265   12.308   3.6540   20.610   5.4195   5.3883   4.9476  157.106   23.238   83.049   30.148 74.05682 38.06434 
1 1 1    7   28   49 o  255.126   12.260   50.962   4.7878   64.121   8.1487   44.024   5.9167  281.202   19.044  234.429   16.597 46.77267 25.26137 
1 1 1    7   28   50 o   99.820   30.755   9.0850   5.1632   0.0000   0.0000   9.0850   5.1632  ?   ?    99.820   30.755 0.000000 30.75534 
1 1 1    7   28   51 o  149.820   30.221   20.532   6.6912   21.400   10.045   19.839   8.9717  140.917   42.800  138.322   40.065 2.595535 58.62664 
1 1 1    7   28   52 o   97.471   25.456   8.5036   3.8391   16.590   5.7308   1.9207   5.1708  134.799   28.658   68.144   28.805 66.65434 40.63284 
1 1 1    7   29    0 f  263.823   20.455   54.390   8.1460   54.390   8.1460   54.390   8.1460  263.823   20.455  263.823   20.455 0.000000 0.000000 
1 1 1    7   29    1 o  504.050   10.713  194.785   8.2650  189.926   11.489  199.996   11.898  497.290   15.094  510.287   15.234 -12.99701 21.44535 
1 1 1    7   29    2 o  814.462   10.913  508.608   13.604  481.685   18.412  540.978   20.189  791.928   15.190  839.149   15.718 -47.22107 21.85853 
1 1 1    7   29    3 o  445.904   11.044  152.458   7.5378  163.291   11.000  142.868   10.350  461.038   15.588  431.234   15.680 29.80392 22.11001 
1 1 1    7   29    4 o  157.361   22.291   19.470   5.2189   16.367   7.7071   22.098   7.0924  142.086   35.531  166.531   28.871 -24.44559 45.78183 
1 1 1    7   29    5 o  542.853   10.999  225.968   9.1389  232.937   13.424  219.949   12.477  550.573   15.929  535.096   15.233 15.47656 22.04084 
1 1 1    7   29    6 o  188.577   18.816   27.641   5.3586   30.315   7.8591   25.317   7.3254  196.107   26.891  178.746   27.669 17.36038 38.58307 
1 1 1    7   29    7 f  139.058   26.861   15.472   5.5103   13.186   8.1222   17.421   7.5005  128.756   38.349  146.602   34.073 -17.84570 51.29942 
1 1 1    7   29    8 o  249.552   15.957   48.062   6.0632   55.999   9.0871   41.693   8.1401  268.453   22.317  231.188   23.322 37.26439 32.28001 
1 1 1    7   29    9 o  329.977   13.204   83.588   6.6690   79.095   9.5866   87.801   9.2835  319.797   19.680  337.269   18.049 -17.47229 26.70334 
1 1 1    7   29   10 o  311.264   14.146   74.418   6.7395   83.029   9.4043   65.326   9.6632  327.793   18.823  290.091   21.925 37.70258 28.89617 
1 1 1    7   29   11 o  360.618   12.376   99.812   6.8310   99.812   6.8310   0.0000   0.0000  360.618   12.376  ?   ?  0.000000 12.37571 
1 1 1    7   29   12 o  279.184   14.360   60.047   6.1157   60.047   6.1157   0.0000   0.0000  279.184   14.360  ?   ?  0.000000 14.36010 
1 1 1    7   29   13 o  189.264   16.277   27.761   4.6695   25.761   5.5908   32.376   8.4915  181.579   20.473  202.206   28.204 -20.62741 34.85111 
1 1 1    7   29   14 o  317.838   11.116   77.514   5.4080   74.918   6.5271   83.198   9.6584  312.264   13.656  327.866   19.332 -15.60257 23.66845 
1 1 1    7   29   15 o  251.709   13.084   48.801   5.0234   48.541   6.1059   49.345   8.8368  250.640   15.999  251.402   23.227 -0.7619019 28.20414 
1 1 1    7   29   16 o  318.856   11.543   78.047   5.6336   74.151   6.8487   86.201   9.9073  310.531   14.409  333.603   19.487 -23.07184 24.23565 
1 1 1    7   29   17 o  408.066   10.307  127.763   6.4376  122.162   7.7496  140.233   11.564  398.760   12.697  426.460   17.715 -27.69952 21.79555 
1 1 1    7   29   18 o  345.116   9.7956   91.371   5.1745   84.639   7.2590   98.326   7.3781  331.710   14.297  357.627   13.479 -25.91714 19.64894 
1 1 1    7   29   19 o  259.122   11.732   51.572   4.6533   49.650   6.6068   53.464   6.5551  253.165   17.151  262.888   16.372 -9.723328 23.71061 
1 1 1    7   29   20 o  406.069   9.1794  126.487   5.7054  125.699   8.0819  127.269   8.0554  404.325   13.059  406.858   12.935 -2.533813 18.38097 
1 1 1    7   29   21 f  472.302   8.6830  171.090   6.2771  173.922   8.8531  168.228   8.9014  475.697   12.159  467.800   12.432 7.896667 17.38924 
1 1 1    7   29   22 o  264.646   11.628   53.822   4.7104   59.154   6.7847   48.861   6.5448  276.465   16.103  250.981   17.139 25.48450 23.51718 
1 1 1    7   29   23 o  201.082   17.645   31.487   5.3758   37.872   9.6489   28.613   6.4736  217.537   29.759  190.518   22.643 27.01929 37.39359 
1 1 1    7   29   24 o  516.716   10.272  205.069   8.1239  200.749   14.141  207.197   9.9251  509.318   18.140  518.945   12.495 -9.627167 22.02689 
1 1 1    7   29   25 o  231.703   13.921   41.520   4.9140   38.305   6.7908   45.054   7.1198  221.197   20.283  240.223   19.533 -19.02534 28.15906 
1 1 1    7   29   26 o  540.043   8.8681  223.874   7.3304  233.650   10.404  214.236   10.330  550.934   12.337  527.433   12.796 23.50128 17.77485 
1 1 1    7   29   27 o  230.105   16.205   41.151   5.6710   37.976   9.2760   43.046   7.1662  217.510   28.552  234.407   20.170 -16.89658 34.95726 
1 1 1    7   29   28 o  158.469   22.448   19.999   5.2926   7.3241   8.2290   28.941   6.9119  104.385   38.716  190.646   24.234 -86.26063 45.67503 
1 1 1    7   29   29 o  209.899   15.831   34.295   5.0487   36.551   7.1017   31.989   7.1786  215.141   21.870  200.528   23.856 14.61250 32.36408 
1 1 1    7   29   30 o  177.068   18.845   24.672   5.0288   23.225   6.9690   26.245   7.2639  169.027   27.911  180.159   27.188 -11.13190 38.96399 
1 1 1    7   29   31 o  286.304   14.517   63.570   6.3410   66.858   8.1215   58.437   10.148  292.540   18.228  271.078   24.731 21.46182 30.72278 
1 1 1    7   29   32 o  214.515   16.707   35.949   5.4423   33.473   7.6415   38.498   7.7530  204.400   24.942  219.957   23.387 -15.55739 34.19133 
1 1 1    7   29   33 o  215.408   17.261   36.324   5.6434   34.952   7.9781   37.699   7.9839  208.543   25.527  217.097   24.452 -8.554138 35.34887 
1 1 1    7   29   34 o  139.322   26.618   15.933   5.4694   6.4710   7.5694   26.271   7.9118   98.363   37.003  178.525   30.019 -80.16201 47.64854 
1 1 1    7   29   35 o   89.395   31.427   5.9181   5.3310   5.4265   7.4063   6.4467   7.6795   94.062   36.305   98.423   37.216 -4.360855 51.99107 
1 1 1    7   29   36 o  144.337   26.483   17.126   5.6351   11.130   7.8199   23.602   8.1276  116.008   38.096  167.393   32.895 -51.38462 50.33302 
1 1 1    7   29   37 o  289.816   16.612   65.700   7.3385   73.638   9.5916   54.493   11.397  305.118   20.660  257.943   29.391 47.17487 35.92568 
1 1 1    7   29   38 o  226.225   13.124   39.784   4.5248   39.784   4.5248   0.0000   0.0000  226.225   13.124  ?   ?  0.000000 13.12368 
1 1 1    7   29   39 o   97.115   24.396   7.8273   3.6216   7.8094   3.8398   7.9716   10.900   96.887   25.533  110.452   43.626 -13.56509 50.54882 
1 1 1    7   29   40 o   58.813   23.972   1.2463   3.4014  -0.3500   3.6937   10.150   8.7237   54.513   23.711  112.292   40.125 -57.77903 46.60699 
1 1 1    7   29   41 o  181.104   12.071   25.522   3.3269   24.771   4.4779   26.448   4.9706  177.074   16.720  182.570   18.022 -5.496033 24.58346 
1 1 1    7   29   42 o  180.500   12.352   25.395   3.3920   23.149   4.5445   28.221   5.0969  170.670   17.652  188.518   17.878 -17.84772 25.12345 
1 1 1    7   29   43 o   82.181   23.523   5.5998   3.1092   6.9781   4.3225   4.1219   4.4757   91.391   28.137   77.026   28.556 14.36429 40.08930 
1 1 1    7   29   44 o  168.548   14.355   22.374   3.6680   26.029   5.3623   19.160   5.0284  179.701   19.825  152.916   22.127 26.78577 29.70933 
1 1 1    7   29   45 o  175.893   14.689   24.430   3.9185   24.816   5.7194   24.089   5.3793  174.096   21.951  172.029   20.856 2.066345 30.27894 
1 1 1    7   29   46 o  278.627   12.292   60.538   5.2421   58.916   11.082   61.006   5.9499  263.890   27.857  278.962   13.935 -15.07205 31.14792 
1 1 1    7   29   47 o  232.332   12.011   42.230   4.2566   44.232   5.9270   40.098   6.1168  235.524   16.546  223.347   18.047 12.17735 24.48395 
1 1 1    7   29   48 o  214.597   21.411   38.012   6.9390   36.689   10.101   39.194   9.5485  200.296   34.175  210.493   30.527 -10.19685 45.82405 
1 1 1    7   29   50 o   70.379   26.040   3.7560   3.7180   6.3630   5.4160   1.4325   5.1132   86.383   31.514   66.721   28.441 19.66196 42.45050 
1 1 1    7   30    0 o  189.066   25.803   28.997   7.0732   28.997   7.0732   28.997   7.0732  189.066   25.803  189.066   25.803 0.000000 0.000000 
1 1 1    7   30    1 o   46.626   22.378  -6.6730   4.6210  -1.7430   6.7122 -11.1151   6.3714   71.616   31.535   51.865   25.224 19.75100 40.38219 
1 1 1    7   30    2 o  452.840   11.083  157.294   7.6818  159.715   10.707  154.727   11.028  455.837   15.345  448.570   16.062 7.267548 22.21392 
1 1 1    7   30    3 o  714.513   10.626  391.536   11.621  380.699   16.112  403.286   16.777  703.831   14.956  724.375   15.132 -20.54370 21.27572 
1 1 1    7   30    4 o  380.972   11.911  111.374   6.9456  116.139   10.290  107.386   9.4135  388.462   17.306  373.637   16.460 14.82498 23.88364 
1 1 1    7   30    5 o  647.623   10.930  321.717   10.835  311.524   15.417  331.664   15.230  636.487   15.824  656.871   15.148 -20.38397 21.90575 
1 1 1    7   30    6 o  376.273   12.508  108.683   7.2038  124.045   10.526   95.151   9.8798  401.454   17.131  350.969   18.456 50.48486 25.18093 
1 1 1    7   30    7 o  410.676   17.763  129.880   11.165  129.880   11.165   0.0000   0.0000  410.676   17.763  ?   ?  0.000000 17.76256 
1 1 1    7   30    8 o  712.367   16.024  390.393   17.472  390.393   17.472   0.0000   0.0000  712.367   16.024  ?   ?  0.000000 16.02429 
1 1 1    7   30    9 o  723.536   16.141  402.816   17.876  402.816   17.876   0.0000   0.0000  723.536   16.141  ?   ?  0.000000 16.14106 
1 1 1    7   30   10 o  451.690   12.129  156.633   8.3855  140.421   11.751  173.456   11.970  426.875   17.984  474.699   16.474 -47.82458 24.38931 
1 1 1    7   30   11 o  177.904   17.115   24.599   4.6029   29.085   5.6178   15.435   8.0289  193.226   19.251  137.610   37.220 55.61620 41.90406 
1 1 1    7   30   12 o  337.464   10.975   87.394   5.6689   88.544   6.9179   85.043   9.8910  339.458   13.314  331.341   19.590 8.116882 23.68608 
1 1 1    7   30   13 o  836.335   9.4874  536.434   12.145  538.816   14.919  531.755   20.911  837.745   11.635  830.927   16.442 6.817505 20.14189 
1 1 1    7   30   14 o  484.950   9.6115  180.387   7.1344  184.819   8.7306  171.479   12.378  490.617   11.626  471.675   17.145 18.94208 20.71476 
1 1 1    7   30   15 o  420.755   10.248  135.845   6.5999  136.420   8.0669  134.680   11.478  421.374   12.507  417.811   17.948 3.562286 21.87637 
1 1 1    7   30   16 o  241.839   14.334   45.156   5.2823   48.069   6.5073   39.529   9.0449  249.081   17.173  223.631   26.968 25.44989 31.97206 
1 1 1    7   30   17 o  507.886   9.7737  197.926   7.5979  201.724   9.3389  190.490   13.067  512.414   11.907  496.909   17.180 15.50507 20.90297 
1 1 1    7   30   18 o  268.404   13.320   55.412   5.4724   53.773   6.6411   58.879   9.6588  263.539   16.548  274.339   23.220 -10.79984 28.51294 
1 1 1    7   30   19 o  601.553   8.3612  277.518   7.6986  265.504   10.612  290.864   11.185  587.783   11.796  615.197   11.878 -27.41388 16.74018 
1 1 1    7   30   20 f   61.393   25.754   0.5300   4.0828  -5.7281   5.7195   7.0319   5.8299   56.083   26.315   97.232   32.916 -41.14946 42.14183 
1 1 1    7   30   21 o  291.307   13.255   65.318   5.9101   56.018   10.112   70.144   7.2838  266.714   25.063  301.098   15.861 -34.38388 29.65963 
1 1 1    7   30   22 o  166.058   20.696   21.730   5.1461   35.802   9.6244   16.096   6.0897  210.907   30.715  140.518   29.264 70.38930 42.42451 
1 1 1    7   30   23 o  245.123   12.984   46.393   4.8543   48.231   6.7288   44.398   7.0098  249.004   17.771  238.484   19.371 10.52065 26.28783 
1 1 1    7   30   24 o  621.578   12.454  297.451   11.849   0.0000   0.0000  297.451   11.849  ?   ?   621.578   12.454 0.000000 12.45426 
1 1 1    7   30   25 o  384.509   11.492  113.756   6.7636  127.151   11.562  106.788   8.3393  404.753   18.663  371.927   14.649 32.82587 23.72522 
1 1 1    7   30   26 o  348.517   12.105   93.544   6.4577   85.485   10.591   98.313   8.1474  330.449   21.049  356.711   14.922 -26.26102 25.80149 
1 1 1    7   30   27 o  378.909   10.553  110.437   6.1202  113.277   8.6497  107.589   8.6607  382.824   14.762  372.986   15.170 9.838318 21.16695 
1 1 1    7   30   28 o  437.326   10.034  147.080   6.7163  147.787   9.5221  146.380   9.4746  437.310   14.226  435.224   14.223 2.085815 20.11593 
1 1 1    7   30   29 o  515.625   10.763  204.662   8.4946  206.077   10.560  202.067   14.300  516.595   13.354  509.538   18.336 7.057098 22.68350 
1 1 1    7   30   30 o  264.655   15.475   54.455   6.2413   55.421   7.8957   52.846   10.190  265.779   19.546  256.976   26.275 8.802979 32.74824 
1 1 1    7   30   31 o  287.176   13.334   63.730   5.8609   56.353   8.0545   72.031   8.5443  267.816   19.789  303.431   18.485 -35.61533 27.07944 
1 1 1    7   30   32 o  402.988   11.173  125.180   6.8918  126.285   9.6810  124.044   9.8132  403.371   15.680  399.646   16.042 3.725739 22.43247 
1 1 1    7   30   33 o   59.299   26.891  -2.6289   5.2786  -9.7549   7.3577   4.9290   7.5774   58.853   28.244   93.107   36.501 -34.25382 46.15267 
1 1 1    7   30   34 o  427.296   11.633  140.926   7.6082  140.110   10.713  141.755   10.807  424.246   16.498  426.709   16.546 -2.462799 23.36560 
1 1 1    7   30   35 o  345.474   13.003   92.362   6.8757   92.775   9.7549   91.954   9.6930  343.797   18.607  342.283   18.571 1.513977 26.28849 
1 1 1    7   30   36 o  122.171   35.610   12.763   7.0675   14.559   8.0680   6.8375   14.653  129.725   38.115  117.640   49.026 12.08495 62.09936 
1 1 1    7   30   37 o  328.431   13.724   83.689   6.8992  101.331   9.9010   67.037   9.6190  359.192   18.066  290.224   21.813 68.96756 28.32305 
1 1 1    7   30   38 o  255.135   20.453   51.714   7.9202   50.625   15.039   52.131   9.3169  238.727   42.726  254.324   24.227 -15.59653 49.11649 
1 1 1    7   30   39 o  346.081   10.252   92.443   5.4309   90.508   5.9642  101.833   13.140  342.103   11.390  355.679   24.281 -13.57599 26.81960 
1 1 1    7   30   40 o  162.149   16.391   20.783   4.0122   22.709   4.3291   9.0577   10.682  169.391   16.924  111.855   43.480 57.53638 46.65767 
1 1 1    7   30   41 o  208.303   14.321   33.989   4.5383   36.555   4.9097   18.927   11.895  215.838   14.954  142.061   47.002 73.77661 49.32342 
1 1 1    7   30   42 o  167.033   13.804   21.900   3.4975   18.601   4.6661   26.131   5.2836  151.474   20.665  180.466   19.434 -28.99191 28.36762 
1 1 1    7   30   43 o   43.054   19.922  -2.3065   3.1008  -0.2294   4.3797  -4.3940   4.3906   59.114   25.764   48.202   22.753 10.91177 34.37297 
1 1 1    7   30   44 f  131.936   18.354   14.078   3.6061   11.745   4.9567   16.702   5.2560  116.477   28.121  140.816   25.316 -24.33908 37.83804 
1 1 1    7   30   45 o   69.536   25.233   3.5081   3.4657   4.0679   4.9908   2.9868   4.8163   77.781   29.860   72.689   28.908 5.092270 41.56073 
1 1 1    7   30   46 o  224.941   20.466   41.243   6.9693   34.015   10.338   47.264   9.4358  192.072   36.499  236.190   26.561 -44.11804 45.14025 
1 1 1    7   30   47 o   79.804   25.824   5.3653   3.5990   12.435   5.4766  -0.0083   4.7747  117.257   30.297   61.226   26.787 56.03169 40.44081 
1 1 1    7   30   48 o  131.951   22.418   14.757   4.3656   24.241   9.4129   12.158   4.9277  155.866   39.427  116.509   27.983 39.35645 48.34816 
1 1 1    7   30   49 o  168.128   15.767   22.795   4.0102   26.677   5.7691   19.165   5.5782  178.232   21.587  148.191   25.513 30.04002 33.42047 
1 1 1    7   31    1 o  226.523   23.886   40.178   8.1568   40.178   8.1568   0.0000   0.0000  226.523   23.886  ?   ?  0.000000 23.88556 
1 1 1    7   31    2 o  334.686   18.723   86.643   9.5532   86.643   9.5532   0.0000   0.0000  334.686   18.723  ?   ?  0.000000 18.72338 
1 1 1    7   31    3 o  145.096   32.297   17.101   6.9883   17.101   6.9883   0.0000   0.0000  145.096   32.297  ?   ?  0.000000 32.29719 
1 1 1    7   31    4 o  386.323   18.711  115.104   11.064  115.104   11.064   0.0000   0.0000  386.323   18.711  ?   ?  0.000000 18.71054 
1 1 1    7   31    5 o  530.809   11.761  216.302   9.5557  258.819   14.743  185.502   12.548  579.748   16.614  490.797   16.704 88.95114 23.55945 
1 1 1    7   31    6 o  724.732   11.289  403.134   12.523  408.275   18.173  398.487   17.280  728.198   16.305  719.576   15.689 8.621948 22.62692 
1 1 1    7   31    7 o  177.564   21.389   24.724   5.6962   25.524   8.1295   23.952   7.9839  178.272   30.913  172.445   31.405 5.827087 44.06696 
1 1 1    7   31    8 o  368.075   13.078  104.101   7.3680  106.445   10.881  102.116   10.013  370.850   19.235  363.902   17.976 6.947601 26.32772 
1 1 1    7   31    9 o  421.114   12.401  136.219   7.9935  137.691   11.778  134.962   10.884  422.486   18.213  418.492   16.992 3.994080 24.90833 
1 1 1    7   31   10 o  122.596   30.445   12.218   5.6871   23.830   8.8624   4.0893   7.4152  170.986   35.040   91.864   36.079 79.12209 50.29420 
1 1 1    7   31   11 o  347.278   13.538   92.725   7.1963   92.187   10.289   93.241   10.069  344.866   19.572  346.957   19.033 -2.090698 27.30046 
1 1 1    7   31   12 o  360.650   10.921   99.851   6.0283  103.770   7.4804   92.591   10.182  367.384   13.302  345.633   19.324 21.75146 23.45963 
1 1 1    7   31   13 o  352.391   11.097   95.350   5.9854   91.384   7.3365  103.245   10.351  344.661   13.907  365.149   18.581 -20.48795 23.20867 
1 1 1    7   31   14 o  591.740   9.3977  268.635   8.5118  265.682   10.454  274.442   14.661  588.100   11.614  596.706   16.052 -8.605713 19.81262 
1 1 1    7   31   15 o  401.535   10.523  123.784   6.4677  122.021   7.8134  127.621   11.527  398.361   12.814  406.360   18.533 -7.998840 22.53164 
1 1 1    7   31   16 o  243.253   14.413   45.722   5.3424   49.870   6.6157   37.948   9.0576  253.596   17.144  218.572   27.695 35.02451 32.57207 
1 1 1    7   31   17 o  537.218   9.7413  221.522   8.0101  219.008   9.7273  226.819   14.118  533.773   11.906  541.974   17.019 -8.200012 20.76996 
1 1 1    7   31   18 o  215.086   16.008   35.890   5.2324   42.484   6.3557   22.023   9.2172  233.737   17.901  162.891   37.712 70.84621 41.74544 
1 1 1    7   31   19 o  105.362   33.653   8.7023   6.1270   9.9857   9.4515   7.7721   8.0469  117.435   41.786  106.163   38.461 11.27251 56.79203 
1 1 1    7   31   20 o  402.061   11.337  124.278   6.9767  117.268   12.279  127.619   8.4783  387.973   20.752  407.025   13.609 -19.05252 24.81603 
1 1 1    7   31   21 o  295.651   11.534   67.226   5.2193   62.783   7.3784   71.676   7.3840  284.398   17.028  304.199   15.914 -19.80069 23.30692 
1 1 1    7   31   22 o  779.664   9.8254  466.967   11.725  468.038   19.907  466.398   14.509  777.796   16.722  778.407   12.178 -0.6101685 20.68596 
1 1 1    7   31   23 o  436.972   10.754  146.824   7.1926  143.903   11.713  148.593   9.1131  430.853   17.762  438.985   13.563 -8.132599 22.34778 
1 1 1    7   31   24 o  601.934   8.7899  278.219   8.0985  274.665   11.248  282.046   11.670  597.122   12.306  604.996   12.602 -7.874207 17.61430 
1 1 1    7   31   25 o  450.360   9.6323  155.881   6.6399  143.068   9.1659  170.031   9.6319  430.469   13.911  469.429   13.405 -38.95953 19.31885 
1 1 1    7   31   26 f  319.909   11.338   78.807   5.5518   75.732   7.7860   81.987   7.9187  312.165   16.352  325.337   15.902 -13.17209 22.80917 
1 1 1    7   31   27 o  306.276   12.302   72.332   5.7674   80.015   8.1508   64.629   8.1617  320.718   16.661  287.546   18.645 33.17169 25.00432 
1 1 1    7   31   28 f  291.759   14.011   65.806   6.2569   72.487   7.9257   54.757   10.193  305.023   17.044  261.904   25.761 43.11954 30.88886 
1 1 1    7   31   29 o  459.782   10.203  162.693   7.1802  175.960   10.163  149.471   10.146  477.017   13.919  439.252   15.091 37.76544 20.52964 
1 1 1    7   31   30 o  350.536   12.106   94.816   6.4952   97.282   9.3145   92.481   9.0619  353.588   17.210  344.765   17.172 8.822906 24.31222 
1 1 1    7   31   31 o  415.304   11.091  132.951   7.0501  132.852   9.8856  133.054   10.057  413.698   15.612  413.914   15.874 -0.2156677 22.26481 
1 1 1    7   31   32 o  274.770   14.344   58.664   6.0119   51.395   8.3069   66.658   8.7118  254.717   21.508  291.067   19.670 -36.35016 29.14590 
1 1 1    7   31   33 o  105.255   31.514   9.1822   5.4743   9.4262   7.5497   8.9117   7.9494  108.958   37.450  107.757   38.324 1.201057 53.58374 
1 1 1    7   31   34 o  151.500   31.028   19.279   6.9531   23.499   8.0022   6.2756   14.047  167.024   32.471  115.299   48.022 51.72435 57.96954 
1 1 1    7   31   35 o  172.459   23.013   23.978   5.9231   30.997   8.2015   16.327   8.5631  194.076   28.454  136.678   39.009 57.39705 48.28390 
1 1 1    7   31   36 o  152.876   26.327   19.251   5.9381   23.790   8.3192   14.536   8.4787  166.990   33.709  129.174   39.342 37.81558 51.80885 
1 1 1    7   31   37 o  237.430   21.285   44.978   7.6532   54.945   14.473   41.109   9.0171  251.706   38.814  224.273   26.798 27.43359 47.16658 
1 1 1    7   31   38 o  283.429   15.723   62.914   6.7942   47.534   9.3773   79.910   9.8577  241.552   25.760  317.132   20.416 -75.57942 32.86969 
1 1 1    7   31   39 o  174.758   24.959   25.058   6.4867   32.436   9.4167   18.395   8.9483  194.964   32.714  142.907   39.561 52.05684 51.33542 
1 1 1    7   31   40 o  179.982   24.736   26.621   6.6342   16.594   9.4067   36.544   9.3580  134.770   41.511  208.078   30.270 -73.30714 51.37519 
1 1 1    7   31   41 o  249.413   13.464   48.623   5.1209   50.203   6.0426   44.594   9.6464  252.503   15.713  231.158   27.823 21.34468 31.95281 
1 1 1    7   31   42 f  177.909   17.578   25.271   4.7242   21.933   5.0893   46.060   12.701  164.321   20.694  226.111   38.050 -61.79053 43.31313 
1 1 1    7   31   43 o   99.939   23.572   8.4402   3.5472   12.815   4.9560   3.8442   5.0794  122.112   27.211   77.434   30.016 44.67832 40.51409 
1 1 1    7   31   44 o  135.555   17.459   14.817   3.5383   8.5753   4.7935   22.289   5.2447   99.183   29.442  164.850   21.282 -65.66692 36.32890 
1 1 1    7   31   45 o  180.852   13.517   25.808   3.7146   25.939   5.2804   25.680   5.2264  178.394   19.665  177.555   19.555 0.8393402 27.73302 
1 1 1    7   31   46 o  139.589   17.808   15.863   3.7181   13.884   5.4691   17.564   5.0700  124.545   29.197  143.788   23.874 -19.24374 37.71498 
1 1 1    7   31   47 o  122.087   24.081   12.862   4.3401   13.983   9.6493   12.577   4.8594  117.282   42.169  118.909   27.279 -1.626633 50.22287 
1 1 1    7   31   48 o  223.990   19.946   41.462   6.7667   39.375   10.072   43.179   9.1353  205.878   33.084  221.557   27.532 -15.67873 43.04112 
1 1 1    7   32    0 o  762.625   15.775  447.050   18.396  447.050   18.396  447.050   18.396  762.625   15.775  762.625   15.775 0.000000 0.000000 
1 1 1    7   32    1 o  278.262   14.565   59.731   6.1819   65.919   8.7487   53.561   8.7364  291.426   19.729  262.088   21.981 29.33774 29.53642 
1 1 1    7   32    2 o  629.400   11.013  304.094   10.610  293.359   14.674  315.853   15.358  617.269   15.532  640.464   15.667 -23.19440 22.06069 
1 1 1    7   32    3 o  293.559   14.382   66.295   6.4623   58.719   8.9742   74.455   9.3134  274.585   21.525  309.784   19.745 -35.19907 29.20922 
1 1 1    7   32    4 o  824.240   11.601  521.709   14.636  516.696   21.172  526.296   20.254  818.710   16.895  826.584   16.009 -7.874329 23.27516 
1 1 1    7   32    5 o  421.736   12.086  136.630   7.8018  133.268   11.419  139.574   10.685  415.580   17.951  425.586   16.402 -10.00659 24.31635 
1 1 1    7   32    6 o  585.777   11.360  263.487   10.185  264.089   14.900  262.960   13.954  585.326   16.631  584.324   15.602 1.002258 22.80396 
1 1 1    7   32    7 o  410.311   12.168  129.350   7.6421  145.786   11.471  116.233   10.247  434.745   17.238  388.187   17.247 46.55832 24.38432 
1 1 1    7   32    8 o  691.749   11.331  367.483   11.997  377.310   17.551  358.864   16.437  699.620   16.389  682.496   15.735 17.12427 22.71991 
1 1 1    7   32    9 o  566.482   11.394  246.468   9.8797  257.501   14.651  237.266   13.380  577.878   16.563  554.907   15.753 22.97131 22.85809 
1 1 1    7   32   10 o  353.274   13.237   95.985   7.1576  116.704   10.925   80.403   9.4741  388.659   18.364  321.880   19.319 66.77963 26.65491 
1 1 1    7   32   11 o  700.015   11.553  376.469   12.379  380.228   18.106  373.169   16.963  701.979   16.851  695.735   15.929 6.244385 23.18800 
1 1 1    7   32   12 o   76.937   31.159   2.1221   5.7031   6.3340   8.2350  -1.7600   7.9060  102.059   38.551   77.735   34.227 24.32438 51.55276 
1 1 1    7   32   13 o  335.087   11.368   86.272   5.8308   88.875   7.2200   81.391   9.8868  339.775   13.883  323.526   20.064 16.24875 24.39896 
1 1 1    7   32   14 o   96.650   28.639   7.4523   4.5384   8.5091   5.7132   5.6451   7.4713  103.862   32.410   96.934   36.695 6.927940 48.95858 
1 1 1    7   32   15 o  563.771   9.6275  243.982   8.3078  237.732   10.025  257.689   14.845  556.085   11.778  577.612   16.791 -21.52686 20.50970 
1 1 1    7   32   16 o  128.418   25.945   13.348   4.9242   12.593   5.9799   14.936   8.6785  123.870   31.475  134.682   39.519 -10.81221 50.52187 
1 1 1    7   32   17 o  389.772   13.966  117.068   8.3318  121.033   11.801  113.127   11.765  395.032   19.517  381.212   20.236 13.82016 28.11401 
1 1 1    7   32   18 o  270.758   25.057   57.853   10.267   0.0000   0.0000   57.853   10.267  ?   ?   270.758   25.057 0.000000 25.05738 
1 1 1    7   32   19 o  271.267   16.890   57.145   6.9780   51.265   9.3478   64.545   10.487  254.883   24.253  286.273   24.158 -31.38986 34.23214 
1 1 1    7   32   20 f  293.290   16.223   66.721   7.2546   66.502   9.5416   67.020   11.169  291.334   21.550  291.204   25.309 0.1293945 33.24062 
1 1 1    7   32   21 o  355.669   10.521   97.262   5.7273  100.452   8.2086   94.236   7.9950  360.623   14.871  349.269   14.955 11.35425 21.09039 
1 1 1    7   32   22 o  146.428   20.892   17.040   4.5497   23.731   6.5042   10.629   6.3666  171.952   25.484  113.959   33.955 57.99290 42.45420 
1 1 1    7   32   23 o  361.285   10.585  100.410   5.8532  105.397   8.2262   95.296   8.3301  369.305   14.553  350.933   15.508 18.37222 21.26682 
1 1 1    7   32   24 o  278.069   12.594   59.626   5.3602   52.488   7.3814   67.589   7.7964  259.070   18.741  294.564   17.369 -35.49377 25.55202 
1 1 1    7   32   25 o  367.377   10.840  103.894   6.0956  104.557   8.3103  103.121   8.9681  367.637   14.768  364.746   16.063 2.890839 21.82054 
1 1 1    7   32   26 o  212.887   17.729   35.474   5.7244   32.021   7.1504   41.637   9.5528  200.388   23.776  227.204   28.066 -26.81564 36.78310 
1 1 1    7   32   27 o  126.015   26.897   13.061   5.0301   18.458   7.0170   7.3577   7.2142  148.809   31.774  100.979   36.443 47.82996 48.34900 
1 1 1    7   32   28 o  380.570   11.026  111.594   6.4229  119.102   9.1910  104.428   8.9795  391.938   15.321  366.789   15.994 25.14948 22.14816 
1 1 1    7   32   29 o  327.427   12.189   82.752   6.1090   87.138   8.7194   78.524   8.5616  334.203   17.103  316.988   17.717 17.21429 24.62484 
1 1 1    7   32   30 o  347.866   12.213   93.446   6.5027   97.273   9.2491   89.705   9.1442  353.407   17.098  338.739   17.698 14.66809 24.60832 
1 1 1    7   32   31 o  392.177   11.572  118.699   6.9467  130.473   10.125  108.229   9.5480  409.549   16.153  372.787   16.733 36.76160 23.25745 
1 1 1    7   32   32 o  402.698   13.935  125.696   8.5892  131.083   10.020  110.774   16.677  410.433   15.950  368.822   29.797 41.61090 33.79718 
1 1 1    7   32   33 o  294.865   14.511   67.507   6.5493   59.811   8.9974   76.179   9.5514  274.411   21.596  310.556   20.204 -36.14514 29.57310 
1 1 1    7   32   34 o   96.956   32.381   7.5028   5.6412   7.6598   7.9741   7.3456   7.9815  102.736   38.110  101.665   38.045 1.070267 53.85012 
1 1 1    7   32   35 o  329.114   16.583   84.814   8.3267   80.723   15.889   86.363   9.7768  310.153   34.029  330.747   19.397 -20.59430 39.16872 
1 1 1    7   32   36 f  347.423   16.208   94.303   8.6192   99.575   16.443   92.305   10.121  346.349   31.358  341.702   19.432 4.647888 36.89011 
1 1 1    7   32   37 o  164.573   25.655   22.303   6.2519   22.664   8.7790   21.932   8.9054  160.613   36.534  157.460   37.489 3.152496 52.34684 
1 1 1    7   32   38 o  151.807   29.292   19.508   6.5596   21.508   9.7052   17.825   8.9004  153.725   40.632  140.469   39.658 13.25670 56.77788 
1 1 1    7   32   39 o   90.230   33.347   5.9941   6.0943  -0.7222   8.8964   11.933   8.3654   81.247   36.013  116.923   39.430 -35.67604 53.40096 
1 1 1    7   32   40 o  183.528   27.144   28.215   7.3950   43.482   13.324   21.419   8.8901  217.391   41.556  153.324   38.059 64.06755 56.35075 
1 1 1    7   32   41 o  185.453   16.342   27.301   4.5915   28.503   5.2291   23.254   9.5950  188.660   18.340  158.059   39.711 30.60187 43.74127 
1 1 1    7   32   42 o  188.318   16.792   28.253   4.7896   29.780   5.2684   20.978   11.498  192.791   18.064  145.204   46.072 47.58772 49.48649 
1 1 1    7   32   43 o  112.650   25.135   10.856   4.2239   11.671   4.8036   8.0750   8.8697  115.872   27.497  101.598   39.585 14.27424 48.19835 
1 1 1    7   32   44 o  132.076   18.395   14.227   3.6178   5.3727   4.8053   25.813   5.4969   82.347   29.739  177.302   20.641 -94.95575 36.20014 
1 1 1    7   32   45 o  136.420   41.043   18.807   9.2690   18.807   9.2690   0.0000   0.0000  136.420   41.043  ?   ?  0.000000 41.04306 
1 1 1    7   32   46 f  205.285   16.725   33.997   5.2097   10.175   9.3006   44.889   6.2889  105.036   40.643  235.437   17.578 -130.4012 44.28175 
1 1 1    7   32   47 o   52.522   22.816   0.0840   3.4116  -1.4280   4.9482   1.4539   4.7101   57.598   26.086   64.901   27.466 -7.303318 37.87959 
1 1 1    7   33    0 o   64.729   39.324   3.1181   7.2624   3.1181   7.2624   3.1181   7.2624   64.729   39.324   64.729   39.324 0.000000 0.000000 
1 1 1    7   33    1 o  362.820   12.265  101.179   6.8114   94.963   9.4334  107.951   9.8454  350.260   17.653  373.989   17.199 -23.72882 24.64587 
1 1 1    7   33    2 o  558.183   10.942  239.269   9.3489  251.195   13.369  227.855   13.079  570.990   15.296  543.714   15.715 27.27545 21.93069 
1 1 1    7   33    3 o  337.939   10.867   87.700   5.6212   83.841   6.8549   95.622   9.8216  330.106   13.567  351.305   18.329 -21.19922 22.80374 
1 1 1    7   33    4 o  224.453   13.983   38.923   4.7800   44.555   6.0105   29.232   7.8845  239.783   16.477  191.462   27.710 48.32036 32.23878 
1 1 1    7   33    5 o  323.233   13.976   80.421   6.9148   79.744   9.9873   81.043   9.5833  320.191   20.486  323.046   19.472 -2.855011 28.26363 
1 1 1    7   33    6 f  248.618   15.875   47.850   6.0097   44.140   8.8463   51.030   8.1897  236.778   24.776  255.686   21.115 -18.90796 32.55307 
1 1 1    7   33    7 o  389.498   12.602  116.665   7.5131  112.845   11.007  119.998   10.280  381.940   18.828  394.240   17.037 -12.29971 25.39157 
1 1 1    7   33    8 o  867.293   12.000  578.230   15.930  583.142   23.168  573.825   21.938  868.840   17.421  862.230   16.623 6.610596 24.07943 
1 1 1    7   33    9 o  491.868   12.052  186.003   9.0739  179.667   12.912  192.185   12.754  482.204   17.494  498.930   16.701 -16.72604 24.18622 
1 1 1    7   33   10 o  580.172   11.614  258.723   10.313  248.466   14.652  268.795   14.519  567.193   16.877  590.190   16.073 -22.99689 23.30614 
1 1 1    7   33   11 o  696.798   11.784  373.285   12.568  365.452   17.966  380.793   17.588  687.727   17.067  702.284   16.362 -14.55731 23.64320 
1 1 1    7   33   12 o  516.054   12.231  204.848   9.6611  208.467   14.044  201.596   13.311  519.168   17.673  510.733   17.028 8.434753 24.54131 
1 1 1    7   33   13 o  457.016   12.685  160.746   8.8731  149.080   12.355  173.173   12.751  438.766   18.397  473.127   17.608 -34.36096 25.46522 
1 1 1    7   33   14 o  401.477   19.122  124.986   11.751   0.0000   0.0000  124.986   11.751  ?   ?   401.477   19.122 0.000000 19.12183 
1 1 1    7   33   15 o  500.173   17.660  193.691   13.520   0.0000   0.0000  193.691   13.520  ?   ?   500.173   17.660 0.000000 17.66045 
1 1 1    7   33   16 o  347.023   14.571   92.918   7.7395   91.885   10.748   94.031   11.154  343.125   20.559  346.943   21.105 -3.817444 29.46328 
1 1 1    7   33   17 o  358.034   12.201   98.690   6.6865   97.569   8.1029  101.080   11.837  355.480   14.892  359.462   21.615 -3.981262 26.24865 
1 1 1    7   33   18 o  182.775   19.634   26.261   5.4068   23.638   6.5032   32.131   9.7301  171.717   25.519  198.043   33.279 -26.32541 41.93686 
1 1 1    7   33   19 o  550.847   10.293  233.292   8.6785  235.468   10.537  228.702   15.303  552.823   12.452  542.665   18.424 10.15790 22.23719 
1 1 1    7   33   20 o  279.526   14.553   60.529   6.2050   56.645   7.3668   70.013   11.512  269.527   17.960  297.105   25.563 -27.57785 31.24158 
1 1 1    7   33   21 o   70.787   29.220   1.4190   5.1343   3.7899   6.2123  -3.6903   9.1196   84.601   33.083   78.947   35.615 5.654251 48.60935 
1 1 1    7   33   22 o   64.349   27.019   0.6860   4.5003   5.9538   6.3482  -4.6356   6.3806   93.293   34.106   62.114   28.684 31.17805 44.56429 
1 1 1    7   33   23 o  326.711   11.395   82.217   5.6982   86.269   8.0451   78.138   8.0718  333.692   15.751  316.918   16.699 16.77438 22.95551 
1 1 1    7   33   24 f  168.858   22.439   22.743   5.6560   19.717   6.8878   29.007   9.9109  154.578   30.194  185.895   36.133 -31.31752 47.08826 
1 1 1    7   33   25 o  223.822   15.489   39.009   5.2738   35.458   7.2351   43.034   7.7035  211.232   22.736  233.235   21.833 -22.00337 31.52121 
1 1 1    7   33   26 o  106.295   29.616   9.3444   4.9978   14.737   6.8325   3.1389   7.3297  132.206   33.672   86.741   35.254 45.46491 48.75109 
1 1 1    7   33   27 o  333.721   11.963   85.933   6.1109   85.783   8.6621   86.082   8.6223  331.596   17.125  332.217   17.013 -0.6215515 24.13959 
1 1 1    7   33   28 f  254.042   14.695   50.189   5.6898   49.779   8.0532   50.598   8.0400  250.878   21.169  253.031   20.948 -2.152893 29.78169 
1 1 1    7   33   29 o  117.313   33.576   11.586   6.3349   16.307   7.4151  -1.1708   12.188  138.234   35.008   95.548   42.262 42.68613 54.87850 
1 1 1    7   33   30 o  211.124   22.165   35.544   7.0557   43.590   8.3312   15.134   13.269  233.397   23.647  135.668   49.353 97.72913 54.72554 
1 1 1    7   33   31 o  191.504   20.325   29.145   5.8665   37.025   8.3636   21.514   8.2309  213.714   26.111  158.624   34.853 55.09003 43.54845 
1 1 1    7   33   32 o  354.753   12.570   97.388   6.8253  103.329   9.8281   91.853   9.4858  363.466   17.666  342.024   18.185 21.44254 25.35294 
1 1 1    7   33   33 o  293.736   14.672   67.078   6.5965   83.536   9.5149   51.847   9.1534  325.483   19.184  254.058   23.816 71.42474 30.58157 
1 1 1    7   33   34 o   96.398   35.562   6.7396   6.9243   5.5086   13.650   7.1661   8.0349  111.456   46.941  100.815   38.080 10.64072 60.44428 
1 1 1    7   33   35 o  283.092   15.929   62.792   6.8740   65.309   9.8775   60.428   9.5722  285.314   22.809  274.271   23.014 11.04297 32.40194 
1 1 1    7   33   36 o  157.086   27.963   20.647   6.4770   18.498   9.2216   22.739   9.0992  143.112   40.355  160.005   37.762 -16.89275 55.26710 
1 1 1    7   33   37 o  379.823   13.373  112.249   7.7747  118.853   11.221  106.152   10.782  387.671   18.911  365.654   19.333 22.01669 27.04415 
1 1 1    7   33   38 o  108.235   35.542   10.073   6.8063   8.1994   11.642   11.045   8.3894  110.107   44.544  113.365   39.448 -3.257889 59.50058 
1 1 1    7   33   39 o  100.631   34.515   8.4897   6.4112   5.8748   9.4224   10.744   8.7487   98.248   39.956  111.992   40.165 -13.74439 56.65387 
1 1 1    7   33   40 o  285.450   18.598   65.065   8.0814   68.937   10.307   58.888   13.020  290.415   23.386  259.894   33.510 30.52127 40.86306 
1 1 1    7   33   41 o   65.340   30.235  -4.0656   7.1429  -2.8547   9.7324  -5.4794   10.516   79.107   36.120   77.874   36.257 1.232391 51.17864 
1 1 1    7   33   42 o  108.598   25.565   10.160   4.1790   6.9805   4.7783   20.502   8.6186   90.533   29.782  147.303   37.981 -56.77022 48.26545 
1 1 1    7   33   43 o   74.990   27.358   4.2661   4.0816   6.1674   4.6524  -2.0882   8.5050   85.747   29.402   74.337   33.874 11.41007 44.85453 
1 1 1    7   33   44 o  131.026   31.254   15.691   6.1802   9.0155   8.9329   21.819   8.5593  102.043   39.735  150.177   37.383 -48.13406 54.55564 
1 1 1    7   33   45 o   89.053   24.218   6.9201   3.3883   17.625   4.9031  -2.8648   4.6877  143.937   23.032   52.674   24.416 91.26324 33.56495 
1 1 1    7   34    0 o  512.282   16.428  202.349   12.852  202.349   12.852  202.349   12.852  512.282   16.428  512.282   16.428 0.000000 0.000000 
1 1 1    7   34    1 o  530.479   11.258  216.264   9.1410  202.067   12.487  232.654   13.418  511.705   15.943  549.064   15.965 -37.35883 22.56292 
1 1 1    7   34    2 o  505.032   11.612  196.068   8.9759  186.914   12.302  206.490   13.126  492.037   16.334  517.092   16.585 -25.05493 23.27770 
1 1 1    7   34    3 o  257.345   13.128   51.104   5.1540   51.032   6.3356   51.246   8.8623  256.612   16.214  255.584   22.897 1.027771 28.05597 
1 1 1    7   34    4 o  363.078   10.718  101.276   5.9566   99.138   7.3660  105.316   10.126  358.837   13.411  368.980   17.929 -10.14258 22.38968 
1 1 1    7   34    5 o  152.531   25.270   18.640   5.6933   14.804   8.6821   21.534   7.5409  134.163   39.573  162.509   31.453 -28.34631 50.55024 
1 1 1    7   34    6 o  340.259   13.733   89.178   7.1523   86.577   10.735   91.255   9.5912  333.153   21.161  342.863   18.343 -9.710449 28.00450 
1 1 1    7   34    7 o  317.137   20.764   78.446   10.024   0.0000   0.0000   78.446   10.024  ?   ?   317.137   20.764 0.000000 20.76401 
1 1 1    7   34    8 o  474.574   17.366  174.208   12.615   0.0000   0.0000  174.208   12.615  ?   ?   474.574   17.366 0.000000 17.36585 
1 1 1    7   34    9 o  351.283   19.362   95.998   10.371   0.0000   0.0000   95.998   10.371  ?   ?   351.283   19.362 0.000000 19.36228 
1 1 1    7   34   10 o  454.635   17.614  159.997   12.257   0.0000   0.0000  159.997   12.257  ?   ?   454.635   17.614 0.000000 17.61389 
1 1 1    7   34   11 o  376.310   18.969  110.116   10.891   0.0000   0.0000  110.116   10.891  ?   ?   376.310   18.969 0.000000 18.96921 
1 1 1    7   34   12 o  552.521   17.247  236.325   14.586   0.0000   0.0000  236.325   14.586  ?   ?   552.521   17.247 0.000000 17.24668 
1 1 1    7   34   13 o  354.417   14.975   96.993   8.1237  104.469   11.992   90.652   11.044  365.499   21.531  340.469   21.299 25.02975 30.28559 
1 1 1    7   34   14 o  153.094   21.513   18.614   4.9021   17.653   5.8815   20.800   8.8719  147.544   27.040  157.454   37.372 -9.910446 46.12848 
1 1 1    7   34   15 o  219.588   16.564   37.537   5.5264   38.958   6.6873   34.475   9.8147  222.937   19.804  205.607   32.248 17.32983 37.84298 
1 1 1    7   34   16 o  488.180   10.606  183.288   7.9249  182.575   9.7760  184.655   13.535  486.595   13.126  487.703   18.131 -1.107483 22.38354 
1 1 1    7   34   17 o  271.012   14.444   56.897   5.9699   62.493   7.2469   45.082   10.530  283.479   16.777  236.383   29.765 47.09615 34.16693 
1 1 1    7   34   18 o  273.196   14.489   57.834   6.0370   56.089   7.2636   61.731   10.856  268.191   17.796  278.676   25.743 -10.48499 31.29488 
1 1 1    7   34   19 o  512.087   10.705  201.787   8.3905  193.997   10.112  219.008   15.034  501.404   13.175  530.630   18.511 -29.22577 22.72088 
1 1 1    7   34   20 o   64.383   27.815  -0.2789   5.0145  -0.1137   6.0602  -0.6376   8.9300   71.121   30.652   84.311   36.766 -13.18933 47.86771 
1 1 1    7   34   21 o  150.452   45.113   19.529   11.212   0.0000   0.0000   19.529   11.212  ?   ?   150.452   45.113 0.000000 45.11266 
1 1 1    7   34   22 o  389.300   11.659  116.808   6.9473  126.081   8.7690  101.175   11.385  403.777   14.189  359.008   20.808 44.76956 25.18541 
1 1 1    7   34   23 o  358.380   11.030   98.938   6.0504  106.246   8.5988   91.771   8.5149  370.309   15.171  343.871   16.178 26.43750 22.17788 
1 1 1    7   34   24 o  130.504   25.290   13.912   4.8694   3.6655   6.7465   25.054   7.0352   86.003   34.211  175.622   27.039 -89.61976 43.60588 
1 1 1    7   34   25 o   85.642   29.886   5.4011   4.8168   8.4166   6.6743   2.1234   6.9584  103.724   35.219   81.925   33.933 21.79876 48.90616 
1 1 1    7   34   26 o  313.799   12.399   76.051   5.9553   76.169   8.2787   75.924   8.5731  312.218   17.392  311.465   18.060 0.7530212 25.07343 
1 1 1    7   34   27 o  168.661   25.848   23.118   6.4600   20.166   7.5473   31.209   12.493  154.696   32.887  187.715   44.211 -33.01936 55.10180 
1 1 1    7   34   28 o  299.082   16.095   69.790   7.3408   70.015   8.6006   69.185   14.089  298.485   18.923  289.651   32.329 8.834595 37.46003 
1 1 1    7   34   29 o   48.671   23.511  -7.9441   5.2982  -7.1871   7.3761  -8.7509   7.6153   62.744   29.579   61.596   29.334 1.148418 41.65765 
1 1 1    7   34   30 o  101.305   31.702   8.4403   5.4618   14.556   7.6907   2.2169   7.7582  129.835   36.938   85.085   35.584 44.75012 51.28990 
1 1 1    7   34   31 o  155.901   24.636   19.822   5.6834   28.159   8.0196   11.410   8.0556  184.275   29.422  116.767   38.682 67.50765 48.60009 
1 1 1    7   34   32 o   68.293   30.728  -2.3470   6.7366 -17.6373   13.264   2.9684   7.8203   76.443   36.992   87.107   36.018 -10.66315 51.63050 
1 1 1    7   34   33 o  221.460   23.548   39.575   7.8595   29.722   15.028   43.285   9.2211  175.400   52.146  230.087   26.678 -54.68645 58.57444 
1 1 1    7   34   34 o   66.891   29.446  -0.7946   5.8490  -1.2168   8.2941  -0.3770   8.2495   78.219   34.717   79.893   35.075 -1.674347 49.35088 
1 1 1    7   34   35 o  116.932   32.886   11.855   6.1324   13.219   8.7830   10.556   8.5662  122.566   40.380  112.611   39.812 9.955505 56.70581 
1 1 1    7   34   36 o  223.987   35.830   43.811   11.870   43.811   11.870   0.0000   0.0000  223.987   35.830  ?   ?  0.000000 35.83022 
1 1 1    7   34   37 o  159.235   30.330   21.784   7.1223   37.119   12.124   13.702   8.8011  201.211   40.762  123.079   40.416 78.13208 57.40193 
1 1 1    7   34   38 o  125.759   32.653   14.003   6.3408   12.230   9.0154   15.739   8.9200  117.200   40.887  130.219   40.475 -13.01865 57.53223 
1 1 1    7   34   39 o  248.326   20.145   49.706   7.5908   51.460   9.8655   47.161   11.884  248.366   26.354  231.046   34.675 17.32028 43.55333 
1 1 1    7   34   40 o   89.231   33.615   6.0116   6.2510   13.463   9.3605   0.0141   8.3981  120.005   41.674   79.244   35.064 40.76064 54.46271 
1 1 1    7   34   41 o  105.731   33.344   10.084   6.0298   9.3107   9.0814   10.693   8.0639  104.896   40.277  108.600   38.602 -3.704346 55.78802 
1 1 1    7   34   42 o  172.552   24.716   25.264   6.3414   13.975   9.3875   34.738   8.6002  119.177   41.714  199.296   29.047 -80.11884 50.83093 
1 1 1    7   34   43 o  161.118   25.295   22.315   6.0327   21.677   8.8534   22.869   8.2424  148.251   38.627  155.294   35.456 -7.042938 52.43254 
1 1 1    7   34   44 o  107.748   26.186   10.296   4.2763   13.625   5.0812   2.2128   7.9174  123.504   27.576   80.101   34.777 43.40298 44.38386 
1 1 1    7   35    0 o  636.283   16.291  311.994   15.843  311.994   15.843  311.994   15.843  636.283   16.291  636.283   16.291 0.000000 0.000000 
1 1 1    7   35    1 o  467.418   11.985  168.110   8.5744  164.609   12.078  171.667   12.175  461.238   17.108  471.091   16.884 -9.852356 24.03684 
1 1 1    7   35    2 o  205.908   18.397   33.113   5.7372   35.293   8.0073   30.814   8.2243  210.809   25.322  195.901   28.244 14.90836 37.93359 
1 1 1    7   35    3 o  408.299   12.396  128.329   7.7468  131.197   10.951  125.456   10.960  411.684   17.379  402.466   17.791 9.217834 24.87107 
1 1 1    7   35    4 o  397.272   10.727  121.319   6.5229  125.481   8.1839  114.068   10.801  403.564   13.249  383.586   18.396 19.97791 22.67054 
1 1 1    7   35    5 o  529.718   12.126  215.972   9.8319  218.725   14.690  213.737   13.233  531.252   18.066  525.723   16.444 5.529663 24.42926 
1 1 1    7   35    6 o  114.728   31.407   10.803   5.6764   26.898   9.1534   0.7447   7.2358  180.693   34.351   80.149   33.988 100.5436 48.32391 
1 1 1    7   35    7 o  279.783   16.626   60.774   7.0878   68.366   10.957   55.312   9.2939  294.423   24.538  265.080   23.138 29.34314 33.72685 
1 1 1    7   35    8 o  242.239   18.449   45.780   6.7891   46.889   9.9084   44.799   9.3210  242.550   27.155  237.386   26.083 5.164124 37.65243 
1 1 1    7   35    9 o  280.176   16.626   60.968   7.0981   64.074   10.681   58.512   9.4988  284.773   24.751  272.642   22.976 12.13098 33.77162 
1 1 1    7   35   10 o  104.433   33.503   8.6246   6.0677   7.1688   9.2776   9.7128   8.0209  107.052   40.803  112.618   38.606 -5.566277 56.17229 
1 1 1    7   35   11 o  408.390   13.656  128.665   8.5360  120.092   12.289  136.656   11.866  392.076   20.549  419.497   18.479 -27.42096 27.63624 
1 1 1    7   35   12 o  201.373   22.088   32.053   6.6964   28.639   9.9405   34.889   9.0608  185.381   36.332  207.823   29.297 -22.44200 46.67257 
1 1 1    7   35   13 o  265.719   18.008   55.063   7.2808   52.545   10.594   57.317   10.023  256.426   27.418  268.998   24.615 -12.57254 36.84612 
1 1 1    7   35   14 o  727.307   12.398  407.682   13.802  422.298   20.374  395.287   18.762  737.348   18.052  713.878   17.171 23.47064 24.91427 
1 1 1    7   35   15 o  594.228   10.136  271.535   9.2189  257.465   11.135  302.206   16.439  577.879   12.588  624.090   17.209 -46.21094 21.32181 
1 1 1    7   35   16 o  497.078   10.684  190.127   8.1290  190.842   9.9613  188.702   14.065  497.339   13.086  492.489   18.658 4.849945 22.78924 
1 1 1    7   35   17 o  212.956   17.835   35.479   5.7599   28.576   6.8239   52.583   10.742  189.183   24.114  255.993   27.864 -66.81023 36.84960 
1 1 1    7   35   18 o  281.977   14.369   61.634   6.1812   67.146   7.6041   50.898   10.613  293.619   16.992  251.620   28.032 41.99916 32.78051 
1 1 1    7   35   19 o  117.118   34.542   11.385   6.6152   11.385   6.6152   0.0000   0.0000  117.118   34.542  ?   ?  0.000000 34.54220 
1 1 1    7   35   20 o  293.465   17.205   67.161   7.6946   67.161   7.6946   0.0000   0.0000  293.465   17.205  ?   ?  0.000000 17.20524 
1 1 1    7   35   21 o  147.694   26.451   17.793   5.7600   17.852   6.9698   17.666   10.230  146.146   32.041  143.237   43.124 2.908813 53.72428 
1 1 1    7   35   22 o   77.586   31.009   2.7677   5.5677   14.970   6.7682 -22.7760   9.7923  133.274   33.279   57.501   28.585 75.77327 43.87028 
1 1 1    7   35   23 o   70.642   28.725   1.8733   4.8694   0.0658   6.7382   3.8489   7.0448   74.951   32.312   87.688   34.934 -12.73737 47.58639 
1 1 1    7   35   24 o  414.625   12.555  132.809   7.9677  144.014   9.6863  109.363   14.012  431.023   14.682  370.497   24.852 60.52606 28.86466 
1 1 1    7   35   25 o  238.613   18.107   44.699   6.5638   38.582   7.6862   61.175   12.614  219.791   23.198  273.454   30.666 -53.66284 38.45200 
1 1 1    7   35   26 o  316.209   12.813   77.331   6.2016   93.563   8.7997   61.313   8.7413  346.595   16.587  278.547   20.650 68.04782 26.48668 
1 1 1    7   35   27 o  308.264   13.321   73.585   6.2856   76.801   8.9625   70.472   8.8175  312.593   18.820  299.162   19.360 13.43100 26.99982 
1 1 1    7   35   28 o   71.583   29.703   1.5120   5.3454   5.0472   7.8687  -1.5174   7.2841   93.936   37.079   73.359   32.548 20.57665 49.33802 
1 1 1    7   35   29 o  152.887   24.414   19.051   5.5210   18.162   7.9157   19.893   7.7044  144.844   35.888  152.495   33.887 -7.651016 49.35855 
1 1 1    7   35   30 o  191.622   24.625   29.786   7.0554   25.882   13.330   31.305   8.3158  166.492   49.012  194.596   28.788 -28.10448 56.84151 
1 1 1    7   35   31 o   70.118   31.310  -1.7759   6.8514  -8.9316   13.128   0.9025   8.0320   85.654   40.088   82.283   35.374 3.371452 53.46360 
1 1 1    7   35   32 o  127.616   30.504   13.908   5.8775   14.980   8.2415   12.799   8.3846  130.176   38.597  121.462   39.427 8.714294 55.17430 
1 1 1    7   35   33 o  317.497   14.596   78.606   7.0934   71.722   10.096   85.316   9.9681  298.930   22.225  327.588   19.975 -28.65765 29.88236 
1 1 1    7   35   34 o  119.782   34.539   12.586   6.6809  -1.5896   10.887   21.149   8.4615   87.471   39.233  154.224   36.426 -66.75298 53.53558 
1 1 1    7   35   35 o   87.206   33.547   5.1054   6.3075   8.0191   9.0132   2.3088   8.8300  103.986   40.074   87.641   37.367 16.34490 54.79262 
1 1 1    7   35   36 o  311.679   14.939   76.122   7.1267   71.035   9.9725   81.432   10.188  296.278   22.151  318.143   21.041 -21.86526 30.55136 
1 1 1    7   35   37 o   74.560   32.131   0.8730   6.6579  -7.2808   8.6117   12.988   10.497   67.433   31.841  120.359   43.879 -52.92606 54.21431 
1 1 1    7   35   38 o  165.125   29.226   23.503   7.1163   21.612   9.2343   26.268   11.167  151.537   39.433  164.050   43.691 -12.51353 58.85485 
1 1 1    7   35   39 o  184.160   22.901   28.100   6.3160   31.630   9.4614   25.262   8.4828  187.382   34.250  166.941   34.344 20.44019 48.50332 
1 1 1    7   35   40 o  230.163   17.990   42.678   6.2875   39.410   9.3692   45.355   8.4808  212.471   29.615  232.790   24.153 -20.31963 38.21507 
1 1 1    7   35   41 o   56.736   26.431  -3.7106   5.6022 -10.2443   8.4335   1.4494   7.4947   61.050   29.532   77.632   33.771 -16.58249 44.86210 
1 1 1    7   35   42 o  215.896   19.380   38.173   6.3362   41.740   9.5170   35.334   8.4918  217.146   29.389  200.420   28.483 16.72578 40.92643 
1 1 1    7   36    0 o  223.878   27.988   40.715   9.1852   40.715   9.1852   40.715   9.1852  223.878   27.988  223.878   27.988 0.000000 0.000000 
1 1 1    7   36    1 o  398.501   13.063  122.426   7.9677  123.951   11.339  120.939   11.198  399.500   18.543  394.618   18.540 4.882263 26.22196 
1 1 1    7   36    2 o  393.575   13.130  119.429   7.9096  124.045   11.190  114.821   11.181  399.723   18.290  384.357   19.006 15.36591 26.37720 
1 1 1    7   36    3 o  485.601   10.063  181.260   7.4797  184.477   9.3457  175.526   12.475  489.318   12.478  475.892   17.127 13.42630 21.19044 
1 1 1    7   36    4 o  471.704   10.279  171.070   7.4218  170.951   9.2114  171.291   12.531  470.951   12.778  469.996   17.418 0.9552002 21.60303 
1 1 1    7   36    5 o  589.714   10.006  267.317   9.0317  267.064   11.321  267.760   14.980  588.693   12.564  587.934   16.646 0.7593384 20.85515 
1 1 1    7   36    6 o  253.102   18.061   49.974   6.9511   49.345   10.393   50.484   9.3499  248.320   27.823  252.412   24.510 -4.092606 37.07887 
1 1 1    7   36    7 o  481.569   12.855  178.793   9.4753  196.514   14.672  166.115   12.410  502.665   19.070  462.729   17.522 39.93570 25.89760 
1 1 1    7   36    8 o  213.293   20.678   35.800   6.6660   34.286   9.6262   37.195   9.2400  204.997   31.702  214.770   28.836 -9.772476 42.85466 
1 1 1    7   36    9 o  280.705   16.828   61.293   7.1970   51.218   10.451   70.380   9.9256  253.064   27.419  299.274   21.818 -46.20943 35.04083 
1 1 1    7   36   10 o  289.088   16.706   64.990   7.3604   65.006   11.010   64.978   9.8971  286.187   25.398  287.150   22.703 -0.9635315 34.06634 
1 1 1    7   36   11 o  359.369   14.909   99.866   8.2007  101.457   12.161   98.539   11.106  359.331   22.219  354.781   20.539 4.549927 30.25819 
1 1 1    7   36   12 o  384.848   14.586  114.495   8.5920  122.539   12.778  107.857   11.608  395.417   21.189  371.182   20.511 24.23444 29.49042 
1 1 1    7   36   13 o  397.042   14.465  121.868   8.7905  120.186   12.982  123.292   11.946  391.259   21.764  397.682   19.625 -6.423187 29.30529 
1 1 1    7   36   14 o  275.403   17.921   59.206   7.5132   40.498   10.889   76.206   10.380  222.097   33.038  311.151   21.935 -89.05379 39.65645 
1 1 1    7   36   15 o  453.343   13.792  158.806   9.5706  157.832   14.182  159.620   12.969  449.303   20.623  452.685   18.717 -3.382324 27.84958 
1 1 1    7   36   16 o  100.245   34.781   7.5851   6.5196   7.5851   6.5196   0.0000   0.0000  100.245   34.781  ?   ?  0.000000 34.78126 
1 1 1    7   36   17 o  585.516   12.998  264.714   11.649  264.714   11.649   0.0000   0.0000  585.516   12.998  ?   ?  0.000000 12.99827 
1 1 1    7   36   18 o  560.370   10.729  241.819   9.2022  258.656   11.475  211.478   15.404  578.729   12.954  520.422   19.338 58.30750 23.27537 
1 1 1    7   36   19 o  162.667   23.797   21.283   5.7497   23.984   7.0456   15.896   9.9486  171.468   27.797  136.557   42.794 34.91115 51.02925 
1 1 1    7   36   20 o  677.177   10.494  353.161   10.877  360.256   13.571  340.417   18.189  682.810   12.985  660.851   17.981 21.95886 22.18007 
1 1 1    7   36   21 o  216.108   18.642   36.725   6.1059   38.158   7.6013   34.117   10.252  218.809   23.042  201.981   34.393 16.82846 41.39816 
1 1 1    7   36   22 o  309.452   14.373   74.207   6.8078   76.153   8.2758   70.135   11.973  312.129   17.391  295.304   26.780 16.82556 31.93199 
1 1 1    7   36   23 o  110.286   33.636   10.108   6.1943   7.9730   7.2633   15.802   11.862  102.848   36.627  136.531   46.941 -33.68243 59.53958 
1 1 1    7   36   24 o   66.856   28.456   0.4605   5.1043   8.2483   7.1644  -7.5678   7.2741  103.563   36.431   61.602   29.142 41.96046 46.65231 
1 1 1    7   36   25 o  301.724   13.561   70.529   6.2629   76.209   8.9034   64.965   8.8114  311.391   18.768  286.816   20.200 24.57455 27.57307 
1 1 1    7   36   26 o  241.760   16.171   45.731   5.9496   38.472   8.2869   53.454   8.5471  218.178   25.283  259.260   21.739 -41.08151 33.34420 
1 1 1    7   36   27 o  405.099   11.566  126.794   7.1713  147.329   10.429  108.378   9.8766  434.956   15.665  372.336   17.330 62.62057 23.36109 
1 1 1    7   36   28 o  176.290   26.367   25.478   6.8962   32.526   13.432   22.955   8.0363  187.944   46.854  164.160   33.125 23.78383 57.38108 
1 1 1    7   36   29 o  214.780   22.659   37.082   7.3367   47.180   14.638   33.694   8.4785  229.586   43.240  202.036   28.185 27.54944 51.61493 
1 1 1    7   36   30 o   91.873   32.723   6.4077   5.7976   8.8722   7.9843   3.6591   8.4320  106.258   38.340   90.899   37.476 15.35921 53.61312 
1 1 1    7   36   31 o   70.190   30.767  -0.4962   6.3257  -6.9853   9.7551   4.2122   8.3096   74.176   34.664   91.714   37.435 -17.53800 51.01984 
1 1 1    7   36   32 o  197.306   23.852   31.748   7.0572   25.025   11.204   36.169   9.0862  163.646   43.846  207.629   29.413 -43.98254 52.79750 
1 1 1    7   36   33 o  149.416   28.310   18.924   6.2374   19.991   8.9446   17.914   8.7025  148.048   38.948  140.095   39.097 7.952667 55.18598 
1 1 1    7   36   34 o  172.467   24.736   24.609   6.3430   26.867   8.9563   22.338   8.9844  174.438   34.764  156.786   37.865 17.65158 51.40339 
1 1 1    7   36   35 o  149.027   28.470   18.981   6.2574   21.337   8.9737   16.751   8.7300  152.258   38.486  134.354   39.697 17.90378 55.29046 
1 1 1    7   36   36 o  107.097   35.537   10.079   6.7981   20.217   8.8868  -4.2220   10.555  147.163   38.873   80.213   36.989 66.94938 53.65921 
1 1 1    7   36   37 o   64.569   28.970  -1.3923   5.9412   6.6870   8.5887  -8.8055   8.2271   96.904   38.583   62.827   30.075 34.07664 48.92033 
1 1 1    7   36   38 o   96.481   33.190   8.0634   5.9307   4.6577   8.7865   10.913   8.0379   90.927   37.935  109.343   38.574 -18.41648 54.10205 
1 1 1    7   36   39 o  103.391   32.917   9.7040   5.8658   4.9919   8.6893   13.649   7.9508   90.842   37.797  119.060   38.368 -28.21782 53.85839 
1 1 1    7   36   40 o  180.113   22.314   27.131   6.0201   38.862   9.1018   18.008   8.0265  210.226   29.063  136.002   37.395 74.22333 47.36079 
1 1 1    7   36   41 o  126.455   34.045   15.193   6.7358   17.493   8.6599   11.670   10.718  131.426   39.701  110.334   43.362 21.09126 58.79151 
1 1 1    7   37    0 o  434.725   18.847  146.633   12.487  146.633   12.487  146.633   12.487  434.725   18.847  434.725   18.847 0.000000 0.000000 
1 1 1    7   37    1 o  424.183   13.236  138.827   8.5936  147.950   12.118  129.598   12.189  436.349   18.144  407.905   19.522 28.44467 26.65160 
1 1 1    7   37    2 o  250.826   14.943   48.817   5.7111   47.665   7.1608   50.832   9.4671  246.767   19.108  253.023   24.762 -6.256134 31.27738 
1 1 1    7   37    3 o  540.213   10.306  224.452   8.5214  225.757   10.563  222.019   14.421  541.070   12.754  534.740   17.619 6.329712 21.75059 
1 1 1    7   37    4 o  258.450   14.179   51.754   5.5878   54.867   6.9806   46.201   9.3230  265.358   17.281  240.755   25.696 24.60274 30.96651 
1 1 1    7   37    5 f  582.489   9.9633  260.888   8.8830  262.632   10.987  257.595   15.096  583.718   12.297  576.174   17.117 7.544006 21.07613 
1 1 1    7   37    6 o  153.278   27.652   19.147   6.2489   22.738   9.2739   16.160   8.4570  163.923   37.742  138.245   38.528 25.67810 53.93381 
1 1 1    7   37    7 o  565.836   12.542  246.895   10.863  247.242   15.788  246.584   14.970  563.838   18.293  563.535   17.355 0.3029785 25.21585 
1 1 1    7   37    8 o  227.899   19.764   40.794   6.8259   48.460   10.262   34.710   9.1416  245.654   27.780  206.702   29.751 38.95262 40.70422 
1 1 1    7   37    9 o  477.746   13.395  176.234   9.7950  160.279   13.773  192.561   13.933  453.215   19.855  497.484   18.297 -44.26987 26.99986 
1 1 1    7   37   10 o  524.005   12.969  211.919   10.402  207.149   15.140  216.184   14.315  515.508   19.188  527.329   17.735 -11.82135 26.12885 
1 1 1    7   37   11 o  275.672   18.152   59.379   7.6165   53.110   11.337   64.535   10.282  256.385   29.423  285.412   23.753 -29.02707 37.81417 
1 1 1    7   37   12 o   54.850   26.295  -8.5010   6.3399  -6.2888   9.2092 -10.4939   8.7410   74.448   34.408   65.596   31.290 8.852760 46.50789 
1 1 1    7   37   13 o  325.337   23.881   83.838   11.809   83.838   11.809   0.0000   0.0000  325.337   23.881  ?   ?  0.000000 23.88062 
1 1 1    7   37   14 o  295.435   25.567   69.599   11.447   69.599   11.447   0.0000   0.0000  295.435   25.567  ?   ?  0.000000 25.56654 
1 1 1    7   37   15 o  332.886   16.612   86.091   8.4640   83.725   12.208   88.281   11.745  324.489   24.767  334.046   23.113 -9.556213 33.87646 
1 1 1    7   37   16 o  605.353   12.786  283.021   11.847  294.300   17.465  273.407   16.124  614.208   18.577  592.476   17.780 21.73199 25.71490 
1 1 1    7   37   17 o  165.186   23.420   21.920   5.7557   22.275   7.1961   21.289   9.5893  164.325   29.704  156.897   39.853 7.428452 49.70493 
1 1 1    7   37   18 o  151.717   25.688   18.742   5.7525   20.110   7.2993   16.499   9.3451  155.087   31.817  138.361   41.118 16.72597 51.98984 
1 1 1    7   37   19 o  374.069   13.072  108.195   7.4845  100.731   8.9954  124.986   13.493  359.908   16.329  397.644   22.258 -37.73584 27.60522 
1 1 1    7   37   20 o  355.332   13.752   97.764   7.4796   97.118   9.3457   98.916   12.475  352.965   17.299  352.964   23.221 0.1098633E-02 28.95576 
1 1 1    7   37   21 o  281.277   16.138   61.745   6.9190   59.850   8.4649   65.561   12.010  275.400   20.223  284.537   27.937 -9.137573 34.48798 
1 1 1    7   37   22 o  103.271   34.194   8.5772   6.2951   8.5315   7.3896   8.6982   12.019  105.078   36.995  116.170   45.835 -11.09174 58.90268 
1 1 1    7   37   23 o  191.884   22.771   29.525   6.5574   33.963   7.9172   19.830   11.702  204.700   25.845  148.877   46.373 55.82362 53.08893 
1 1 1    7   37   24 o  262.163   17.643   53.964   7.0385   58.766   8.4686   43.237   12.657  272.466   20.456  224.326   38.234 48.13918 43.36205 
1 1 1    7   37   25 f  246.396   16.119   47.528   6.0456   53.725   8.5533   41.342   8.5462  259.734   21.714  226.111   25.118 33.62280 33.20251 
1 1 1    7   37   26 o  390.834   14.263  118.705   8.5326  127.151   16.385  115.562   9.9948  395.872   27.206  384.407   16.987 11.46530 32.07405 
1 1 1    7   37   27 o   88.004   34.654   4.4888   6.8575 -19.5291   13.210   13.348   8.0232   74.223   36.148  123.930   38.364 -49.70670 52.71129 
1 1 1    7   37   28 o   70.547   29.770   1.0754   5.5080   16.056   8.0128 -12.3440   7.5839  134.794   37.479   56.103   27.337 78.69101 46.38994 
1 1 1    7   37   29 o   64.519   29.388  -3.0065   6.3932 -11.0774   9.7772   3.0222   8.4501   68.533   32.801   88.915   37.158 -20.38269 49.56421 
1 1 1    7   37   30 o   82.792   33.009   3.7813   6.2940   3.3195   10.009   4.0834   8.0948   94.649   40.046   90.267   36.908 4.381714 54.46029 
1 1 1    7   37   31 o  245.599   17.246   47.731   6.4421   43.273   9.1258   52.160   9.0953  228.735   26.560  253.174   23.748 -24.43936 35.62893 
1 1 1    7   37   32 o  155.771   27.305   20.450   6.2730   19.983   9.0405   20.884   8.7113  147.439   39.333  151.715   37.683 -4.275726 54.47136 
1 1 1    7   37   33 o   83.475   32.728   4.3744   6.0919   14.188   8.7173  -4.9925   8.5167  124.501   40.180   70.844   32.864 53.65704 51.90860 
1 1 1    7   37   34 o  263.708   18.833   55.658   7.5517   52.693   9.5283   60.667   12.384  252.433   24.989  265.893   31.012 -13.46086 39.82648 
1 1 1    7   37   35 o  139.811   30.094   17.154   6.2494   10.011   8.6731   24.867   9.0126  107.798   39.793  164.405   36.740 -56.60698 54.16011 
1 1 1    7   37   36 o  192.940   21.496   30.590   6.2402   49.864   9.2281   14.352   8.4705  243.995   25.066  122.613   39.612 121.3821 46.87596 
1 1 1    7   37   37 o   49.538   24.035  -8.2384   5.6928 -10.2069   8.3796  -6.5510   7.7581   61.142   29.543   63.330   29.999 -2.188709 42.10391 
1 1 1    7   37   38 o  220.327   18.787   39.448   6.2751   41.738   9.3889   37.598   8.4360  218.599   28.759  208.840   27.025 9.758316 39.46391 
1 1 1    7   37   39 o  149.672   32.055   20.562   7.1222   25.096   9.3300   14.230   11.026  159.931   38.563  118.163   44.614 41.76756 58.97021 
1 1 1    7   38    0 o  257.199   27.029   53.175   10.372   53.175   10.372   53.175   10.372  257.199   27.029  257.199   27.029 0.000000 0.000000 
1 1 1    7   38    1 o  320.344   16.273   79.788   7.9529   82.869   11.296   76.761   11.198  324.021   22.925  311.483   23.665 12.53833 32.94844 
1 1 1    7   38    2 o  225.302   16.530   39.590   5.6605   37.241   6.8337   44.724   10.103  217.286   20.802  235.375   28.633 -18.08900 35.39179 
1 1 1    7   38    3 o  407.349   11.706  127.880   7.2990  121.741   8.9304  140.233   12.668  396.655   14.709  423.957   19.521 -27.30176 24.44265 
1 1 1    7   38    4 o  315.593   13.095   76.895   6.3255   78.501   7.6517   73.429   11.242  318.263   15.707  304.277   24.341 13.98523 28.96918 
1 1 1    7   38    5 o  295.232   13.557   67.340   6.1262   69.979   7.6399   62.587   10.253  299.783   16.716  280.854   24.084 18.92938 29.31679 
1 1 1    7   38    6 o  354.081   15.043   97.081   8.1530   84.215   11.336  110.868   11.735  326.590   22.820  376.013   20.466 -49.42221 30.65347 
1 1 1    7   38    7 o  111.136   34.846   10.080   6.5953   10.155   9.3318   10.005   9.3226  115.913   41.491  115.383   41.453 0.5298843 58.65007 
1 1 1    7   38    8 o  193.851   34.863   31.369   9.9641   31.369   9.9641   0.0000   0.0000  193.851   34.863  ?   ?  0.000000 34.86321 
1 1 1    7   38    9 o  367.210   22.424  106.351   12.543  106.351   12.543   0.0000   0.0000  367.210   22.424  ?   ?  0.000000 22.42403 
1 1 1    7   38   10 o  561.830   18.752  246.207   16.126  246.207   16.126   0.0000   0.0000  561.830   18.752  ?   ?  0.000000 18.75207 
1 1 1    7   38   11 o  239.850   29.583   46.738   10.630   46.738   10.630   0.0000   0.0000  239.850   29.583  ?   ?  0.000000 29.58264 
1 1 1    7   38   12 o  408.336   14.281  129.068   8.9256  136.468   12.892  122.257   12.370  417.533   20.173  394.533   20.554 22.99924 28.79968 
1 1 1    7   38   13 o  363.678   15.514  102.615   8.6359  102.869   12.711  102.398   11.769  360.459   23.162  360.495   21.426 -0.3567505E-01 31.55178 
1 1 1    7   38   14 o  419.770   14.788  136.577   9.5014  159.056   14.250  118.586   12.749  450.296   20.676  387.854   21.560 62.44141 29.87153 
1 1 1    7   38   15 o  271.745   18.971   57.989   7.8414   44.564   11.153   71.114   11.027  232.439   32.213  298.717   24.329 -66.27795 40.36822 
1 1 1    7   38   16 o  129.082   36.333   14.203   7.4822   10.023   10.950   17.863   10.248  117.947   44.477  143.139   43.177 -25.19165 61.98749 
1 1 1    7   38   17 o  226.291   23.723   40.952   8.0948   45.336   11.931   37.213   11.019  232.972   34.501  210.183   35.516 22.78975 49.51491 
1 1 1    7   38   18 o  295.137   15.416   67.847   6.9398   73.202   8.7134   58.559   11.477  305.343   18.734  268.574   28.346 36.76886 33.97718 
1 1 1    7   38   19 o   61.408   28.207  -3.8067   6.0558  -5.8860   7.4667   0.1900   10.352   65.544   30.528   91.022   39.642 -25.47760 50.03482 
1 1 1    7   38   20 o  136.805   30.660   15.752   6.2613   19.524   7.4635   6.7905   11.504  151.714   33.073  109.903   44.344 41.81041 55.31907 
1 1 1    7   38   21 o  533.752   11.854  220.140   9.6847  216.508   11.892  227.290   16.687  527.965   14.716  537.410   20.287 -9.445068 25.06233 
1 1 1    7   38   22 f  238.738   19.438   45.066   7.0413   45.357   8.5666   44.460   12.363  237.610   23.878  228.298   36.616 9.312820 43.71367 
1 1 1    7   38   23 o  437.559   23.378  152.844   15.600   0.0000   0.0000  152.844   15.600  ?   ?   437.559   23.378 0.000000 23.37751 
1 1 1    7   38   24 o  147.265   39.612   19.255   9.1238   34.061   13.700   7.4530   12.231  191.968   47.001  112.213   45.565 79.75561 65.46226 
1 1 1    7   38   25 o  281.426   23.399   63.665   9.9878   55.613   14.658   70.643   13.646  252.479   39.200  291.410   31.073 -38.93083 50.02208 
1 1 1    7   38   26 o  157.735   27.712   20.756   6.4464   37.082   10.627   11.251   8.1087  207.844   34.622  115.174   38.820 92.67069 52.01641 
1 1 1    7   38   27 o  176.403   25.669   25.635   6.7276   35.256   10.868   19.658   8.5660  200.742   36.725  148.453   37.644 52.28918 52.59099 
1 1 1    7   38   28 o  141.528   28.823   17.014   6.0318   23.762   8.7546   10.915   8.3222  164.019   35.871  113.308   39.297 50.71141 53.20710 
1 1 1    7   38   29 o  130.816   32.219   14.946   6.4088   5.6168   9.2627   23.512   8.8764   97.809   39.675  162.312   36.602 -64.50276 53.97983 
1 1 1    7   38   30 o  313.430   14.784   76.881   7.0925   86.986   10.387   68.054   9.7077  329.353   20.711  290.314   22.010 39.03915 30.22202 
1 1 1    7   38   31 o  134.283   30.876   15.725   6.2135   18.992   8.8801   12.592   8.6973  143.266   39.309  118.525   40.203 24.74038 56.22698 
1 1 1    7   38   32 o  160.132   29.936   22.157   7.0676   22.059   8.8978   22.324   11.634  154.743   37.874  150.098   46.152 4.644775 59.70313 
1 1 1    7   38   33 o  176.060   27.640   26.428   7.2032   15.272   8.6142   52.366   13.135  127.157   39.816  240.471   36.860 -113.3142 54.25872 
1 1 1    7   38   34 o  174.651   24.726   25.639   6.4253   25.299   9.2378   25.957   8.9427  164.406   37.535  167.938   35.879 -3.531448 51.92509 
1 1 1    7   38   35 o   63.926   28.620  -1.0970   5.7650  -1.8471   8.6410  -0.4954   7.7391   75.525   34.310   74.624   33.302 0.9010544 47.81405 
1 1 1    7   38   36 o  117.940   32.244   12.786   5.9876   17.654   8.9670   8.8697   8.0435  133.131   40.440  101.098   38.121 32.03294 55.57547 
1 1 1    7   38   37 o  184.001   25.604   29.022   7.0156   28.309   8.9993   30.126   11.201  174.023   34.999  171.757   42.770 2.265976 55.26492 
1 1 1    7   39    0 o  169.221   44.298   26.832   9.9140   26.832   9.9140   26.832   9.9140  169.221   44.298  169.221   44.298 0.000000 0.000000 
1 1 1    7   39    1 o  349.900   16.160   95.050   8.6550  115.480   12.227   74.530   12.253  383.311   20.919  305.188   26.494 78.12350 33.75682 
1 1 1    7   39    2 o  579.943   13.250  259.905   11.762  259.905   11.762   0.0000   0.0000  579.943   13.250  ?   ?  0.000000 13.25032 
1 1 1    7   39    3 o   82.106   33.200   2.8653   6.4638   2.8653   6.4638   0.0000   0.0000   82.106   33.200  ?   ?  0.000000 33.19980 
1 1 1    7   39    4 o  432.592   14.104  144.810   9.3388  144.810   9.3388   0.0000   0.0000  432.592   14.104  ?   ?  0.000000 14.10396 
1 1 1    7   39    5 o  139.849   32.399   16.423   6.7991   16.423   6.7991   0.0000   0.0000  139.849   32.399  ?   ?  0.000000 32.39854 
1 1 1    7   39    6 o  285.416   26.171   65.241   11.306   65.241   11.306   0.0000   0.0000  285.416   26.171  ?   ?  0.000000 26.17120 
1 1 1    7   39    7 o  195.935   23.775   30.727   6.9841   44.122   10.702   20.790   9.2178  232.155   30.883  155.355   38.862 76.79964 49.63861 
1 1 1    7   39    8 o  544.554   13.560  229.365   11.302  235.949   16.629  223.713   15.408  549.052   19.787  535.201   18.809 13.85162 27.30046 
1 1 1    7   39    9 o  182.805   27.055   27.164   7.3415   32.630   10.839   22.531   9.9789  195.958   37.504  161.034   40.519 34.92342 55.21163 
1 1 1    7   39   10 o  447.268   14.320  154.966   9.8037  147.197   13.954  162.538   13.777  432.894   21.060  455.595   19.756 -22.70160 28.87552 
1 1 1    7   39   11 o   77.970   33.207   0.7952   6.9594   0.8680   10.460   0.7373   9.3222   93.271   40.234   88.443   38.068 4.827721 55.38865 
1 1 1    7   39   12 o  434.619   14.785  146.494   9.8358  136.468   14.082  156.044   13.744  415.514   22.222  446.061   20.130 -30.54675 29.98401 
1 1 1    7   39   13 o  634.562   13.344  311.578   12.961  307.853   18.466  315.194   18.197  627.067   19.239  634.876   18.726 -7.808777 26.84772 
1 1 1    7   39   14 o  296.650   18.764   69.103   8.4759   65.260   12.269   72.610   11.723  283.522   28.666  300.838   25.705 -17.31696 38.50320 
1 1 1    7   39   15 o  358.729   16.739  100.266   9.1912   95.810   12.910  104.845   13.088  346.410   24.506  362.929   23.691 -16.51865 34.08549 
1 1 1    7   39   16 o  292.833   19.476   67.536   8.6798   71.726   12.839   64.008   11.780  297.114   28.584  281.017   27.749 16.09637 39.83759 
1 1 1    7   39   17 o  248.200   22.520   49.109   8.4621   58.766   12.315   40.470   11.647  267.378   30.644  218.430   36.099 48.94751 47.35133 
1 1 1    7   39   18 o  239.155   24.307   45.970   8.7742   49.110   13.126   43.434   11.797  240.256   36.871  226.749   35.127 13.50705 50.92529 
1 1 1    7   39   19 o  165.243   26.315   22.386   6.4325   24.702   8.0500   18.296   10.698  171.302   31.875  143.238   44.294 28.06453 54.57114 
1 1 1    7   39   20 o   93.834   34.146   6.4244   6.3525   8.0909   7.7579   3.0334   11.066  103.630   37.731   99.035   42.017 4.594795 56.47148 
1 1 1    7   39   21 o   96.880   37.679   5.9699   8.0251  -3.2037   12.575   12.273   10.424   92.180   41.681  122.121   43.836 -29.94032 60.48936 
1 1 1    7   39   22 o  108.209   40.007   8.9258   8.7731   12.141   13.467   6.5552   11.564  125.740   48.836  108.101   44.147 17.63908 65.83250 
1 1 1    7   39   23 o  397.362   17.057  123.770   10.375  114.915   13.645  135.903   15.972  378.112   23.696  409.692   25.599 -31.57932 34.88270 
1 1 1    7   39   24 o   98.326   38.016   6.5485   8.1318   14.146   10.610  -4.2691   12.660  127.118   44.355   89.930   41.114 37.18821 60.47892 
1 1 1    7   39   25 o  139.165   33.146   16.873   6.9595   11.039   8.1202   33.016   13.508  113.799   38.846  186.159   47.307 -72.35984 61.21237 
1 1 1    7   39   26 o  126.031   35.793   14.088   7.2280   18.559   8.4201   1.5661   14.091  143.559   37.799  103.060   45.520 40.49891 59.16785 
1 1 1    7   39   27 o  254.018   16.754   50.963   6.4777   57.947   9.3691   44.568   8.9657  267.295   23.128  232.723   25.593 34.57246 34.49471 
1 1 1    7   39   28 o  220.414   19.328   38.878   6.4548   31.264   9.1934   46.281   9.0648  189.930   32.810  237.049   25.378 -47.11931 41.47947 
1 1 1    7   39   29 o  177.847   24.194   26.127   6.4152   21.659   8.7859   31.230   9.3890  154.067   37.590  188.679   33.750 -34.61186 50.51785 
1 1 1    7   39   30 o  174.800   27.525   25.901   7.1209   22.560   8.7614   32.404   12.223  156.944   37.064  183.024   44.141 -26.08051 57.63869 
1 1 1    7   39   31 o  104.923   35.790   9.6729   6.8931   10.626   8.5578   7.9123   11.631  109.812   39.682  106.604   43.990 3.208069 59.24346 
1 1 1    7   39   32 o  253.093   17.178   51.184   6.6152   57.288   9.5618   45.580   9.1617  262.669   24.050  232.422   26.211 30.24683 35.57246 
1 1 1    7   39   33 o  111.220   32.818   11.274   5.9701   15.856   8.6813   7.1616   8.2233  127.638   39.972   96.559   37.972 31.07896 55.13248 
1 1 1    7   39   34 o  135.835   30.683   16.615   6.2289   6.3360   8.6882   27.487   8.9350   94.477   38.388  172.172   35.095 -77.69467 52.01302 
1 1 1    7   39   35 o   98.529   35.756   8.5773   6.9588   11.114   8.4837   3.3599   12.166  108.731   39.476   95.129   42.143 13.60204 57.74392 
1 1 1    7   40    0 o  674.287   18.212  352.182   18.766  352.182   18.766  352.182   18.766  674.287   18.212  674.287   18.212 0.000000 0.000000 
1 1 1    7   40    1 o  330.340   13.526   84.434   6.8392   83.153   8.2692   87.208   12.167  326.526   16.600  330.998   24.184 -4.471924 29.33265 
1 1 1    7   40    2 o  276.474   15.863   59.572   6.6847   57.906   8.1864   62.907   11.580  271.186   19.860  279.269   27.445 -8.082184 33.87737 
1 1 1    7   40    3 o  119.927   36.088   12.099   7.1656   27.604   10.364  -2.0988   9.9176  178.996   38.938   84.904   37.808 94.09239 54.27322 
1 1 1    7   40    4 o  642.040   13.438  318.940   13.206  323.194   19.298  315.194   18.111  642.363   19.627  635.083   18.631 7.279968 27.06231 
1 1 1    7   40    6 o  334.391   17.507   87.416   8.9296   86.220   13.214   88.422   12.114  327.651   26.577  333.319   23.904 -5.668213 35.74540 
1 1 1    7   40    7 o  591.537   13.387  270.781   12.121  277.077   17.861  265.407   16.502  594.621   19.625  582.722   18.501 11.89856 26.97063 
1 1 1    7   40    8 o  436.343   14.939  147.755   9.9772  141.927   14.342  153.221   13.888  423.602   22.197  441.625   20.546 -18.02258 30.24680 
1 1 1    7   40    9 o  483.449   14.356  181.212   10.623  180.138   15.316  182.208   14.747  478.560   20.910  481.860   19.994 -3.300385 28.93073 
1 1 1    7   40   10 o  673.250   13.529  350.971   13.942  328.841   19.443  374.393   20.002  647.542   19.617  691.539   18.897 -43.99689 27.23819 
1 1 1    7   40   11 o  419.879   15.550  137.049   9.9937  113.315   13.815  163.103   14.474  377.065   24.062  455.295   20.770 -78.22931 31.78655 
1 1 1    7   40   12 o  369.325   17.072  106.411   9.6505   99.763   14.034  112.374   13.292  352.253   26.217  375.877   23.217 -23.62369 35.01917 
1 1 1    7   40   13 o  113.037   37.649   10.496   7.6273   11.652   10.941   9.4031   10.639  121.960   44.745  114.730   43.703 7.229515 62.54655 
1 1 1    7   40   14 o  314.843   18.930   78.009   9.0801   80.977   13.123   75.283   12.576  316.145   27.391  304.851   27.239 11.29343 38.62943 
1 1 1    7   40   15 o  102.662   36.887   8.0032   7.3821   21.430   11.010  -2.9618   9.9498  154.265   44.298   82.741   37.275 71.52380 57.89448 
1 1 1    7   40   16 o  285.866   20.698   64.799   8.9950   54.945   13.145   73.476   12.335  255.381   34.512  300.884   27.074 -45.50365 43.86452 
1 1 1    7   40   17 f  232.640   24.985   43.782   8.7573   63.801   13.888   30.569   11.283  275.761   33.598  185.735   40.803 90.02570 52.85580 
1 1 1    7   40   18 o  297.531   20.330   70.217   9.2031   80.667   13.964   62.192   12.237  313.147   29.479  274.620   29.579 38.52698 41.76052 
1 1 1    7   40   19 o  284.827   30.196   67.208   12.964   0.0000   0.0000   67.208   12.964  ?   ?   284.827   30.196 0.000000 30.19608 
1 1 1    7   40   20 o  165.505   46.500   25.628   12.267   0.0000   0.0000   25.628   12.267  ?   ?   165.505   46.500 0.000000 46.50000 
1 1 1    7   40   21 o  171.408   30.615   24.873   7.7376   19.153   10.049   33.204   12.127  144.738   42.540  190.961   42.576 -46.22322 60.18622 
1 1 1    7   40   22 o  359.598   15.101  101.020   8.3117  102.103   10.023   98.633   14.873  359.405   18.280  345.646   28.363 13.75925 33.74305 
1 1 1    7   40   23 o  145.531   32.408   18.374   7.0337   15.138   8.3391   26.352   13.094  129.783   38.904  164.787   48.595 -35.00420 62.24952 
1 1 1    7   40   24 o  316.551   16.846   79.015   8.1328   69.717   9.3674  107.480   16.390  294.961   20.883  358.236   30.171 -63.27460 36.69374 
1 1 1    7   40   25 o  289.830   18.149   66.660   8.0107   67.562   9.3496   64.168   15.535  289.925   21.216  268.176   38.988 21.74899 44.38633 
1 1 1    7   40   26 o  369.623   15.933  107.377   9.0139  107.536   10.780  107.010   16.435  367.250   19.244  355.874   30.466 11.37570 36.03484 
1 1 1    7   40   27 o  124.680   36.140   14.089   7.2976   12.403   8.8227   17.741   12.985  117.490   40.478  135.249   48.879 -17.75935 63.46386 
1 1 1    7   40   28 o   93.586   35.777   6.5170   7.1460   10.547   9.0340  -0.2192   11.680  110.496   40.642   90.663   40.653 19.83293 57.48385 
1 1 1    7   40   29 o  130.335   34.856   15.562   7.0887   15.144   8.7906   16.339   11.987  126.216   40.309  128.938   46.907 -2.722023 61.84708 
1 1 1    7   40   30 o   97.194   33.523   8.1465   6.0519   4.9713   8.7372   11.075   8.3908   91.923   38.045  110.460   39.364 -18.53762 54.74447 
1 1 1    7   40   31 o  109.151   32.873   10.841   5.9437   1.2234   8.5237   19.944   8.2925   81.520   35.724  145.008   37.184 -63.48863 51.56464 
1 1 1    7   40   32 o  101.274   36.055   9.1365   7.0377   13.523   8.7372   1.0325   11.876  118.026   40.294   90.965   40.875 27.06110 57.39711 
1 1 1    7   40   33 o  106.171   35.644   10.459   6.8358   11.585   8.4336   8.3020   11.671  110.530   39.457  104.367   43.647 6.163017 58.83767 
1 1 1    7   41    0 o  478.556   20.197  178.538   14.735  178.538   14.735  178.538   14.735  478.556   20.197  478.556   20.197 0.000000 0.000000 
1 1 1    7   41    1 o  500.322   11.506  193.245   8.8113  193.701   10.871  192.373   15.044  499.777   14.211  494.977   19.857 4.800934 24.41828 
1 1 1    7   41    3 o   57.362   26.426  -3.6408   5.3682  -5.6579   6.5533   0.4735   9.3594   60.684   28.376   87.609   37.924 -26.92458 47.36509 
1 1 1    7   41    4 o  515.002   11.165  204.670   8.8013  203.784   10.829  206.396   15.108  512.772   13.797  513.019   19.240 -0.2466431 23.67530 
1 1 1    7   41    5 o  538.188   10.974  223.466   9.0399  222.026   11.069  226.349   15.663  535.344   13.509  537.324   19.045 -1.979492 23.34946 
1 1 1    7   41    6 o  293.988   15.676   67.430   7.0286   68.040   8.6439   66.239   12.075  293.879   19.324  285.552   27.987 8.326569 34.01012 
1 1 1    7   41    7 o  215.008   25.009   37.321   8.0767   27.199   11.509   47.143   11.337  174.505   43.296  238.372   31.871 -63.86681 53.76146 
1 1 1    7   41    9 o  188.584   28.596   29.308   7.9953   39.416   11.638   20.273   11.003  214.772   36.721  150.259   44.608 64.51268 57.77793 
1 1 1    7   41   10 o  219.432   23.532   38.689   7.7803   36.668   11.452   40.423   10.603  206.318   37.650  219.856   32.487 -13.53757 49.72863 
1 1 1    7   41   11 o  336.363   18.058   88.881   9.2630   67.086   12.976  111.527   13.227  285.492   30.151  373.821   23.232 -88.32849 38.06338 
1 1 1    7   41   12 o  236.890   23.592   45.107   8.4405   43.764   12.056   46.399   11.821  226.472   35.982  234.607   33.902 -8.135178 49.43729 
1 1 1    7   41   13 o  390.054   17.028  119.015   10.166  118.210   14.904  119.715   13.902  382.834   25.582  386.740   23.598 -3.906403 34.80376 
1 1 1    7   41   14 o  266.453   31.230   59.077   12.495   0.0000   0.0000   59.077   12.495  ?   ?   266.453   31.230 0.000000 31.22973 
1 1 1    7   41   15 o  335.271   26.242   91.245   13.359   0.0000   0.0000   91.245   13.359  ?   ?   335.271   26.242 0.000000 26.24155 
1 1 1    7   41   16 o  157.743   44.814   22.983   11.328   0.0000   0.0000   22.983   11.328  ?   ?   157.743   44.814 0.000000 44.81355 
1 1 1    7   41   17 o  344.969   19.434   94.293   10.220   94.869   15.334   93.834   13.708  338.301   29.922  339.136   26.621 -0.8342285 40.05017 
1 1 1    7   41   18 o  100.281   37.874   7.3194   7.9474   3.2348   11.730   10.786   10.806  100.172   42.898  116.747   44.146 -16.57491 61.55532 
1 1 1    7   41   19 o  329.277   19.640   86.176   9.8535  110.210   14.270   64.272   13.623  367.973   25.493  275.033   33.020 92.94046 41.71581 
1 1 1    7   41   20 o  186.931   23.978   28.565   6.7025   22.225   7.8111   46.267   13.052  160.117   32.970  228.370   38.723 -68.25290 50.85745 
1 1 1    7   41   21 o  405.032   14.189  128.006   8.7962  124.007   10.486  137.503   16.160  396.831   17.263  410.089   25.877 -13.25739 31.10725 
1 1 1    7   41   22 f   66.846   30.334  -2.6153   6.7314  -1.3877   7.8878  -5.9058   12.913   75.255   33.599   87.371   40.508 -12.11598 52.62899 
1 1 1    7   41   23 o   85.018   34.445   3.8616   6.9728   9.5750   8.2840 -10.0233   12.914  107.547   39.015   81.684   38.697 25.86294 54.95087 
1 1 1    7   41   24 o  187.065   27.539   29.482   7.6491   22.898   8.9183   47.801   14.877  158.520   37.367  223.954   44.961 -65.43407 58.46125 
1 1 1    7   41   25 o  175.720   29.450   26.526   7.6406   28.084   9.1567   22.955   13.864  177.107   35.019  148.916   50.758 28.19118 61.66570 
1 1 1    7   41   26 o   72.067   33.388  -4.4983   8.7493  -4.4983   8.7493   0.0000   0.0000   72.067   33.388  ?   ?  0.000000 33.38820 
1 1 1    7   41   27 o  118.676   37.819   13.114   7.7415   22.554   9.3363  -7.6592   13.849  153.824   39.461   85.744   40.454 68.07999 56.51287 
1 1 1    7   41   28 o  148.293   34.252   20.137   7.6179   34.455   9.8110  -1.6009   12.089  195.474   34.027   88.218   40.271 107.2560 52.72174 
1 1 1    7   41   29 o  254.183   17.571   51.875   6.7942   50.901   9.6632   52.828   9.5545  245.006   26.173  250.443   25.270 -5.436996 36.38131 
1 1 1    7   41   30 o  220.001   22.822   40.280   7.5732   34.047   9.3771   51.971   12.843  194.327   32.686  236.465   36.670 -42.13866 49.12295 
1 1 1    7   42    0 o  241.750   30.417   48.216   10.771   48.216   10.771   48.216   10.771  241.750   30.417  241.750   30.417 0.000000 0.000000 
1 1 1    7   42    1 o  306.206   14.771   72.920   6.9232   77.594   8.5465   63.999   11.807  314.252   17.842  280.044   27.918 34.20801 33.13235 
1 1 1    7   42    2 o  234.736   18.624   43.507   6.6367   47.803   8.2067   35.388   11.282  244.598   22.161  202.124   37.859 42.47374 43.86812 
1 1 1    7   42    3 o  293.409   15.045   67.167   6.7339   60.312   8.0913   82.615   12.146  276.303   19.252  320.331   24.969 -44.02777 31.52969 
1 1 1    7   42    4 o  248.483   16.934   48.483   6.4022   45.253   7.7315   55.528   11.420  238.214   21.434  259.817   29.223 -21.60266 36.24088 
1 1 1    7   42    5 o  106.790   35.598   9.3641   6.8183   5.3618   10.003   12.837   9.3185  101.124   41.152  122.912   41.615 -21.78772 58.52563 
1 1 1    7   42    6 o  308.367   17.902   74.794   8.4134   78.888   11.975   70.803   11.823  312.640   25.240  295.360   26.432 17.28030 36.54683 
1 1 1    7   42    7 o  280.738   19.392   62.346   8.2817   61.429   11.358   63.387   12.102  274.292   27.420  277.724   28.892 -3.432953 39.83217 
1 1 1    7   42    8 o   82.232   37.148  -3.0183   9.9610   0.0000   0.0000  -3.0183   9.9610  ?   ?    82.232   37.148 0.000000 37.14754 
1 1 1    7   42    9 o   88.990   39.391  -0.7745   10.608   0.0000   0.0000  -0.7745   10.608  ?   ?    88.990   39.391 0.000000 39.39059 
1 1 1    7   42   10 o  186.955   41.642   31.406   11.611   0.0000   0.0000   31.406   11.611  ?   ?   186.955   41.642 0.000000 41.64164 
1 1 1    7   42   11 o  256.087   32.185   55.133   12.337   0.0000   0.0000   55.133   12.337  ?   ?   256.087   32.185 0.000000 32.18499 
1 1 1    7   42   12 o  353.949   17.805   98.702   9.6155   84.808   13.630  112.468   13.567  321.330   27.992  373.731   23.841 -52.40112 36.76863 
1 1 1    7   42   13 o  445.892   15.679  155.432   10.701  165.738   15.389  145.786   14.890  455.761   22.061  426.247   22.906 29.51404 31.80166 
1 1 1    7   42   14 o   69.667   31.996  -4.1179   7.7879  -3.5077   10.635  -4.8234   11.436   83.474   37.976   84.432   38.775 -0.9571457 54.27404 
1 1 1    7   42   15 o  333.156   18.968   87.984   9.6323   78.954   13.511   97.316   13.736  308.580   28.944  345.151   26.195 -36.57065 39.03801 
1 1 1    7   42   16 o  247.814   23.575   49.806   8.8343   58.258   12.841   42.211   12.173  261.679   32.779  218.816   37.707 42.86285 49.96254 
1 1 1    7   42   17 o  316.115   20.300   79.774   9.7705   66.493   13.497   94.398   14.162  280.035   32.066  338.225   27.597 -58.19037 42.30640 
1 1 1    7   42   18 o  302.898   21.636   73.770   9.9652   61.994   13.668   87.132   14.560  268.314   34.047  322.564   29.828 -54.25027 45.26460 
1 1 1    7   42   19 o   87.295   37.135   2.4003   8.6844  -1.8014   11.606   7.7467   13.091   89.091   40.185  111.811   46.447 -22.71972 61.41811 
1 1 1    7   42   20 f   79.367   35.444  -1.1486   8.7835   6.1956   11.891  -9.9669   13.030  105.239   44.038   82.046   38.869 23.19310 58.73759 
1 1 1    7   42   21 o  174.630   27.928   25.837   7.2135   19.758   8.4373   42.352   13.907  146.857   37.426  210.621   44.530 -63.76381 58.16881 
1 1 1    7   42   22 o  262.465   20.228   55.547   8.0635   54.679   9.7082   57.477   14.479  257.026   24.993  251.042   38.944 5.984177 46.27386 
1 1 1    7   42   23 o  279.331   23.809   64.278   10.082   64.278   10.082   0.0000   0.0000  279.331   23.809  ?   ?  0.000000 23.80862 
1 1 1    7   42   24 o  259.902   25.363   56.406   9.9611   56.406   9.9611   0.0000   0.0000  259.902   25.363  ?   ?  0.000000 25.36280 
1 1 1    7   42   25 o   88.600   35.128   5.3493   7.0914   1.8518   8.6576   12.480   12.362   83.883   36.393  117.633   46.461 -33.75014 59.01778 
1 1 1    7   42   26 o  134.162   34.322   16.623   7.0767   22.818   9.0179   6.6945   11.417  154.721   38.287  101.878   42.919 52.84245 57.51506 
1 1 1    7   42   27 o   66.955   30.431  -2.0481   6.8081  -3.2123   8.4767   0.0679   11.428   72.204   33.242   88.385   39.870 -16.18126 51.91039 
1 1 1    7   43    0 o   82.709   44.241   8.2876   7.6590   8.2876   7.6590   8.2876   7.6590   82.709   44.241   82.709   44.241 0.000000 0.000000 
1 1 1    7   43    1 o  220.915   19.274   38.796   6.4520   45.133   8.1426   28.103   10.576  236.727   22.752  177.171   39.954 59.55627 45.97819 
1 1 1    7   43    2 o  226.952   19.369   40.948   6.6639   36.503   8.1520   49.900   11.569  211.203   25.750  243.527   31.797 -32.32399 40.91604 
1 1 1    7   43    3 o   99.488   33.413   8.0773   6.0068   7.5026   7.5427   9.0737   9.9320  100.194   37.085  110.471   42.191 -10.27732 56.17273 
1 1 1    7   43    4 o  280.723   15.863   61.802   6.7884   62.156   8.2885   61.081   11.831  279.835   19.472  271.704   28.891 8.131470 34.84059 
1 1 1    7   43    5 o  229.828   18.297   41.837   6.3831   47.349   8.1232   32.941   10.321  242.763   22.103  194.627   35.969 48.13620 42.21769 
1 1 1    7   43    6 o  302.536   14.736   71.379   6.8239   75.207   8.6923   65.232   11.017  308.388   18.500  282.910   25.721 25.47794 31.68373 
1 1 1    7   43    7 o  235.417   18.555   43.949   6.6319   50.361   8.3787   33.195   10.852  250.329   22.094  193.958   37.912 56.37109 43.87996 
1 1 1    7   43    8 o  330.570   18.402   86.403   9.2740   91.236   14.216   82.822   12.236  332.727   28.179  319.168   25.253 13.55893 37.83895 
1 1 1    7   43    9 o  249.658   23.345   50.421   8.8175   42.522   12.916   57.317   12.067  218.158   40.159  261.371   30.751 -43.21390 50.58047 
1 1 1    7   43   10 o  150.940   35.139   20.045   7.9663   23.774   11.888   17.007   10.732  158.371   46.191  136.116   44.627 22.25467 64.22816 
1 1 1    7   43   11 o  323.036   19.201   82.867   9.4513  103.998   14.189   66.013   12.672  356.633   26.175  281.007   29.921 75.62598 39.75488 
1 1 1    7   43   12 o  123.782   36.978   13.606   7.5435   15.416   11.220   12.113   10.190  130.530   45.610  119.315   43.273 11.21489 62.87113 
1 1 1    7   43   13 o  247.346   23.922   49.805   8.9437   42.785   12.489   57.194   12.814  219.072   38.658  258.474   33.153 -39.40195 50.92710 
1 1 1    7   43   14 o  165.251   34.266   23.976   8.3826   24.122   11.224   23.792   12.606  159.413   44.369  156.123   48.049 3.289902 65.40137 
1 1 1    7   43   15 o  249.505   23.437   50.707   8.8455   57.862   12.303   43.049   12.727  260.646   31.475  218.219   39.560 42.42769 50.55355 
1 1 1    7   43   16 o  241.992   24.376   48.056   8.9060   43.227   12.139   53.684   13.106  219.933   37.400  246.982   35.705 -27.04895 51.70665 
1 1 1    7   43   17 o  226.674   26.617   42.864   9.0590   53.947   12.807   31.764   12.816  247.906   34.702  180.078   46.253 67.82831 57.82345 
1 1 1    7   43   18 o  300.272   21.664   73.083   9.8899   72.657   13.801   73.533   14.179  290.644   31.528  291.618   32.310 -0.9742126 45.14386 
1 1 1    7   43   19 f  273.140   23.494   61.269   9.7265   55.199   13.278   68.300   14.289  248.413   35.966  278.382   34.257 -29.96970 49.67007 
1 1 1    7   43   20 o  232.812   36.905   49.157   12.712   49.157   12.712   0.0000   0.0000  232.812   36.905  ?   ?  0.000000 36.90470 
1 1 1    7   43   21 o  137.755   46.870   19.303   11.821   19.303   11.821   0.0000   0.0000  137.755   46.870  ?   ?  0.000000 46.87000 
1 1 1    7   43   22 o  148.744   33.108   19.996   7.3438   20.765   8.5916   17.910   14.150  148.344   37.746  131.971   50.369 16.37335 62.94270 
1 1 1    7   43   23 o  156.273   31.442   21.785   7.2604   25.410   8.9573   14.842   12.397  165.260   36.395  123.181   47.114 42.07893 59.53472 
1 1 1    7   43   24 o  122.555   35.039   14.016   6.9029   15.597   8.6207   11.190   11.524  126.585   39.863  112.523   44.726 14.06197 59.91253 
1 1 1    7   44    0 o  174.105   33.341   26.575   7.9415   26.575   7.9415   26.575   7.9415  174.105   33.341  174.105   33.341 0.000000 0.000000 
1 1 1    7   44    1 o  212.415   20.910   36.268   6.7103   40.606   8.6777   29.816   10.583  222.074   26.023  181.989   39.153 40.08444 47.01211 
1 1 1    7   44    2 o  185.911   23.152   28.160   6.4455   23.642   8.0225   36.385   10.826  165.212   32.881  203.761   36.029 -38.54927 48.77726 
1 1 1    7   44    3 f  253.981   17.712   51.078   6.8425   53.772   8.7440   46.823   10.990  258.117   22.353  235.045   31.328 23.07236 38.48465 
1 1 1    7   44    4 o  423.892   12.489  139.590   8.1030  139.824   10.233  139.197   13.269  422.347   15.829  417.865   20.746 4.482330 26.09496 
1 1 1    7   44    5 o   85.262   32.997   4.6857   6.1310   0.9688   7.5662   11.793   10.462   79.510   34.259  118.326   43.701 -38.81652 55.52842 
1 1 1    7   44    7 o  395.802   13.233  121.999   8.0166  125.276   10.133  116.516   13.107  399.120   16.587  379.970   22.639 19.15027 28.06480 
1 1 1    7   44    8 o  234.204   23.031   44.603   8.1493   52.319   12.967   39.566   10.477  244.455   35.708  214.081   33.036 30.37483 48.64645 
1 1 1    7   44    9 o  152.508   35.727   20.811   8.1937   19.181   11.846   22.305   11.345  141.185   46.915  152.179   45.324 -10.99452 65.23193 
1 1 1    7   44   10 o  291.070   21.068   68.214   9.3225   67.726   13.588   68.648   12.814  281.128   32.157  285.161   29.798 -4.033203 43.84031 
1 1 1    7   44   11 o   89.086   36.270   4.3769   7.7753  -2.4442   11.276   10.560   10.736   86.315   39.205  113.741   43.763 -27.42647 58.75553 
1 1 1    7   44   12 o  256.687   22.811   53.716   8.8689   36.686   12.260   72.413   12.846  198.052   41.757  292.997   29.026 -94.94507 50.85398 
1 1 1    7   44   13 o  188.020   30.524   30.475   8.4832   27.585   11.525   33.891   12.532  168.641   44.135  187.357   44.383 -18.71558 62.59245 
1 1 1    7   44   14 o  110.640   39.133   10.754   8.2775   22.654   10.988  -4.8620   12.587  151.908   44.436   86.356   40.022 65.55151 59.80241 
1 1 1    7   44   15 o   87.409   36.464   3.6619   8.1174  -3.8333   10.585   14.362   12.648   80.702   37.152  124.471   47.593 -43.76859 60.37696 
1 1 1    7   44   16 o   88.430   36.979   3.8120   8.3769   4.2296   11.319   3.3063   12.456   97.747   42.007   98.791   43.242 -1.043869 60.28676 
1 1 1    7   44   17 o   96.459   41.756   3.7326   11.346   3.7326   11.346   0.0000   0.0000   96.459   41.756  ?   ?  0.000000 41.75581 
1 1 1    7   44   18 o  118.875   45.715   13.035   11.711   13.035   11.711   0.0000   0.0000  118.875   45.715  ?   ?  0.000000 45.71517 
1 1 1    7   44   19 o   81.441   35.694   1.0501   8.5111   1.1906   11.737   0.8944   12.361   91.993   41.035   93.187   41.800 -1.193138 58.57553 
1 1 1    7   44   20 o  225.422   26.040   42.992   8.8193   43.839   12.472   42.145   12.472  215.551   39.249  210.275   40.217 5.276367 56.19571 
1 1 1    7   45    0 o   68.795   41.216   4.7863   7.7571   4.7863   7.7571   4.7863   7.7571   68.795   41.216   68.795   41.216 0.000000 0.000000 
1 1 1    7   45    1 o  190.552   23.252   29.844   6.6412   31.846   8.0684   25.637   11.695  194.085   27.967  161.698   45.392 32.38696 53.31588 
1 1 1    7   45    2 o   70.498   31.047  -0.3806   6.5082  -1.2320   8.0047   1.2800   11.179   75.508   33.770   92.367   40.684 -16.85971 52.87298 
1 1 1    7   45    3 o  189.841   23.539   29.686   6.6932   27.037   8.3649   34.399   11.159  175.836   32.269  193.624   39.001 -17.78816 50.61994 
1 1 1    7   45    4 o  258.692   17.683   53.285   6.9597   58.349   8.8801   45.223   11.206  268.089   21.830  227.599   33.138 40.48965 39.68261 
1 1 1    7   45    5 o   61.526   28.267  -3.2155   6.0857  -3.0586   7.7049  -3.4757   9.9231   70.265   32.104   79.099   36.250 -8.834007 48.42259 
1 1 1    7   45    6 o  139.317   30.026   16.917   6.2142   15.005   7.9055   20.009   10.053  127.510   37.801  144.148   42.601 -16.63831 56.95374 
1 1 1    7   45    7 o  327.477   15.905   84.551   7.9721  101.774   10.239   58.041   12.704  356.772   18.817  257.939   32.928 98.83224 37.92546 
1 1 1    7   45    8 o  122.019   34.127   13.444   6.6231   8.5990   8.1103   23.143   11.475  102.681   38.366  152.417   45.625 -49.73617 59.61178 
1 1 1    7   45    9 o  373.536   17.958  111.016   10.267  115.951   14.887  106.539   14.179  373.085   26.236  357.745   26.074 15.34009 36.98888 
1 1 1    7   45   10 o  404.716   17.132  129.955   10.612  134.586   15.284  125.645   14.747  403.445   24.872  389.805   24.846 13.63992 35.15561 
1 1 1    7   45   11 o  202.067   28.242   34.862   8.4963   17.882   11.517   55.142   12.586  133.963   46.241  249.587   33.816 -115.6239 57.28678 
1 1 1    7   45   12 o  192.067   29.310   31.835   8.3437   24.875   11.159   40.658   12.565  157.903   44.346  207.025   41.102 -49.12225 60.46447 
1 1 1    7   45   13 o  246.191   34.464   54.192   12.631   54.192   12.631   0.0000   0.0000  246.191   34.464  ?   ?  0.000000 34.46423 
1 1 1    7   45   14 o  149.080   45.703   22.738   11.418   22.738   11.418   0.0000   0.0000  149.080   45.703  ?   ?  0.000000 45.70328 
1 1 1    7   45   15 o  146.942   45.121   22.051   11.124   22.051   11.124   0.0000   0.0000  146.942   45.121  ?   ?  0.000000 45.12136 
1 1 1    7   46    0 o  290.428   21.039   67.376   9.2400   67.376   9.2400   67.376   9.2400  290.428   21.039  290.428   21.039 0.000000 0.000000 
1 1 1    7   46    1 o  138.147   28.209   16.553   5.7631   18.713   8.0452   14.277   8.2597  141.799   36.762  123.143   39.046 18.65569 53.62825 
1 1 1    7   46    2 o  124.806   33.225   14.114   6.4595   12.872   8.0587   16.348   10.803  117.683   38.675  129.048   44.773 -11.36422 59.16412 
1 1 1    7   46    3 o  181.662   24.241   27.551   6.5722   23.345   8.1152   35.566   11.204  160.751   34.042  195.219   38.861 -34.46799 51.66245 
1 1 1    7   46    4 f   88.764   33.033   6.0945   6.0006  -2.1698   7.4187   21.731   10.205   70.156   31.840  148.557   42.643 -78.40077 53.21840 
1 1 1    7   46    5 o  110.810   33.777   11.098   6.2476   11.721   7.9320   10.080   10.140  113.059   38.394  109.286   42.396 3.772972 57.19703 
1 1 1    7   46    6 o  265.333   17.450   56.273   7.0475   55.542   8.9078   57.495   11.523  259.908   22.617  258.264   29.689 1.644196 37.32230 
1 1 1    7   46    7 o  233.545   24.199   45.378   8.5248   45.378   8.5248   0.0000   0.0000  233.545   24.199  ?   ?  0.000000 24.19866 
1 1 1    7   46    8 o   58.283   28.038  -8.8000   7.3519  -8.8000   7.3519   0.0000   0.0000   58.283   28.038  ?   ?  0.000000 28.03836 
1 1 1    8    0    3 o   90.092   13.388   6.6126   1.7263   6.6126   1.7263   6.6126   1.7263   90.092   13.388   90.092   13.388 0.000000 0.000000 
1 1 1    8    0    4 o  1035.59   8.3096  821.076   13.170  821.076   13.170  821.076   13.170  1035.59   8.3096  1035.59   8.3096 0.000000 0.000000 
1 1 1    8    0    5 o  1227.19   8.2107  1152.92   15.421  1152.92   15.421  1152.92   15.421  1227.19   8.2107  1227.19   8.2107 0.000000 0.000000 
1 1 1    8    0    6 o  832.458   7.0959  530.544   9.0400  530.544   9.0400  530.544   9.0400  832.458   7.0959  832.458   7.0959 0.000000 0.000000 
1 1 1    8    0    7 o  482.968   4.7802  178.581   3.5330  178.581   3.5330  178.581   3.5330  482.968   4.7802  482.968   4.7802 0.000000 0.000000 
1 1 1    8    0    8 o  473.370   4.8287  171.557   3.4979  171.557   3.4979  171.557   3.4979  473.370   4.8287  473.370   4.8287 0.000000 0.000000 
1 1 1    8    0    9 o  582.013   6.1487  259.362   5.4762  259.362   5.4762  259.362   5.4762  582.013   6.1487  582.013   6.1487 0.000000 0.000000 
1 1 1    8    0   10 o  194.197   8.1554   29.021   2.4144   29.021   2.4144   29.021   2.4144  194.197   8.1554  194.197   8.1554 0.000000 0.000000 
1 1 1    8    0   11 o  1090.89   8.8592  911.206   14.790  911.206   14.790  911.206   14.790  1090.89   8.8592  1090.89   8.8592 0.000000 0.000000 
1 1 1    8    0   12 o  159.527   9.9246   19.709   2.4019   19.709   2.4019   19.709   2.4019  159.527   9.9246  159.527   9.9246 0.000000 0.000000 
1 1 1    8    0   13 o  915.899   6.8458  642.244   9.5959  642.244   9.5959  642.244   9.5959  915.899   6.8458  915.899   6.8458 0.000000 0.000000 
1 1 1    8    0   14 o  400.696   5.2855  122.957   3.2404  122.957   3.2404  122.957   3.2404  400.696   5.2855  400.696   5.2855 0.000000 0.000000 
1 1 1    8    0   15 o  114.031   9.5705   10.165   1.6434   10.165   1.6434   10.165   1.6434  114.031   9.5705  114.031   9.5705 0.000000 0.000000 
1 1 1    8    0   16 o  900.154   6.9199  620.373   9.5330  620.373   9.5330  620.373   9.5330  900.154   6.9199  900.154   6.9199 0.000000 0.000000 
1 1 1    8    0   17 o  321.745   5.8453   79.317   2.8765   79.317   2.8765   79.317   2.8765  321.745   5.8453  321.745   5.8453 0.000000 0.000000 
1 1 1    8    0   18 o  677.191   7.1017  351.161   7.3593  351.161   7.3593  351.161   7.3593  677.191   7.1017  677.191   7.1017 0.000000 0.000000 
1 1 1    8    0   19 o  163.292   10.165   20.652   2.5180   20.652   2.5180   20.652   2.5180  163.292   10.165  163.292   10.165 0.000000 0.000000 
1 1 1    8    0   20 o   52.887   23.509   3.0914   2.0133   3.0914   2.0133   3.0914   2.0133   52.887   23.509   52.887   23.509 0.000000 0.000000 
1 1 1    8    0   21 o  260.010   7.1268   51.865   2.8315   51.865   2.8315   51.865   2.8315  260.010   7.1268  260.010   7.1268 0.000000 0.000000 
1 1 1    8    0   22 o   79.731   21.625   5.8258   2.2812   5.8258   2.2812   5.8258   2.2812   79.731   21.625   79.731   21.625 0.000000 0.000000 
1 1 1    8    0   23 o  456.010   6.3385  159.254   4.4222  159.254   4.4222  159.254   4.4222  456.010   6.3385  456.010   6.3385 0.000000 0.000000 
1 1 1    8    0   24 o  420.729   6.5129  135.583   4.1919  135.583   4.1919  135.583   4.1919  420.729   6.5129  420.729   6.5129 0.000000 0.000000 
1 1 1    8    0   25 o  320.022   10.398   78.649   5.0813   78.649   5.0813   78.649   5.0813  320.022   10.398  320.022   10.398 0.000000 0.000000 
1 1 1    8    0   26 o  348.928   7.6380   93.326   4.0749   93.326   4.0749   93.326   4.0749  348.928   7.6380  348.928   7.6380 0.000000 0.000000 
1 1 1    8    0   27 o  789.865   7.2238  477.657   8.7318  477.657   8.7318  477.657   8.7318  789.865   7.2238  789.865   7.2238 0.000000 0.000000 
1 1 1    8    0   28 o  380.263   7.8235  110.824   4.5492  110.824   4.5492  110.824   4.5492  380.263   7.8235  380.263   7.8235 0.000000 0.000000 
1 1 1    8    0   29 o  210.674   12.019   34.313   3.8470   34.313   3.8470   34.313   3.8470  210.674   12.019  210.674   12.019 0.000000 0.000000 
1 1 1    8    0   30 o  968.652   8.0443  718.387   11.925  718.387   11.925  718.387   11.925  968.652   8.0443  968.652   8.0443 0.000000 0.000000 
1 1 1    8    0   31 o  171.008   24.275   23.738   5.9842   23.738   5.9842   23.738   5.9842  171.008   24.275  171.008   24.275 0.000000 0.000000 
1 1 1    8    0   32 o  448.850   9.6721  154.455   6.6380  154.455   6.6380  154.455   6.6380  448.850   9.6721  448.850   9.6721 0.000000 0.000000 
1 1 1    8    0   33 o  359.004   9.9256   98.903   5.4447   98.903   5.4447   98.903   5.4447  359.004   9.9256  359.004   9.9256 0.000000 0.000000 
1 1 1    8    0   34 o  197.473   16.530   30.502   4.9159   30.502   4.9159   30.502   4.9159  197.473   16.530  197.473   16.530 0.000000 0.000000 
1 1 1    8    0   35 o   69.793   35.786   5.4874   4.8546   5.4874   4.8546   5.4874   4.8546   69.793   35.786   69.793   35.786 0.000000 0.000000 
1 1 1    8    0   36 o  323.456   11.697   80.443   5.7738   80.443   5.7738   80.443   5.7738  323.456   11.697  323.456   11.697 0.000000 0.000000 
1 1 1    8    0   37 o  396.802   11.976  120.936   7.2588  120.936   7.2588  120.936   7.2588  396.802   11.976  396.802   11.976 0.000000 0.000000 
1 1 1    8    0   38 o  166.489   23.341   22.503   5.6129   22.503   5.6129   22.503   5.6129  166.489   23.341  166.489   23.341 0.000000 0.000000 
1 1 1    8    0   39 o  177.757   19.126   25.081   5.0514   25.081   5.0514   25.081   5.0514  177.757   19.126  177.757   19.126 0.000000 0.000000 
1 1 1    8    0   40 o  402.465   10.005  124.313   6.1545  124.313   6.1545  124.313   6.1545  402.465   10.005  402.465   10.005 0.000000 0.000000 
1 1 1    8    0   41 o  239.290   14.541   44.406   5.2809   44.406   5.2809   44.406   5.2809  239.290   14.541  239.290   14.541 0.000000 0.000000 
1 1 1    8    0   42 o  225.216   15.453   39.478   5.2693   39.478   5.2693   39.478   5.2693  225.216   15.453  225.216   15.453 0.000000 0.000000 
1 1 1    8    0   43 o  373.686   14.482  107.668   8.2553  107.668   8.2553  107.668   8.2553  373.686   14.482  373.686   14.482 0.000000 0.000000 
1 1 1    8    0   44 o   50.438   31.241   1.4423   4.7929   1.4423   4.7929   1.4423   4.7929   50.438   31.241   50.438   31.241 0.000000 0.000000 
1 1 1    8    0   45 o  596.448   8.6586  272.797   7.9010  272.797   7.9010  272.797   7.9010  596.448   8.6586  596.448   8.6586 0.000000 0.000000 
1 1 1    8    0   46 o  110.426   32.858   11.652   4.8335   11.652   4.8335   11.652   4.8335  110.426   32.858  110.426   32.858 0.000000 0.000000 
1 1 1    8    0   47 o  696.474   8.6807  372.030   9.2508  372.030   9.2508  372.030   9.2508  696.474   8.6807  696.474   8.6807 0.000000 0.000000 
1 1 1    8    0   48 o  316.372   14.309   77.457   6.8966   77.457   6.8966   77.457   6.8966  316.372   14.309  316.372   14.309 0.000000 0.000000 
1 1 1    8    0   49 o  317.797   13.323   78.077   6.4547   78.077   6.4547   78.077   6.4547  317.797   13.323  317.797   13.323 0.000000 0.000000 
1 1 1    8    0   50 o  283.919   13.011   62.400   5.6273   62.400   5.6273   62.400   5.6273  283.919   13.011  283.919   13.011 0.000000 0.000000 
1 1 1    8    0   51 o  104.891   35.108   11.109   5.0283   11.109   5.0283   11.109   5.0283  104.891   35.108  104.891   35.108 0.000000 0.000000 
1 1 1    8    0   52 o  191.383   18.621   29.155   5.3363   29.155   5.3363   29.155   5.3363  191.383   18.621  191.383   18.621 0.000000 0.000000 
1 1 1    8    0   53 f  122.036   33.382   14.039   5.3910   14.039   5.3910   14.039   5.3910  122.036   33.382  122.036   33.382 0.000000 0.000000 
1 1 1    8    0   54 o  312.428   15.287   75.962   7.2705   75.962   7.2705   75.962   7.2705  312.428   15.287  312.428   15.287 0.000000 0.000000 
1 1 1    8    0   55 o  145.887   32.472   19.106   6.3359   19.106   6.3359   19.106   6.3359  145.887   32.472  145.887   32.472 0.000000 0.000000 
1 1 1    8    0   56 o  302.505   13.850   71.122   6.3821   71.122   6.3821   71.122   6.3821  302.505   13.850  302.505   13.850 0.000000 0.000000 
1 1 1    8    0   57 o   61.539   35.902   3.9671   5.6110   3.9671   5.6110   3.9671   5.6110   61.539   35.902   61.539   35.902 0.000000 0.000000 
1 1 1    8    0   58 f   55.855   34.353   2.4420   5.6982   2.4420   5.6982   2.4420   5.6982   55.855   34.353   55.855   34.353 0.000000 0.000000 
1 1 1    8    0   59 o   86.265   43.591   9.4312   7.1427   9.4312   7.1427   9.4312   7.1427   86.265   43.591   86.265   43.591 0.000000 0.000000 
1 1 1    8    0   60 o   35.125   25.157  -9.1427   6.2898  -9.1427   6.2898  -9.1427   6.2898   35.125   25.157   35.125   25.157 0.000000 0.000000 
1 1 1    8    0   61 o  126.661   32.169   15.172   5.3924   15.172   5.3924   15.172   5.3924  126.661   32.169  126.661   32.169 0.000000 0.000000 
1 1 1    8    0   62 o   84.927   37.692   8.7393   5.1755   8.7393   5.1755   8.7393   5.1755   84.927   37.692   84.927   37.692 0.000000 0.000000 
1 1 1    8    0   63 o   38.262   26.303  -2.7866   5.0279  -2.7866   5.0279  -2.7866   5.0279   38.262   26.303   38.262   26.303 0.000000 0.000000 
1 1 1    8    0   64 o   46.242   29.690   0.9628   4.7833   0.9628   4.7833   0.9628   4.7833   46.242   29.690   46.242   29.690 0.000000 0.000000 
1 1 1    8    1    0 o  1007.44   13.915  777.585   21.447  777.585   21.447  777.585   21.447  1007.44   13.915  1007.44   13.915 0.000000 0.000000 
1 1 1    8    1    1 o  407.827   8.6175  127.339   5.3793  127.339   5.3793   0.0000   0.0000  407.827   8.6175  ?   ?  0.000000 8.617531 
1 1 1    8    1    2 o  1129.39   10.869  976.785   18.789  935.700   25.357  1026.80   27.979  1105.07   14.991  1157.55   15.792 -52.47290 21.77428 
1 1 1    8    1    3 o  531.700   9.6845  216.467   7.8816   0.0000   0.0000  216.467   7.8816  ?   ?   531.700   9.6845 0.000000 9.684534 
1 1 1    8    1    4 o  190.985   5.2066   27.919   1.5220   31.049   2.5387   26.163   1.9017  201.383   8.2360  184.871   6.7206 16.51199 10.63006 
1 1 1    8    1    5 o  439.119   5.3627  147.596   3.6044  146.756   4.3785  149.362   6.3487  437.850   6.5333  441.665   9.3913 -3.814819 11.44025 
1 1 1    8    1    6 o  471.394   3.5226  170.075   2.5417  171.456   3.8686  169.025   3.3714  473.283   5.3403  469.925   4.6872 3.358795 7.105523 
1 1 1    8    1    7 o  1210.75   5.7787  1122.11   10.709  1103.06   14.848  1142.76   15.460  1200.32   8.0818  1221.71   8.2676 -21.39539 11.56147 
1 1 1    8    1    8 o  1387.84   6.9328  1474.53   14.727  1477.15   22.576  1472.59   19.431  1388.79   10.621  1386.78   9.1540 2.018066 14.02108 
1 1 1    8    1    9 o  1037.52   5.5384  823.987   8.7953  823.745   13.461  824.166   11.618  1037.22   8.4789  1037.55   7.3158 -0.3282471 11.19875 
1 1 1    8    1   10 o  376.405   3.4188  108.439   1.9697  104.340   2.7468  112.777   2.8260  369.207   4.8606  383.845   4.8100 -14.63748 6.838230 
1 1 1    8    1   11 o  680.139   4.3547  354.077   4.5334  343.403   5.8474  370.160   7.1776  669.774   5.7038  695.344   6.7439 -25.56921 8.832519 
1 1 1    8    1   12 o  739.817   6.0339  419.006   6.8327  420.899   9.7242  417.159   9.6029  741.372   8.5693  738.075   8.5002 3.296875 12.07010 
1 1 1    8    1   13 o  423.568   4.7495  137.333   3.0792  137.534   3.9778  137.033   4.8639  423.849   6.1314  423.040   7.5117 0.8090210 9.696379 
1 1 1    8    1   14 o  242.308   4.0962   44.941   1.5192   44.734   2.1709   45.140   2.1268  241.729   5.8674  242.826   5.7222 -1.096390 8.195703 
1 1 1    8    1   15 o  778.971   4.4847  464.481   5.3471  466.815   7.6166  462.213   7.5085  780.847   6.3728  776.992   6.3135 3.855408 8.970628 
1 1 1    8    1   16 o  521.068   3.9347  207.823   3.1381  203.739   4.4170  211.986   4.4593  515.882   5.5938  526.221   5.5364 -10.33923 7.870321 
1 1 1    8    1   17 o  395.753   3.9950  119.882   2.4200  119.201   3.4531  120.539   3.3924  394.596   5.7173  396.807   5.5855 -2.211273 7.992822 
1 1 1    8    1   18 o  840.646   5.5084  540.988   7.0877  546.639   10.123  535.554   9.9267  844.905   7.8279  836.300   7.7548 8.605652 11.01875 
1 1 1    8    1   19 o  939.681   6.4294  676.011   9.2474  680.123   12.016  670.038   14.483  942.421   8.3297  935.276   10.117 7.145020 13.10471 
1 1 1    8    1   20 o  1131.65   5.7605  980.334   9.9779  985.039   14.201  975.746   14.023  1134.21   8.1800  1128.85   8.1156 5.358032 11.52285 
1 1 1    8    1   21 o  150.754   7.1355   17.399   1.6465   17.616   2.3748   17.199   2.2849  151.307   10.315  149.522   10.042 1.785599 14.39602 
1 1 1    8    1   22 o  786.530   4.7798  473.515   5.7543  470.992   8.1297  476.048   8.1459  784.374   6.7714  788.574   6.7488 -4.199951 9.560259 
1 1 1    8    1   23 o  970.157   5.3296  720.436   7.9141  727.404   11.293  713.710   11.094  974.755   7.5690  965.539   7.5069 9.216064 10.66036 
1 1 1    8    1   24 o  700.760   4.7218  375.864   5.0646  362.729   7.0256  390.074   7.3077  688.365   6.6680  713.840   6.6882 -25.47473 9.444258 
1 1 1    8    1   25 o  594.015   6.6198  270.107   6.0189  272.628   8.7123  267.806   8.3248  596.706   9.5390  591.416   9.1963 5.290527 13.25009 
1 1 1    8    1   26 o  1481.10   7.6806  1679.35   17.412  1683.90   26.727  1676.00   22.950  1482.79   11.776  1479.45   10.135 3.339722 15.53692 
1 1 1    8    1   27 o  486.189   4.9195  180.928   3.6610  185.340   5.3093  176.930   5.0549  492.046   7.0496  480.756   6.8694 11.28998 9.843013 
1 1 1    8    1   28 o  1168.89   6.1627  1045.88   11.026  1070.79   15.991  1023.30   15.223  1182.59   8.8344  1156.08   8.6029 26.50378 12.33112 
1 1 1    8    1   29 o  525.604   5.1357  211.460   4.1317  208.626   5.8757  214.231   5.8110  522.025   7.3536  528.996   7.1768 -6.970642 10.27531 
1 1 1    8    1   30 o  505.721   5.3495  195.770   4.1409  194.063   5.9314  197.392   5.7837  503.461   7.6970  507.767   7.4416 -4.305939 10.70615 
1 1 1    8    1   31 o  176.395   13.767   23.990   3.6876   26.792   4.8114   20.000   5.7409  186.130   17.079  159.529   24.277 26.60101 29.68246 
1 1 1    8    1   32 o  423.424   6.4875  137.256   4.2046  143.129   6.5057  133.043   5.5100  432.296   9.8320  416.823   8.6363 15.47330 13.08640 
1 1 1    8    1   33 o  1381.69   7.0507  1461.63   14.911  1466.14   21.138  1457.17   21.038  1383.53   9.9817  1379.29   9.9650 4.240601 14.10445 
1 1 1    8    1   34 o  365.356   7.1662  102.206   4.0075  104.822   5.7175   99.679   5.6188  369.918   10.098  360.727   10.176 9.191559 14.33625 
1 1 1    8    1   35 o  530.649   6.1541  215.584   4.9986  220.125   7.1404  211.221   6.9997  536.108   8.7017  525.153   8.7081 10.95526 12.31061 
1 1 1    8    1   36 o  382.784   7.6979  112.209   4.5102  105.039   6.8025  117.834   6.0248  370.179   12.006  392.172   10.037 -21.99295 15.64849 
1 1 1    8    1   37 o  487.584   8.2582  182.098   6.1632  179.833   8.2821  184.910   9.2262  484.371   11.171  491.082   12.274 -6.710968 16.59674 
1 1 1    8    1   38 o  623.643   6.3343  297.825   6.0465  294.036   9.1228  300.793   8.0748  619.430   9.6221  626.604   8.4191 -7.174133 12.78538 
1 1 1    8    1   39 o   67.104   25.032   2.6421   3.4498   3.8070   4.9867   1.5727   4.7776   80.442   30.078   70.167   28.483 10.27487 41.42453 
1 1 1    8    1   40 f  297.822   8.6168   67.979   3.9280   72.163   5.6903   64.170   5.4290  306.638   12.124  289.146   12.267 17.49139 17.24704 
1 1 1    8    1   41 o  635.923   6.0014  309.738   5.8415  308.736   8.3378  310.704   8.1866  634.630   8.5834  636.671   8.4007 -2.041565 12.01028 
1 1 1    8    1   42 f  254.771   9.3624   49.785   3.6509   47.980   5.1766   51.571   5.1499  249.438   13.610  258.708   13.047 -9.269547 18.85375 
1 1 1    8    1   43 o  122.943   25.710   12.209   4.6824   13.139   6.3822   11.124   6.8909  126.745   32.686  117.709   35.383 9.035835 48.16953 
1 1 1    8    1   44 o  559.781   6.1701  240.107   5.2866  244.898   7.5480  235.493   7.4068  564.995   8.7280  554.039   8.7342 10.95514 12.34763 
1 1 1    8    1   45 f  488.880   6.3987  183.181   4.7881  185.072   6.8224  181.345   6.7216  491.034   9.0773  486.071   9.0344 4.962555 12.80694 
1 1 1    8    1   46 o  735.862   6.0549  415.020   6.8198  421.599   9.8326  408.921   9.4671  741.103   8.6680  729.923   8.4737 11.17950 12.12177 
1 1 1    8    1   47 o  226.467   10.477   39.443   3.6317   41.989   5.2087   37.034   5.0662  232.665   14.702  218.331   15.256 14.33377 21.18681 
1 1 1    8    1   48 o  113.767   24.617   10.574   4.1623   16.792   6.1433   5.2968   5.6592  142.792   29.095   88.225   32.210 54.56731 43.40508 
1 1 1    8    1   49 f  548.135   7.2606  230.615   6.0916  235.585   8.7139  225.865   8.5190  553.194   10.291  541.667   10.275 11.52686 14.54255 
1 1 1    8    1   50 o  212.717   11.707   35.026   3.7971   29.414   5.3850   40.577   5.3551  193.200   18.434  228.084   15.430 -34.88405 24.03911 
1 1 1    8    1   51 o  293.992   9.2726   66.529   4.1726   72.671   5.9572   60.614   5.8463  306.495   12.698  279.681   13.657 26.81345 18.64824 
1 1 1    8    1   52 o  205.469   12.223   32.769   3.8269   40.257   5.4789   25.637   5.3475  226.770   15.885  179.515   19.790 47.25536 25.37714 
1 1 1    8    1   53 o  228.876   11.420   40.497   4.0006   38.736   5.6594   42.255   5.6560  221.969   16.781  232.153   16.015 -10.18460 23.19694 
1 1 1    8    1   54 o  359.452   9.1179   99.573   5.0166   96.197   7.5044  102.300   6.7451  351.679   13.941  363.374   12.127 -11.69440 18.47786 
1 1 1    8    1   55 o  176.877   18.603   24.938   4.9610   26.294   6.2291   22.586   8.2037  179.768   23.178  160.961   34.345 18.80708 41.43422 
1 1 1    8    1   56 o  106.799   24.897   9.5917   3.9949   13.830   5.5577   5.0604   5.7462  127.017   29.198   85.437   32.220 41.57957 43.48120 
1 1 1    8    1   57 o  233.296   12.215   42.418   4.3466   39.830   6.1265   45.040   6.1678  223.678   18.048  238.439   17.011 -14.76024 24.80184 
1 1 1    8    1   58 o  122.617   23.207   12.557   4.1961   9.6532   5.9165   15.495   5.9519  105.043   33.015  133.349   29.899 -28.30613 44.54167 
1 1 1    8    1   59 o   87.235   30.083   6.2527   4.8737  -0.5813   6.8050   13.450   6.9834   70.903   31.459  121.005   35.434 -50.10213 47.38407 
1 1 1    8    1   60 o  106.114   25.130   9.7349   4.0186   8.9433   5.3916   10.724   6.0278  100.142   31.524  108.438   33.201 -8.296486 45.78268 
1 1 1    8    1   61 o   69.743   25.988   3.5155   3.7164   4.4333   5.3398   2.6534   5.1756   79.212   30.756   71.905   29.469 7.307007 42.59505 
1 1 1    8    1   62 o   70.089   25.972   3.6845   3.7014   1.6211   5.4039   5.5082   5.0804   68.793   29.279   82.284   30.440 -13.49081 42.23571 
1 1 1    8    1   63 o  203.555   12.455   32.845   3.8619   36.315   5.5216   29.522   5.4034  210.809   17.264  188.729   18.962 22.08032 25.64324 
1 1 1    8    1   64 o  160.032   15.135   20.802   3.6634   12.554   5.1391   29.324   5.2236  115.101   29.141  187.747   18.414 -72.64624 34.47186 
1 1 1    8    2    1 o  697.599   7.6712  372.553   8.1910  367.805   11.467  377.499   11.704  693.033   10.810  702.103   10.891 -9.070129 15.34512 
1 1 1    8    2    2 o  330.199   5.9812   83.459   3.0230   84.733   4.3472   82.267   4.2065  332.675   8.5374  327.801   8.3839 4.874115 11.96560 
1 1 1    8    2    3 o  650.073   7.5505  323.518   7.5129  317.829   10.494  329.500   10.761  644.234   10.642  655.952   10.717 -11.71832 15.10377 
1 1 1    8    2    4 o  2077.15   18.479  3308.21   58.752  3239.47   80.794  3385.35   85.589  2053.65   25.703  2099.09   26.639 -45.44775 37.01725 
1 1 1    8    2    5 o  205.504   6.5165   32.329   2.0498   27.519   2.7214   38.635   3.1162  189.580   9.3783  224.630   9.0634 -35.04985 13.04216 
1 1 1    8    2    6 o  1159.25   7.8927  1028.85   14.005  1019.28   27.533  1032.19   16.266  1153.23   15.598  1161.06   9.1529 -7.828247 18.08534 
1 1 1    8    2    7 o   57.204   9.4762   2.5726   0.8007   3.2046   1.7912   2.4147   0.8951   63.734   17.720   55.180   10.984 8.553616 20.84829 
1 1 1    8    2    8 o  957.485   5.1919  701.743   7.6090  710.153   11.750  695.670   9.9853  963.092   7.9709  953.272   6.8434 9.820374 10.50563 
1 1 1    8    2    9 o  1311.41   6.1989  1316.53   12.443  1328.49   17.779  1305.04   17.420  1317.18   8.8186  1305.51   8.7179 11.67200 12.40032 
1 1 1    8    2   10 f  600.321   4.0801  275.841   3.7491  274.561   4.9366  277.586   5.7627  598.900   5.3853  602.167   6.2523 -3.267761 8.251796 
1 1 1    8    2   11 o  678.520   4.3224  352.394   4.4891  356.188   6.9158  349.632   5.9013  682.096   6.6241  675.820   5.7049 6.276489 8.742125 
1 1 1    8    2   12 o  845.284   4.8925  546.932   6.3300  545.979   8.4011  548.184   9.6278  844.482   6.4995  846.138   7.4339 -1.656067 9.874468 
1 1 1    8    2   13 f  451.156   4.2903  155.800   2.9627  156.094   4.2295  155.516   4.1514  451.543   6.1196  450.709   6.0177 0.8332825 8.582626 
1 1 1    8    2   14 o  1038.80   5.6606  826.111   9.0005  826.286   11.914  825.880   13.737  1038.80   7.4931  1038.45   8.6425 0.3463135 11.43848 
1 1 1    8    2   15 o  1037.38   5.3191  823.835   8.4460  833.852   12.092  814.294   11.802  1043.52   7.5705  1031.22   7.4772 12.30322 10.64054 
1 1 1    8    2   16 o  441.522   3.8681  149.213   2.6141  150.698   3.7691  147.838   3.6286  443.678   5.5501  439.451   5.3946 4.226898 7.739881 
1 1 1    8    2   17 o  1152.10   6.1646  1016.20   10.871  1025.17   16.796  1009.74   14.261  1156.88   9.4852  1148.28   8.1139 8.602661 12.48217 
1 1 1    8    2   18 o  519.131   4.3297  206.285   3.4404  207.106   4.6035  205.247   5.1778  520.128   5.7824  517.766   6.5334 2.361450 8.724801 
1 1 1    8    2   19 o  1625.99   9.5802  2024.94   23.843  2021.25   30.693  2030.57   37.863  1624.09   12.347  1627.29   15.201 -3.200684 19.58386 
1 1 1    8    2   20 o  399.825   4.2321  122.360   2.5900  124.666   3.7266  120.205   3.6021  403.546   6.0333  396.263   5.9388 7.282990 8.465792 
1 1 1    8    2   21 o  492.910   4.2777  185.964   3.2274  187.211   4.5836  184.739   4.5451  494.527   6.0554  491.252   6.0446 3.275665 8.556046 
1 1 1    8    2   22 o  584.355   4.4164  261.364   3.9502  259.051   5.5709  263.703   5.6020  581.727   6.2566  586.928   6.2358 -5.200500 8.833463 
1 1 1    8    2   23 o  230.129   5.6791   40.538   2.0004   39.577   2.8739   41.442   2.7862  227.360   8.2581  232.660   7.8239 -5.299576 11.37588 
1 1 1    8    2   24 o  338.710   6.1353   87.818   3.1808   89.561   5.1132   86.718   4.0625  342.001   9.7679  336.560   7.8860 5.440643 12.55390 
1 1 1    8    2   25 o  1420.60   7.9944  1545.00   17.383  1533.74   24.419  1556.56   24.752  1415.18   11.273  1425.66   11.343 -10.48206 15.99182 
1 1 1    8    2   26 f  938.212   5.7616  673.780   8.2739  689.505   12.972  662.995   10.743  948.979   8.9304  930.614   7.5420 18.36505 11.68907 
1 1 1    8    2   27 o  1016.26   5.6678  790.549   8.8163  799.983   12.678  781.714   12.269  1022.22   8.1026  1010.48   7.9324 11.73193 11.33911 
1 1 1    8    2   28 o  978.793   5.6223  733.334   8.4231  734.024   12.004  732.664   11.823  979.161   8.0092  978.259   7.8957 0.9024658 11.24674 
1 1 1    8    2   29 o  590.717   5.1297  267.097   4.6381  269.544   6.6526  264.783   6.4697  593.366   7.3248  588.105   7.1872 5.260620 10.26203 
1 1 1    8    2   30 o  696.811   5.5668  371.672   5.9373  361.687   8.9965  379.377   7.9026  687.290   8.5520  703.943   7.3344 -16.65277 11.26631 
1 1 1    8    2   31 f  622.174   6.7831  296.351   6.4597  301.311   8.3751  289.068   10.149  627.290   8.7228  614.325   10.793 12.96552 13.87750 
1 1 1    8    2   32 o  828.876   5.9524  525.942   7.5518  523.907   11.550  527.462   9.9808  827.117   9.1231  829.988   7.8564 -2.870789 12.03970 
1 1 1    8    2   33 o  802.456   5.6350  492.945   6.9213  495.933   9.8809  490.067   9.6980  804.774   8.0214  800.006   7.9199 4.768005 11.27245 
1 1 1    8    2   34 o  568.795   5.9283  247.680   5.1613  254.856   7.5081  241.250   7.1067  576.879   8.5031  561.279   8.2722 15.60052 11.86299 
1 1 1    8    2   35 o  196.754   11.914   29.777   3.5712   36.789   5.1445   23.257   4.9612  218.443   15.487  172.974   19.055 45.46883 24.55464 
1 1 1    8    2   36 o  626.019   5.9346  300.043   5.6866  298.945   8.1585  301.081   7.9304  624.742   8.5318  626.986   8.2636 -2.243225 11.87760 
1 1 1    8    2   37 f  723.683   7.3972  401.084   8.1938  399.301   10.809  403.492   12.564  721.888   9.7820  725.520   11.314 -3.631897 14.95635 
1 1 1    8    2   38 o  706.147   6.3150  381.839   6.8256  376.690   10.435  385.690   9.0238  701.092   9.7240  709.549   8.3088 -8.457275 12.79030 
1 1 1    8    2   39 o  867.888   6.0374  576.811   8.0201  571.575   11.345  582.042   11.339  863.669   8.5823  871.551   8.4999 -7.882446 12.07905 
1 1 1    8    2   40 o  141.232   16.559   15.553   3.5117   19.088   5.0474   12.237   4.8889  155.750   21.767  123.285   26.682 32.46546 34.43460 
1 1 1    8    2   41 o  439.597   6.7968  148.046   4.5733  143.146   6.4148  153.111   6.5217  432.030   9.7007  446.831   9.5356 -14.80093 13.60260 
1 1 1    8    2   42 o  228.877   10.906   40.212   3.8207   35.521   5.7206   43.990   5.1336  213.885   17.631  238.734   14.112 -24.84940 22.58300 
1 1 1    8    2   43 o  112.850   25.206   10.303   4.2440   16.718   5.3398  -0.6995   6.9933  144.537   25.044   75.481   32.728 69.05673 41.21056 
1 1 1    8    2   44 o  412.650   6.9722  130.521   4.4037  132.111   6.2962  128.999   6.1616  414.824   9.9162  409.922   9.8203 4.902344 13.95594 
1 1 1    8    2   45 o  328.147   7.9386   82.596   3.9873   77.630   5.6678   87.463   5.6105  317.713   11.655  337.342   10.866 -19.62878 15.93437 
1 1 1    8    2   46 o  410.320   7.0273  129.106   4.4135  127.621   6.2349  130.599   6.2483  407.539   9.9952  412.282   9.9014 -4.742950 14.06919 
1 1 1    8    2   47 o  133.840   16.646   14.084   3.3363   14.926   4.8043   13.301   4.6367  136.057   23.944  128.116   24.538 7.940796 34.28471 
1 1 1    8    2   48 o  221.488   13.531   38.027   4.5651   34.987   6.6624   40.717   6.2676  210.531   20.953  228.104   18.100 -17.57292 27.68848 
1 1 1    8    2   49 o  211.729   11.955   34.690   3.8584   32.684   5.3291   36.900   5.5936  204.282   17.203  217.211   16.959 -12.92822 24.15698 
1 1 1    8    2   50 o  367.706   8.1570  103.905   4.5909  102.889   6.9111  104.708   6.1419  364.925   12.373  368.529   10.888 -3.603821 16.48166 
1 1 1    8    2   51 o   49.102   22.093  -1.5281   3.4829   0.6903   5.0982  -3.4695   4.7693   67.501   28.572   53.643   24.781 13.85771 37.82141 
1 1 1    8    2   52 o  165.075   14.683   21.339   3.6712   23.503   5.3216   19.373   5.0712  171.484   20.693  155.044   21.985 16.44009 30.19147 
1 1 1    8    2   53 o  357.212   8.3427   98.184   4.5614   98.265   6.6535   98.113   6.2656  356.266   12.201  356.221   11.491 0.4541016E-01 16.76083 
1 1 1    8    2   54 o  202.165   13.866   31.927   4.2648   39.127   6.6600   26.922   5.5526  221.668   19.839  183.480   20.101 38.18837 28.24206 
1 1 1    8    2   55 o   61.431   26.381   0.2047   4.4587   0.9742   5.9719  -0.7645   6.7021   72.370   30.790   71.339   31.457 1.030830 44.01788 
1 1 1    8    2   56 o  459.789   7.7215  162.737   5.4341  169.563   7.8040  156.312   7.5712  467.988   10.895  449.275   11.010 18.71292 15.48912 
1 1 1    8    2   57 o  137.462   20.631   15.395   4.2068   12.172   5.9813   18.550   5.9179  117.713   32.246  148.208   27.085 -30.49504 42.11147 
1 1 1    8    2   58 o  291.122   10.686   65.725   4.7619   61.951   6.7143   69.545   6.7545  280.103   15.724  297.659   14.825 -17.55597 21.61122 
1 1 1    8    2   59 o   94.283   29.818   7.6675   4.8194   13.292   7.0024   2.6057   6.6430  120.231   35.561   78.748   32.930 41.48286 48.46632 
1 1 1    8    2   60 o  168.871   16.389   22.868   4.1830   22.947   5.6247   22.770   6.2570  165.799   22.765  163.235   25.908 2.564392 34.48870 
1 1 1    8    2   61 o  189.193   14.655   28.486   4.2108   31.826   6.5207   26.097   5.5149  195.410   22.195  177.745   20.656 17.66418 30.31948 
1 1 1    8    2   62 o   80.019   26.078   5.5036   3.6668   1.6614   5.1651   9.4074   5.2063   67.819   28.735  100.951   30.847 -33.13223 42.15761 
1 1 1    8    2   63 o   58.591   24.283   1.4780   3.5667   8.8098   5.1691  -5.1847   4.9276   96.717   30.912   48.873   23.363 47.84396 38.74806 
1 1 1    8    2   64 o  153.039   16.006   19.169   3.6938   18.098   5.1437   20.309   5.3079  142.885   24.395  152.189   23.546 -9.304672 33.90478 
1 1 1    8    3    0 o  1729.26   22.022  2292.66   58.268  2292.66   58.268  2292.66   58.268  1729.26   22.022  1729.26   22.022 0.000000 0.000000 
1 1 1    8    3    1 o  1462.66   10.945  1638.36   24.504  1604.71   29.247  1717.61   44.886  1447.35   13.202  1496.54   19.595 -49.19861 23.62744 
1 1 1    8    3    2 o  1348.12   12.527  1392.09   25.849  1414.56   37.269  1371.27   35.883  1358.34   17.925  1337.44   17.528 20.89636 25.07110 
1 1 1    8    3    3 o  877.771   9.0468  589.929   12.155  585.966   17.111  593.965   17.269  874.619   12.781  880.567   12.813 -5.948181 18.09770 
1 1 1    8    3    4 o  714.865   8.0639  391.245   8.8235  373.358   11.997  412.322   13.023  698.212   11.226  733.724   11.596 -35.51147 16.13934 
1 1 1    8    3    5 o  678.528   7.9265  352.480   8.2323  337.782   11.297  369.122   12.021  664.113   11.113  694.230   11.313 -30.11700 15.85851 
1 1 1    8    3    6 o  1654.50   12.289  2096.85   31.120  2061.14   52.681  2116.00   38.569  1638.92   21.000  1661.64   15.165 -22.72424 25.90344 
1 1 1    8    3    7 o  893.044   7.6317  610.582   10.432  596.601   17.424  618.394   13.024  882.460   12.900  898.649   9.4687 -16.18964 16.00199 
1 1 1    8    3    8 o  1620.69   8.5551  2011.17   21.222  1974.30   29.319  2051.75   30.759  1605.40   11.931  1636.54   12.279 -31.13867 17.12135 
1 1 1    8    3    9 o  469.032   4.0116  168.382   2.8800  162.139   3.9739  175.287   4.1797  460.231   5.6412  478.526   5.7065 -18.29514 8.024129 
1 1 1    8    3   10 o  690.074   4.3183  364.495   4.5612  365.330   6.9853  363.875   6.0223  690.799   6.6063  689.451   5.7067 1.348022 8.729857 
1 1 1    8    3   11 o  1044.35   5.5994  834.920   8.9507  825.338   13.506  842.425   11.953  1038.17   8.4991  1048.94   7.4447 -10.76233 11.29858 
1 1 1    8    3   12 o  542.440   4.0004  225.219   3.3214  220.725   4.3886  231.243   5.0816  536.971   5.3396  549.598   6.0407 -12.62653 8.062284 
1 1 1    8    3   13 o  100.932   7.0894   7.8384   1.0883   10.889   1.7889   6.0459   1.3712  118.815   9.9274   88.235   10.350 30.58087 14.34126 
1 1 1    8    3   14 o  624.651   4.3431  298.671   4.1525  308.020   5.6039  287.288   6.1838  634.308   5.7720  612.559   6.5954 21.74823 8.764392 
1 1 1    8    3   15 o  954.579   5.3921  697.571   7.8784  703.024   10.509  690.576   11.904  958.197   7.1656  949.602   8.1900 8.595154 10.88214 
1 1 1    8    3   16 o  100.572   8.7601   7.8054   1.3350   9.4575   1.9240   6.2715   1.8540  110.494   11.547   89.370   14.014 21.12423 18.15850 
1 1 1    8    3   17 o  474.617   3.9419  172.421   2.8637  170.601   4.0525  174.236   4.0472  472.070   5.6084  477.074   5.5425 -5.003906 7.885034 
1 1 1    8    3   18 o  186.479   6.3107   26.623   1.8012   30.411   2.6966   23.571   2.4204  199.270   8.8411  175.198   9.0569 24.07150 12.65666 
1 1 1    8    3   19 o  436.655   4.7158  145.947   3.1518  146.449   4.4199  145.428   4.4958  437.366   6.6023  435.836   6.7393 1.530609 9.434429 
1 1 1    8    3   20 o  889.658   4.9873  605.851   6.7914  599.309   9.5254  612.616   9.6855  884.760   7.0338  894.526   7.0739 -9.766724 9.975701 
1 1 1    8    3   21 o  416.157   4.3278  132.559   2.7567  129.929   3.9299  135.107   3.8681  411.980   6.2321  420.113   6.0153 -8.133270 8.661558 
1 1 1    8    3   22 o  820.014   4.8623  514.690   6.1029  512.588   8.6223  516.799   8.6392  818.279   6.8842  821.634   6.8695 -3.355225 9.725336 
1 1 1    8    3   23 o  1724.63   8.0309  2277.13   21.200  2283.32   30.084  2271.03   29.879  1726.65   11.383  1722.00   11.336 4.645386 16.06489 
1 1 1    8    3   24 o  1366.72   7.7437  1430.01   16.199  1422.30   22.747  1437.95   23.076  1362.81   10.905  1370.29   11.002 -7.472412 15.49045 
1 1 1    8    3   25 o  488.343   4.9344  182.535   3.6884  179.070   4.8953  187.084   5.6097  483.661   6.6125  494.352   7.4136 -10.69070 9.934139 
1 1 1    8    3   26 o  1216.99   6.6935  1133.76   12.468  1119.29   18.902  1144.90   16.589  1209.01   10.214  1222.85   8.8631 -13.83777 13.52365 
1 1 1    8    3   27 o  1046.69   5.7661  838.599   9.2378  850.743   13.310  827.313   12.831  1054.14   8.2494  1039.53   8.0642 14.60815 11.53625 
1 1 1    8    3   28 o  757.686   5.1164  439.426   5.9337  441.471   8.5289  437.507   8.2605  759.385   7.3377  755.975   7.1389 3.410339 10.23745 
1 1 1    8    3   29 o  658.012   5.0999  331.420   5.1365  330.756   7.3588  332.051   7.1730  657.296   7.3143  658.587   7.1157 -1.291138 10.20454 
1 1 1    8    3   30 o  889.909   5.8655  606.223   7.9896  604.326   12.234  607.633   10.550  888.375   8.9971  890.867   7.7370 -2.491333 11.86626 
1 1 1    8    3   31 o  858.383   6.9879  564.101   9.1812  564.320   11.824  563.769   14.571  858.449   8.9984  857.899   11.096 0.5505981 14.28635 
1 1 1    8    3   32 o  939.439   6.6614  675.660   9.5787  672.377   13.513  678.975   13.580  936.990   9.4223  941.577   9.4223 -4.586426 13.32519 
1 1 1    8    3   33 o  1006.25   5.9815  775.146   9.2127  778.619   13.189  771.836   12.874  1008.34   8.5453  1003.95   8.3780 4.389709 11.96716 
1 1 1    8    3   34 o  780.360   5.7361  466.188   6.8514  464.473   9.8962  467.767   9.4950  778.794   8.3018  781.572   7.9370 -2.778259 11.48548 
1 1 1    8    3   35 o  218.489   10.757   36.577   3.5975   33.235   5.3138   39.405   4.8882  207.411   16.884  226.238   14.188 -18.82701 22.05399 
1 1 1    8    3   36 o  292.082   10.004   65.364   4.4723   62.642   7.0206   67.222   5.8019  285.228   16.147  296.100   12.801 -10.87167 20.60606 
1 1 1    8    3   37 o  1241.32   8.5504  1180.35   16.246  1178.06   21.188  1183.62   25.306  1239.71   11.166  1242.21   13.309 -2.504150 17.37317 
1 1 1    8    3   38 o  130.590   18.928   13.389   3.6731   18.840   5.7834   9.7043   4.7552  154.200   25.387  109.892   28.146 44.30859 37.90446 
1 1 1    8    3   39 o   95.991   23.489   7.4002   3.4231   6.9990   4.9580   7.7657   4.7318   95.566   30.246   99.187   29.203 -3.620605 42.04305 
1 1 1    8    3   40 o  357.193   7.6555   97.757   4.1855   98.823   6.1167   96.818   5.7396  358.904   11.134  355.289   10.554 3.614716 15.34181 
1 1 1    8    3   41 o  156.163   14.727   18.919   3.4785   18.646   5.0961   19.157   4.7598  153.682   22.317  156.198   20.396 -2.515457 30.23305 
1 1 1    8    3   42 f  116.304   20.374   10.760   3.4947   11.426   5.4435   10.293   4.5581  118.562   29.978  112.723   26.809 5.839096 40.21732 
1 1 1    8    3   43 o  684.338   7.6344  359.020   7.9968  356.307   10.149  363.462   12.987  681.387   9.7311  687.620   12.339 -6.232605 15.71458 
1 1 1    8    3   44 o  141.982   16.104   15.752   3.4378   8.5158   4.7796   23.509   4.9483  102.691   29.086  173.257   18.969 -70.56594 34.72519 
1 1 1    8    3   45 o  235.303   10.108   42.531   3.6407   47.557   5.2434   37.852   5.0590  248.034   13.867  220.987   15.046 27.04695 20.46128 
1 1 1    8    3   46 o  548.726   6.3928  230.819   5.3693  225.631   7.7001  235.729   7.4909  542.027   9.2812  554.114   8.8322 -12.08704 12.81200 
1 1 1    8    3   47 o  595.672   6.2207  272.028   5.6718  275.731   8.1980  268.629   7.8552  599.154   8.9392  591.448   8.6770 7.705322 12.45791 
1 1 1    8    3   48 o  144.127   21.085   16.573   4.5139   18.644   6.8447   14.979   6.0047  150.047   30.834  134.437   29.948 15.61026 42.98407 
1 1 1    8    3   49 o  261.856   10.038   52.776   4.0234   57.376   5.6848   48.159   5.6950  272.033   13.697  248.833   15.023 23.20084 20.32957 
1 1 1    8    3   50 o  134.773   18.538   14.447   3.7229   11.985   5.6775   16.305   4.9309  119.409   30.846  141.823   23.541 -22.41336 38.80213 
1 1 1    8    3   51 o   54.977   23.517   0.0746   3.5179  -2.5936   5.2227   2.2907   4.7596   58.850   26.711   71.386   28.621 -12.53602 39.14878 
1 1 1    8    3   52 o   51.263   22.606  -0.8015   3.4614   1.1663   5.0358  -2.5640   4.7658   68.589   28.676   55.737   25.382 12.85191 38.29549 
1 1 1    8    3   53 o  106.374   22.918   9.3315   3.6215   9.8844   5.1849   8.8049   5.0604  108.112   30.180  102.459   30.209 5.652863 42.70178 
1 1 1    8    3   54 o  117.899   24.462   11.540   4.2697   2.9874   6.0188   20.203   6.0579   79.313   32.048  156.214   26.268 -76.90094 41.43795 
1 1 1    8    3   55 o  189.604   15.681   28.310   4.5101   24.951   5.7887   33.499   7.1946  175.519   22.033  202.952   23.601 -27.43355 32.28687 
1 1 1    8    3   56 o  145.723   18.618   17.047   4.0579   11.837   5.6763   22.493   5.8032  116.782   31.173  165.597   23.560 -48.81467 39.07445 
1 1 1    8    3   57 o  405.854   8.4373  127.016   5.2413  122.808   7.5091  131.014   7.3192  397.371   12.346  410.798   11.640 -13.42691 16.96819 
1 1 1    8    3   58 o  177.022   16.407   24.929   4.3949   27.053   6.2593   22.863   6.1722  181.257   23.085  165.345   25.184 15.91165 34.16365 
1 1 1    8    3   59 o   88.193   29.900   6.4803   4.8107   6.4914   6.9476   6.4701   6.6678   92.442   35.292   91.735   34.680 0.7073822 49.47939 
1 1 1    8    3   60 o  117.758   23.345   11.781   4.0591   5.2456   5.3743   20.460   6.1934   83.083   31.194  153.657   27.335 -70.57427 41.47628 
1 1 1    8    3   61 o   89.863   26.888   7.0723   3.9861   10.193   6.2288   4.9076   5.1874  104.986   33.973   80.656   30.566 24.32990 45.69957 
1 1 1    8    3   62 o   84.833   25.870   6.3184   3.6643   11.303   5.2515   1.5892   5.1153  110.568   30.184   67.299   28.560 43.26938 41.55422 
1 1 1    8    3   63 o   71.058   25.594   4.0820   3.5562   3.2892   4.9867   4.9024   5.0727   71.918   29.133   78.549   30.116 -6.630249 41.90083 
1 1 1    8    3   64 o   74.286   25.961   4.7489   3.6353   3.8468   5.4034   5.4949   4.9135   74.444   30.264   79.893   29.860 -5.449097 42.51534 
1 1 1    8    4    0 o  289.009   5.6999   64.004   2.5192   64.004   2.5192   64.004   2.5192  289.009   5.6999  289.009   5.6999 0.000000 0.000000 
1 1 1    8    4    1 o  796.344   8.3652  485.527   10.196  481.967   14.294  489.214   14.549  793.266   11.773  799.201   11.893 -5.935242 16.73461 
1 1 1    8    4    2 o  178.898   6.7480   24.500   1.8478   22.409   2.5776   26.710   2.6502  170.782   9.9032  186.772   9.2703 -15.99017 13.56508 
1 1 1    8    4    3 o  1197.02   11.419  1097.41   20.922  1112.45   30.053  1083.27   29.145  1204.72   16.298  1188.85   16.016 15.87170 22.85053 
1 1 1    8    4    4 o  738.448   8.2483  417.498   9.3230  411.663   13.031  423.616   13.344  733.125   11.613  743.687   11.722 -10.56146 16.50064 
1 1 1    8    4    5 o  1307.96   12.361  1310.48   24.747  1303.51   34.795  1317.62   35.204  1303.88   17.434  1310.90   17.545 -7.026245 24.73418 
1 1 1    8    4    6 o  850.276   12.830  553.872   16.698   0.0000   0.0000  553.872   16.698  ?   ?   850.276   12.830 0.000000 12.83003 
1 1 1    8    4    7 o  793.574   6.1716  482.084   7.4964  471.147   10.453  493.666   10.756  784.423   8.7062  802.948   8.7520 -18.52502 12.34485 
1 1 1    8    4    8 o  1090.24   6.7303  909.962   11.231  902.437   17.519  915.213   14.634  1085.48   10.544  1093.27   8.7453 -7.788330 13.69892 
1 1 1    8    4    9 o  333.865   4.2493   85.318   2.1715   86.857   3.2798   84.116   2.8975  336.836   6.3615  331.488   5.7106 5.347931 8.548665 
1 1 1    8    4   10 o  1073.82   6.7602  882.796   11.111  870.297   17.309  891.555   14.491  1065.92   10.609  1079.00   8.7741 -13.08984 13.76753 
1 1 1    8    4   11 o  863.946   4.9447  571.351   6.5388  555.407   9.7266  584.498   8.8325  851.693   7.4612  873.758   6.6043 -22.06512 9.964223 
1 1 1    8    4   12 o  361.172   4.0586   99.846   2.2437   99.279   3.2613  100.355   3.0916  360.115   5.9167  362.068   5.5785 -1.952881 8.131829 
1 1 1    8    4   13 f  1041.73   6.1176  830.806   9.7544  848.372   17.421  822.783   11.773  1052.29   10.816  1036.60   7.4201 15.68921 13.11642 
1 1 1    8    4   14 o  561.560   3.9042  241.378   3.3558  241.887   4.7897  240.887   4.7031  562.109   5.5670  560.948   5.4776 1.160706 7.809940 
1 1 1    8    4   15 o  650.774   4.4320  324.178   4.4147  329.807   6.8702  320.220   5.7617  656.312   6.8389  646.744   5.8203 9.568665 8.980361 
1 1 1    8    4   16 o  370.706   3.9106  105.187   2.2189  107.924   3.1910  102.625   3.0877  375.469   5.5524  366.136   5.5096 9.332764 7.822081 
1 1 1    8    4   17 o  584.455   5.2067  261.487   4.6578  268.944   6.1772  251.660   7.0912  592.677   6.8093  573.266   8.0815 19.41150 10.56777 
1 1 1    8    4   18 o  439.197   4.6312  147.652   3.1133  148.263   3.8470  146.492   5.3001  440.084   5.7110  437.391   7.9166 2.693268 9.761613 
1 1 1    8    4   19 o  327.090   4.9522   81.895   2.4793   82.076   3.3994   81.690   3.6240  327.423   6.7831  326.643   7.2484 0.7807312 9.927192 
1 1 1    8    4   20 o  630.490   4.3495  304.267   4.1975  303.141   5.9414  305.390   5.9308  629.278   6.1685  631.610   6.1347 -2.331848 8.699708 
1 1 1    8    4   21 o  551.735   4.2915  232.999   3.6241  229.779   5.1392  236.183   5.1116  547.876   6.1283  555.461   6.0122 -7.584900 8.585008 
1 1 1    8    4   22 o  901.319   5.0870  621.819   7.0179  627.906   10.024  615.965   9.8288  905.649   7.2310  896.999   7.1588 8.650146 10.17522 
1 1 1    8    4   23 o  1302.92   7.4461  1299.59   14.850  1316.89   21.321  1283.30   20.695  1311.35   10.622  1294.53   10.444 16.81836 14.89665 
1 1 1    8    4   24 o  805.680   5.3021  496.855   6.5385  489.916   9.9439  502.141   8.6784  799.954   8.1213  809.909   7.0006 -9.955444 10.72208 
1 1 1    8    4   25 o  199.558   7.2168   30.486   2.2044   29.977   3.0338   31.055   3.2084  197.603   10.064  201.111   10.459 -3.508408 14.51440 
1 1 1    8    4   26 o  870.370   5.5906  579.857   7.4479  592.542   11.755  571.348   9.6269  879.732   8.7297  863.911   7.2803 15.82184 11.36703 
1 1 1    8    4   27 o  791.252   5.0946  479.217   6.1701  488.275   8.9741  471.096   8.4971  798.632   7.3414  784.465   7.0766 14.16681 10.19678 
1 1 1    8    4   28 o  1969.21   9.0908  2969.18   27.401  2991.93   39.191  2947.43   38.325  1976.23   12.956  1961.51   12.765 14.72046 18.18818 
1 1 1    8    4   29 o  1461.74   7.6950  1635.86   17.217  1620.20   26.075  1647.96   22.924  1454.37   11.713  1466.93   10.210 -12.56055 15.53830 
1 1 1    8    4   30 o  336.340   6.3784   86.600   3.2837   84.836   4.7629   88.197   4.5332  332.844   9.3489  339.386   8.7265 -6.542145 12.78882 
1 1 1    8    4   31 o  639.242   6.2262  312.820   6.0920  324.120   8.6581  301.741   8.5731  650.597   8.6945  627.725   8.9228 22.87128 12.45832 
1 1 1    8    4   32 o  696.844   5.9326  371.735   6.3278  364.659   8.3516  381.272   9.6958  690.105   7.9065  705.599   8.9775 -15.49384 11.96284 
1 1 1    8    4   33 o  616.495   5.5745  290.948   5.2603  288.511   7.5523  293.244   7.3309  613.820   8.0384  618.846   7.7393 -5.026245 11.15854 
1 1 1    8    4   34 o  734.863   5.7117  413.414   6.4245  408.352   9.1756  418.282   8.9983  730.231   8.2092  739.071   7.9543 -8.840332 11.43077 
1 1 1    8    4   35 o  492.520   6.2326  185.721   4.6985  180.128   6.8052  190.816   6.4951  484.935   9.1683  499.144   8.5014 -14.20901 12.50321 
1 1 1    8    4   36 o   78.917   26.945   4.4143   3.9069   4.7981   6.5719   4.2045   4.8588   91.574   34.473   81.827   29.849 9.747185 45.60010 
1 1 1    8    4   37 o  307.481   8.8751   72.431   4.1770   71.842   5.7095   73.108   6.1268  306.090   12.186  308.735   12.965 -2.644409 17.79340 
1 1 1    8    4   38 f  736.426   6.2788  415.295   7.0774  404.471   10.927  423.118   9.2894  726.452   9.8268  743.177   8.1663 -16.72510 12.77716 
1 1 1    8    4   39 o  855.255   5.9792  560.149   7.8272  564.571   11.197  555.922   10.946  858.347   8.5222  851.763   8.3962 6.584412 11.96347 
1 1 1    8    4   40 o  262.052   9.4769   52.650   3.8012   44.020   5.4575   60.783   5.2976  238.824   15.006  281.389   12.300 -42.56522 19.40252 
1 1 1    8    4   41 o  399.558   6.9585  122.316   4.2556  119.441   6.2138  124.855   5.8403  394.574   10.289  403.493   9.4564 -8.919617 13.97431 
1 1 1    8    4   42 o  442.338   6.9366  149.932   4.6965  148.642   7.2638  150.859   6.1564  440.038   10.785  443.504   9.0689 -3.466156 14.09087 
1 1 1    8    4   43 o  217.913   13.392   36.670   4.4452   32.552   5.4356   44.987   7.7239  204.576   17.528  239.948   21.250 -35.37154 27.54667 
1 1 1    8    4   44 o  442.102   7.2186  149.841   4.8848  151.960   6.5445  147.175   7.3399  444.922   9.6100  437.662   10.957 7.260071 14.57405 
1 1 1    8    4   45 o  550.828   6.1635  232.530   5.1966  238.150   7.5009  227.344   7.2060  557.039   8.7975  544.281   8.6497 12.75787 12.33751 
1 1 1    8    4   46 o  194.396   11.546   29.181   3.4200   30.053   4.9657   28.393   4.7172  196.359   16.680  190.899   16.300 5.459900 23.32180 
1 1 1    8    4   47 o  366.702   7.4038  103.171   4.1557   96.420   5.9223  109.720   5.8327  353.975   10.931  377.755   10.088 -23.77951 14.87416 
1 1 1    8    4   48 o  147.684   31.072   18.102   6.8013   18.102   6.8013   0.0000   0.0000  147.684   31.072  ?   ?  0.000000 31.07206 
1 1 1    8    4   49 f  147.038   15.799   16.967   3.5000   19.660   4.9969   14.373   4.9039  156.913   21.360  132.696   25.063 24.21690 32.93011 
1 1 1    8    4   50 o   61.287   24.651   1.5254   3.5433  -0.3520   5.4054   2.9399   4.6920   66.174   28.733   73.806   28.781 -7.631828 40.66894 
1 1 1    8    4   51 o  216.306   11.479   36.228   3.7870   36.209   5.3984   36.246   5.3139  214.922   16.537  215.119   16.259 -0.1969299 23.19117 
1 1 1    8    4   52 f  151.296   16.542   18.069   3.7684   17.459   5.6167   18.569   5.0821  145.499   26.183  151.475   22.612 -5.976639 34.59560 
1 1 1    8    4   53 o  127.499   20.579   13.147   3.8792   12.683   5.8047   13.522   5.2147  121.908   31.029  126.964   27.619 -5.055649 41.54110 
1 1 1    8    4   54 o  112.301   24.748   10.510   4.1392   6.3874   5.6132   15.423   6.1280   91.222   32.229  134.392   30.490 -43.16959 44.36652 
1 1 1    8    4   55 f  120.006   24.233   11.978   4.2978   9.9466   5.3659   15.613   7.1783  107.737   30.921  133.126   34.828 -25.38908 46.57371 
1 1 1    8    4   56 o  351.485   9.1457   95.333   4.9203   94.766   6.6664   96.011   7.2924  349.206   12.472  351.000   13.573 -1.793976 18.43353 
1 1 1    8    4   57 o  223.492   12.961   39.040   4.4147   41.039   6.3863   37.211   6.1096  226.729   18.565  215.773   18.683 10.95590 26.33879 
1 1 1    8    4   58 o  347.326   9.3376   93.277   4.9641   95.593   7.0169   90.957   7.0238  349.882   13.103  341.110   13.453 8.772125 18.77892 
1 1 1    8    4   59 o  212.681   16.645   36.079   5.3752   37.314   7.4192   34.715   7.7982  212.387   23.199  203.143   25.652 9.244446 34.58646 
1 1 1    8    4   60 o  139.323   18.533   15.838   3.8541   13.527   5.4302   18.185   5.4712  123.257   29.226  145.747   25.452 -22.49048 38.75525 
1 1 1    8    4   61 o   72.024   26.680   3.8533   3.9055   2.4915   5.8465   4.9507   5.2481   73.985   30.912   80.949   30.728 -6.963242 43.58614 
1 1 1    8    4   62 o  208.300   12.487   34.279   3.9627   32.832   5.5494   35.784   5.6606  200.305   18.302  209.519   17.820 -9.214172 25.54491 
1 1 1    8    4   63 o  103.392   23.167   9.3994   3.5754   9.1344   4.9877   9.6794   5.1279   98.408   30.213  101.004   30.559 -2.596062 42.97309 
1 1 1    8    4   64 o   75.482   25.926   4.9754   3.6181   7.1500   5.3732   3.1715   4.8938   87.560   31.469   70.344   28.723 17.21558 42.60613 
1 1 1    8    5    1 o  909.139   7.4729  632.768   10.399  647.800   18.470  625.792   12.583  919.556   13.123  904.042   9.0932 15.51428 15.96532 
1 1 1    8    5    2 o  586.953   7.1862  263.742   6.4562  254.301   8.8398  274.536   9.4516  576.267   10.022  598.744   10.313 -22.47754 14.38059 
1 1 1    8    5    3 o  616.605   7.4746  291.073   7.0545  284.512   9.7591  298.253   10.209  609.517   10.461  624.053   10.688 -14.53601 14.95521 
1 1 1    8    5    4 o  193.526   7.6764   28.673   2.2739   27.105   3.1839   30.305   3.2485  187.793   11.126  198.633   10.725 -10.83990 15.45344 
1 1 1    8    5    5 o  715.530   6.7104  391.941   7.3493  394.222   9.0331  387.475   12.640  717.557   8.2245  711.237   11.611 6.320435 14.22865 
1 1 1    8    5    6 o  700.435   8.1790  375.637   8.7687  349.546   11.619  410.157   13.365  675.538   11.237  731.727   11.933 -56.18915 16.39108 
1 1 1    8    5    7 o  1129.55   11.093  977.295   19.180   0.0000   0.0000  977.295   19.180  ?   ?   1129.55   11.093 0.000000 11.09333 
1 1 1    8    5    8 f  740.159   5.9217  419.375   6.7087  424.804   9.4812  413.930   9.4939  744.843   8.3163  735.242   8.4361 9.600037 11.84607 
1 1 1    8    5    9 o  731.417   6.0320  409.537   6.7530  385.669   9.1318  438.341   10.032  709.689   8.4065  756.588   8.6627 -46.89911 12.07112 
1 1 1    8    5   10 o  276.072   4.9759   58.341   2.1027   58.998   2.8297   57.531   3.1420  277.599   6.6596  274.113   7.4886 3.486084 10.02149 
1 1 1    8    5   11 o  368.150   4.4408  103.745   2.5024  104.708   3.7953  103.004   3.3283  369.814   6.7049  366.808   5.9281 3.005737 8.949773 
1 1 1    8    5   12 o  790.010   5.5362  477.781   6.6944  488.705   10.767  470.896   8.5476  798.817   8.8056  784.224   7.1209 14.59253 11.32458 
1 1 1    8    5   13 o  269.092   4.8512   55.429   1.9981   54.832   5.3765   55.525   2.1522  267.446   13.134  269.319   5.2210 -1.873047 14.13364 
1 1 1    8    5   14 o  720.026   4.9454  396.862   5.4502  390.225   9.3273  400.304   6.7161  713.809   8.5370  723.097   6.0681 -9.287659 10.47387 
1 1 1    8    5   15 o  437.118   4.4652  146.258   2.9875  148.011   4.2460  144.540   4.2043  439.687   6.3091  434.501   6.3217 5.185547 8.931333 
1 1 1    8    5   16 o  615.678   4.1077  290.146   3.8710  293.541   5.5551  286.941   5.3971  619.219   5.8611  612.221   5.7595 6.997253 8.217287 
1 1 1    8    5   17 o  508.962   4.2749  198.281   3.3303  205.214   4.5527  190.303   4.8842  517.750   5.7449  498.567   6.4003 19.18268 8.600422 
1 1 1    8    5   18 o  947.184   5.4599  686.779   7.9157  679.206   10.371  697.349   12.252  941.862   7.1936  954.284   8.3883 -12.42206 11.05040 
1 1 1    8    5   19 o  440.815   5.2354  148.745   3.5324  151.453   4.4921  144.356   5.7181  444.783   6.5983  434.186   8.6041 10.59644 10.84290 
1 1 1    8    5   20 o  520.033   4.2028  206.992   3.3453  205.402   4.7313  208.583   4.7307  517.999   5.9673  521.995   5.9209 -3.996460 8.406336 
1 1 1    8    5   21 o  437.239   4.2403  146.328   2.8378  146.298   4.0365  146.357   3.9905  437.169   6.0323  437.259   5.9624 -0.8996582E-01 8.481668 
1 1 1    8    5   22 o  697.231   4.8926  372.095   5.2214  374.775   6.9675  368.662   7.8859  699.701   6.5057  693.945   7.4243 5.755371 9.871404 
1 1 1    8    5   23 o  511.960   4.7514  200.616   3.7233  206.636   5.8402  196.494   4.8327  519.540   7.3441  506.651   6.2318 12.88901 9.631749 
1 1 1    8    5   24 f  1224.17   6.6195  1147.15   12.403  1156.38   16.620  1135.55   18.634  1228.97   8.8352  1217.78   9.9970 11.18909 13.34166 
1 1 1    8    5   25 o  886.071   5.2414  600.951   7.1086  604.944   10.136  597.086   9.9724  888.944   7.4492  883.154   7.3772 5.790161 10.48399 
1 1 1    8    5   26 o  644.362   5.2004  317.807   5.1291  305.106   7.8200  327.396   6.7948  631.290   8.0930  653.977   6.7880 -22.68762 10.56280 
1 1 1    8    5   27 o  610.223   4.9251  285.021   4.6002  288.605   6.6528  281.737   6.3678  614.003   7.0789  606.658   6.8576 7.344604 9.855862 
1 1 1    8    5   28 o  1265.06   6.9355  1225.14   13.429  1214.62   20.336  1233.28   17.883  1259.37   10.550  1269.11   9.2062 -9.737061 14.00191 
1 1 1    8    5   29 o  910.802   5.8491  635.016   8.1542  628.571   12.369  639.970   10.844  906.034   8.9194  914.271   7.7491 -8.236816 11.81544 
1 1 1    8    5   30 o  237.771   8.6715   43.290   3.1559   48.095   4.2547   37.412   4.7056  250.579   11.093  220.503   14.015 30.07640 17.87393 
1 1 1    8    5   31 o  546.737   6.3586  228.838   5.3212  231.119   7.5276  226.560   7.5231  549.373   8.9520  543.924   9.0363 5.448792 12.71975 
1 1 1    8    5   32 o  300.528   8.0139   69.157   3.6864   73.243   4.9823   64.215   5.4797  309.220   10.527  289.486   12.367 19.73355 16.24048 
1 1 1    8    5   33 o  587.303   5.6255  264.049   5.0570  262.901   7.2651  265.128   7.0435  585.938   8.1007  588.425   7.8204 -2.487122 11.25964 
1 1 1    8    5   34 o  295.930   8.0723   67.064   3.6564   69.468   5.3497   64.956   5.0090  301.087   11.608  291.157   11.240 9.929871 16.15794 
1 1 1    8    5   35 o  795.736   6.2138  484.791   7.5683  474.317   10.099  498.210   11.431  786.962   8.3839  806.475   9.2602 -19.51257 12.49160 
1 1 1    8    5   36 o  149.983   18.226   17.535   4.0982   27.382   6.8395   12.019   5.1189  186.934   24.493  122.353   27.946 64.58141 37.16043 
1 1 1    8    5   37 o   55.323   23.587  -0.0550   3.5181  -1.8972   4.9187   1.8747   5.0341   59.798   26.627   72.922   29.365 -13.12402 39.63945 
1 1 1    8    5   38 o  544.903   6.5412  227.388   5.4556  216.539   8.4718  235.075   7.1311  531.472   10.414  553.916   8.4109 -22.44336 13.38655 
1 1 1    8    5   39 o  463.250   6.5608  164.364   4.6521  163.674   6.8329  164.961   6.3514  462.066   9.6612  463.935   8.9443 -1.869354 13.16583 
1 1 1    8    5   40 o  407.666   6.9225  127.315   4.3195  132.417   6.3120  122.822   5.9240  415.536   9.9240  400.219   9.6704 15.31714 13.85650 
1 1 1    8    5   41 o  310.814   8.4678   74.059   4.0285   71.748   6.0317   75.920   5.4127  305.586   12.896  314.492   11.244 -8.906281 17.10934 
1 1 1    8    5   42 o  455.848   6.5570  159.214   4.5750  156.290   6.4969  162.089   6.4436  451.368   9.4038  459.694   9.1578 -8.325836 13.12622 
1 1 1    8    5   43 o  164.302   16.760   21.046   4.1559   22.381   4.9648   17.921   7.5965  168.944   19.561  147.617   34.278 21.32645 39.46702 
1 1 1    8    5   44 o  146.204   16.023   16.693   3.5269   16.829   4.5943   16.497   5.5037  145.736   21.219  143.097   26.089 2.639267 33.62843 
1 1 1    8    5   45 o  202.475   10.969   31.608   3.3868   37.177   4.8514   26.315   4.7302  219.059   14.552  183.671   17.019 35.38771 22.39179 
1 1 1    8    5   46 o  286.040   8.4344   62.804   3.6928   63.120   5.3553   62.519   5.0988  286.288   12.221  284.997   11.689 1.290863 16.91085 
1 1 1    8    5   47 o   73.810   24.021   4.1588   3.1116   5.2127   4.3931   3.0979   4.4077   83.777   28.572   73.598   28.107 10.17973 40.07970 
1 1 1    8    5   48 o   91.113   27.379   6.6913   4.1265   6.3984   6.2499   6.9177   5.4943   94.579   33.945   94.866   31.955 -0.2864227 46.61956 
1 1 1    8    5   49 o  200.244   11.562   31.028   3.5286   33.359   5.1277   28.931   4.8633  206.555   16.352  192.179   16.699 14.37582 23.37218 
1 1 1    8    5   50 o   76.296   25.251   4.4674   3.4330  -2.7246   5.1705   10.137   4.5909   58.259   26.494  110.380   27.320 -52.12141 38.05716 
1 1 1    8    5   51 o  138.247   16.824   15.117   3.4867   15.868   4.9565   14.381   4.9057  139.481   24.087  132.286   25.147 7.195023 34.82197 
1 1 1    8    5   52 o  411.513   7.5493  130.150   4.7551  134.652   6.8974  126.073   6.5643  417.650   10.790  404.184   10.611 13.46597 15.13275 
1 1 1    8    5   53 o  140.857   17.912   15.802   3.7744   19.167   5.6589   13.105   5.0658  152.767   25.071  125.045   27.238 27.72195 37.02005 
1 1 1    8    5   54 o  354.947   9.4580   97.162   5.1384   94.543   7.1367   99.981   7.4044  348.804   13.367  358.646   13.488 -9.841248 18.98992 
1 1 1    8    5   55 o  108.419   26.015   9.9121   4.2620   12.635   5.4026   5.4246   6.9353  121.468   29.379   90.741   35.101 30.72686 45.77354 
1 1 1    8    5   56 o   91.068   26.363   6.9661   3.8854   2.7399   5.5426   11.050   5.4481   75.772   30.707  112.942   30.707 -37.17067 43.42610 
1 1 1    8    5   57 o  251.533   11.516   49.120   4.4339   53.419   6.4738   45.322   6.0850  259.967   16.353  239.204   16.725 20.76259 23.39103 
1 1 1    8    5   58 o  225.141   12.715   39.664   4.3636   42.690   6.4480   37.108   5.9271  230.886   18.398  215.301   18.155 15.58521 25.84768 
1 1 1    8    5   59 o   86.690   29.776   6.2138   4.7725   11.078   6.7723   1.4149   6.7265  110.360   35.394   75.495   32.412 34.86503 47.99253 
1 1 1    8    5   60 o  213.795   12.211   35.871   3.9794   35.216   5.5690   36.555   5.6883  209.094   17.563  213.031   17.603 -3.936661 24.86606 
1 1 1    8    5   61 o  119.808   23.175   12.265   4.0962   11.798   6.0384   12.663   5.5750  112.457   32.955  117.675   30.648 -5.218353 45.00364 
1 1 1    8    5   62 o   81.870   26.132   5.8521   3.6949   8.6474   5.0928   2.7455   5.3689   96.824   30.656   72.044   29.821 24.78060 42.76743 
1 1 1    8    5   63 f  190.177   13.098   28.828   3.7894   29.759   5.1434   27.722   5.6043  190.043   17.893  181.368   20.551 8.674789 27.24833 
1 1 1    8    5   64 o  196.806   16.062   31.654   4.7962   26.614   6.9445   36.251   6.6319  170.479   27.553  205.859   21.358 -35.38045 34.86208 
1 1 1    8    6    0 o  2105.06   26.414  3400.41   85.079  3400.41   85.079  3400.41   85.079  2105.06   26.414  2105.06   26.414 0.000000 0.000000 
1 1 1    8    6    1 o  319.866   4.7534   78.314   2.3272   77.815   2.8786   79.255   3.9543  318.833   5.8985  321.740   8.0296 -2.906738 9.963279 
1 1 1    8    6    2 o  510.864   5.4895  199.772   4.2925  199.456   5.1755  200.467   7.6832  510.438   6.6243  511.643   9.8109 -1.205200 11.83785 
1 1 1    8    6    3 o  486.955   5.4557  181.510   4.0664  179.764   4.8582  185.596   7.4315  484.586   6.5500  492.297   9.8623 -7.710907 11.83920 
1 1 1    8    6    4 o  274.817   6.9291   57.819   2.9147   56.357   4.0173   59.444   4.2353  271.279   9.6749  278.605   9.9317 -7.326111 13.86517 
1 1 1    8    6    5 o  748.236   8.4921  428.680   9.7258  437.921   14.031  420.133   13.493  756.063   12.125  740.563   11.904 15.50085 16.99130 
1 1 1    8    6    6 o  668.842   6.6144  342.470   6.7714  342.461   8.2986  342.488   11.714  668.780   8.1068  668.651   11.445 0.1295776 14.02537 
1 1 1    8    6    7 o  535.961   5.2930  219.885   4.3421  216.289   6.0660  223.665   6.2182  531.505   7.4563  540.489   7.5164 -8.984802 10.58738 
1 1 1    8    6    8 o  461.422   4.4995  162.969   3.1778  158.851   3.9810  170.203   5.2761  455.532   5.7095  471.489   7.3109 -15.95694 9.276197 
1 1 1    8    6    9 o  206.860   5.4129   32.757   1.7139   31.544   2.2458   34.448   2.6521  202.974   7.2287  212.100   8.1693 -9.125732 10.90833 
1 1 1    8    6   10 f  540.154   5.3302  223.350   4.4069  227.324   6.1859  219.253   6.2797  544.874   7.4171  535.104   7.6671 9.770081 10.66764 
1 1 1    8    6   11 o  569.209   5.4564  248.029   4.7539  245.537   5.4876  255.525   9.5166  566.315   6.3308  577.516   10.766 -11.20123 12.48924 
1 1 1    8    6   12 o  519.867   10.556  207.055   8.3998   0.0000   0.0000  207.055   8.3998  ?   ?   519.867   10.556 0.000000 10.55622 
1 1 1    8    6   13 o  223.878   5.1402   38.368   1.7614   34.202   4.2272   39.244   1.9376  210.811   13.167  226.412   5.5912 -15.60127 14.30450 
1 1 1    8    6   14 o  934.239   5.6946  668.177   8.1431  691.338   14.486  657.478   9.8460  949.986   9.9624  926.658   6.9418 23.32770 12.14240 
1 1 1    8    6   15 o  612.197   5.7911  286.920   5.4266  330.346   8.7191  259.463   6.9330  656.764   8.6734  582.093   7.7814 74.67053 11.65240 
1 1 1    8    6   16 o  522.850   4.5794  209.255   3.6648  208.945   5.2467  209.551   5.1213  522.410   6.5615  523.172   6.3953 -0.7627563 9.162621 
1 1 1    8    6   17 o  621.167   4.4658  295.345   4.2460  304.134   6.6937  289.428   5.4924  630.266   6.9386  614.876   5.8359 15.38995 9.066521 
1 1 1    8    6   18 f  945.168   5.8641  683.873   8.4836  700.036   14.989  676.256   10.290  956.007   10.244  939.828   7.1533 16.17944 12.49412 
1 1 1    8    6   19 o  612.117   5.4397  286.814   5.0966  287.653   6.4883  285.462   8.2354  612.972   6.9154  610.568   8.8122 2.404297 11.20168 
1 1 1    8    6   20 o  164.999   6.5590   20.841   1.6565   18.849   2.2393   23.249   2.4617  156.613   9.3847  173.996   9.2768 -17.38318 13.19594 
1 1 1    8    6   21 o  1353.35   7.0536  1402.13   14.611  1422.20   19.641  1377.26   21.864  1362.84   9.4156  1341.04   10.652 21.80066 14.21676 
1 1 1    8    6   22 o  850.092   5.7217  553.160   7.4450  563.228   10.782  543.985   10.293  857.711   8.2126  842.940   7.9774 14.77057 11.44932 
1 1 1    8    6   23 o  901.525   5.4962  622.107   7.5842  623.740   11.691  620.920   9.9659  902.609   8.4620  900.612   7.2295 1.996948 11.12977 
1 1 1    8    6   24 o  1062.41   6.0544  863.983   9.8453  866.593   13.144  860.646   14.860  1063.93   8.0713  1060.22   9.1571 3.708984 12.20648 
1 1 1    8    6   25 o  981.490   5.4855  737.363   8.2408  742.687   11.788  732.274   11.525  984.946   7.8192  978.022   7.6987 6.923828 10.97313 
1 1 1    8    6   26 o  440.129   5.3421  148.275   3.5988  152.994   5.8635  145.423   4.5584  447.023   8.5696  435.854   6.8329 11.16873 10.96020 
1 1 1    8    6   27 o  1034.96   5.7580  819.920   9.1214  815.334   12.895  824.513   12.905  1031.96   8.1634  1037.76   8.1243 -5.794312 11.51719 
1 1 1    8    6   28 o  525.071   5.3217  211.034   4.2770  222.334   6.6759  203.167   5.5703  538.883   8.0937  515.157   7.0642 23.72614 10.74294 
1 1 1    8    6   29 o  858.598   5.4246  564.293   7.1290  556.735   10.041  571.977   10.124  852.744   7.6925  864.340   7.6524 -11.59619 10.85049 
1 1 1    8    6   30 o  373.239   6.5365  106.646   3.7342  105.214   4.9753  108.494   5.6510  370.678   8.7691  376.387   9.8089 -5.708435 13.15712 
1 1 1    8    6   31 f  512.446   6.4014  201.035   5.0210  199.513   6.9338  202.714   7.2806  510.427   8.8750  514.493   9.2452 -4.066101 12.81557 
1 1 1    8    6   32 o  205.033   9.9154   32.199   3.1118   35.728   4.5956   29.211   4.2286  215.435   14.013  194.682   14.291 20.75366 20.01450 
1 1 1    8    6   33 o  726.932   5.5759  404.528   6.2041  407.808   8.9680  401.517   8.5920  729.764   8.0287  724.128   7.7519 5.636047 11.16024 
1 1 1    8    6   34 o  922.297   5.9036  651.222   8.3340  660.902   12.116  642.530   11.481  928.955   8.5214  915.977   8.1891 12.97784 11.81846 
1 1 1    8    6   35 o  596.078   6.1576  272.035   5.6181  267.378   7.5799  277.711   8.3688  590.851   8.3814  602.120   9.0805 -11.26910 12.35731 
1 1 1    8    6   36 o  506.194   7.1966  196.223   5.5759  198.842   8.5353  194.273   7.3645  509.350   10.948  503.552   9.5550 5.797638 14.53119 
1 1 1    8    6   37 o  755.068   5.8295  436.535   6.7373  440.323   9.8394  433.190   9.2444  758.136   8.4791  752.009   8.0313 6.126831 11.67897 
1 1 1    8    6   38 o  363.290   7.7482  101.105   4.3085   99.455   6.8787  102.170   5.5270  360.035   12.482  365.087   9.8906 -5.052216 15.92582 
1 1 1    8    6   39 o  930.889   6.0623  663.642   8.6378  665.820   12.449  661.620   11.995  932.071   8.7261  929.171   8.4340 2.900452 12.13581 
1 1 1    8    6   40 o  145.876   15.213   16.542   3.3468   17.094   4.9232   16.067   4.5635  146.998   22.605  142.630   21.578 4.368301 31.25043 
1 1 1    8    6   41 o  578.632   6.2824  256.485   5.5641  257.368   8.5004  255.823   7.3600  579.256   9.5873  577.675   8.3238 1.581543 12.69657 
1 1 1    8    6   42 o  311.956   8.6694   74.633   4.1395   77.393   5.4653   70.919   6.3399  317.447   11.248  303.631   13.642 13.81622 17.68089 
1 1 1    8    6   43 o  140.505   17.236   15.469   3.6291   16.792   4.9430   13.922   5.3452  145.253   22.999  131.008   27.531 14.24445 35.87306 
1 1 1    8    6   44 o  292.979   8.4194   65.853   3.7756   66.359   5.4452   65.384   5.2398  293.719   12.112  291.600   11.740 2.119781 16.86773 
1 1 1    8    6   45 o  284.826   8.4300   62.257   3.6752   57.757   5.3006   66.423   5.1002  273.873   12.645  293.876   11.338 -20.00354 16.98370 
1 1 1    8    6   46 o  105.009   20.454   8.8720   3.1693   11.172   4.5910   6.7784   4.3806  116.899   26.295   92.289   28.311 24.61026 38.63902 
1 1 1    8    6   47 o   88.455   23.980   6.3577   3.3282   2.1018   4.6475   10.837   4.7683   70.602   28.290  114.734   27.508 -44.13209 39.45953 
1 1 1    8    6   48 o  144.689   18.796   16.580   4.0644   12.700   6.6948   18.844   5.1148  123.056   34.274  153.385   22.450 -30.32835 40.97205 
1 1 1    8    6   49 o  217.611   10.734   36.490   3.5753   30.357   5.1777   42.079   4.9429  196.675   17.378  232.738   13.940 -36.06337 22.27817 
1 1 1    8    6   50 o   80.951   25.103   5.2314   3.4334   4.8249   5.4394   5.5006   4.4266   84.817   31.473   84.769   28.682 0.4870605E-01 42.58205 
1 1 1    8    6   51 o   92.253   23.727   7.0182   3.3694   10.094   4.9085   4.2772   4.6334  109.723   28.846   79.273   29.114 30.45046 40.98396 
1 1 1    8    6   52 o   75.469   25.331   4.3618   3.4523   0.1093   4.9389   8.4248   4.8276   64.455   27.725  100.492   29.471 -36.03671 40.46286 
1 1 1    8    6   53 o  351.903   8.8082   95.369   4.7444  115.385   7.6217   82.706   6.0620  385.694   12.910  326.800   12.119 58.89438 17.70728 
1 1 1    8    6   54 o  182.930   15.481   26.319   4.2939   23.915   6.0009   28.841   6.1467  171.341   23.501  189.238   21.608 -17.89764 31.92512 
1 1 1    8    6   55 f  228.708   12.934   40.785   4.5092   42.426   5.7625   38.191   7.2423  232.025   16.330  217.504   22.059 14.52132 27.44580 
1 1 1    8    6   56 f  141.504   18.185   16.067   3.8475   16.393   5.4838   15.751   5.3997  139.517   26.651  136.637   26.776 2.879700 37.77876 
1 1 1    8    6   57 o  166.986   16.500   22.176   4.1623   23.540   6.0822   20.974   5.7082  168.595   24.269  159.013   24.218 9.581757 34.28511 
1 1 1    8    6   58 o   86.213   27.407   6.2281   4.0676   4.5802   5.8911   7.7296   5.6231   82.989   32.281   95.578   32.327 -12.58905 45.68503 
1 1 1    8    6   59 o  178.922   19.002   25.951   5.1243   19.709   7.1493   32.546   7.3486  148.003   32.453  196.848   24.950 -48.84514 40.93501 
1 1 1    8    6   60 o  125.095   20.889   13.040   3.8587   15.535   5.4208   10.478   5.4940  133.165   27.506  107.422   31.421 25.74306 41.75975 
1 1 1    8    6   61 o  100.295   26.260   8.8921   4.0787   7.2772   6.0010   10.279   5.5605   91.840   33.223  105.562   31.796 -13.72148 45.98663 
1 1 1    8    6   62 o  114.092   22.517   11.223   3.7926   8.8446   5.0859   14.202   5.6921   97.653   30.597  123.561   30.323 -25.90787 43.07737 
1 1 1    8    6   63 o  127.080   19.029   13.561   3.5875   13.144   4.8949   14.044   5.2733  119.767   27.308  122.978   28.561 -3.211250 39.51539 
1 1 1    8    6   64 o   94.774   27.234   8.4045   4.1603   10.686   5.7434   5.8862   6.0345  103.357   32.536   82.913   32.553 20.44444 46.02438 
1 1 1    8    7    0 o  931.799   9.3788  664.887   13.373  664.887   13.373  664.887   13.373  931.799   9.3788  931.799   9.3788 0.000000 0.000000 
1 1 1    8    7    1 o  674.076   6.2142  347.836   6.4116  339.324   7.6959  367.146   11.592  665.736   7.5524  692.341   10.939 -26.60541 13.29271 
1 1 1    8    7    2 o  504.422   6.6758  194.788   5.1543  194.788   5.1543   0.0000   0.0000  504.422   6.6758  ?   ?  0.000000 6.675778 
1 1 1    8    7    3 o  1192.76   11.354  1089.79   20.728  1089.79   20.728   0.0000   0.0000  1192.76   11.354  ?   ?  0.000000 11.35380 
1 1 1    8    7    4 o  267.453   10.171   54.785   4.1635   0.0000   0.0000   54.785   4.1635  ?   ?   267.453   10.171 0.000000 10.17059 
1 1 1    8    7    5 o  917.073   9.6226  644.093   13.507  634.812   18.881  653.823   19.331  910.131   13.553  923.647   13.674 -13.51642 19.25261 
1 1 1    8    7    6 o  140.006   8.2453   15.061   1.7591   15.623   2.0934   13.713   3.2450  142.497   9.6551  132.726   16.317 9.771011 18.95930 
1 1 1    8    7    7 o  536.656   5.3336  220.462   4.3811  220.798   6.1692  220.120   6.2228  537.003   7.5056  536.177   7.5824 0.8266602 10.66894 
1 1 1    8    7    8 o  477.616   7.4319  174.665   5.4331   0.0000   0.0000  174.665   5.4331  ?   ?   477.616   7.4319 0.000000 7.431852 
1 1 1    8    7    9 o  590.474   6.4666  266.935   5.8445  258.630   9.9636  271.291   7.2164  580.998   11.204  595.217   7.9209 -14.21924 13.72115 
1 1 1    8    7   10 o  798.459   6.3102  488.096   7.7119  489.070   10.790  487.079   11.027  799.115   8.8213  797.473   9.0337 1.642273 12.62626 
1 1 1    8    7   11 o  321.743   10.135   79.302   4.9914   0.0000   0.0000   79.302   4.9914  ?   ?   321.743   10.135 0.000000 10.13538 
1 1 1    8    7   12 o  913.847   7.0044  639.434   9.7974  634.932   13.846  643.948   13.866  910.404   9.9361  916.850   9.8803 -6.445984 14.01230 
1 1 1    8    7   13 o  675.695   5.9202  349.533   6.1229  359.710   8.6702  339.408   8.6479  685.352   8.2651  665.718   8.4870 19.63367 11.84653 
1 1 1    8    7   14 o  304.630   4.9580   71.037   2.3118   71.800   3.4330   70.404   3.1271  306.220   7.3243  303.240   6.7373 2.980072 9.951737 
1 1 1    8    7   15 o   86.767   12.557   5.8896   1.6191   5.6031   2.0937   6.3158   2.5538   83.965   16.877   88.984   19.305 -5.019363 25.64194 
1 1 1    8    7   16 o  786.207   4.9034  473.154   5.9007  491.000   9.3274  461.247   7.6190  800.779   7.6099  776.194   6.4130 24.58569 9.951721 
1 1 1    8    7   17 f  291.092   4.4909   64.859   2.0010   66.054   3.2097   64.100   2.5591  293.724   7.1393  289.368   5.7779 4.355377 9.184428 
1 1 1    8    7   18 o  439.708   5.1848  147.997   3.4895  151.578   5.4300  145.478   4.5545  444.936   7.9732  435.918   6.8260 9.017975 10.49602 
1 1 1    8    7   19 f  243.500   5.0678   45.385   1.8888   46.521   3.0104   44.648   2.4256  246.497   7.9789  241.499   6.5621 4.997375 10.33069 
1 1 1    8    7   20 o  841.580   5.6168  542.144   7.2353  561.808   10.587  524.913   9.9108  856.618   8.0745  828.023   7.8198 28.59509 11.24045 
1 1 1    8    7   21 o  1377.54   7.7227  1452.76   16.283  1453.27   23.071  1452.25   22.985  1377.54   10.942  1377.06   10.905 0.4761963 15.44812 
1 1 1    8    7   22 o  775.829   5.5220  460.726   6.5574  454.813   9.2459  466.710   9.3016  770.770   7.8371  780.788   7.7831 -10.01733 11.04525 
1 1 1    8    7   23 o  644.639   4.9077  318.074   4.8424  328.795   6.6257  305.780   7.0948  655.380   6.6049  632.010   7.3341 23.37091 9.869817 
1 1 1    8    7   24 o  808.260   5.2818  500.040   6.5344  517.446   9.0014  480.648   9.5009  822.157   7.1529  792.364   7.8338 29.79376 10.60813 
1 1 1    8    7   25 o  526.158   5.0278  211.900   4.0492  205.840   6.2719  216.231   5.3022  518.528   7.9024  531.484   6.5178 -12.95538 10.24347 
1 1 1    8    7   26 o  1530.22   7.9120  1792.67   18.531  1780.48   28.190  1801.95   24.592  1524.65   12.080  1533.97   10.474 -9.323486 15.98804 
1 1 1    8    7   27 o  480.582   5.7992  176.791   4.2659  169.667   5.7910  185.245   6.3078  470.754   8.0369  491.883   8.3781 -21.12845 11.60965 
1 1 1    8    7   28 o  1192.39   6.2701  1088.39   11.444  1088.52   16.260  1088.27   16.108  1192.30   8.9099  1192.18   8.8273 0.1292725 12.54226 
1 1 1    8    7   29 o  365.808   6.3113  102.439   3.5338  105.762   4.7286   98.234   5.3184  371.657   8.3122  358.155   9.7015 13.50214 12.77546 
1 1 1    8    7   30 o  250.716   8.2432   48.131   3.1634   45.184   4.2920   51.636   4.6806  242.861   11.546  259.617   11.779 -16.75635 16.49387 
1 1 1    8    7   31 o  465.571   6.6292  165.944   4.7241  165.798   6.6444  166.093   6.7179  465.287   9.3296  465.697   9.4245 -0.4100647 13.26135 
1 1 1    8    7   32 o  599.473   5.4950  275.100   5.0420  281.171   7.4293  269.916   6.8651  605.963   8.0099  593.730   7.5542 12.23370 11.01025 
1 1 1    8    7   33 o  529.481   5.8197  214.623   4.7165  218.224   6.8633  211.402   6.4924  533.814   8.3999  525.416   8.0729 8.397461 11.65035 
1 1 1    8    7   34 o   84.094   23.516   5.5948   3.1450   3.6985   4.4190   7.5412   4.4771   77.510   28.437   97.852   28.291 -20.34235 40.11316 
1 1 1    8    7   35 o  309.083   8.7252   73.175   4.1278   69.659   7.1845   74.908   5.0433  300.877   15.654  312.660   10.538 -11.78296 18.87118 
1 1 1    8    7   36 o  767.594   6.1619  451.141   7.2396  459.624   9.9821  441.728   10.515  774.614   8.4191  759.331   9.0475 15.28339 12.35876 
1 1 1    8    7   37 o   88.860   23.122   6.3157   3.1750   5.6195   4.6637   6.9172   4.3347   87.810   29.441   93.964   28.022 -6.153999 40.64504 
1 1 1    8    7   38 o   65.471   24.394   2.5237   3.2743   1.9932   5.1223   2.8902   4.2577   73.759   29.649   72.721   27.660 1.037498 40.54790 
1 1 1    8    7   39 o  315.180   7.7235   76.114   3.7260   70.212   5.3000   81.881   5.2392  302.504   11.447  326.743   10.476 -24.23972 15.51681 
1 1 1    8    7   40 o  471.175   6.5739  170.068   4.7410  183.949   7.3115  159.996   6.2278  489.744   9.7536  456.827   8.9066 32.91742 13.20837 
1 1 1    8    7   41 o  339.736   7.3291   88.453   3.8112   91.290   5.5698   85.955   5.2263  344.890   10.551  334.692   10.202 10.19769 14.67643 
1 1 1    8    7   42 o  301.133   8.5594   69.545   3.9452   71.381   5.1874   67.026   6.0762  304.864   11.117  295.177   13.449 9.686676 17.44840 
1 1 1    8    7   43 f  430.342   7.5238  141.987   4.9559  141.818   6.8325  142.175   7.1991  429.736   10.387  430.196   10.933 -0.4606628 15.08086 
1 1 1    8    7   44 o  415.029   6.9393  132.051   4.4082  134.493   6.0903  129.363   6.3887  418.536   9.5068  410.382   10.171 8.154205 13.92210 
1 1 1    8    7   45 o  344.897   7.3987   91.235   3.9059   86.485   5.6722   95.517   5.3863  335.354   11.050  352.587   9.9806 -17.23306 14.89038 
1 1 1    8    7   46 o  155.704   13.313   18.832   3.1424   14.063   4.4541   23.559   4.4340  132.291   22.821  173.571   16.904 -41.27979 28.39997 
1 1 1    8    7   47 o  157.819   16.312   19.508   3.8834   16.285   6.4745   21.319   4.8533  140.077   31.016  164.236   19.700 -24.15903 36.74326 
1 1 1    8    7   48 o   92.263   23.814   6.9655   3.3858   14.781   4.8268  -0.6050   4.7506  134.943   24.261   61.516   26.821 73.42731 36.16594 
1 1 1    8    7   49 o   87.874   23.489   6.3200   3.2201   2.8182   4.6695   9.4954   4.4465   73.262   28.673  107.000   27.116 -33.73730 39.46368 
1 1 1    8    7   50 o  245.117   10.581   46.321   3.9696   41.909   6.2407   49.320   5.1445  230.971   17.789  252.030   13.384 -21.05913 22.26198 
1 1 1    8    7   51 o   78.900   24.837   4.9517   3.3470   8.5934   4.8842   1.7275   4.5957  101.605   29.599   68.231   27.844 33.37446 40.63758 
1 1 1    8    7   52 o  156.128   15.963   19.202   3.7612   21.242   5.7692   17.695   4.9602  161.552   24.066  147.693   22.666 13.85910 33.05885 
1 1 1    8    7   53 o   61.160   24.499   1.6546   3.4840  -3.0922   4.9936   6.1566   4.8632   55.817   25.630   88.535   30.063 -32.71787 39.50495 
1 1 1    8    7   54 o  330.959   9.9184   84.559   5.0244   86.715   7.0065   82.276   7.2091  333.841   13.712  324.870   14.498 8.970978 19.95487 
1 1 1    8    7   55 f  149.776   18.953   18.004   4.2478   19.506   5.3871   15.536   6.9069  154.133   23.585  132.961   33.850 21.17213 41.25577 
1 1 1    8    7   56 o  122.254   21.498   12.280   3.8760   8.3241   5.4783   16.246   5.4847   99.185   31.836  138.757   26.795 -39.57223 41.61134 
1 1 1    8    7   57 o  144.372   18.544   16.804   4.0031   13.820   5.8281   19.470   5.5080  125.661   30.589  152.971   24.339 -27.31044 39.09066 
1 1 1    8    7   58 o  254.858   13.584   50.989   5.2798   39.137   8.4198   58.669   6.7780  216.058   25.981  271.921   16.361 -55.86340 30.70359 
1 1 1    8    7   59 o  106.860   24.516   9.7962   3.9247   5.2607   5.6368   14.064   5.4678   84.127   31.867  126.280   28.912 -42.15279 43.02752 
1 1 1    8    7   60 o   62.062   25.109   1.8841   3.6996   5.0809   5.2096  -1.3684   5.2548   81.687   30.704   60.176   27.101 21.51126 40.95382 
1 1 1    8    7   61 o   79.797   26.944   5.3718   3.9064   4.5447   5.7246   6.0925   5.3439   80.318   31.651   85.663   31.296 -5.344917 44.51055 
1 1 1    8    7   62 o  101.882   23.489   9.1001   3.5880   11.698   4.9693   6.2708   5.1859  112.699   28.723   85.119   30.870 27.57978 42.16631 
1 1 1    8    7   63 o   98.622   24.653   8.7484   3.7114   7.0032   5.2395   10.506   5.2580   87.427   31.111  104.486   30.790 -17.05874 43.77126 
1 1 1    8    7   64 o   99.043   26.116   9.0798   4.0156   16.349   5.4774   0.6336   5.9044  132.395   27.909   66.094   29.316 66.30102 40.47599 
1 1 1    8    8    1 o  1046.57   8.4032  838.701   13.461  840.380   16.510  835.373   23.251  1047.47   10.297  1043.93   14.551 3.545166 17.82612 
1 1 1    8    8    2 o  266.634   5.3052   54.421   2.1651   55.299   2.5978   52.423   3.9179  268.765   6.3150  261.625   9.7838 7.140411 11.64479 
1 1 1    8    8    3 o  262.536   8.6383   52.780   3.4713   52.780   3.4713   0.0000   0.0000  262.536   8.6383  ?   ?  0.000000 8.638324 
1 1 1    8    8    5 o  542.348   10.395  225.313   8.6289  225.313   8.6289   0.0000   0.0000  542.348   10.395  ?   ?  0.000000 10.39458 
1 1 1    8    8    6 o  778.004   8.7632  463.548   10.435  488.179   15.361  442.439   14.221  798.123   12.574  759.842   12.227 38.28137 17.53909 
1 1 1    8    8    7 o  1090.07   10.905  910.352   18.196  871.890   24.450  958.100   27.241  1066.29   14.981  1117.62   15.924 -51.32813 21.86331 
1 1 1    8    8    8 o  466.182   5.3259  166.366   3.8003  167.540   5.4129  165.224   5.3369  467.763   7.5602  464.521   7.5061 3.242584 10.65355 
1 1 1    8    8    9 o  295.032   5.4919   66.635   2.4801   67.123   3.5249   66.155   3.4901  296.070   7.7782  293.927   7.7576 2.142273 10.98546 
1 1 1    8    8   10 o  396.905   6.0702  120.606   3.6877  123.803   4.6371  115.104   6.0826  402.094   7.5344  387.619   10.252 14.47470 12.72299 
1 1 1    8    8   11 o  454.085   5.4794  157.849   3.8084  159.094   5.3828  156.600   5.3889  455.808   7.7154  452.219   7.7854 3.588379 10.96083 
1 1 1    8    8   12 f  374.903   7.9178  107.631   4.5436   0.0000   0.0000  107.631   4.5436  ?   ?   374.903   7.9178 0.000000 7.917836 
1 1 1    8    8   13 o  528.675   5.5835  213.966   4.5182  212.126   6.1646  216.101   6.6413  526.329   7.6521  531.217   8.1679 -4.888062 11.19238 
1 1 1    8    8   14 o  972.076   6.5120  723.447   9.6892  716.956   12.328  733.936   15.671  967.587   8.3241  978.799   10.460 -11.21259 13.36782 
1 1 1    8    8   15 o  449.273   5.5538  154.516   3.8192  153.808   5.1776  155.362   5.6563  448.191   7.5474  450.431   8.2042 -2.239594 11.14777 
1 1 1    8    8   16 o  426.723   5.0097  139.386   3.2721  131.727   4.8292  145.887   4.4491  414.778   7.6065  436.526   6.6587 -21.74814 10.10931 
1 1 1    8    8   17 o  109.717   9.6657   9.2906   1.6066   10.065   2.4198   8.6804   2.1486  113.711   14.213  105.557   13.616 8.154625 19.68265 
1 1 1    8    8   18 o  560.182   5.9181  240.216   5.0744  236.413   6.8885  244.729   7.5034  555.672   8.0991  565.342   8.6711 -9.670227 11.86523 
1 1 1    8    8   19 o  403.594   5.3631  124.683   3.3131  147.203   5.9612  114.618   3.9852  438.462   8.8824  386.941   6.7288 51.52054 11.14338 
1 1 1    8    8   20 o  793.997   5.0744  482.550   6.1670  486.071   9.5433  480.025   8.0809  796.807   7.8248  791.875   6.6670 4.932190 10.27997 
1 1 1    8    8   21 o  574.857   4.6473  252.936   4.0891  258.648   6.4542  249.105   5.2852  581.263   7.2543  570.464   6.0529 10.79901 9.447941 
1 1 1    8    8   22 o  789.394   5.1718  476.966   6.2489  495.420   9.9668  465.014   8.0213  804.438   8.0946  779.402   6.7238 25.03546 10.52292 
1 1 1    8    8   23 o  787.285   6.1070  474.447   7.3592  458.879   9.4349  498.633   11.760  774.209   7.9618  806.991   9.5206 -32.78192 12.41095 
1 1 1    8    8   24 o  947.951   6.7218  687.885   9.7531  689.659   12.809  685.437   15.045  949.091   8.8174  946.106   10.389 2.984863 13.62661 
1 1 1    8    8   25 o  1015.03   6.0485  788.653   9.3971  824.732   15.118  765.935   11.996  1037.84   9.5167  1000.24   7.8356 37.59888 12.32740 
1 1 1    8    8   26 o  855.750   5.5435  560.545   7.2610  572.584   11.359  552.226   9.4422  864.782   8.5813  849.322   7.2632 15.46075 11.24247 
1 1 1    8    8   27 o  943.653   5.4892  681.624   7.9286  684.180   11.360  679.196   11.071  945.328   7.8512  941.887   7.6790 3.441589 10.98219 
1 1 1    8    8   28 o  268.700   6.5839   55.271   2.7078   58.962   3.9659   52.048   3.7061  277.486   9.3376  260.711   9.2872 16.77429 13.16980 
1 1 1    8    8   29 o  1163.90   6.7010  1037.08   11.938  1034.84   15.812  1040.04   18.206  1162.51   8.8860  1165.32   10.207 -2.808105 13.53308 
1 1 1    8    8   30 o  255.003   7.8782   49.789   3.0750   49.158   4.6489   50.280   4.1000  253.305   11.990  256.210   10.455 -2.905823 15.90836 
1 1 1    8    8   31 o  1249.72   7.1068  1195.77   13.594  1186.31   17.820  1208.94   21.025  1244.58   9.3546  1256.23   10.934 -11.65039 14.38992 
1 1 1    8    8   32 o  436.645   5.9320  145.959   3.9646  149.603   5.8181  142.801   5.4170  441.987   8.6001  431.834   8.1954 10.15308 11.87970 
1 1 1    8    8   33 o  536.091   6.0490  220.023   4.9635  213.383   6.7626  227.777   7.3080  527.855   8.3701  545.351   8.7549 -17.49597 12.11229 
1 1 1    8    8   34 o  393.870   6.9124  118.786   4.1673  122.680   5.8229  114.697   5.9665  400.186   9.5063  386.922   10.075 13.26343 13.85156 
1 1 1    8    8   35 o  324.783   8.2444   80.793   4.0985   90.526   7.3091   76.329   4.9499  343.538   13.900  315.615   10.246 27.92313 17.26847 
1 1 1    8    8   36 o  306.562   7.9044   71.985   3.7090   71.771   5.1750   72.210   5.3186  305.984   11.049  306.906   11.322 -0.9226379 15.82018 
1 1 1    8    8   37 f  191.107   11.089   28.098   3.2297   29.987   4.7881   26.521   4.3749  196.909   16.026  185.159   15.581 11.74969 22.35176 
1 1 1    8    8   38 o  409.138   7.1008  128.224   4.4468  131.524   7.2048  126.194   5.6517  414.078   11.368  405.769   9.0998 8.308929 14.56129 
1 1 1    8    8   39 o  448.106   6.5434  153.809   4.4880  151.165   6.7019  155.958   6.0431  443.992   9.8618  451.071   8.7528 -7.079468 13.18585 
1 1 1    8    8   40 o  323.950   7.6857   80.425   3.8110   79.749   5.6977   80.973   5.1265  322.307   11.549  324.874   10.309 -2.566193 15.48132 
1 1 1    8    8   41 o  730.431   5.8044  408.680   6.4894  411.624   9.3573  405.951   9.0075  732.711   8.3435  727.685   8.0871 5.026367 11.61957 
1 1 1    8    8   42 o  208.474   11.627   33.497   3.6954   33.602   4.9265   33.363   5.5879  208.223   15.570  207.077   17.803 1.145874 23.65118 
1 1 1    8    8   43 o  522.993   6.6664  209.636   5.3365  213.210   6.9924  204.650   8.2585  527.167   8.6658  516.188   10.453 10.97949 13.57766 
1 1 1    8    8   44 o  221.437   9.7766   37.658   3.3137   39.990   4.7557   35.458   4.6197  227.400   13.728  213.999   14.184 13.40050 19.73927 
1 1 1    8    8   45 o  254.099   8.7677   49.569   3.4100   46.678   4.9024   52.278   4.7463  245.766   13.079  260.608   11.899 -14.84135 17.68192 
1 1 1    8    8   46 o  267.911   8.7538   55.123   3.5897   54.863   4.9892   55.402   5.1687  266.840   12.216  268.091   12.596 -1.251282 17.54639 
1 1 1    8    8   47 o  285.703   9.8770   62.778   4.3193   67.606   7.1873   60.050   5.4039  294.896   15.983  278.984   12.655 15.91150 20.38628 
1 1 1    8    8   48 o  431.126   6.7888  142.618   4.4799  152.705   6.5996  134.000   6.1007  445.514   9.6780  417.366   9.5498 28.14816 13.59645 
1 1 1    8    8   49 o  209.089   10.735   33.785   3.4241   30.981   4.9174   36.425   4.7709  198.926   16.293  216.282   14.495 -17.35632 21.80763 
1 1 1    8    8   50 o  193.554   12.430   29.083   3.6629   32.267   5.9977   27.189   4.6258  201.859   19.661  186.133   16.404 15.72517 25.60619 
1 1 1    8    8   51 o   75.409   24.551   4.4337   3.2503   6.4986   4.6875   2.5217   4.5107   90.280   29.488   70.915   28.047 19.36547 40.69664 
1 1 1    8    8   52 o  172.416   13.594   23.212   3.5584   26.556   5.3033   20.474   4.7992  182.755   19.248  159.969   20.040 22.78650 27.78650 
1 1 1    8    8   53 o  193.622   13.549   29.266   3.9903   32.942   5.3096   24.495   6.0485  204.317   17.136  173.670   23.345 30.64731 28.95925 
1 1 1    8    8   54 o  144.896   17.476   16.726   3.7976   20.595   5.4921   13.181   5.2569  158.784   23.290  124.647   28.211 34.13683 36.58287 
1 1 1    8    8   55 o  106.984   25.713   9.6600   4.1585   10.983   5.2454   7.4224   6.8228  112.955   29.879   97.623   35.408 15.33143 46.33001 
1 1 1    8    8   56 o  136.163   18.999   14.971   3.8518   15.000   5.6052   14.945   5.3019  132.363   28.509  132.778   27.007 -0.4149475 39.27000 
1 1 1    8    8   57 o   59.549   24.854   0.9989   3.7737   5.1734   5.5533  -2.5829   5.1440   84.587   31.719   57.355   26.216 27.23210 41.15046 
1 1 1    8    8   58 o   61.026   26.727  -0.2545   4.7647 -11.5205   7.3929   7.7497   6.2315   55.092   26.877   96.157   33.960 -41.06488 43.30854 
1 1 1    8    8   59 o  143.139   17.931   16.620   3.8424   14.578   5.5796   18.462   5.2991  128.361   29.073  147.729   24.279 -19.36795 37.87753 
1 1 1    8    8   60 o  103.575   24.181   9.2693   3.7638   15.275   5.3527   3.3955   5.2934  131.858   27.415   75.159   30.166 56.69941 40.76218 
1 1 1    8    8   61 o   79.610   27.337   5.3352   4.0226   0.6150   6.0404   9.0967   5.3921   68.795   30.113   99.436   31.550 -30.64100 43.61397 
1 1 1    8    8   62 o  274.211   10.770   58.911   4.5203   44.033   6.7250   71.172   6.1051  230.691   19.220  299.570   13.315 -68.87970 23.38171 
1 1 1    8    8   63 o  131.356   19.519   14.580   3.8051   11.205   5.6754   17.336   5.1285  106.790   32.113  139.586   24.918 -32.79610 40.64663 
1 1 1    8    9    0 o  257.032   6.6691   50.673   2.6198   50.673   2.6198   50.673   2.6198  257.032   6.6691  257.032   6.6691 0.000000 0.000000 
1 1 1    8    9    1 o  1177.83   11.333  1062.90   20.432  1071.98   29.129  1054.10   28.666  1182.19   16.098  1172.31   15.976 9.881958 22.67954 
1 1 1    8    9    2 o  630.136   7.6030  304.038   7.3331  299.100   10.140  309.453   10.618  624.849   10.602  635.552   10.915 -10.70319 15.21629 
1 1 1    8    9    3 o  598.318   6.1100  274.061   5.5955  277.820   6.8666  266.630   9.6541  602.359   7.4476  589.951   10.691 12.40790 13.02946 
1 1 1    8    9    4 o  830.465   8.9738  528.195   11.407  543.896   16.487  513.779   15.798  842.407   12.787  818.768   12.606 23.63867 17.95589 
1 1 1    8    9    5 o  266.810   7.4936   54.508   3.0603   54.508   3.0603   0.0000   0.0000  266.810   7.4936  ?   ?  0.000000 7.493637 
1 1 1    8    9    6 o  478.255   7.3947  175.137   5.4132  175.137   5.4132   0.0000   0.0000  478.255   7.3947  ?   ?  0.000000 7.394714 
1 1 1    8    9    7 o  794.900   8.9738  483.940   10.918  483.940   10.918   0.0000   0.0000  794.900   8.9738  ?   ?  0.000000 8.973782 
1 1 1    8    9    8 o  1045.72   7.5507  837.346   12.086  872.361   17.808  807.451   16.455  1067.04   10.904  1026.62   10.472 40.41968 15.11780 
1 1 1    8    9    9 o  593.923   6.5473  270.072   5.9520  276.304   7.4081  258.724   9.9970  600.671   8.0575  581.076   11.240 19.59509 13.82975 
1 1 1    8    9   10 o  182.095   7.8361   25.392   2.1841   25.433   2.7894   25.327   3.5111  181.930   10.056  181.330   12.731 0.6004639 16.22360 
1 1 1    8    9   11 o  703.356   6.1315  378.743   6.6010  384.786   9.4364  372.952   9.2373  708.818   8.6977  697.836   8.6481 10.98193 12.26537 
1 1 1    8    9   12 o  1014.50   7.4960  788.081   11.640  773.438   16.135  803.972   16.808  1004.78   10.491  1024.40   10.720 -19.61829 14.99934 
1 1 1    8    9   13 o  646.132   5.3537  319.590   5.2947  318.126   6.7416  321.946   8.5535  644.598   6.8329  648.378   8.6188 -3.779541 10.99871 
1 1 1    8    9   14 o  578.402   5.7903  256.108   5.1262  243.240   6.8308  272.698   7.7563  563.615   7.9180  596.745   8.4917 -33.13000 11.61052 
1 1 1    8    9   15 o  916.843   7.0686  643.581   9.9197  633.222   13.647  655.187   14.445  909.267   9.8053  924.874   10.204 -15.60657 14.15125 
1 1 1    8    9   16 o  625.887   5.3858  299.864   5.1596  293.226   6.4561  311.597   8.5839  618.882   6.8154  637.901   8.7914 -19.01953 11.12379 
1 1 1    8    9   17 o  888.237   7.0135  604.007   9.5353  615.294   13.437  592.558   13.533  896.356   9.7941  879.624   10.051 16.73236 14.03413 
1 1 1    8    9   18 o  864.475   6.9593  572.105   9.2085  578.955   12.926  565.046   13.121  869.510   9.7125  858.988   9.9798 10.52191 13.92581 
1 1 1    8    9   19 o  293.120   5.6819   65.767   2.5492   64.611   3.8199   66.696   3.4230  290.497   8.5909  295.159   7.5766 -4.662415 11.45462 
1 1 1    8    9   20 o  236.512   5.9423   42.818   2.1512   44.710   3.0145   40.855   3.0708  241.660   8.1497  231.000   8.6850 10.66048 11.90991 
1 1 1    8    9   21 o  711.531   5.3870  387.519   5.8669  387.238   8.2596  387.804   8.3350  711.220   7.5872  711.737   7.6509 -0.5172119 10.77510 
1 1 1    8    9   22 o  562.852   4.7395  242.481   4.0832  243.639   6.3306  241.656   5.3431  564.148   7.3313  561.870   6.2128 2.278687 9.609735 
1 1 1    8    9   23 f  991.653   6.2532  752.744   9.4915  763.532   13.797  743.051   13.078  998.623   9.0262  985.154   8.6730 13.46844 12.51773 
1 1 1    8    9   24 o  368.396   5.2198  103.880   2.9433  104.464   4.6506  103.490   3.8016  369.390   8.2253  367.686   6.7549 1.703918 10.64347 
1 1 1    8    9   25 o  899.368   7.5108  619.232   10.339  634.341   21.950  614.923   11.721  909.780   15.762  896.191   8.5449 13.58826 17.92941 
1 1 1    8    9   26 o  527.075   5.6687  212.651   4.5732  210.533   6.6842  214.516   6.2706  524.385   8.3278  529.336   7.7395 -4.951050 11.36887 
1 1 1    8    9   27 o  602.922   5.9742  278.267   5.5133  280.950   7.9379  275.766   7.6632  605.749   8.5614  600.141   8.3423 5.608093 11.95372 
1 1 1    8    9   28 o  580.438   5.4547  257.893   4.8461  259.995   6.5260  255.310   7.2357  582.751   7.3163  577.450   8.1864 5.301392 10.97937 
1 1 1    8    9   29 o  705.266   5.2055  380.743   5.6193  400.464   8.2956  364.022   7.6388  723.224   7.4939  689.541   7.2376 33.68225 10.41834 
1 1 1    8    9   30 o  963.992   6.0931  711.399   8.9904  734.648   14.106  695.493   11.667  979.420   9.4092  953.053   7.9981 26.36615 12.34917 
1 1 1    8    9   31 o  652.003   5.8975  325.437   5.8855  326.003   7.7611  324.672   9.0287  652.499   7.7710  651.106   9.0595 1.392334 11.93576 
1 1 1    8    9   32 o  645.329   5.5053  318.803   5.4379  327.227   7.9467  311.385   7.4573  653.702   7.9421  637.695   7.6401 16.00635 11.02037 
1 1 1    8    9   33 o  253.762   8.7250   49.320   3.3889   48.445   4.7217   50.249   4.8669  251.409   12.270  256.041   12.419 -4.632294 17.45783 
1 1 1    8    9   34 o  344.485   7.6839   90.879   4.0516   86.674   6.7900   93.204   5.0489  336.208   13.195  348.806   9.4568 -12.59814 16.23351 
1 1 1    8    9   35 o  648.809   5.9629  322.305   5.9216  326.615   8.2315  317.681   8.5252  653.002   8.2356  643.982   8.6489 9.020325 11.94270 
1 1 1    8    9   36 o  438.837   6.2183  147.464   4.1768  149.789   6.1318  145.452   5.7050  442.146   9.0606  435.725   8.5540 6.421234 12.46056 
1 1 1    8    9   37 o  436.313   6.7389  145.801   4.5004  147.769   7.3740  144.633   5.6812  438.976   10.975  434.462   8.5431 4.513641 13.90787 
1 1 1    8    9   38 o  381.280   7.1550  111.365   4.1756  111.963   6.8310  111.008   5.2761  381.995   11.683  380.559   9.0578 1.436127 14.78303 
1 1 1    8    9   39 o  174.787   11.697   23.554   3.1112   18.841   4.5196   27.798   4.2892  155.086   19.469  189.555   14.904 -34.46849 24.51819 
1 1 1    8    9   40 o  119.333   16.364   11.170   2.9103   10.201   4.1351   12.121   4.0967  112.488   24.694  123.221   22.552 -10.73384 33.44181 
1 1 1    8    9   41 o  545.607   6.4680  228.086   5.4016  227.872   7.1256  228.375   8.2823  545.118   8.5401  545.528   9.9189 -0.4100952 13.08880 
1 1 1    8    9   42 o  282.605   8.2159   61.249   3.5539   63.633   5.4168   59.447   4.7091  287.683   12.302  278.184   11.060 9.498688 16.54213 
1 1 1    8    9   43 o  112.219   19.779   10.044   3.2733   9.8623   4.2525   10.308   5.1275  110.146   25.694  112.361   29.455 -2.214417 39.08677 
1 1 1    8    9   44 o  134.223   14.923   14.072   3.0140   15.733   4.2958   12.461   4.2297  140.853   20.529  124.470   23.050 16.38264 30.86664 
1 1 1    8    9   45 o  246.258   9.0206   46.570   3.4001   50.306   4.9727   43.290   4.6596  255.513   12.715  236.658   12.912 18.85484 18.12151 
1 1 1    8    9   46 o  402.961   7.1318  124.567   4.3988  114.034   6.0731  136.192   6.3798  385.047   10.304  420.877   9.9034 -35.83081 14.29191 
1 1 1    8    9   47 o  330.712   9.5908   84.106   4.8549   79.639   7.6040   87.179   6.3079  320.577   15.497  336.191   12.258 -15.61371 19.75879 
1 1 1    8    9   48 o  283.896   8.3991   61.936   3.6497   63.589   5.2895   60.434   5.0423  287.039   12.039  279.881   11.770 7.158020 16.83714 
1 1 1    8    9   49 o  384.497   7.8269  113.584   4.6063  117.496   7.5157  111.231   5.8295  389.859   12.595  380.021   10.022 9.837616 16.09561 
1 1 1    8    9   50 o   79.305   23.827   5.0664   3.1254   5.1197   4.5489   5.0189   4.3015   83.081   29.040   81.824   28.260 1.256180 40.52071 
1 1 1    8    9   51 o  178.355   12.835   24.763   3.4805   23.578   5.1932   25.728   4.6894  171.920   20.116  180.643   17.166 -8.723083 26.44472 
1 1 1    8    9   52 f   75.170   24.655   4.4079   3.2756   3.0049   4.7309   5.6998   4.5396   73.791   28.866   85.608   29.046 -11.81681 40.94984 
1 1 1    8    9   53 o  219.427   12.285   37.432   4.1094   38.235   5.5804   36.482   6.0742  220.349   16.669  214.433   18.694 5.916382 25.04611 
1 1 1    8    9   54 o  109.034   21.628   9.7841   3.4821   12.307   5.0132   7.4325   4.8401  120.463   27.759   94.589   29.879 25.87452 40.78365 
1 1 1    8    9   55 o   93.188   27.119   7.3086   4.1018   8.3770   5.1604   5.4753   6.7599   99.413   30.767   90.092   34.709 9.321037 46.38226 
1 1 1    8    9   56 o  222.800   12.066   38.689   4.0994   40.209   6.0134   37.369   5.6031  224.894   17.610  217.038   17.002 7.855347 24.47829 
1 1 1    8    9   57 f  270.095   10.846   56.604   4.4838   54.319   6.4546   58.735   6.2333  261.953   16.177  273.072   14.970 -11.11911 22.04112 
1 1 1    8    9   58 o  119.774   25.356   12.268   4.5038   13.900   7.2756   11.254   5.7345  122.481   36.253  112.077   31.900 10.40408 48.28977 
1 1 1    8    9   59 f  114.234   22.230   11.005   3.7471   15.482   5.3327   6.6391   5.2664  133.417   27.039   88.998   31.239 44.41837 41.31553 
1 1 1    8    9   60 o  184.406   16.500   27.347   4.6080   4.8079   7.5965   40.468   5.7962   86.931   35.674  224.247   17.013 -137.3154 39.52298 
1 1 1    8    9   61 o  133.358   20.474   14.910   4.0456   14.791   6.0521   15.006   5.4394  125.824   31.498  128.967   28.330 -3.143570 42.36364 
1 1 1    8    9   62 o  132.777   19.600   14.810   3.8635   17.137   5.6468   12.762   5.2976  137.268   27.829  116.734   29.605 20.53327 40.63134 
1 1 1    8    9   63 o  134.955   19.868   15.454   3.9813   17.266   5.0715   12.543   6.4271  139.291   24.691  110.996   34.333 28.29472 42.28955 
1 1 1    8   10    0 o   35.408   21.353   0.9270   2.1097   0.9270   2.1097   0.9270   2.1097   35.408   21.353   35.408   21.353 0.000000 0.000000 
1 1 1    8   10    1 o  673.796   6.4803  347.587   6.6833  354.134   8.2898  335.429   11.296  680.046   7.9641  661.658   11.154 18.38800 13.70559 
1 1 1    8   10    2 o  645.327   6.3710  318.832   6.2930  312.222   7.5608  333.735   11.353  638.547   7.7358  659.977   11.239 -21.43091 13.64386 
1 1 1    8   10    3 o  423.128   5.6081  137.060   3.6321  136.854   4.3946  137.503   6.4517  422.781   6.7910  423.680   9.9487 -0.8984680 12.04554 
1 1 1    8   10    4 o  130.621   10.280   13.151   2.0387   12.903   2.7415   13.459   3.0494  128.960   14.120  131.569   15.435 -2.608749 20.91920 
1 1 1    8   10    5 o  445.240   6.0157  151.767   4.0997  147.213   4.9443  161.785   7.3340  438.472   7.3671  459.543   10.427 -21.07056 12.76668 
1 1 1    8   10    6 o  840.476   7.5679  540.916   9.7358  549.869   12.104  524.508   16.386  847.281   9.3331  827.191   12.942 20.08990 15.95640 
1 1 1    8   10    7 o  665.078   8.2893  338.744   8.4384  338.744   8.4384   0.0000   0.0000  665.078   8.2893  ?   ?  0.000000 8.289332 
1 1 1    8   10    8 o  694.899   8.4810  369.811   9.0206  369.811   9.0206   0.0000   0.0000  694.899   8.4810  ?   ?  0.000000 8.480976 
1 1 1    8   10    9 o  584.269   6.5663  261.362   5.8722  257.605   7.1324  269.266   10.346  579.997   8.0342  592.795   11.403 -12.79840 13.94869 
1 1 1    8   10   10 o  405.398   5.5527  125.814   3.4455  125.807   4.8507  125.821   4.8950  405.329   7.8186  405.351   7.8895 -0.2178955E-01 11.10745 
1 1 1    8   10   11 o  120.405   10.067   11.183   1.8383   10.957   2.5748   11.418   2.6255  118.663   14.476  121.177   14.440 -2.513527 20.44677 
1 1 1    8   10   12 o  567.310   5.8453  246.382   5.0757  252.654   7.2840  240.462   7.0768  574.400   8.2848  560.371   8.2507 14.02930 11.69240 
1 1 1    8   10   13 f  959.257   7.2984  704.532   10.716  696.493   14.979  712.959   15.336  953.564   10.263  964.760   10.386 -11.19611 14.60100 
1 1 1    8   10   14 o  105.941   12.624   8.7218   2.0068   7.7594   2.7915   9.7512   2.8870   98.882   19.136  111.409   17.507 -12.52706 25.93609 
1 1 1    8   10   15 o  800.890   7.6376  491.097   9.3626  488.286   11.183  497.685   17.119  798.522   9.1499  805.856   13.879 -7.334473 16.62360 
1 1 1    8   10   16 f  372.922   7.9778  106.478   4.5538   99.198   5.5316  121.786   8.0213  359.904   10.041  398.684   13.145 -38.78055 16.54114 
1 1 1    8   10   17 o  1495.46   9.0196  1712.41   20.646  1711.97   26.628  1713.07   32.691  1495.02   11.637  1495.19   14.284 -0.1638184 18.42422 
1 1 1    8   10   18 o  1233.25   7.7891  1164.38   14.703  1164.62   18.907  1164.00   23.387  1233.24   10.016  1232.72   12.395 0.5190430 15.93590 
1 1 1    8   10   19 o  551.681   5.4571  232.963   4.6080  228.828   6.9577  236.193   6.1503  546.705   8.3146  555.459   7.2339 -8.753967 11.02098 
1 1 1    8   10   20 o   39.872   16.508   0.2964   1.6458  -2.6462   2.3232   3.2612   2.3319   35.163   16.584   65.725   20.737 -30.56146 26.55255 
1 1 1    8   10   21 o  1262.93   7.9976  1221.07   15.460  1231.27   24.495  1214.32   19.932  1267.88   12.622  1259.30   10.341 8.582886 16.31680 
1 1 1    8   10   22 o  837.121   6.3032  536.420   8.0764  531.497   10.406  543.879   12.808  833.212   8.1594  842.792   9.9288 -9.580139 12.85132 
1 1 1    8   10   23 o  501.073   5.4216  192.181   4.1581  193.931   5.8271  190.365   5.9353  503.313   7.5639  498.659   7.7762 4.653625 10.84813 
1 1 1    8   10   24 o  344.250   7.6913   90.726   4.0527   99.763   8.9249   88.378   4.5487  360.786   16.162  339.751   8.7469 21.03500 18.37681 
1 1 1    8   10   25 o  196.639   7.5091   29.602   2.2601   29.622   3.6435   29.590   2.8815  196.273   12.188  196.579   9.5766 -0.3057404 15.50052 
1 1 1    8   10   26 o  188.802   10.768   27.389   3.0990   9.1728   5.8984   34.335   3.6421  108.705   32.749  211.424   11.296 -102.7192 34.64233 
1 1 1    8   10   27 o  437.607   6.6846  146.601   4.4774  149.918   5.9633  142.316   6.7789  442.480   8.8048  431.076   10.274 11.40472 13.53062 
1 1 1    8   10   28 o  838.239   6.8882  537.926   8.8378  550.377   11.788  521.941   13.356  847.779   9.0838  825.501   10.570 22.27771 13.93727 
1 1 1    8   10   29 o  914.141   6.4234  639.738   8.9878  647.324   15.889  636.170   10.899  919.242   11.293  911.519   7.8117 7.723511 13.73154 
1 1 1    8   10   30 o  464.555   7.2279  165.234   5.1394  175.336   8.1833  158.654   6.6045  478.403   11.175  455.141   9.4803 23.26251 14.65487 
1 1 1    8   10   31 o  289.636   7.7199   64.235   3.4224   60.947   5.6537   66.137   4.2997  281.987   13.099  293.850   9.5596 -11.86328 16.21621 
1 1 1    8   10   32 o  876.250   6.1226  587.828   8.2117  593.315   11.122  581.252   12.176  880.201   8.2549  871.144   9.1316 9.057129 12.30978 
1 1 1    8   10   33 o  631.090   5.6118  304.906   5.4208  301.499   7.8534  308.006   7.4917  627.438   8.1775  634.197   7.7176 -6.759094 11.24424 
1 1 1    8   10   34 o  415.561   6.9546  132.237   4.4236  131.869   7.3914  132.443   5.5217  414.771   11.643  415.818   8.6755 -1.046997 14.51947 
1 1 1    8   10   35 o  179.814   11.264   24.884   3.0846   29.095   4.3238   20.519   4.4018  194.154   14.658  162.406   18.011 31.74843 23.22161 
1 1 1    8   10   36 o  351.258   6.8194   94.493   3.6664   97.800   5.3928   91.651   4.9996  357.213   9.8632  345.821   9.4453 11.39114 13.65639 
1 1 1    8   10   37 o  507.806   6.4464  197.493   5.0105  190.378   8.0219  202.045   6.4160  498.273   10.518  513.512   8.1630 -15.23926 13.31414 
1 1 1    8   10   38 o  188.497   10.666   27.341   3.0648   21.956   4.5151   31.942   4.1736  167.916   17.841  203.486   13.476 -35.56960 22.35849 
1 1 1    8   10   39 o  672.049   5.7668  345.916   5.9321  340.488   8.4565  351.174   8.3235  666.488   8.2895  676.898   8.0336 -10.40997 11.54364 
1 1 1    8   10   40 o  194.474   10.070   29.097   2.9871   27.250   4.3602   30.730   4.1005  187.518   15.325  199.464   13.511 -11.94580 20.43046 
1 1 1    8   10   41 f  511.384   6.5053  200.384   5.0920  198.329   6.7220  203.152   7.7999  508.517   8.6362  514.489   9.9048 -5.971802 13.14110 
1 1 1    8   10   42 o  296.921   7.7730   67.602   3.5326   64.495   5.1398   70.384   4.8634  289.675   11.592  302.728   10.496 -13.05295 15.63782 
1 1 1    8   10   43 o  586.955   6.4308  264.051   5.7775  267.228   7.6148  259.741   8.8690  590.164   8.4298  581.546   9.9637 8.618347 13.05128 
1 1 1    8   10   44 o  135.871   13.791   14.378   2.8283   13.008   4.0367   15.699   3.9639  127.573   21.433  141.044   18.832 -13.47141 28.53037 
1 1 1    8   10   45 o   90.284   21.053   6.6076   2.8558   5.0177   3.9420   8.3638   4.1431   81.470   27.063  101.151   26.458 -19.68102 37.84695 
1 1 1    8   10   46 o  198.468   11.749   30.453   3.5533   32.232   6.2518   29.604   4.3186  202.183   20.484  195.141   14.563 7.041748 25.13377 
1 1 1    8   10   47 o  431.668   7.7820  143.076   5.1417  124.841   7.9209  156.355   6.7595  402.081   12.870  450.824   9.7957 -48.74335 16.17412 
1 1 1    8   10   48 o  220.338   9.7472   37.368   3.2873   41.478   4.7903   33.709   4.5194  231.131   13.600  208.128   14.273 23.00334 19.71524 
1 1 1    8   10   49 o   57.873   23.243   1.3606   3.1450   9.8476   5.1778  -3.6012   3.9590  108.531   30.111   47.277   22.090 61.25384 37.34471 
1 1 1    8   10   50 f  361.101   7.5702  100.190   4.1841  102.484   6.1920   98.263   5.6760  364.378   11.102  356.984   10.388 7.393860 15.20417 
1 1 1    8   10   51 o  289.857   8.8974   64.681   3.9475   63.601   5.8635   65.576   5.3385  286.365   13.377  291.159   11.979 -4.793976 17.95679 
1 1 1    8   10   52 o  378.556   7.7134  110.200   4.4694  116.145   6.5262  104.948   6.1334  387.678   10.998  368.558   10.872 19.11911 15.46508 
1 1 1    8   10   53 o  269.600   10.869   56.197   4.4850   55.903   6.0893   56.547   6.6309  267.295   14.943  268.312   16.222 -1.017822 22.05584 
1 1 1    8   10   54 o   80.091   26.806   5.0533   3.8659   1.4026   4.8082   11.728   6.5015   67.596   28.120  115.992   34.254 -48.39629 44.31747 
1 1 1    8   10   55 o   76.912   25.683   4.6635   3.5487   3.3745   5.0769   5.8949   4.9622   76.138   29.869   86.796   30.331 -10.65740 42.56935 
1 1 1    8   10   56 o  206.486   12.614   33.317   3.9675   32.072   5.8258   34.394   5.4182  199.859   19.283  208.012   17.171 -8.153458 25.82051 
1 1 1    8   10   57 o   84.160   26.533   5.9130   3.8183   10.696   5.6105   1.7859   5.2113  109.942   31.637   70.210   29.247 39.73216 43.08424 
1 1 1    8   10   58 o  135.726   21.977   15.323   4.4095   16.767   7.1538   14.437   5.5998  135.065   34.484  128.017   29.222 7.048813 45.20040 
1 1 1    8   10   59 o  139.555   17.996   15.844   3.7546   13.042   5.4101   18.447   5.2148  120.758   29.518  147.660   23.889 -26.90176 37.97388 
1 1 1    8   10   60 o  219.891   13.070   38.174   4.3792   33.076   6.4457   42.544   5.9680  199.549   21.439  229.737   17.094 -30.18752 27.42011 
1 1 1    8   10   61 o   58.587   24.319   1.3748   3.5850   2.0653   5.0136   0.6523   5.1284   68.219   28.574   64.215   27.935 4.003845 39.96068 
1 1 1    8   10   62 o   90.072   25.868   7.3422   3.7544   6.3270   5.4961   8.2303   5.1407   85.046   31.621   93.564   30.896 -8.518028 44.20953 
1 1 1    8   10   63 o   65.754   26.160   2.8773   3.9454   5.3905   5.3956  -0.0105   5.7839   80.153   30.973   64.153   28.698 15.99990 42.22425 
1 1 1    8   11    0 o  261.181   9.9944   52.460   3.9822   52.460   3.9822   52.460   3.9822  261.181   9.9944  261.181   9.9944 0.000000 0.000000 
1 1 1    8   11    1 o  266.784   5.7874   54.488   2.3633   56.536   2.9137   50.550   4.0404  271.731   7.0054  256.874   10.276 14.85767 12.43701 
1 1 1    8   11    2 o  655.537   6.4882  329.010   6.5101  325.633   7.8955  336.182   11.506  652.101   7.9103  662.369   11.349 -10.26813 13.83374 
1 1 1    8   11    3 o  171.607   7.0071   22.548   1.8405   20.974   2.1950   26.277   3.3780  165.258   8.7083  184.781   12.009 -19.52364 14.83379 
1 1 1    8   11    4 o  661.302   8.1201  334.897   8.2192  333.641   11.559  336.182   11.690  659.857   11.445  662.359   11.530 -2.501892 16.24568 
1 1 1    8   11    5 o  342.230   6.1140   89.666   3.2027   87.954   3.9119   93.146   5.5774  338.916   7.5409  348.690   10.450 -9.774078 12.88683 
1 1 1    8   11    6 f  296.313   6.3176   67.221   2.8653   66.616   3.4745   68.507   5.0657  294.949   7.6962  299.019   11.068 -4.069366 13.48081 
1 1 1    8   11    7 o  638.446   8.2167  312.148   8.0295  312.148   8.0295   0.0000   0.0000  638.446   8.2167  ?   ?  0.000000 8.216675 
1 1 1    8   11    8 o  501.492   6.3793  192.544   4.8967  194.420   5.9502  188.608   8.6193  503.885   7.7149  496.138   11.350 7.747528 13.72385 
1 1 1    8   11    9 o  773.014   7.3763  457.537   8.7277  454.011   10.606  464.932   15.360  769.938   8.9998  778.847   12.884 -8.909485 15.71646 
1 1 1    8   11   10 o  605.735   6.7295  280.914   6.2393  282.440   7.6672  277.924   10.735  607.317   8.2481  602.268   11.646 5.049805 14.27056 
1 1 1    8   11   11 o   89.793   13.882   6.3254   1.8464   4.2624   2.5086   8.7643   2.7276   73.671   21.142  105.486   17.507 -31.81424 27.44955 
1 1 1    8   11   12 o  843.458   6.7993  544.660   8.7781  563.076   12.769  528.161   12.087  857.434   9.7298  830.439   9.5090 26.99500 13.60473 
1 1 1    8   11   13 o  409.193   6.8861  128.188   4.3129  125.337   5.1204  135.150   8.0015  404.586   8.2684  419.991   12.447 -15.40567 14.94291 
1 1 1    8   11   14 f  804.487   7.7759  495.518   9.5750  498.654   11.688  489.120   16.695  806.948   9.4633  798.930   13.653 8.017883 16.61158 
1 1 1    8   11   15 o  491.745   6.9137  185.120   5.2038  182.491   8.8292  186.520   6.4416  488.096   11.818  493.561   8.5267 -5.465424 14.57300 
1 1 1    8   11   16 o  795.954   6.6791  484.989   8.1372  474.022   11.130  497.581   11.926  786.807   9.2421  806.102   9.6660 -19.29547 13.37344 
1 1 1    8   11   17 o  1115.42   8.1034  952.528   13.835  936.093   18.989  971.124   20.198  1105.57   11.221  1126.03   11.719 -20.46082 16.22509 
1 1 1    8   11   18 o  683.670   6.3823  357.789   6.6787  349.305   8.9934  368.222   9.9727  675.452   8.6988  693.477   9.3953 -18.02515 12.80393 
1 1 1    8   11   19 o  1020.20   6.9543  796.750   10.860  787.174   13.757  812.581   17.689  1013.97   8.8642  1030.08   11.219 -16.10815 14.29823 
1 1 1    8   11   20 o  539.744   5.0945  222.984   4.2088  219.523   5.8110  226.801   6.1041  535.507   7.0895  544.307   7.3267 -8.799805 10.19516 
1 1 1    8   11   21 o  1232.82   7.8940  1163.53   14.896  1157.65   23.157  1167.68   19.456  1229.42   12.306  1234.88   10.293 -5.458984 16.04301 
1 1 1    8   11   22 o  1158.54   16.489  1028.69   29.240  1028.69   29.240   0.0000   0.0000  1158.54   16.489  ?   ?  0.000000 16.48919 
1 1 1    8   11   23 o  880.033   8.6217  592.946   11.614   0.0000   0.0000  592.946   11.614  ?   ?   880.033   8.6217 0.000000 8.621743 
1 1 1    8   11   24 o  523.510   6.2610  209.792   5.0169  207.929   8.1602  210.923   6.3611  521.083   10.231  524.884   7.9178 -3.801514 12.93709 
1 1 1    8   11   25 o  647.957   5.7149  321.380   5.6680  319.706   7.9926  323.074   8.0390  646.202   8.0807  649.597   8.0851 -3.394592 11.43099 
1 1 1    8   11   26 f  1008.03   6.6548  777.874   10.268  805.715   15.003  753.345   14.083  1025.75   9.5557  991.870   9.2759 33.87903 13.31745 
1 1 1    8   11   27 o  648.919   6.6848  322.371   6.6397  332.140   8.6143  308.072   10.422  658.613   8.5451  634.208   10.736 24.40472 13.72143 
1 1 1    8   11   28 o  646.084   5.9664  319.545   5.9003  321.284   8.6811  318.052   8.0439  647.740   8.7559  644.499   8.1540 3.241394 11.96473 
1 1 1    8   11   29 o  357.580   7.0945   97.895   3.8830   96.142   6.3646   98.934   4.9007  354.241   11.738  359.431   8.9078 -5.190674 14.73553 
1 1 1    8   11   30 o  781.166   6.5419  467.181   7.8220  483.235   11.381  452.807   10.768  794.322   9.3606  768.921   9.1496 25.40149 13.08956 
1 1 1    8   11   31 o  582.108   6.3386  259.422   5.6477  272.046   8.6769  250.143   7.4392  595.964   9.5120  571.518   8.5041 24.44562 12.75923 
1 1 1    8   11   32 o  463.149   6.3780  164.233   4.5215  157.827   7.3021  168.216   5.7581  453.868   10.511  468.676   8.0267 -14.80878 13.22541 
1 1 1    8   11   33 o  206.996   10.101   32.829   3.2002   33.226   5.4965   32.625   3.9361  207.280   17.488  205.908   12.549 1.372147 21.52423 
1 1 1    8   11   34 o  185.535   11.562   26.491   3.2671   20.882   5.4379   29.658   4.0868  163.184   22.360  196.151   13.698 -32.96747 26.22186 
1 1 1    8   11   35 o  452.326   6.9319  156.690   4.7993  151.973   7.5569  159.879   6.2131  445.226   11.089  456.804   8.8861 -11.57797 14.21021 
1 1 1    8   11   36 o  480.568   5.9535  176.849   4.3792  183.092   6.3933  171.331   6.0106  488.825   8.5448  472.881   8.3042 15.94415 11.91526 
1 1 1    8   11   37 o  508.183   6.6646  197.807   5.1840  202.026   9.1096  195.787   6.3043  513.139   11.598  505.477   8.1483 7.662415 14.17440 
1 1 1    8   11   38 o  457.399   6.1085  160.242   4.2766  158.510   6.1238  161.891   5.9751  454.725   8.7984  459.576   8.4941 -4.850769 12.22953 
1 1 1    8   11   39 o  626.035   5.7176  300.178   5.4788  293.062   7.8017  307.102   7.6957  618.307   8.2436  632.982   7.9430 -14.67542 11.44768 
1 1 1    8   11   40 o  240.510   9.3488   44.375   3.4416   44.756   4.4866   43.830   5.3646  241.035   12.201  238.155   14.790 2.880341 19.17261 
1 1 1    8   11   41 o   51.815   21.261   0.7064   2.6980   4.9243   3.8821  -3.2341   3.7523   81.153   26.852   46.924   21.784 34.22834 34.57679 
1 1 1    8   11   42 o  497.911   6.6517  190.014   5.0694  186.669   6.5753  194.917   7.9598  493.248   8.7093  503.768   10.323 -10.52066 13.50611 
1 1 1    8   11   43 o   75.331   23.056   4.4447   2.9072   2.8799   3.6016   7.3712   4.9253   68.726   25.589   96.596   30.084 -27.86999 39.49499 
1 1 1    8   11   44 o  240.922   8.7332   44.561   3.2205   41.604   4.4174   47.917   4.7050  232.080   12.481  249.440   12.323 -17.36049 17.53981 
1 1 1    8   11   45 o  189.431   10.338   27.678   2.9862   26.783   4.3275   28.492   4.1259  185.452   15.384  191.557   14.173 -6.105011 20.91729 
1 1 1    8   11   46 o  284.203   9.2306   62.084   4.0154   55.213   6.5984   66.125   5.0603  266.331   16.264  292.994   11.284 -26.66345 19.79499 
1 1 1    8   11   47 o  158.218   11.993   19.422   2.8828   22.032   4.1677   17.027   3.9919  167.622   16.456  146.744   18.160 20.87874 24.50713 
1 1 1    8   11   48 o  136.399   13.841   14.550   2.8497   19.049   4.2026   10.721   3.8772  155.232   18.023  114.630   22.899 40.60199 29.14119 
1 1 1    8   11   49 o  347.539   7.9604   92.826   4.2346   97.604   6.9926   90.059   5.3212  355.175   12.863  341.868   10.169 13.30646 16.39682 
1 1 1    8   11   50 o  189.241   11.525   27.768   3.3223   24.337   4.8660   30.763   4.5470  175.320   18.408  198.333   15.091 -23.01283 23.80336 
1 1 1    8   11   51 o  156.868   13.747   19.245   3.2676   22.630   4.6924   16.057   4.5528  168.845   18.457  140.831   21.827 28.01428 28.58510 
1 1 1    8   11   52 o   66.993   24.873   2.9238   3.3983   2.8638   4.4454   3.0081   5.2712   71.750   28.005   76.173   30.259 -4.423042 41.22949 
1 1 1    8   11   53 o  166.840   14.089   21.824   3.5643   30.166   5.3088   14.977   4.8096  194.994   17.990  134.664   24.225 60.33005 30.17394 
1 1 1    8   11   54 o  219.229   12.905   37.490   4.3114   38.253   5.4701   36.238   7.0053  220.219   16.345  211.822   21.924 8.396973 27.34613 
1 1 1    8   11   55 o   55.422   23.497   0.4419   3.4571   0.1251   4.8317   0.7742   4.9485   63.185   27.300   65.955   28.044 -2.769375 39.13747 
1 1 1    8   11   56 o  103.517   23.566   9.0223   3.6502   5.9694   5.2507   11.878   5.0780   87.310   31.137  117.155   28.574 -29.84429 42.26044 
1 1 1    8   11   57 o  236.671   13.086   43.913   4.7220   30.945   7.5620   52.202   6.0455  191.492   26.511  256.929   15.444 -65.43661 30.68155 
1 1 1    8   11   58 f   71.212   25.494   3.8382   3.5234   5.4891   5.0808   2.3088   4.8903   83.662   30.523   69.974   28.658 13.68821 41.86797 
1 1 1    8   11   59 o   55.278   23.702   0.3782   3.5892  -0.0342   5.1994   0.7536   4.9607   63.517   27.867   64.627   27.793 -1.110668 39.35698 
1 1 1    8   11   60 o  105.466   24.544   9.7073   3.8877   10.174   5.8804   9.3451   5.1817  104.500   32.925  101.059   30.751 3.441132 45.05229 
1 1 1    8   11   61 f  175.027   14.684   24.598   3.8976   24.760   5.7445   24.460   5.3056  170.412   22.579  170.703   20.732 -0.2906342 30.65337 
1 1 1    8   11   62 o  124.424   19.615   13.091   3.6119   9.4066   5.0657   16.901   5.1513   99.269   30.443  137.645   25.386 -38.37614 39.63875 
1 1 1    8   11   63 o   98.495   25.352   8.8855   3.8446   11.318   5.3036   6.1919   5.5811  107.623   30.694   83.459   31.686 24.16399 44.11475 
1 1 1    8   12    0 o  1283.89   17.379  1263.98   34.138  1263.98   34.138  1263.98   34.138  1283.89   17.379  1283.89   17.379 0.000000 0.000000 
1 1 1    8   12    1 o  236.379   6.2349   42.777   2.2558   44.194   2.7610   39.933   3.9124  240.241   7.5085  228.295   11.196 11.94576 13.48095 
1 1 1    8   12    2 o  587.292   6.3065  264.063   5.6691  261.432   6.8770  269.642   10.015  584.307   7.6894  593.239   11.029 -8.932739 13.44490 
1 1 1    8   12    3 o  615.684   11.214  290.442   10.568   0.0000   0.0000  290.442   10.568  ?   ?   615.684   11.214 0.000000 11.21409 
1 1 1    8   12    4 o  327.583   7.4284   82.168   3.7246   82.718   5.2026   81.589   5.3347  328.600   10.344  326.339   10.680 2.261536 14.86810 
1 1 1    8   12    6 o  635.649   8.2370  309.412   8.0142  309.412   8.0142   0.0000   0.0000  635.649   8.2370  ?   ?  0.000000 8.237031 
1 1 1    8   12    7 o  578.651   6.5991  256.353   5.8449  253.973   7.0781  261.454   10.363  575.907   8.0297  584.151   11.590 -8.244019 14.09979 
1 1 1    8   12    8 o  893.857   7.9651  611.798   10.898  609.303   13.285  616.930   19.054  891.916   9.7311  897.112   13.876 -5.195862 16.94797 
1 1 1    8   12    9 o  772.438   7.4315  456.838   8.7864  453.252   10.655  464.462   15.534  769.316   9.0481  778.492   13.036 -9.175964 15.86867 
1 1 1    8   12   10 o  1070.93   9.0190  878.295   14.784  895.409   18.392  847.043   24.853  1081.14   11.114  1051.06   15.449 30.07825 19.03101 
1 1 1    8   12   11 o  599.797   8.3814  275.470   7.6947  275.470   7.6947   0.0000   0.0000  599.797   8.3814  ?   ?  0.000000 8.381445 
1 1 1    8   12   12 f  852.408   7.9341  556.321   10.352  586.377   13.221  508.696   16.642  875.027   9.8711  814.780   13.344 60.24670 16.59841 
1 1 1    8   12   13 o  965.206   7.4277  713.242   10.973  744.710   16.091  685.881   15.004  986.079   10.661  946.349   10.358 39.72943 14.86422 
1 1 1    8   12   14 o  1185.93   9.7867  1077.00   17.765  1100.21   31.534  1066.21   21.502  1197.91   17.199  1179.81   11.907 18.09631 20.91790 
1 1 1    8   12   15 o  863.320   8.1484  570.625   10.767  600.177   19.485  557.634   12.919  885.033   14.384  853.358   9.8909 31.67456 17.45623 
1 1 1    8   12   16 o  878.721   7.1534  591.104   9.6213  604.825   13.837  578.260   13.388  888.733   10.172  869.002   10.065 19.73077 14.30967 
1 1 1    8   12   17 o  426.789   6.3790  139.431   4.1671  141.110   5.8858  137.743   5.9006  429.306   8.9571  424.151   9.0888 5.154633 12.76067 
1 1 1    8   12   18 o  559.192   5.6148  239.349   4.8058  230.579   5.9573  255.692   8.1324  548.825   7.0916  577.889   9.1940 -29.06415 11.61125 
1 1 1    8   12   19 o  1821.04   11.902  2539.75   33.176  2462.05   44.911  2633.06   49.218  1792.39   16.370  1853.44   17.349 -61.04993 23.85324 
1 1 1    8   12   20 o  541.426   6.3552  224.392   5.2667  229.377   7.1478  218.471   7.7902  547.361   8.5315  534.167   9.5280 13.19476 12.78939 
1 1 1    8   12   21 o  827.415   8.0428  524.124   10.186  514.600   12.230  545.684   18.402  819.798   9.7469  843.956   14.246 -24.15808 17.26086 
1 1 1    8   12   22 o  920.037   6.1465  647.948   8.6557  621.369   11.641  680.807   12.944  900.887   8.4424  942.967   8.9680 -42.08020 12.31663 
1 1 1    8   12   23 o  1130.12   8.5634  977.852   14.813  968.453   29.460  981.032   17.137  1123.97   17.124  1131.88   9.8914 -7.909546 19.77578 
1 1 1    8   12   24 o  922.835   6.8581  651.946   9.6872  662.349   15.277  644.950   12.528  929.976   10.733  917.779   8.9180 12.19617 13.95420 
1 1 1    8   12   25 o  1341.84   9.5597  1378.78   19.634  1365.79   27.227  1392.86   28.340  1335.13   13.323  1348.25   13.733 -13.11816 19.13387 
1 1 1    8   12   26 o  953.319   7.2070  695.779   10.516  691.824   13.363  702.213   17.045  950.501   9.1850  957.443   11.631 -6.942749 14.82029 
1 1 1    8   12   27 o  284.874   7.6654   62.134   3.3424   59.701   4.6941   64.637   4.7603  279.177   10.985  290.495   10.706 -11.31818 15.33914 
1 1 1    8   12   28 o  573.279   6.6932  251.608   5.8731  247.983   8.9349  254.366   7.7933  569.001   10.259  576.338   8.8343 -7.337097 13.53861 
1 1 1    8   12   29 o  481.590   6.6523  177.564   4.9036  180.634   6.9122  174.453   6.9576  485.650   9.2988  477.260   9.5243 8.389191 13.31087 
1 1 1    8   12   30 o  1055.27   7.7542  852.711   12.525  847.307   16.068  861.078   19.995  1051.73   9.9811  1060.00   12.324 -8.263428 15.85864 
1 1 1    8   12   31 o  697.698   7.2001  372.730   7.6891  390.431   10.250  349.946   11.628  713.948   9.3794  675.794   11.242 38.15479 14.64060 
1 1 1    8   12   32 o  796.916   6.0506  486.223   7.3804  491.858   11.685  482.482   9.5198  801.289   9.5269  793.740   7.8358 7.549255 12.33537 
1 1 1    8   12   33 o  416.205   6.6618  132.643   4.2439  144.312   7.2859  126.651   5.2211  433.929   10.970  406.631   8.3887 27.29828 13.80954 
1 1 1    8   12   34 o  1081.56   7.1892  895.882   11.901  909.315   17.629  884.633   16.132  1089.20   10.575  1074.43   9.8097 14.77014 14.42395 
1 1 1    8   12   35 o  562.935   6.1826  242.669   5.3272  245.995   8.7604  240.718   6.7105  566.498   10.103  560.567   7.8209 5.931152 12.77648 
1 1 1    8   12   36 o  186.764   12.911   26.900   3.6682   4.2503   12.091   29.196   3.8496  111.000   45.215  194.597   12.999 -83.59682 47.04651 
1 1 1    8   12   37 o  141.083   14.954   15.471   3.1801   21.237   5.9734   13.191   3.7568  163.840   24.577  129.364   19.586 34.47586 31.42695 
1 1 1    8   12   38 o   91.488   22.501   6.7347   3.1290   4.6307   5.2363   7.9033   3.9024   84.905   30.985   99.039   25.567 -14.13467 40.17176 
1 1 1    8   12   39 o  246.928   9.2449   46.766   3.4941   41.430   5.9938   49.513   4.3005  231.190   17.059  253.956   11.063 -22.76643 20.33210 
1 1 1    8   12   40 o  496.618   6.4157  188.972   4.8768  195.247   6.5171  180.986   7.3516  504.579   8.4384  485.617   9.8906 18.96210 13.00113 
1 1 1    8   12   41 o  213.959   9.2393   35.130   3.0258   36.305   4.4412   34.112   4.1335  216.769   13.452  210.176   12.911 6.593140 18.64560 
1 1 1    8   12   42 o  183.812   11.320   26.071   3.1694   23.684   3.9495   30.390   5.3116  174.609   14.921  197.404   17.770 -22.79428 23.20343 
1 1 1    8   12   43 o   71.317   21.578   3.9943   2.5566   3.5473   3.5468   4.4777   3.6885   71.989   25.599   77.763   26.183 -5.774017 36.61765 
1 1 1    8   12   44 o  464.128   6.3843  165.151   4.5355  162.604   6.1017  168.295   6.7801  460.196   8.6624  468.033   9.4643 -7.837189 12.83005 
1 1 1    8   12   45 o   40.262   18.974  -3.2822   3.0311 -14.1322   5.3234   1.9231   3.6872   41.048   20.511   64.297   25.381 -23.24928 32.63310 
1 1 1    8   12   46 o  114.553   16.488   10.387   2.8076   12.609   3.9217   8.0506   4.0213  125.258   21.212   99.000   26.149 26.25760 33.67043 
1 1 1    8   12   47 o  329.175   7.2017   83.180   3.6285   81.277   5.2257   84.952   5.0423  324.829   10.510  332.208   9.9163 -7.379059 14.44995 
1 1 1    8   12   48 o  199.738   10.256   30.816   3.1251   28.739   4.5056   32.743   4.3381  191.726   15.486  205.127   13.899 -13.40141 20.80822 
1 1 1    8   12   49 o  131.583   16.388   13.688   3.2291   14.002   5.3583   13.509   4.0464  129.663   27.831  129.377   21.166 0.2855072 34.96517 
1 1 1    8   12   50 o   93.273   21.096   7.1321   2.9413   13.617   4.4591   2.1373   3.9134  129.035   23.440   66.046   26.124 62.98895 35.09862 
1 1 1    8   12   51 o   77.999   23.062   4.9418   2.9456   5.9467   4.1970   3.9663   4.1350   86.182   27.887   75.603   27.543 10.57873 39.19579 
1 1 1    8   12   52 o  259.818   10.246   52.122   4.0747   52.309   5.3747   51.869   6.2487  259.077   13.601  257.117   15.957 1.959778 20.96673 
1 1 1    8   12   53 o   79.973   24.127   5.2280   3.1997   1.8674   4.4292   8.8963   4.6276   67.329   27.389  102.423   28.484 -35.09380 39.51575 
1 1 1    8   12   54 o  198.018   13.453   30.672   4.0534   33.182   5.0455   26.103   6.8068  205.021   16.210  177.521   25.807 27.50015 30.47559 
1 1 1    8   12   55 o  194.758   12.235   29.601   3.6287   26.900   5.1942   32.175   5.0716  183.228   18.786  201.492   16.592 -18.26355 25.06417 
1 1 1    8   12   56 o  152.298   16.121   18.474   3.7008   16.227   5.1898   20.798   5.2789  138.749   25.372  159.028   22.300 -20.27934 33.77927 
1 1 1    8   12   57 o  134.870   20.813   14.983   4.1583   22.102   7.1099   11.282   5.1266  158.817   30.355  113.155   29.350 45.66159 42.22365 
1 1 1    8   12   58 f  106.253   22.469   9.5626   3.5400   3.2751   4.9964   15.900   5.0163   73.971   29.436  136.506   24.927 -62.53523 38.57215 
1 1 1    8   12   59 o  214.908   11.825   36.231   3.8747   38.206   5.3666   34.080   5.6000  218.431   16.166  205.145   18.017 13.28664 24.20674 
1 1 1    8   12   60 o   61.450   25.221   1.7404   3.7980   2.6633   5.9773   1.1156   4.9185   74.352   31.175   64.883   27.782 9.469017 41.75754 
1 1 1    8   12   61 o  181.499   13.950   26.360   3.8458   29.491   5.6411   23.640   5.2568  187.956   19.911  167.358   20.983 20.59859 28.92622 
1 1 1    8   12   62 o  217.773   12.427   37.694   4.1250   30.436   6.4103   42.824   5.3891  187.641   22.787  229.918   15.402 -42.27792 27.50421 
1 1 1    8   13    0 o  574.376   10.963  252.889   9.6305  252.889   9.6305  252.889   9.6305  574.376   10.963  574.376   10.963 0.000000 0.000000 
1 1 1    8   13    1 o  518.169   6.1562  205.553   4.8827  205.046   5.9632  206.584   8.5053  517.488   7.5285  519.297   10.701 -1.809204 13.08356 
1 1 1    8   13    2 o  709.370   8.4106  385.343   9.1321  385.343   9.1321   0.0000   0.0000  709.370   8.4106  ?   ?  0.000000 8.410613 
1 1 1    8   13    3 o  203.354   11.833   31.792   3.6672   31.792   3.6672   0.0000   0.0000  203.354   11.833  ?   ?  0.000000 11.83292 
1 1 1    8   13    4 o  453.241   10.543  157.362   7.3141  157.362   7.3141   0.0000   0.0000  453.241   10.543  ?   ?  0.000000 10.54300 
1 1 1    8   13    5 o  692.032   8.4539  366.730   8.9547  367.522   12.603  365.922   12.726  692.581   11.888  691.063   12.031 1.518799 16.91391 
1 1 1    8   13    6 o  589.855   6.6860  266.370   6.0365  264.923   7.3544  269.360   10.568  588.198   8.1687  592.939   11.644 -4.741455 14.22362 
1 1 1    8   13    7 o  853.822   7.8025  558.188   10.197  562.526   12.566  549.825   17.449  857.030   9.5794  847.004   13.459 10.02600 16.51982 
1 1 1    8   13    8 o  419.428   6.4840  134.676   4.1626  132.179   4.9985  140.327   7.5191  415.491   7.8597  427.993   11.478 -12.50217 13.91098 
1 1 1    8   13    9 o  626.236   6.9306  300.238   6.6432  305.498   8.1824  290.065   11.379  631.645   8.4633  615.320   12.082 16.32452 14.75111 
1 1 1    8   13   10 o  696.245   6.2712  371.091   6.6832  368.746   9.3431  373.548   9.5638  693.952   8.7961  698.449   8.9460 -4.497192 12.54597 
1 1 1    8   13   11 o  880.575   6.9993  593.623   9.4339  598.557   13.404  588.780   13.280  884.086   9.9054  876.836   9.8947 7.249573 14.00080 
1 1 1    8   13   12 o  677.969   6.3282  351.857   6.5669  358.514   9.3777  345.451   9.1989  684.268   8.9536  671.686   8.9475 12.58148 12.65799 
1 1 1    8   13   13 o  941.703   10.381  679.111   14.963  684.693   21.503  673.870   20.835  945.254   14.862  937.781   14.515 7.473083 20.77445 
1 1 1    8   13   14 o   56.358   22.217   1.3437   2.8216   6.7491   4.4572  -2.2710   3.6449   93.584   28.530   48.976   22.262 44.60833 36.18801 
1 1 1    8   13   15 o  465.057   6.1948  165.555   4.4096  175.258   6.3542  156.540   6.1245  478.445   8.6768  452.170   8.8491 26.27515 12.39323 
1 1 1    8   13   16 o  239.964   7.8715   44.083   2.8912   43.423   3.9875   44.814   4.1980  238.126   10.940  241.905   11.338 -3.779861 15.75555 
1 1 1    8   13   17 o  796.342   6.9413  485.450   8.4608  471.667   11.604  501.096   12.363  784.866   9.6589  808.968   9.9846 -24.10150 13.89196 
1 1 1    8   13   18 f  586.123   6.5226  262.972   5.8517  255.844   8.0646  270.899   8.5040  578.066   9.1145  594.824   9.3404 -16.75818 13.05059 
1 1 1    8   13   19 o  927.388   7.3992  658.391   10.503  649.652   14.420  668.266   15.329  921.095   10.228  934.174   10.721 -13.07825 14.81689 
1 1 1    8   13   20 o  316.323   7.5647   76.600   3.6626   78.158   4.3613   72.874   6.7467  319.504   8.9180  308.414   14.292 11.08942 16.84591 
1 1 1    8   13   21 o  849.872   10.552  553.109   13.727   0.0000   0.0000  553.109   13.727  ?   ?   849.872   10.552 0.000000 10.55222 
1 1 1    8   13   22 o  553.227   7.0882  234.299   6.0022  232.455   8.4627  236.166   8.5142  550.966   10.035  555.347   10.016 -4.381531 14.17844 
1 1 1    8   13   23 o  624.254   5.5762  298.294   5.3281  295.910   7.3311  300.963   7.7570  621.701   7.7040  626.976   8.0830 -5.274597 11.16628 
1 1 1    8   13   24 o   65.176   20.039   3.2530   2.1933   4.9604   2.9871   1.2556   3.2308   79.617   23.135   58.902   23.593 20.71418 33.04316 
1 1 1    8   13   25 o  640.018   7.2015  313.601   7.0548  338.113   9.9592  288.913   9.9950  664.461   9.7923  614.182   10.632 50.27899 14.45441 
1 1 1    8   13   26 o  946.831   7.9773  686.411   11.561  654.670   15.369  727.787   17.547  924.499   10.861  974.688   11.761 -50.18890 16.00895 
1 1 1    8   13   27 o  628.543   6.4901  302.448   6.2439  298.168   9.5228  305.676   8.2696  623.942   9.9712  631.813   8.5512 -7.870667 13.13579 
1 1 1    8   13   28 o  570.311   7.4325  249.035   6.4881  247.071   8.8923  251.271   9.4878  567.943   10.229  572.720   10.823 -4.777039 14.89214 
1 1 1    8   13   29 o  143.833   15.131   16.039   3.2811   17.379   4.3485   14.268   4.9997  149.188   19.511  133.993   25.305 15.19417 31.95334 
1 1 1    8   13   30 o  496.143   6.6086  188.466   5.0186  193.390   7.1819  183.768   7.0158  502.478   9.3380  489.817   9.3578 12.66116 13.21998 
1 1 1    8   13   31 o  864.359   7.3101  572.096   9.6714  585.481   12.682  553.496   14.950  874.246   9.4777  849.844   11.493 24.40192 14.89700 
1 1 1    8   13   32 o  319.460   9.1285   78.179   4.4636   83.396   6.0165   71.793   6.6569  329.834   11.917  305.925   14.216 23.90921 18.55071 
1 1 1    8   13   33 o  114.202   20.440   10.336   3.4417   12.082   4.7453   8.3983   4.9992  122.819   26.050  103.109   29.920 19.71006 39.67087 
1 1 1    8   13   34 o  435.871   7.7660  145.527   5.1812  147.174   7.1144  143.668   7.5605  438.159   10.608  432.852   11.411 5.306702 15.58046 
1 1 1    8   13   35 o  308.894   9.2677   73.129   4.3818   71.059   6.5366   74.819   5.9050  304.204   14.038  312.266   12.354 -8.061523 18.70056 
1 1 1    8   13   36 o  699.749   7.2783  375.117   7.7954  369.781   19.777  376.098   8.4822  692.792   18.650  700.599   7.9098 -7.806458 20.25842 
1 1 1    8   13   37 o  289.057   8.1869   64.038   3.6222   60.197   6.1599   66.068   4.4783  279.457   14.450  293.500   9.9686 -14.04361 17.55523 
1 1 1    8   13   38 o  494.335   6.3936  187.204   4.8377  177.811   7.7981  193.081   6.1681  481.356   10.584  501.889   8.0292 -20.53384 13.28494 
1 1 1    8   13   39 o  754.339   6.8347  436.041   7.8914  438.126   11.464  434.164   10.879  755.609   9.9124  752.276   9.4481 3.332703 13.69389 
1 1 1    8   13   40 o  398.178   7.2819  121.532   4.4380  106.692   8.0696  127.967   5.3138  372.246   14.163  408.465   8.4993 -36.21902 16.51754 
1 1 1    8   13   41 o  176.732   11.482   24.110   3.0891   25.766   5.3521   23.282   3.7827  181.307   19.598  173.232   14.397 8.075058 24.31739 
1 1 1    8   13   42 o  470.418   7.5065  169.714   5.4049  170.530   7.8611  168.982   7.4435  471.001   10.904  468.957   10.370 2.043701 15.04770 
1 1 1    8   13   43 o  198.704   10.951   30.457   3.3178   25.992   5.4770   33.045   4.1700  181.753   20.019  206.634   13.254 -24.88098 24.00946 
1 1 1    8   13   44 o  337.750   7.6290   87.535   3.9439   85.669   6.6511   88.546   4.8979  333.286   13.038  339.459   9.4266 -6.173798 16.08879 
1 1 1    8   13   45 o  459.397   6.8631  161.900   4.8259  165.908   7.9957  159.604   6.0527  464.118   11.255  455.804   8.6757 8.314301 14.21092 
1 1 1    8   13   46 o  262.764   8.3542   53.047   3.3600   52.301   4.7680   53.783   4.7356  260.377   11.964  264.083   11.716 -3.706238 16.74478 
1 1 1    8   13   47 o  218.059   9.3399   36.585   3.1173   31.122   4.4187   41.998   4.3986  199.858   14.544  232.846   12.386 -32.98827 19.10374 
1 1 1    8   13   48 o  348.472   8.1513   93.338   4.3477  103.979   7.5270   88.010   5.3261  366.448   13.420  337.945   10.297 28.50247 16.91464 
1 1 1    8   13   49 o  222.561   9.9895   38.175   3.4030   44.847   5.1513   33.009   4.5329  240.007   14.084  205.677   14.491 34.32935 20.20797 
1 1 1    8   13   50 o  211.406   10.047   34.464   3.2511   39.967   4.8148   29.851   4.4076  226.459   13.958  195.346   14.852 31.11224 20.38209 
1 1 1    8   13   51 o  333.264   8.5259   85.499   4.3491   87.420   5.7561   82.944   6.6390  336.280   11.183  326.891   13.269 9.389374 17.35278 
1 1 1    8   13   52 o  115.410   18.430   10.731   3.1462   6.7612   4.4816   14.588   4.4179   90.792   28.758  133.596   22.397 -42.80453 36.45114 
1 1 1    8   13   53 o   60.932   23.715   2.0236   3.1809   3.5251   4.4171   0.4061   4.5844   74.232   28.187   62.842   26.862 11.39074 38.93732 
1 1 1    8   13   54 o  300.345   9.8365   69.706   4.5220   75.240   5.8362   61.391   7.1530  311.219   12.252  278.829   16.839 32.38965 20.82464 
1 1 1    8   13   55 o   75.158   25.102   4.4709   3.3901   1.7016   4.7331   7.3884   4.8581   67.825   28.031   93.660   29.971 -25.83521 41.03677 
1 1 1    8   13   56 o  113.558   23.051   10.825   3.8697   9.6134   6.7285   11.424   4.7304  104.863   35.362  115.013   27.283 -10.15070 44.66367 
1 1 1    8   13   57 o   37.908   18.432  -5.5236   3.3970   0.3571   4.6241 -12.4181   5.0068   61.935   26.734   40.001   19.974 21.93385 33.37123 
1 1 1    8   13   58 o   59.597   23.884   1.7898   3.3130   6.9071   4.7732  -2.9669   4.6020   89.598   29.780   52.292   24.222 37.30666 38.38740 
1 1 1    8   13   59 o  258.988   12.100   52.575   4.7965   48.703   7.6354   55.099   6.1647  243.098   20.718  262.828   15.391 -19.72978 25.80911 
1 1 1    8   13   60 o  136.038   25.164   16.202   5.0467   0.0000   0.0000   16.202   5.0467  ?   ?   136.038   25.164 0.000000 25.16368 
1 1 1    8   13   61 o   43.498   20.278  -2.4096   3.3065  -5.7340   4.5263   1.3939   4.8416   45.229   21.819   64.569   27.603 -19.34056 35.18541 
1 1 1    8   13   62 o  122.883   21.254   13.037   3.8530   11.819   5.1862   14.537   5.7562  110.961   29.873  122.702   30.719 -11.74133 42.84921 
1 1 1    8   14    2 o  810.378   9.1422  502.909   11.340  502.673   16.060  503.143   16.014  809.930   12.955  810.312   12.912 -0.3823853 18.29023 
1 1 1    8   14    3 o  787.875   9.0274  475.355   10.887  482.532   15.581  468.509   15.217  793.555   12.828  781.947   12.714 11.60760 18.06104 
1 1 1    8   14    4 o  1138.12   11.365  992.266   19.798  1002.33   28.266  982.570   27.739  1143.33   16.152  1132.02   16.009 11.30957 22.74120 
1 1 1    8   14    5 o  800.290   9.1792  490.452   11.244  480.273   15.571  501.543   16.254  791.714   12.849  809.035   13.126 -17.32092 18.36817 
1 1 1    8   14    6 o  719.323   7.2162  396.136   7.9452  394.645   9.7160  399.145   13.804  717.903   8.8420  721.789   12.494 -3.886536 15.30647 
1 1 1    8   14    7 o  827.602   7.7553  524.394   9.8240  518.296   11.920  537.308   17.345  822.693   9.4662  837.383   13.533 -14.68939 16.51512 
1 1 1    8   14    8 o  311.657   6.9252   74.358   3.3036   72.801   3.9702   77.862   5.9560  308.353   8.4120  318.810   12.205 -10.45703 14.82345 
1 1 1    8   14    9 o  613.192   6.9901  287.849   6.5607  288.669   8.0331  286.206   11.369  614.018   8.5474  611.251   12.152 2.767029 14.85682 
1 1 1    8   14   10 o  598.052   6.0567  273.787   5.5443  272.268   7.7869  275.348   7.8959  596.326   8.5312  599.688   8.6021 -3.361633 12.11519 
1 1 1    8   14   11 o  1885.60   12.210  2723.40   35.241  2760.36   50.639  2688.69   49.074  1897.52   17.435  1872.78   17.120 24.73621 24.43500 
1 1 1    8   14   12 o  722.067   7.5631  399.145   8.3588  398.957   14.529  399.238   10.219  721.667   13.154  722.094   9.2461 -0.4273682 16.07813 
1 1 1    8   14   13 o  273.995   7.9550   57.474   3.3362   57.044   5.7843   57.688   4.0839  272.519   13.913  274.482   9.7206 -1.963776 16.97279 
1 1 1    8   14   14 o  869.191   7.1504  578.341   9.5130  586.756   13.491  570.019   13.416  875.380   10.069  862.799   10.159 12.57996 14.30329 
1 1 1    8   14   15 o  1074.98   9.2491  884.762   15.218  886.905   18.692  880.548   26.210  1076.16   11.348  1071.96   15.974 4.203979 19.59438 
1 1 1    8   14   16 o  109.195   16.948   9.3542   2.7408   7.8806   3.4311   11.953   4.5561   99.365   23.012  122.554   25.132 -23.18932 34.07608 
1 1 1    8   14   17 o  624.229   7.6595  298.301   7.3183  299.477   12.528  297.693   9.0166  625.282   13.090  623.544   9.4472 1.737549 16.14333 
1 1 1    8   14   18 o  1627.95   12.610  2029.90   31.422  2028.20   54.398  2030.76   38.493  1625.94   21.858  1627.96   15.448 -2.018433 26.76569 
1 1 1    8   14   19 o  531.864   7.5222  216.556   6.1237  208.332   7.4908  233.125   10.633  521.625   9.3821  551.688   12.592 -30.06348 15.70273 
1 1 1    8   14   20 o  874.957   7.4404  586.064   9.9644  577.444   13.816  595.410   14.385  868.373   10.394  881.765   10.658 -13.39215 14.88774 
1 1 1    8   14   21 o  948.093   7.8171  688.168   11.344  663.063   15.546  716.761   16.591  930.484   10.915  967.410   11.204 -36.92603 15.64228 
1 1 1    8   14   22 o  651.716   6.8009  325.146   6.7841  310.639   8.9016  345.248   10.479  636.939   9.1306  671.442   10.196 -34.50275 13.68663 
1 1 1    8   14   23 o  345.790   7.5753   91.543   4.0094   84.628   5.0504  103.330   6.5938  332.430   9.9255  367.283   11.729 -34.85355 15.36507 
1 1 1    8   14   24 o  209.905   9.4097   33.740   3.0232   33.427   3.6081   34.479   5.5387  208.591   11.344  211.340   17.273 -2.749634 20.66478 
1 1 1    8   14   25 o  459.853   5.9910  161.879   4.2168  158.045   5.8482  166.031   6.0859  454.318   8.4100  465.651   8.5387 -11.33319 11.98487 
1 1 1    8   14   26 o  513.655   6.0081  201.977   4.7237  199.602   6.5554  204.543   6.8126  510.559   8.3885  516.832   8.6118 -6.272461 12.02206 
1 1 1    8   14   27 o  715.649   10.856  392.334   11.891   0.0000   0.0000  392.334   11.891  ?   ?   715.649   10.856 0.000000 10.85575 
1 1 1    8   14   28 o  358.484   8.4060   98.412   4.6124   95.703   6.3023  101.536   6.7686  353.417   11.651  364.008   12.148 -10.59164 16.83198 
1 1 1    8   14   29 o  174.198   15.562   23.460   4.1057   17.021   5.0080   36.660   7.1701  147.033   23.007  217.300   21.854 -70.26648 31.73175 
1 1 1    8   14   30 o  654.021   6.3872  327.495   6.3940  327.832   9.0882  327.165   8.9975  654.219   9.0758  653.558   8.9943 0.6611328 12.77761 
1 1 1    8   14   31 o  465.176   6.9797  165.696   4.9696  172.634   7.2635  159.591   6.8143  474.677   9.9971  456.405   9.7544 18.27170 13.96750 
1 1 1    8   14   32 o  155.380   14.127   18.675   3.3230   19.676   4.7840   17.742   4.6192  158.683   20.151  150.481   20.595 8.202499 28.81378 
1 1 1    8   14   33 f  572.298   7.8877  250.884   6.9095  246.213   8.4068  260.607   12.129  566.817   9.6899  582.769   13.598 -15.95197 16.69714 
1 1 1    8   14   34 o  179.593   13.699   24.903   3.7372   27.826   5.1674   21.697   5.4114  189.329   18.050  166.350   21.776 22.97925 28.28419 
1 1 1    8   14   35 o   88.763   28.322   6.0009   4.3404   18.437   11.833   4.0677   4.6656  151.699   46.531   80.106   29.246 71.59340 54.95832 
1 1 1    8   14   36 o  597.096   6.8875  273.123   6.2947  271.265   8.9513  274.941   8.8537  594.755   9.8328  598.792   9.6601 -4.037354 13.78407 
1 1 1    8   14   37 o   63.772   24.096   2.2922   3.2178   9.8698   4.7213  -4.2809   4.3973  110.444   27.915   49.690   23.238 60.75363 36.32176 
1 1 1    8   14   38 o  794.521   7.8747  483.902   9.5766  476.828   11.986  496.392   15.925  788.313   9.9335  803.597   12.947 -15.28418 16.31891 
1 1 1    8   14   39 o  481.283   7.2979  177.547   5.3761  180.676   7.7718  174.675   7.4448  485.108   10.467  477.023   10.196 8.085449 14.61221 
1 1 1    8   14   40 o  212.487   9.9505   34.664   3.2363   38.930   5.8194   32.754   3.8940  223.854   17.114  206.001   12.407 17.85323 21.13833 
1 1 1    8   14   41 o  263.781   9.6965   53.429   3.9150   48.781   5.4596   58.348   5.6170  251.164   14.260  275.250   13.332 -24.08524 19.52181 
1 1 1    8   14   42 o  270.920   8.6827   56.339   3.6005   53.799   5.6866   58.038   4.6518  263.731   14.139  274.722   11.062 -10.99146 17.95209 
1 1 1    8   14   43 o  407.923   6.9605  127.617   4.3460  126.898   7.2084  128.028   5.4474  406.015   11.599  408.336   8.7157 -2.321167 14.50869 
1 1 1    8   14   44 o  261.399   8.6604   52.482   3.4651   57.150   6.0041   50.152   4.2429  271.519   14.499  255.266   10.859 16.25328 18.11521 
1 1 1    8   14   45 o  254.236   9.1578   49.688   3.5637   49.401   5.9366   49.849   4.4558  252.011   15.465  254.331   11.446 -2.320480 19.24020 
1 1 1    8   14   46 o  295.251   8.2760   66.983   3.7401   64.808   6.4664   68.076   4.5848  288.823   14.675  297.365   10.073 -8.541595 17.79983 
1 1 1    8   14   47 o  414.208   7.2417  131.738   4.5912  137.179   7.9696  129.036   5.6169  421.346   12.357  409.579   8.9597 11.76773 15.26379 
1 1 1    8   14   48 o  352.402   9.2404   95.589   4.9843  102.963   16.926   94.888   5.2155  353.984   31.570  351.005   9.7077 2.979614 33.02906 
1 1 1    8   14   49 o  109.065   19.890   9.6316   3.1980   12.332   6.2121   8.6580   3.7304  120.253   32.829  102.271   24.206 17.98126 40.78836 
1 1 1    8   14   50 o  193.575   11.007   29.038   3.2478   34.525   4.9303   24.832   4.3168  209.920   15.453  177.680   16.046 32.23947 22.27712 
1 1 1    8   14   51 o  112.467   19.977   10.270   3.3129   13.664   4.4928   6.2269   4.9045  128.875   23.647   88.925   30.190 39.95045 38.34902 
1 1 1    8   14   52 o   64.818   23.252   2.9464   2.9322   0.9210   4.3990   4.5659   3.9336   63.607   26.710   77.707   27.013 -14.10003 37.98915 
1 1 1    8   14   53 o   75.330   25.626   4.3799   3.5338   7.8666   4.4381  -1.6598   5.8411   96.525   28.243   64.285   28.792 32.24011 40.33157 
1 1 1    8   14   54 o  202.528   11.791   31.949   3.6395   35.022   5.1997   28.997   5.0959  210.461   16.267  190.848   17.644 19.61223 23.99907 
1 1 1    8   14   55 o  165.264   13.834   21.498   3.4671   24.077   5.0104   19.128   4.8026  172.812   19.270  153.060   21.057 19.75195 28.54403 
1 1 1    8   14   56 o  101.385   24.933   8.7927   3.8423   21.291   6.5384   2.1997   4.7489  157.321   28.188   69.300   28.295 88.02152 39.93956 
1 1 1    8   14   57 o   91.756   22.848   7.1703   3.1965   7.8950   4.6011   6.4942   4.4441   95.015   28.992   87.436   28.720 7.578476 40.80868 
1 1 1    8   14   58 o  200.040   12.029   31.412   3.6661   31.871   5.2060   30.960   5.1636  198.906   17.271  195.955   17.397 2.951691 24.51394 
1 1 1    8   14   59 o  116.154   21.011   11.385   3.5979   15.387   5.4463   8.2860   4.7926  131.266   27.963   95.753   29.653 35.51234 40.75783 
1 1 1    8   14   60 o   98.817   23.929   8.6131   3.5808   16.608   5.5709   2.9845   4.6743  135.539   27.786   69.946   28.250 65.59235 39.62513 
1 1 1    8   14   61 o  120.732   18.705   12.235   3.3448   10.712   4.7093   13.786   4.7514  107.113   28.300  123.627   25.937 -16.51365 38.38762 
1 1 1    8   15    0 o  263.305   11.465   53.383   4.6008   53.383   4.6008   53.383   4.6008  263.305   11.465  263.305   11.465 0.000000 0.000000 
1 1 1    8   15    1 o  386.944   7.6926  114.631   4.5561  115.574   6.4496  113.692   6.4369  388.458   10.847  385.280   10.915 3.178192 15.38847 
1 1 1    8   15    2 o  940.093   8.1839  676.659   11.776  681.538   14.520  667.282   20.129  943.371   10.056  933.158   14.093 10.21362 17.31285 
1 1 1    8   15    3 o  198.591   9.4609   30.200   2.8758   34.061   4.1225   26.541   4.0138  210.459   12.859  185.560   14.240 24.89935 19.18712 
1 1 1    8   15    4 o  1200.53   11.884  1104.01   21.838  1131.27   31.742  1079.51   30.091  1214.69   17.073  1186.64   16.567 28.05225 23.78963 
1 1 1    8   15    5 o  972.190   10.305  723.813   15.335  733.633   21.996  714.528   21.389  978.433   14.687  965.627   14.472 12.80566 20.61913 
1 1 1    8   15    6 o  423.994   6.6697  137.618   4.3285  133.153   5.2663  146.915   7.5990  417.029   8.2503  437.971   11.336 -20.94168 14.02006 
1 1 1    8   15    7 o  777.045   7.5931  462.251   9.0310  462.419   11.092  461.921   15.555  777.120   9.3249  776.509   13.088 0.6105957 16.06976 
1 1 1    8   15    8 o  365.874   6.8698  102.476   3.8472  102.332   4.6792  102.774   6.7587  365.595   8.3619  366.306   12.054 -0.7112122 14.67076 
1 1 1    8   15    9 f  316.083   7.2349   76.484   3.5003   76.553   4.2521   76.337   6.1650  316.206   8.7854  315.686   12.759 0.5199585 15.49092 
1 1 1    8   15   10 f  1078.70   11.305  891.123   18.665  868.972   25.819  915.371   27.014  1064.86   15.841  1092.89   16.149 -28.03088 22.62135 
1 1 1    8   15   11 o  848.652   8.1067  551.375   10.530  554.343   18.378  549.925   12.849  850.638   14.115  847.464   9.9054 3.173950 17.24381 
1 1 1    8   15   12 o  1142.10   8.3021  998.611   14.513  1013.52   20.774  984.398   20.284  1150.39   11.798  1133.75   11.689 16.64014 16.60776 
1 1 1    8   15   13 o  665.966   6.4511  339.496   6.5759  331.324   9.0430  348.666   9.5797  657.839   8.9809  674.826   9.2745 -16.98676 12.91024 
1 1 1    8   15   14 o  344.649   7.7107   90.933   4.0676   85.975   6.6032   93.965   5.1637  335.033   12.876  350.319   9.6300 -15.28629 16.07914 
1 1 1    8   15   15 f  525.893   7.3402  211.714   5.9085  216.561   10.115  209.205   7.2793  531.746   12.428  522.729   9.0980 9.016602 15.40238 
1 1 1    8   15   16 o  651.491   9.6349  324.982   9.6078   0.0000   0.0000  324.982   9.6078  ?   ?   651.491   9.6349 0.000000 9.634858 
1 1 1    8   15   17 f  1127.47   9.6390  973.331   16.634  982.961   20.598  955.276   28.205  1132.90   11.879  1116.45   16.505 16.44446 20.33508 
1 1 1    8   15   18 o  475.719   7.5450  173.250   5.4939  173.973   6.8540  171.950   9.1885  476.672   9.3941  473.800   12.670 2.871887 15.77278 
1 1 1    8   15   19 o  611.602   9.5190  286.415   8.9111  286.415   8.9111   0.0000   0.0000  611.602   9.5190  ?   ?  0.000000 9.519009 
1 1 1    8   15   20 o  891.837   7.5924  608.914   10.364  617.943   14.763  600.140   14.554  898.274   10.737  885.239   10.741 13.03424 15.18735 
1 1 1    8   15   21 o  613.869   7.0429  288.485   6.6175  278.876   9.0928  299.306   9.6492  603.471   9.8439  625.176   10.084 -21.70508 14.09198 
1 1 1    8   15   22 o  601.874   6.2137  277.306   5.7243  275.299   7.1409  280.914   9.5752  599.650   7.7801  605.644   10.329 -5.993713 12.93140 
1 1 1    8   15   23 o  548.997   6.9737  230.740   5.8601  232.339   7.7739  228.637   8.9182  550.827   9.2205  546.368   10.664 4.459534 14.09754 
1 1 1    8   15   24 o  337.150   7.8923   87.032   4.0728   83.037   5.1084   94.002   6.7473  329.273   10.136  350.269   12.585 -20.99597 16.15936 
1 1 1    8   15   25 o  192.556   11.227   28.500   3.2947   30.822   3.9521   23.210   5.9653  200.135   12.971  172.261   23.216 27.87448 26.59369 
1 1 1    8   15   26 o  722.924   7.3797  400.145   8.1659  389.987   11.077  412.238   12.086  713.549   10.142  733.584   10.763 -20.03540 14.78884 
1 1 1    8   15   27 o  838.721   6.4115  538.554   8.2309  532.454   11.418  545.153   11.877  833.817   8.9462  843.685   9.1968 -9.868286 12.83026 
1 1 1    8   15   28 o  1182.02   7.4240  1069.82   13.432  1068.16   18.924  1071.52   19.068  1180.80   10.470  1182.65   10.534 -1.848999 14.85204 
1 1 1    8   15   29 o  471.412   7.0688  170.161   5.1006  176.362   7.9917  165.899   6.6255  479.759   10.883  465.385   9.3011 14.37366 14.31605 
1 1 1    8   15   30 o  178.438   12.485   24.529   3.3884   24.492   5.1719   24.556   4.4851  177.485   19.352  178.082   16.647 -0.5975647 25.52692 
1 1 1    8   15   31 o  586.968   7.0010  263.836   6.2899  265.790   9.6124  262.372   8.3179  588.902   10.664  585.202   9.2862 3.699585 14.14053 
1 1 1    8   15   32 o  382.618   7.8766  112.137   4.6129  111.777   6.3936  112.528   6.6619  381.849   10.939  383.105   11.361 -1.255554 15.77134 
1 1 1    8   15   33 o  527.908   7.2776  213.463   5.8805  217.972   9.0195  210.129   7.7555  533.160   11.052  523.599   9.6770 9.560486 14.69013 
1 1 1    8   15   34 o  408.050   8.2905  127.586   5.1780  118.802   6.7147  140.474   8.1333  393.556   11.147  427.834   12.420 -34.27759 16.68850 
1 1 1    8   15   35 o  212.632   15.048   34.932   4.8660   35.393   9.1686   34.751   5.7412  211.365   29.113  211.665   17.888 -0.3005219 34.16921 
1 1 1    8   15   36 o  315.745   8.8211   76.433   4.2631   78.030   6.1774   74.980   5.8907  318.730   12.662  312.468   12.317 6.261871 17.66453 
1 1 1    8   15   37 o  659.271   6.8454  333.031   6.9077  349.028   9.9627  318.220   9.5861  674.524   9.6496  644.055   9.7241 30.46869 13.69940 
1 1 1    8   15   38 o  123.789   21.796   12.222   3.9790   12.189   4.6149   12.316   7.8548  122.921   25.370  123.889   37.895 -0.9686279 45.60304 
1 1 1    8   15   39 o  336.124   8.6439   86.665   4.4471   88.722   6.7982   85.127   5.8797  339.583   13.079  332.826   11.542 6.756744 17.44330 
1 1 1    8   15   40 o  181.235   12.863   25.405   3.5450   25.220   5.1420   25.573   4.8939  179.456   19.009  180.950   17.905 -1.494064 26.11366 
1 1 1    8   15   41 o  313.823   9.4475   75.627   4.5381   71.994   6.1219   80.058   6.7613  305.722   13.082  322.288   13.706 -16.56598 18.94753 
1 1 1    8   15   42 o  289.369   9.6041   64.330   4.2538   73.526   6.5188   57.509   5.6137  308.736   13.795  273.101   13.429 35.63486 19.25213 
1 1 1    8   15   43 o  300.970   9.1718   69.593   4.2252   56.468   5.7596   84.888   6.2173  270.065   13.981  331.899   12.238 -61.83490 18.58101 
1 1 1    8   15   44 o  369.847   8.8631  105.103   5.0174   94.998   6.6918  118.078   7.5828  350.938   12.458  391.203   12.664 -40.26489 17.76413 
1 1 1    8   15   45 o   66.345   22.890   3.1803   2.8219   9.0543   4.8632   0.1986   3.4649  104.672   29.232   55.236   23.476 49.43680 37.49163 
1 1 1    8   15   46 o  248.667   9.2163   47.569   3.5079   44.451   5.9861   49.199   4.3291  238.486   16.500  252.582   11.198 -14.09618 19.94091 
1 1 1    8   15   47 o   99.063   23.234   8.0687   3.4620   17.741   14.068   7.4452   3.5718  143.673   50.994   95.033   24.423 48.63945 56.54115 
1 1 1    8   15   48 o   44.039   20.500  -2.8947   3.3587   24.585   11.171  -5.6259   3.5217  165.533   43.514   39.252   19.011 126.2813 47.48587 
1 1 1    8   15   49 o  159.022   13.941   19.777   3.3590   15.405   6.3424   21.482   3.9600  134.588   31.368  165.281   15.847 -30.69351 35.14352 
1 1 1    8   15   50 o  147.612   18.052   17.342   3.9936   12.564   6.3878   20.409   5.1170  120.786   33.421  159.085   21.571 -38.29887 39.77752 
1 1 1    8   15   51 o  154.404   15.505   18.797   3.6148   12.674   6.7951   21.214   4.2690  120.681   34.843  163.551   17.316 -42.86999 38.90863 
1 1 1    8   15   52 o  303.349   9.6655   71.031   4.4878   54.951   7.6215   79.566   5.5525  262.968   19.065  320.550   11.317 -57.58191 22.17047 
1 1 1    8   15   53 o  141.348   21.465   16.293   4.4979   15.845   6.6103   16.679   6.1379  134.641   32.456  139.490   29.661 -4.849472 43.96746 
1 1 1    8   15   54 o  158.765   16.577   20.059   3.9690   11.431   7.0394   24.080   4.8057  113.598   36.049  173.370   18.391 -59.77232 40.46903 
1 1 1    8   15   55 o  171.998   14.936   23.405   3.8930   18.545   6.8060   25.768   4.7461  145.053   31.552  179.475   17.499 -34.42130 36.08027 
1 1 1    8   15   56 o  240.324   11.893   45.036   4.3749   35.345   7.2019   50.703   5.5075  206.617   23.172  253.613   14.245 -46.99605 27.20049 
1 1 1    8   15   57 o   90.318   23.088   6.9732   3.2039   10.809   4.6165   3.4084   4.4502  110.914   27.362   72.339   28.080 38.57434 39.20679 
1 1 1    8   15   58 o  126.836   17.986   13.166   3.3940   16.462   4.8826   10.084   4.7212  138.995   23.806  106.093   28.477 32.90208 37.11685 
1 1 1    8   15   59 o  350.190   13.812   97.178   7.4036   0.0000   0.0000   97.178   7.4036  ?   ?   350.190   13.812 0.000000 13.81231 
1 1 1    8   15   60 o  174.408   13.061   24.230   3.4613   25.657   5.0050   22.923   4.7921  175.861   18.890  165.915   19.226 9.945160 26.95303 
1 1 1    8   15   61 o   81.747   25.483   6.0070   3.5329   14.186   4.8787  -3.0099   5.1226  124.882   26.352   53.996   25.195 70.88638 36.45822 
1 1 1    8   16    0 o  1016.50   14.977  791.797   23.291  791.797   23.291  791.797   23.291  1016.50   14.977  1016.50   14.977 0.000000 0.000000 
1 1 1    8   16    1 o  1295.68   12.592  1285.95   24.973  1295.04   35.598  1277.15   35.042  1299.66   17.895  1290.68   17.738 8.984009 25.19657 
1 1 1    8   16    2 o  441.041   7.8311  148.918   5.2865  148.327   7.3531  149.550   7.6059  440.093   10.916  441.896   11.245 -1.802338 15.67184 
1 1 1    8   16    3 o  965.556   10.297  713.921   15.219  699.846   21.122  729.116   21.946  955.719   14.439  975.480   14.698 -19.76068 20.60418 
1 1 1    8   16    4 o  591.148   8.3513  267.545   7.5565  255.713   10.337  281.124   11.074  577.822   11.688  605.843   11.942 -28.02051 16.70965 
1 1 1    8   16    5 o  952.141   10.254  694.207   14.944  688.646   20.976  699.940   21.297  948.054   14.455  955.789   14.557 -7.734924 20.51499 
1 1 1    8   16    6 o  889.413   8.1404  605.620   11.082  604.547   13.635  607.706   19.022  888.545   10.025  890.641   13.954 -2.095581 17.18173 
1 1 1    8   16    7 f  1224.01   9.9786  1147.19   18.695  1150.56   23.046  1140.68   31.970  1225.65   12.285  1219.92   17.121 5.725830 21.07262 
1 1 1    8   16    8 o  427.063   6.9052  139.614   4.5137  138.268   5.5292  142.303   7.8151  424.972   8.5003  431.054   11.845 -6.081970 14.57937 
1 1 1    8   16    9 o  1436.55   13.861  1580.87   30.478  1555.73   42.494  1607.50   43.738  1424.41   19.490  1447.88   19.736 -23.46826 27.73794 
1 1 1    8   16   10 o  1518.60   14.466  1766.75   33.626  1727.03   46.374  1810.79   48.828  1500.69   20.189  1536.57   20.761 -35.87305 28.95887 
1 1 1    8   16   11 o  214.188   9.1814   35.125   3.0101   35.162   4.9591   35.103   3.7876  213.680   15.263  213.780   11.619 -0.9947205E-01 19.18202 
1 1 1    8   16   12 o  947.902   8.6106  687.898   12.493  705.493   21.861  679.366   15.224  959.601   14.884  941.919   10.559 17.68225 18.24906 
1 1 1    8   16   13 o  427.596   7.2979  139.965   4.7764  143.150   8.1085  138.273   5.9108  432.331   12.253  424.973   9.0869 7.358215 15.25501 
1 1 1    8   16   14 o  361.838   6.8072  100.223   3.7701   94.494   5.0688  107.318   5.6403  351.306   9.4264  374.378   9.8429 -23.07208 13.62866 
1 1 1    8   16   15 o  795.656   7.0221  484.618   8.5519  475.803   11.882  494.092   12.318  788.291   9.8477  803.291   10.019 -14.99976 14.04807 
1 1 1    8   16   16 o  563.659   6.5166  243.203   5.6222  244.321   7.8983  242.055   8.0048  564.893   9.1348  562.262   9.3012 2.630554 13.03680 
1 1 1    8   16   17 o  991.537   9.0242  752.749   13.696  748.127   16.672  762.339   24.017  988.381   11.021  997.383   15.732 -9.001709 19.20791 
1 1 1    8   16   18 o  1025.22   11.313  804.989   17.753  804.989   17.753   0.0000   0.0000  1025.22   11.313  ?   ?  0.000000 11.31295 
1 1 1    8   16   19 o  385.233   8.2554  113.622   4.8678  113.227   6.0446  114.351   8.2110  384.521   10.270  386.324   13.886 -1.802826 17.27115 
1 1 1    8   16   20 f  546.724   7.9382  228.848   6.6430  230.599   8.2401  225.596   11.227  548.756   9.8103  542.624   13.518 6.131592 16.70259 
1 1 1    8   16   21 o  721.946   7.3476  399.027   8.1193  413.414   11.677  385.559   11.298  734.716   10.383  709.532   10.403 25.18481 14.69786 
1 1 1    8   16   22 o  608.851   7.3408  283.806   6.8411  283.630   9.6441  283.985   9.7056  608.550   10.354  608.928   10.413 -0.3775635 14.68454 
1 1 1    8   16   23 o  1044.93   7.4718  835.964   11.950  852.982   15.555  811.451   18.669  1055.37   9.6293  1029.18   11.851 26.19128 15.26993 
1 1 1    8   16   24 o  641.108   7.4026  314.691   7.2641  313.846   8.1117  318.112   16.323  640.213   8.2778  644.041   16.558 -3.827454 18.51192 
1 1 1    8   16   25 o  637.528   10.035  311.311   9.7925  315.476   12.239  303.900   16.325  641.637   12.462  629.417   16.945 12.21948 21.03414 
1 1 1    8   16   26 o  161.991   14.289   20.274   3.5066   22.632   4.1430   14.318   6.5844  171.032   16.012  133.533   32.518 37.49860 36.24661 
1 1 1    8   16   27 o  244.360   8.7385   45.731   3.2684   46.528   4.5872   44.908   4.6580  246.400   12.163  241.730   12.633 4.670334 17.53666 
1 1 1    8   16   28 o  454.433   6.5897  158.113   4.5836  154.556   6.3762  161.918   6.5935  449.195   9.2738  459.765   9.3693 -10.57007 13.18290 
1 1 1    8   16   29 o  448.009   6.7436  153.685   4.6243  148.751   6.3955  159.091   6.6943  440.651   9.4822  455.703   9.5974 -15.05157 13.49159 
1 1 1    8   16   30 o   73.290   22.919   4.0972   2.8553   8.5487   4.0236  -0.4186   4.0526  103.253   25.589   58.102   25.053 45.15164 35.81124 
1 1 1    8   16   31 o  701.488   7.5251  376.896   8.0798  387.399   11.871  367.829   11.029  710.888   10.909  692.752   10.401 18.13611 15.07320 
1 1 1    8   16   32 o  628.214   7.6324  302.310   7.3390  307.571   12.639  299.635   9.0143  633.100   13.043  625.279   9.4186 7.821533 16.08839 
1 1 1    8   16   33 o  357.259   8.1970   97.796   4.4823   96.527   6.8152   98.764   5.9505  354.650   12.555  358.863   10.833 -4.213196 16.58242 
1 1 1    8   16   34 o  279.160   10.770   59.778   4.6018   51.227   9.0588   62.753   5.3424  256.312   23.346  285.927   12.207 -29.61456 26.34521 
1 1 1    8   16   35 o  578.212   6.7430  256.125   5.9678  254.611   8.4327  257.644   8.4467  576.208   9.5613  579.635   9.5206 -3.427063 13.49301 
1 1 1    8   16   36 f  402.554   7.9669  124.213   4.9089  137.279   6.7089  109.158   7.2018  422.966   10.363  376.940   12.482 46.02579 16.22333 
1 1 1    8   16   37 o  360.741   10.264   99.882   5.6673  101.320   6.1382   91.575   14.754  363.246   11.040  341.011   28.529 22.23547 30.59081 
1 1 1    8   16   38 o  465.755   9.2313  166.445   6.5810  172.669   8.4587  156.899   10.475  474.023   11.658  451.221   15.167 22.80154 19.12986 
1 1 1    8   16   39 o  317.470   8.8859   77.336   4.3179   76.515   6.5284   77.975   5.7570  315.235   13.530  318.459   11.811 -3.224091 17.95981 
1 1 1    8   16   40 f  308.937   9.0605   73.263   4.2844   69.129   5.6008   79.094   6.6521  299.729   12.208  320.400   13.564 -20.67126 18.24909 
1 1 1    8   16   41 o  502.879   7.2601  193.949   5.5882  198.474   8.0808  189.801   7.7363  508.148   10.389  496.966   10.170 11.18234 14.53886 
1 1 1    8   16   42 o   36.735   17.774  -4.9264   3.0596  -4.6480   4.4751  -5.1708   4.1925   49.176   23.139   45.885   21.828 3.290821 31.80955 
1 1 1    8   16   43 o  230.627   10.990   40.947   3.8795   39.321   5.7278   42.325   5.2733  224.524   16.788  233.457   14.834 -8.933426 22.40326 
1 1 1    8   16   44 o  200.710   12.564   31.212   3.8403   26.995   5.2485   36.071   5.6338  185.157   18.779  214.710   17.289 -29.55325 25.52597 
1 1 1    8   16   45 o  387.587   8.4638  115.456   5.0211  114.971   7.1240  115.935   7.0781  385.933   12.060  387.583   11.931 -1.650177 16.96450 
1 1 1    8   16   46 f  172.426   15.316   23.263   4.0000   20.215   6.0018   25.698   5.3653  157.461   25.796  180.032   19.797 -22.57108 32.51690 
1 1 1    8   16   47 o  124.346   25.719   12.768   4.7334   12.299   10.946   12.876   5.2496  123.990   44.868  124.140   28.262 -0.1506119 53.02666 
1 1 1    8   16   48 o   76.479   26.506   4.3412   3.7857   12.409   5.7005  -2.0244   5.0634  121.025   30.720   59.155   26.626 61.86979 40.65256 
1 1 1    8   16   49 o   87.609   26.836   6.2622   3.9376   5.1511   5.8300   7.1942   5.3394   86.976   32.522   94.716   31.498 -7.740242 45.27505 
1 1 1    8   16   50 o  238.109   13.167   44.143   4.7802   41.511   7.7882   45.734   6.0549  227.099   22.710  241.218   16.498 -14.11942 28.07014 
1 1 1    8   16   51 o  201.763   11.946   31.655   3.6726   31.590   6.4800   31.686   4.4577  198.020   21.737  201.089   14.582 -3.068787 26.17497 
1 1 1    8   16   52 o  201.414   14.712   31.844   4.5042   22.625   6.3755   41.030   6.3642  165.048   26.105  227.211   18.459 -62.16302 31.97229 
1 1 1    8   16   53 o   45.777   21.903  -5.4858   4.3519  -6.1704   5.9868  -4.7186   6.3372   55.477   26.301   60.247   28.082 -4.769180 38.47515 
1 1 1    8   16   54 o   49.481   22.469  -1.7771   3.7006  -7.2446   6.3781   0.9973   4.5435   55.786   26.643   64.173   27.057 -8.387077 37.97313 
1 1 1    8   16   55 o  217.963   12.516   37.188   4.1582   38.352   6.7054   36.461   5.3004  217.452   20.384  214.170   16.291 3.281326 26.09406 
1 1 1    8   16   56 o   55.425   23.765   0.3234   3.6079  -1.5320   6.4190   1.1803   4.3621   66.425   29.931   63.200   26.572 3.224895 40.02388 
1 1 1    8   16   57 o  158.906   16.116   20.265   3.8656   19.121   6.8412   20.802   4.6852  145.346   31.648  159.289   19.632 -13.94295 37.24273 
1 1 1    8   16   58 o  239.426   14.253   45.548   5.1996   0.0000   0.0000   45.548   5.1996  ?   ?   239.426   14.253 0.000000 14.25268 
1 1 1    8   16   59 o   78.211   27.006   5.2027   3.9283 -11.9785   8.3465   10.092   4.4523   57.553   28.180  105.392   27.360 -47.83881 39.27650 
1 1 1    8   16   60 o   88.179   25.309   7.0060   3.5947   6.4589   6.0844   7.2994   4.4555   86.259   33.004   89.053   28.724 -2.793579 43.75297 
1 1 1    8   17    0 o  1104.08   15.940  934.100   26.925  934.100   26.925  934.100   26.925  1104.08   15.940  1104.08   15.940 0.000000 0.000000 
1 1 1    8   17    1 o  472.529   8.0055  170.938   5.7901  167.432   8.0583  174.679   8.3252  467.585   11.259  477.594   11.388 -10.00842 16.01462 
1 1 1    8   17    2 o  1660.77   15.419  2113.37   39.197  2112.90   55.402  2113.84   55.463  1659.59   21.810  1659.96   21.829 -0.3659668 30.85742 
1 1 1    8   17    3 o  1127.45   11.444  973.455   19.748  982.570   28.204  964.688   27.660  1132.33   16.273  1122.00   16.106 10.33594 22.89593 
1 1 1    8   17    4 o  1941.03   17.669  2887.85   52.493  2862.06   73.453  2914.77   75.046  1930.88   24.853  1948.51   25.163 -17.62305 35.36735 
1 1 1    8   17    5 o  1584.17   14.865  1922.71   36.044  1915.26   50.717  1930.32   51.236  1580.25   20.968  1586.42   21.100 -6.178345 29.74694 
1 1 1    8   17    6 o  681.899   12.531  356.134   13.079   0.0000   0.0000  356.134   13.079  ?   ?   681.899   12.531 0.000000 12.53110 
1 1 1    8   17    7 o  981.684   14.942  738.339   22.451   0.0000   0.0000  738.339   22.451  ?   ?   981.684   14.942 0.000000 14.94157 
1 1 1    8   17    8 o  217.299   11.036   36.252   3.6584   37.533   5.2159   35.011   5.1326  220.783   15.534  213.170   15.844 7.613419 22.18828 
1 1 1    8   17    9 o  818.445   13.787  513.120   17.272   0.0000   0.0000  513.120   17.272  ?   ?   818.445   13.787 0.000000 13.78722 
1 1 1    8   17   10 o  583.159   7.2807  260.331   6.4988  259.225   7.9357  262.583   11.324  581.882   8.9101  585.525   12.635 -3.643494 15.46091 
1 1 1    8   17   11 o  1293.19   10.524  1280.56   20.831  1291.32   25.758  1260.21   35.414  1298.43   12.960  1282.20   18.045 16.23340 22.21668 
1 1 1    8   17   12 o  1016.44   7.8304  790.927   12.182  779.204   16.974  803.381   17.495  1008.73   10.994  1024.25   11.160 -15.52014 15.66498 
1 1 1    8   17   13 f  936.019   7.5165  670.709   10.769  675.999   15.342  665.570   15.120  939.567   10.668  932.295   10.595 7.272095 15.03549 
1 1 1    8   17   14 o  1171.79   8.5912  1051.26   15.409  1044.71   21.622  1058.01   21.965  1167.92   12.095  1175.32   12.210 -7.404785 17.18654 
1 1 1    8   17   15 o  627.610   6.7592  301.527   6.4931  304.920   8.9999  297.845   9.3770  631.060   9.3175  623.681   9.8227 7.379822 13.53885 
1 1 1    8   17   16 o  779.926   8.1216  465.701   9.6953  473.679   11.990  450.627   16.480  786.506   9.9595  766.919   14.039 19.58704 17.21308 
1 1 1    8   17   17 o  920.789   7.5885  649.091   10.695  649.914   15.055  648.253   15.197  921.221   10.677  920.037   10.791 1.184326 15.18046 
1 1 1    8   17   18 o  1345.62   9.5339  1386.51   19.636  1364.42   27.198  1410.56   28.380  1334.51   13.315  1356.84   13.665 -22.33350 19.07957 
1 1 1    8   17   19 o  485.783   7.1320  180.661   5.3030  179.154   7.3304  182.316   7.6809  483.680   9.9015  487.917   10.285 -4.237244 14.27651 
1 1 1    8   17   20 o  564.362   7.2297  243.841   6.2452  246.141   8.6245  241.306   9.0554  566.930   9.9389  561.311   10.540 5.618835 14.48690 
1 1 1    8   17   21 o  294.557   10.359   66.451   4.6706   67.621   5.8848   64.460   7.6777  297.077   12.942  289.391   17.414 7.685364 21.69668 
1 1 1    8   17   22 f  910.970   11.122  635.687   15.507  635.687   15.507   0.0000   0.0000  910.970   11.122  ?   ?  0.000000 11.12151 
1 1 1    8   17   23 o  706.409   9.0613  382.147   9.7975  392.448   11.774  358.958   17.665  715.775   10.747  684.104   16.870 31.67126 20.00285 
1 1 1    8   17   24 o  1148.60   10.400  1010.57   18.284  991.981   31.039  1020.45   22.627  1137.01   17.835  1153.94   12.811 -16.92639 21.95919 
1 1 1    8   17   25 o  462.452   7.2163  163.746   5.1080  167.383   6.3194  156.891   8.6758  467.506   8.8311  452.461   12.527 15.04562 15.32714 
1 1 1    8   17   26 o  1091.83   8.6965  912.965   14.533  914.954   20.008  910.744   21.145  1092.67   11.963  1090.06   12.673 2.606079 17.42808 
1 1 1    8   17   27 o   64.300   24.138   2.3453   3.2177   1.0224   3.7395   6.1182   6.3152   61.409   25.095   95.878   34.152 -34.46908 42.38073 
1 1 1    8   17   28 o  119.567   16.278   11.174   2.9017   11.450   4.3030   10.945   3.9295  119.790   24.299  117.283   22.710 2.507164 33.25959 
1 1 1    8   17   29 o  234.070   9.2517   41.975   3.3146   41.847   4.6022   42.113   4.7780  233.237   12.942  233.939   13.399 -0.7018127 18.62900 
1 1 1    8   17   30 f  214.863   14.607   35.599   4.7752   35.599   4.7752   0.0000   0.0000  214.863   14.607  ?   ?  0.000000 14.60666 
1 1 1    8   17   31 o  264.920   9.1951   53.783   3.7286   56.837   5.2717   50.725   5.2743  272.178   12.654  256.735   13.469 15.44339 18.48052 
1 1 1    8   17   32 o  911.327   6.8383  636.127   9.5387  638.469   13.493  633.787   13.486  912.631   9.6594  909.274   9.6901 3.357117 13.68218 
1 1 1    8   17   33 o  195.549   14.713   29.553   4.3716   23.905   13.038   30.269   4.6402  170.429   47.958  197.818   15.448 -27.38910 50.38413 
1 1 1    8   17   34 o  472.437   7.3717  171.018   5.3307  169.409   8.0957  172.251   7.0828  469.838   11.257  473.925   9.7640 -4.086639 14.90181 
1 1 1    8   17   35 o  624.340   7.0973  298.685   6.7824  315.007   10.747  287.880   8.7437  640.631   10.960  612.672   9.3239 27.95880 14.38915 
1 1 1    8   17   36 o  545.620   7.8053  228.208   6.5185  230.402   7.9878  223.834   11.278  548.017   9.5228  539.456   13.659 8.561523 16.65104 
1 1 1    8   17   37 o  239.576   10.287   44.064   3.7721   43.157   5.0566   45.201   5.6640  236.372   14.039  241.704   15.390 -5.332031 20.83162 
1 1 1    8   17   38 o  139.294   16.921   15.201   3.5336   21.703   5.2173   9.6908   4.8028  165.955   21.010  109.106   28.461 56.84903 35.37601 
1 1 1    8   17   39 o  410.465   10.612  129.459   6.6670  129.459   6.6670   0.0000   0.0000  410.465   10.612  ?   ?  0.000000 10.61169 
1 1 1    8   17   40 o  128.417   16.121   12.943   3.0990   6.7990   4.2082   20.223   4.5807   92.266   27.631  160.342   19.036 -68.07619 33.55387 
1 1 1    8   17   41 o  360.775   9.5985  100.008   5.3004  102.157   6.3624   95.133   9.5822  364.334   11.409  349.705   17.962 14.62897 21.27937 
1 1 1    8   17   42 o  324.767   8.4256   80.992   4.1884   81.878   6.0548   80.180   5.7999  325.948   12.136  322.623   11.745 3.325653 16.88879 
1 1 1    8   17   43 o  210.384   11.553   34.211   3.7061   30.405   5.0488   38.658   5.4576  197.166   16.893  222.683   16.121 -25.51707 23.35067 
1 1 1    8   17   44 o  337.586   9.1724   87.639   4.7395   88.962   7.1734   86.614   6.3139  339.093   13.821  334.961   12.315 4.132263 18.51163 
1 1 1    8   17   45 o  377.179   9.4465  109.474   5.4537  106.961   7.5886  112.158   7.8430  371.820   13.334  380.707   13.459 -8.886444 18.94586 
1 1 1    8   17   46 o  423.388   10.108  138.103   6.5504  147.202   13.632  135.372   7.4692  432.622   20.586  418.723   11.654 13.89978 23.65579 
1 1 1    8   17   47 o  108.525   27.850   9.8519   4.6493   11.426   11.475   9.5427   5.0855  121.918   45.619  106.706   29.925 15.21135 54.55857 
1 1 1    8   17   48 o  311.798   10.019   74.962   4.7816   76.465   7.0003   73.647   6.5469  313.600   14.584  307.994   13.888 5.606598 20.13826 
1 1 1    8   17   49 o  139.907   24.532   16.093   5.0620   16.946   5.8634   13.594   10.031  142.337   27.910  125.681   43.168 16.65584 51.40505 
1 1 1    8   17   50 o  324.787   10.429   81.486   5.1845   77.225   7.9911   84.584   6.8130  313.496   16.714  329.873   13.493 -16.37726 21.48071 
1 1 1    8   17   51 o  104.791   24.829   9.2061   3.9213   2.0320   5.6593   15.831   5.4385   74.156   30.649  137.367   26.828 -63.21088 40.73264 
1 1 1    8   17   52 o  365.245   10.387  103.185   5.8067   97.022   7.7416  111.112   8.7797  352.482   14.349  376.737   15.225 -24.25525 20.92160 
1 1 1    8   17   53 o  104.099   27.045   9.2694   4.3482   6.0964   6.2098   12.322   6.0906   90.409   33.612  118.188   32.606 -27.77979 46.82908 
1 1 1    8   17   54 o  145.268   20.443   17.231   4.4198   11.558   6.2613   22.866   6.2398  113.709   33.625  165.077   25.519 -51.36806 42.21186 
1 1 1    8   17   55 o  110.801   26.800   10.654   4.4956   7.6715   6.1567   14.060   6.5798   95.446   33.750  124.141   33.744 -28.69528 47.72541 
1 1 1    8   17   56 o   85.923   28.791   6.2275   4.4598   6.2098   6.6131   6.2422   6.0400   89.908   34.406   88.791   33.122 1.116928 47.75829 
1 1 1    8   17   57 o  108.376   24.189   10.148   3.9109  -0.7644   7.3879   14.396   4.6098   71.914   32.283  129.660   24.115 -57.74576 40.29543 
1 1 1    8   17   58 o  166.318   17.148   22.510   4.3026   14.128   9.5247   24.659   4.8228  116.533   41.896  173.348   18.460 -56.81541 45.78276 
1 1 1    8   17   59 o  183.440   13.855   26.908   3.8614   24.158   6.3551   28.518   4.8618  165.327   25.970  186.757   17.201 -21.43056 31.14979 
1 1 1    8   17   60 o   64.983   25.939   2.6902   3.8907   11.281   6.1100  -3.1693   5.0460  106.326   33.568   53.274   24.908 53.05149 41.79987 
1 1 1    8   18    0 o  1057.98   15.512  857.678   25.108  857.678   25.108  857.678   25.108  1057.98   15.512  1057.98   15.512 0.000000 0.000000 
1 1 1    8   18    1 o  640.289   8.5520  313.866   8.3813  312.088   11.818  315.665   11.888  638.361   12.095  642.008   12.098 -3.647156 17.10701 
1 1 1    8   18    2 o  598.170   8.4054  273.928   7.6957  276.136   10.875  271.713   10.892  600.476   11.832  595.643   11.947 4.832825 16.81436 
1 1 1    8   18    3 o  1197.66   16.951  1099.27   31.074   0.0000   0.0000  1099.27   31.074  ?   ?   1197.66   16.951 0.000000 16.95121 
1 1 1    8   18    4 o  465.075   11.807  165.644   8.4052   0.0000   0.0000  165.644   8.4052  ?   ?   465.075   11.807 0.000000 11.80747 
1 1 1    8   18    5 o  701.700   12.796  377.122   13.743   0.0000   0.0000  377.122   13.743  ?   ?   701.700   12.796 0.000000 12.79570 
1 1 1    8   18    6 o  1328.53   10.698  1351.51   21.754  1366.44   27.058  1324.21   36.584  1335.65   13.235  1314.36   18.185 21.29272 22.49115 
1 1 1    8   18    7 o  807.176   7.9882  498.783   9.8693  495.092   12.090  506.155   17.087  804.120   9.8226  812.874   13.733 -8.753235 16.88463 
1 1 1    8   18    8 o  1191.93   9.9389  1087.80   18.132  1074.82   22.003  1115.27   32.011  1184.65   12.134  1206.29   17.337 -21.63367 21.16165 
1 1 1    8   18    9 o  1073.49   9.2948  882.315   15.272  900.896   19.163  849.961   25.286  1084.61   11.543  1053.21   15.685 31.40125 19.47486 
1 1 1    8   18   10 o  487.586   7.2848  181.994   5.4367  184.485   6.7299  177.314   9.2243  490.878   8.9570  481.151   12.525 9.727631 15.39828 
1 1 1    8   18   11 o  474.806   7.4331  172.582   5.4021  169.903   6.6094  177.973   9.3756  471.071   9.1666  482.033   12.707 -10.96207 15.66851 
1 1 1    8   18   12 o  1010.83   7.8482  782.234   12.143  786.881   17.261  777.681   17.085  1013.66   11.125  1007.72   11.077 5.940674 15.69903 
1 1 1    8   18   13 o  712.271   6.8367  388.365   7.4535  382.479   10.375  394.644   10.715  706.766   9.5901  717.912   9.7514 -11.14545 13.67698 
1 1 1    8   18   14 o  819.264   8.2782  513.871   10.381  511.171   12.655  519.425   18.149  817.031   10.120  823.360   14.401 -6.328796 17.60109 
1 1 1    8   18   15 o  561.309   7.6571  241.208   6.5787  240.380   8.0172  242.913   11.510  560.298   9.3483  563.094   13.355 -2.795410 16.30149 
1 1 1    8   18   16 o  1382.03   9.7197  1462.58   20.561  1469.88   29.159  1455.37   28.997  1385.07   13.754  1378.22   13.746 6.847900 19.44503 
1 1 1    8   18   17 f  890.643   7.5754  607.300   10.327  607.041   14.468  607.570   14.745  890.298   10.617  890.674   10.816 -0.3762817 15.15603 
1 1 1    8   18   18 o  428.703   7.3932  140.704   4.8513  136.561   6.6911  145.297   7.0441  422.271   10.352  435.561   10.566 -13.29041 14.79213 
1 1 1    8   18   19 o  1284.47   9.3219  1263.42   18.327  1266.00   25.867  1260.81   25.971  1285.41   13.147  1282.76   13.227 2.646362 18.64963 
1 1 1    8   18   20 o  905.410   9.0946  627.751   12.604  628.536   15.251  626.059   22.385  905.852   10.999  903.610   16.185 2.242310 19.56881 
1 1 1    8   18   21 o  438.742   9.4200  147.417   6.3260  141.576   7.3871  163.479   12.250  429.902   11.226  461.659   17.336 -31.75650 20.65383 
1 1 1    8   18   22 o  1348.77   13.815  1394.34   28.521  1394.34   28.521   0.0000   0.0000  1348.77   13.815  ?   ?  0.000000 13.81517 
1 1 1    8   18   23 f  725.996   10.870  403.774   12.080  393.310   17.215  413.922   16.954  716.143   15.705  734.728   15.076 -18.58453 21.76996 
1 1 1    8   18   24 o  530.901   9.1444  215.868   7.4308  209.967   9.1774  227.102   12.662  523.484   11.454  544.183   15.202 -20.69928 19.03356 
1 1 1    8   18   25 o  361.382   9.8510  100.040   5.4490  104.955   7.7946   95.342   7.6205  369.991   13.764  352.622   14.119 17.36902 19.71752 
1 1 1    8   18   26 o  187.134   12.070   26.952   3.4389   28.730   4.0462   22.327   6.5265  193.074   13.782  168.260   26.194 24.81444 29.59826 
1 1 1    8   18   27 o  292.092   9.7121   65.365   4.3421   71.777   5.3044   52.340   7.5597  306.026   11.324  260.287   19.109 45.73975 22.21200 
1 1 1    8   18   28 o  492.652   12.612  186.117   9.5104   0.0000   0.0000  186.117   9.5104  ?   ?   492.652   12.612 0.000000 12.61213 
1 1 1    8   18   29 o  802.482   8.0068  493.287   9.8348  484.191   12.813  506.330   15.343  794.788   10.533  812.521   12.337 -17.73309 16.22143 
1 1 1    8   18   30 o   35.860   17.268  -4.2907   2.8049 -10.8885   3.8424   3.2354   4.1039   34.342   17.199   73.590   27.332 -39.24781 32.29295 
1 1 1    8   18   31 o  750.975   6.5236  431.931   7.4986  428.158   10.450  435.936   10.766  747.420   9.1344  754.155   9.3269 -6.735168 13.05484 
1 1 1    8   18   32 o  795.039   7.4817  484.274   9.1046  475.499   14.844  489.566   11.527  787.068   12.322  799.115   9.4243 -12.04749 15.51284 
1 1 1    8   18   33 o  257.216   8.7463   50.717   3.4434   51.508   4.8114   49.887   4.9302  259.015   12.136  254.872   12.638 4.143341 17.52145 
1 1 1    8   18   34 o  247.267   8.8801   46.881   3.3609   51.049   4.7689   42.768   4.7373  257.818   12.085  235.537   13.193 22.28104 17.89144 
1 1 1    8   18   35 o  263.635   11.204   53.369   4.5213   58.025   5.3890   42.301   8.3087  274.754   12.814  232.222   23.708 42.53134 26.94951 
1 1 1    8   18   36 o  195.918   11.207   29.578   3.3466   37.834   5.0503   23.114   4.4686  221.120   15.011  172.217   17.182 48.90326 22.81507 
1 1 1    8   18   37 o  371.586   8.0454  105.890   4.5759  111.327   6.9570  101.744   6.0749  380.536   11.944  363.927   10.906 16.60925 16.17410 
1 1 1    8   18   38 o  258.864   9.8018   51.456   3.8837   45.397   5.1463   59.473   5.9193  242.338   13.933  277.474   13.982 -35.13599 19.73874 
1 1 1    8   18   39 o  146.982   14.709   16.833   3.2648   16.149   4.4737   17.612   4.7752  142.582   21.140  148.918   21.578 -6.335983 30.20765 
1 1 1    8   18   40 o  465.815   7.9300  166.500   5.6540  168.550   7.5825  163.933   8.4855  468.192   10.581  461.422   12.015 6.769104 16.00945 
1 1 1    8   18   41 o  234.103   9.9324   42.134   3.5590   41.703   4.9986   42.578   5.0686  231.940   14.148  234.359   14.197 -2.419312 20.04252 
1 1 1    8   18   42 o  247.328   9.8481   47.046   3.7282   49.037   5.4237   45.262   5.1331  251.468   14.149  241.611   13.939 9.856628 19.86169 
1 1 1    8   18   43 o  277.877   9.6402   59.401   4.1002   53.787   5.5370   66.216   6.1012  263.365   13.783  292.635   13.621 -29.26923 19.37846 
1 1 1    8   18   44 o  165.829   13.677   21.421   3.4405   23.878   4.9465   19.119   4.7884  173.825   18.896  154.809   20.728 19.01578 28.04870 
1 1 1    8   18   45 o  113.581   19.932   10.396   3.3388   6.8120   4.7361   13.938   4.7076   92.316   29.598  130.584   24.451 -38.26752 38.39140 
1 1 1    8   18   46 o  101.699   27.627   8.6072   4.4122   1.4352   10.824   10.036   4.8319   95.196   40.997  109.497   28.539 -14.30059 49.95239 
1 1 1    8   18   47 o  100.670   24.203   8.3917   3.6834   2.3425   5.3344   13.904   5.0922   74.322   30.122  129.396   26.600 -55.07378 40.18586 
1 1 1    8   18   48 o  423.675   10.394  138.528   6.7404  142.398   8.1394  130.082   12.025  428.796   12.401  406.415   19.330 22.38116 22.96643 
1 1 1    8   18   49 f  139.909   19.291   15.705   4.0212   14.506   6.0119   16.676   5.4095  130.305   30.655  141.825   25.872 -11.51996 40.11366 
1 1 1    8   18   50 o   87.145   26.229   6.2685   3.7848   5.6717   5.4982   6.8060   5.2177   87.622   31.785   92.131   31.140 -4.508904 44.49707 
1 1 1    8   18   51 o  177.765   16.545   25.009   4.4501   29.977   6.1229   19.447   6.4790  192.880   21.083  151.434   29.008 41.44588 35.86059 
1 1 1    8   18   52 o  158.140   18.503   20.056   4.3941   18.911   6.6269   20.955   5.8702  148.180   30.242  158.872   24.963 -10.69225 39.21368 
1 1 1    8   18   53 o  130.947   22.397   14.192   4.3278   15.797   6.3050   12.763   5.9511  134.077   31.293  120.164   31.844 13.91283 44.64649 
1 1 1    8   18   54 o  209.712   18.667   35.378   5.9292   19.683   9.9227   44.094   7.3944  142.110   42.401  232.855   20.972 -90.74570 47.30351 
1 1 1    8   18   55 o   92.892   28.298   7.4911   4.3863   2.7890   6.3870   11.688   6.0343   77.929   32.413  113.397   32.862 -35.46821 46.15744 
1 1 1    8   18   56 o   81.077   28.337   5.3698   4.3314   5.7793   6.1416   4.9646   6.1098   86.891   33.179   83.769   32.794 3.121971 46.65093 
1 1 1    8   18   57 f   68.098   27.926   2.3341   4.6511   6.2017   7.1762  -0.4673   6.1075   89.583   35.394   66.419   29.616 23.16382 46.15048 
1 1 1    8   18   58 o  120.574   27.209   13.111   4.9023   12.840   8.5548   13.244   5.9819  111.740   39.755  117.788   32.239 -6.047760 51.18422 
1 1 1    8   18   59 o  145.484   19.781   17.805   4.2908   11.936   6.0184   23.871   6.1190  110.173   33.056  164.606   25.079 -54.43333 41.49245 
1 1 1    8   19    0 o  1138.85   16.402  993.864   28.578  993.864   28.578  993.864   28.578  1138.85   16.402  1138.85   16.402 0.000000 0.000000 
1 1 1    8   19    1 o  901.300   10.068  622.005   13.889  624.177   19.675  619.847   19.610  902.649   14.241  899.513   14.243 3.136047 20.14116 
1 1 1    8   19    2 o  306.297   8.9354   71.828   4.1891   69.288   5.9342   74.352   5.9145  300.769   12.890  311.574   12.402 -10.80545 17.88755 
1 1 1    8   19    3 o  1596.81   21.266  1955.73   51.978   0.0000   0.0000  1955.73   51.978  ?   ?   1596.81   21.266 0.000000 21.26641 
1 1 1    8   19    4 f  298.714   9.4732   68.319   4.3313   74.267   6.2837   62.935   5.9785  311.381   13.184  286.634   13.627 24.74609 18.96085 
1 1 1    8   19    5 o  1105.93   11.499  936.656   19.465  928.641   27.318  944.923   27.743  1100.83   16.213  1110.43   16.323 -9.598633 23.00630 
1 1 1    8   19    6 o  2029.30   15.136  3155.22   47.012  3180.17   58.261  3108.65   79.594  2036.69   18.689  2012.05   25.845 24.63904 31.89400 
1 1 1    8   19    7 o  873.465   8.3601  584.097   11.177  583.421   13.775  585.401   19.122  872.878   10.310  874.140   14.292 -1.261902 17.62273 
1 1 1    8   19    8 o  1025.37   9.0978  804.983   14.279  804.171   17.551  806.573   24.555  1024.74   11.190  1025.95   15.637 -1.212524 19.22790 
1 1 1    8   19    9 o  1358.05   10.946  1412.37   22.753  1397.08   27.615  1444.68   40.149  1350.48   13.359  1372.61   19.110 -22.13525 23.31655 
1 1 1    8   19   10 o  1041.80   9.2124  831.003   14.690  840.545   18.267  813.538   24.714  1047.63   11.392  1030.34   15.671 17.28943 19.37413 
1 1 1    8   19   11 o  1104.23   9.5754  933.633   16.184  939.266   19.985  922.900   27.585  1107.41   11.790  1097.32   16.424 10.08643 20.21760 
1 1 1    8   19   12 o  759.206   9.8673  441.366   11.466  441.366   11.466   0.0000   0.0000  759.206   9.8673  ?   ?  0.000000 9.867251 
1 1 1    8   19   13 o  825.064   8.3914  521.188   10.597  511.793   12.757  542.107   19.035  817.513   10.195  841.094   14.786 -23.58057 17.95979 
1 1 1    8   19   14 o  1351.51   9.5476  1398.68   19.751  1394.69   27.781  1402.76   28.085  1349.22   13.452  1353.10   13.560 -3.881470 19.10105 
1 1 1    8   19   15 o  623.686   6.8937  297.784   6.5809  287.605   9.0196  309.371   9.6233  612.847   9.6154  635.604   9.8917 -22.75623 13.79493 
1 1 1    8   19   16 o  964.550   7.8762  712.302   11.628  707.882   16.277  716.910   16.618  961.364   11.061  967.463   11.222 -6.099426 15.75730 
1 1 1    8   19   17 o  861.205   7.6671  567.840   10.107  575.257   14.160  560.137   14.430  866.650   10.675  855.162   11.024 11.48767 15.34519 
1 1 1    8   19   18 o  1219.19   10.466  1138.45   19.532  1128.38   23.584  1160.45   34.850  1213.56   12.696  1229.90   18.512 -16.33582 22.44777 
1 1 1    8   19   19 o  1282.99   10.855  1260.86   21.316  1270.31   26.194  1242.33   36.679  1287.51   13.292  1272.42   18.833 15.09180 23.05109 
1 1 1    8   19   20 o  587.874   7.4515  264.603   6.7050  263.146   9.3272  266.161   9.6453  586.134   10.396  589.468   10.690 -3.334167 14.91196 
1 1 1    8   19   21 o  847.133   7.8195  549.488   10.139  536.751   13.933  563.826   14.783  837.063   10.874  857.885   11.258 -20.82202 15.65219 
1 1 1    8   19   22 f  913.306   9.4474  638.858   13.207  600.648   21.738  661.212   16.627  884.934   16.049  928.958   11.694 -44.02429 19.85728 
1 1 1    8   19   23 o  236.592   12.842   43.029   4.6330   41.842   6.4167   44.322   6.6965  232.774   18.153  239.584   18.401 -6.809937 25.84856 
1 1 1    8   19   24 o  827.581   11.239  524.803   14.237  524.803   14.237   0.0000   0.0000  827.581   11.239  ?   ?  0.000000 11.23895 
1 1 1    8   19   25 o  162.453   20.287   20.597   4.9346   26.538   6.4098   11.953   7.7316  184.256   23.245  123.682   37.547 60.57406 44.15991 
1 1 1    8   19   26 f  261.476   13.687   52.581   5.4590   50.290   6.9003   56.413   8.9249  255.263   17.772  269.893   21.790 -14.63043 28.11835 
1 1 1    8   19   27 o  1138.44   9.0135  992.912   15.706  980.101   21.123  1008.76   23.489  1130.58   12.206  1146.76   13.382 -16.18591 18.11274 
1 1 1    8   19   28 o  658.740   7.7757  332.386   7.8401  338.186   10.322  324.477   12.054  664.260   10.152  650.454   12.107 13.80560 15.79993 
1 1 1    8   19   29 o  1026.68   9.7003  807.905   15.244  807.563   18.437  808.644   27.101  1026.10   11.739  1025.48   17.266 0.6207275 20.87850 
1 1 1    8   19   30 o  866.415   8.1475  575.178   10.805  558.615   14.103  598.716   16.812  853.470   10.796  883.276   12.436 -29.80560 16.46792 
1 1 1    8   19   31 o  668.839   8.0836  342.800   8.2755  337.594   17.355  344.332   9.4148  662.262   17.121  670.208   9.1777 -7.946472 19.42528 
1 1 1    8   19   32 f  124.873   15.012   12.162   2.8118   11.709   3.8272   12.694   4.1449  121.349   21.386  126.306   22.253 -4.956726 30.86340 
1 1 1    8   19   33 o  382.469   7.1289  112.088   4.1734  121.120   5.9299  103.225   5.8745  397.368   9.7496  366.777   10.464 30.59052 14.30213 
1 1 1    8   19   34 o  318.270   9.1068   77.693   4.4364   78.880   5.2567   74.755   8.2705  320.558   10.714  310.807   17.455 9.750763 20.48108 
1 1 1    8   19   35 f  451.494   6.7745  156.213   4.6816  160.089   6.6102  152.312   6.6316  456.775   9.4546  445.508   9.7250 11.26691 13.56336 
1 1 1    8   19   36 o  380.828   8.4804  111.245   4.9433  113.824   6.8249  108.399   7.1695  384.839   11.586  375.432   12.476 9.407623 17.02650 
1 1 1    8   19   37 o  207.021   11.111   33.033   3.5079   33.909   4.7040   31.935   5.2650  209.196   14.786  202.547   17.143 6.649109 22.63893 
1 1 1    8   19   38 o  405.944   7.6640  126.396   4.7620  116.576   6.9520  135.078   6.5362  389.287   11.667  419.298   10.184 -30.01093 15.48701 
1 1 1    8   19   39 o  250.333   9.3751   48.134   3.5922   50.343   5.1600   46.056   5.0040  255.216   13.255  244.042   13.448 11.17349 18.88219 
1 1 1    8   19   40 o  300.237   8.8247   69.232   4.0554   68.197   5.3859   70.586   6.1626  297.569   11.825  302.480   13.311 -4.911346 17.80466 
1 1 1    8   19   41 o  549.026   7.5743  231.346   6.3651  238.502   8.5109  222.264   9.5883  556.869   9.9851  537.096   11.663 19.77289 15.35368 
1 1 1    8   19   42 o  320.084   9.0128   78.757   4.4156   83.491   6.1286   73.645   6.3676  328.968   12.171  308.683   13.477 20.28500 18.15955 
1 1 1    8   19   43 o  173.831   13.004   23.482   3.4350   20.643   4.8322   26.382   4.8838  161.203   20.015  183.202   17.634 -21.99869 26.67490 
1 1 1    8   19   44 o  219.590   11.370   37.297   3.8085   33.090   5.3873   41.501   5.3849  205.343   17.302  230.698   15.337 -25.35443 23.12088 
1 1 1    8   19   45 o  272.379   12.339   57.357   5.1444   44.465   11.371   60.674   5.7684  230.914   33.122  279.877   13.465 -48.96307 35.75416 
1 1 1    8   19   46 o  124.071   19.393   12.358   3.5623   10.125   5.2157   14.311   4.8770  109.705   30.136  131.902   25.073 -22.19707 39.20218 
1 1 1    8   19   47 o  128.324   18.799   13.189   3.5829   24.097   5.6653   5.9184   4.6253  173.116   21.868   87.035   29.319 86.08055 36.57671 
1 1 1    8   19   48 o   61.883   26.076   0.7060   4.2160  -4.3330   4.7391   19.825   9.2312   51.252   24.018  148.932   39.753 -97.67990 46.44489 
1 1 1    8   19   49 o  156.395   17.315   19.419   4.0753   21.696   6.3755   17.845   5.2994  161.718   26.687  147.315   24.353 14.40292 36.12889 
1 1 1    8   19   50 o  256.470   12.571   51.076   4.9349   58.503   6.6264   41.826   7.3946  272.864   15.935  228.108   21.430 44.75575 26.70525 
1 1 1    8   19   51 o  113.061   24.308   10.707   4.0815   12.319   5.7898   9.1147   5.7545  118.965   31.354  103.273   32.575 15.69218 45.21244 
1 1 1    8   19   52 o  260.594   12.534   52.866   4.9997   42.246   6.7476   65.794   7.4449  229.558   19.385  288.258   16.948 -58.69977 25.74917 
1 1 1    8   19   53 f  112.355   24.793   10.722   4.1495   3.5817   5.7964   18.228   5.9428   79.046   31.623  145.905   27.622 -66.85886 41.98772 
1 1 1    8   19   54 o   90.526   27.979   7.0378   4.2693   2.1755   5.7448   13.035   6.3803   73.549   30.678  119.631   33.508 -46.08199 45.43114 
1 1 1    8   19   55 o  187.841   15.951   28.178   4.5427   32.592   6.5003   23.965   6.3509  198.729   21.724  167.830   25.527 30.89925 33.51960 
1 1 1    8   19   56 o   66.989   27.512   2.1271   4.5228   9.9456   6.9871  -3.5115   5.9336  103.731   36.006   58.904   27.361 44.82781 45.22242 
1 1 1    8   19   57 o  213.420   16.217   36.742   5.2580   37.315   9.4138   36.482   6.3390  201.835   31.501  209.943   19.967 -8.108063 37.29566 
1 1 1    8   19   58 o  147.559   19.602   18.221   4.3177   9.3372   6.2544   26.309   5.9678   98.609   34.075  175.227   22.790 -76.61774 40.99394 
1 1 1    8   19   59 o  101.394   31.483   9.9607   5.3985   16.923   7.1925   0.9777   8.1697  128.874   35.384   75.745   33.979 53.12984 49.05672 
1 1 1    8   20    0 o  404.082   12.360  125.362   7.6285  125.362   7.6285  125.362   7.6285  404.082   12.360  404.082   12.360 0.000000 0.000000 
1 1 1    8   20    1 o  321.551   9.2647   79.165   4.5599   85.297   6.5156   73.279   6.3837  333.706   12.756  309.288   13.485 24.41757 18.56212 
1 1 1    8   20    2 o  1020.99   10.934  798.273   17.088  777.021   23.460  822.291   24.939  1007.01   15.220  1035.89   15.729 -28.87677 21.88723 
1 1 1    8   20    3 o  824.169   13.862  520.367   17.487   0.0000   0.0000  520.367   17.487  ?   ?   824.169   13.862 0.000000 13.86214 
1 1 1    8   20    4 o  1297.81   18.188  1291.27   36.131   0.0000   0.0000  1291.27   36.131  ?   ?   1297.81   18.188 0.000000 18.18845 
1 1 1    8   20    5 o  859.668   10.085  565.896   13.270  543.990   18.216  590.671   19.372  842.644   14.123  878.036   14.414 -35.39154 20.17989 
1 1 1    8   20    6 o  790.257   8.0438  478.111   9.7297  480.965   12.079  472.838   16.418  792.538   9.9575  785.629   13.654 6.909424 16.89882 
1 1 1    8   20    7 o  234.260   9.6839   42.020   3.4723   40.147   4.2958   45.552   5.8974  228.609   12.322  243.280   15.925 -14.67116 20.13598 
1 1 1    8   20    8 o  1268.48   10.456  1232.17   20.301  1236.22   25.064  1224.45   34.613  1270.36   12.890  1263.75   17.894 6.608276 22.05357 
1 1 1    8   20    9 o  215.149   10.646   35.449   3.5059   34.565   4.2659   37.289   6.1536  212.002   13.212  219.747   18.466 -7.745102 22.70598 
1 1 1    8   20   10 o  524.499   9.3480  210.645   7.5047  210.645   7.5047   0.0000   0.0000  524.499   9.3480  ?   ?  0.000000 9.348014 
1 1 1    8   20   11 o  1108.29   11.829  940.836   20.066  940.836   20.066   0.0000   0.0000  1108.29   11.829  ?   ?  0.000000 11.82874 
1 1 1    8   20   12 o  432.093   7.9923  142.944   5.2859  145.447   6.4816  137.974   9.1337  435.818   9.7164  424.339   14.063 11.47867 17.09278 
1 1 1    8   20   13 f  627.009   6.8815  300.967   6.6043  302.271   9.2602  299.616   9.4217  628.276   9.6294  625.503   9.8408 2.773254 13.76831 
1 1 1    8   20   14 o  631.589   8.0101  305.416   7.7436  313.439   9.5757  290.253   13.164  639.765   9.7786  615.446   13.974 24.31818 17.05548 
1 1 1    8   20   15 o  1548.91   12.275  1837.95   29.101  1818.74   35.192  1879.49   51.752  1540.42   14.926  1564.64   21.609 -24.22046 26.26282 
1 1 1    8   20   16 o  500.194   8.3587  191.571   6.3995  194.296   7.7416  185.691   11.372  503.684   10.042  492.183   15.096 11.50089 18.13052 
1 1 1    8   20   17 o  966.600   8.0173  715.383   11.862  717.563   16.712  713.170   16.838  967.848   11.281  964.872   11.401 2.976379 16.03924 
1 1 1    8   20   18 o  271.221   10.080   56.341   4.1847   54.474   5.8332   58.321   6.0069  266.196   14.370  275.469   14.296 -9.272644 20.26948 
1 1 1    8   20   19 o  1228.15   9.2128  1155.15   17.319  1145.93   24.167  1164.89   24.831  1222.84   12.912  1232.88   13.158 -10.04333 18.43512 
1 1 1    8   20   20 o  588.833   7.6925  265.485   6.9331  259.047   9.6214  272.439   9.9994  581.509   10.810  596.343   10.955 -14.83368 15.39023 
1 1 1    8   20   21 o  257.200   13.472   50.847   5.2852   42.634   8.7314   55.596   6.6398  234.108   24.742  268.727   16.219 -34.61954 29.58367 
1 1 1    8   20   22 o  439.102   8.4299  147.660   5.6658  144.241   7.8328  151.412   8.2054  433.849   11.795  444.491   12.061 -10.64111 16.86967 
1 1 1    8   20   23 o  137.701   20.458   14.887   4.1808   12.807   5.7472   17.225   6.0930  126.283   30.150  147.033   28.098 -20.74995 41.21341 
1 1 1    8   20   24 o  682.009   7.9793  356.225   8.3296  354.007   11.582  358.601   11.988  679.658   11.134  684.027   11.450 -4.369019 15.97050 
1 1 1    8   20   25 o  537.853   9.5672  221.639   7.8762  220.137   13.122  222.485   9.8472  535.496   16.010  538.713   11.942 -3.216797 19.97334 
1 1 1    8   20   26 o  301.024   13.173   69.510   6.0697   71.857   10.103   68.183   7.5928  304.691   21.807  297.461   16.744 7.229523 27.49418 
1 1 1    8   20   27 o  669.205   9.3819  343.181   9.6099  341.926   12.018  345.405   16.002  667.733   11.759  670.603   15.590 -2.870056 19.52746 
1 1 1    8   20   28 o  515.066   7.9183  203.241   6.2426  211.079   7.2396  180.514   12.327  524.825   9.0121  484.571   16.620 40.25388 18.90646 
1 1 1    8   20   29 o  326.417   8.4868   81.649   4.2402   77.898   4.8997   92.837   8.4621  318.748   10.043  347.496   15.910 -28.74792 18.81422 
1 1 1    8   20   30 o  159.515   20.929   19.971   4.9867   33.430   7.4145   8.8538   6.7385  206.496   23.900  108.070   35.358 98.42574 42.67833 
1 1 1    8   20   31 o  518.103   7.8561  205.713   6.2301  187.288   7.6097  243.166   10.850  494.144   10.061  562.698   12.597 -68.55478 16.12177 
1 1 1    8   20   32 o  685.391   7.9370  360.062   8.3266  351.600   10.693  373.099   13.272  676.933   10.320  696.917   12.442 -19.98352 16.16469 
1 1 1    8   20   33 o  340.742   8.7228   89.036   4.5494   85.925   5.3568   97.087   8.6169  334.588   10.460  354.990   15.859 -20.40216 18.99741 
1 1 1    8   20   34 o  659.651   6.4579  333.418   6.5204  339.069   9.2183  327.759   9.2241  664.832   9.0588  653.622   9.2199 11.20923 12.92550 
1 1 1    8   20   35 o  102.210   19.274   8.3462   2.9048   7.6844   3.9826   9.0985   4.2461   97.488   26.150  105.845   26.320 -8.356911 37.10176 
1 1 1    8   20   36 o  267.185   8.3995   54.766   3.4351   59.845   4.9322   49.982   4.7869  279.000   11.550  254.900   12.269 24.09930 16.85008 
1 1 1    8   20   37 o   78.030   21.550   4.8860   2.6588   8.1660   3.8241   1.8165   3.6994  100.199   25.012   64.101   25.385 36.09735 35.63726 
1 1 1    8   20   38 o  271.218   8.5209   56.463   3.5373   52.461   4.9576   60.613   5.0486  260.997   12.410  280.634   11.753 -19.63718 17.09229 
1 1 1    8   20   39 o  276.670   8.5959   58.776   3.6402   55.006   4.9503   63.215   5.3714  267.216   12.103  286.439   12.251 -19.22333 17.22157 
1 1 1    8   20   40 o  414.783   7.7093  132.051   4.8945  129.588   7.2571  134.106   6.6291  410.155   11.560  417.507   10.373 -7.351837 15.53165 
1 1 1    8   20   41 o   51.399   21.590   0.3704   2.8755   1.3284   3.9322  -0.7307   4.2159   63.100   25.753   57.477   25.158 5.623585 36.00221 
1 1 1    8   20   42 o  454.478   8.4942  158.735   5.9089  160.708   8.2162  156.622   8.5041  456.425   11.761  450.407   12.335 6.017365 17.04329 
1 1 1    8   20   43 o  339.453   8.9939   88.622   4.6730   88.512   6.2757   88.759   7.0008  338.565   12.110  338.671   13.505 -0.1065674 18.13969 
1 1 1    8   20   44 o  172.026   17.218   23.302   4.4728   10.835   10.466   26.088   4.9474  118.942   43.745  181.879   18.008 -62.93702 47.30676 
1 1 1    8   20   45 o  187.614   16.482   27.644   4.6851   33.177   10.707   26.333   5.2105  196.685   36.920  182.331   18.947 14.35428 41.49791 
1 1 1    8   20   46 o  214.553   11.892   35.705   3.8900   38.453   5.6508   33.230   5.3630  221.247   16.812  205.456   17.212 15.79030 24.06048 
1 1 1    8   20   47 f  227.412   17.017   40.696   5.8802   40.696   5.8802   0.0000   0.0000  227.412   17.017  ?   ?  0.000000 17.01655 
1 1 1    8   20   48 o  142.140   17.425   16.075   3.7117   25.325   5.7248   9.3675   4.8752  177.324   21.534  105.179   29.231 72.14519 36.30648 
1 1 1    8   20   49 o  256.795   11.720   51.092   4.6067   53.394   6.3603   48.553   6.6813  260.679   16.018  247.808   17.732 12.87132 23.89549 
1 1 1    8   20   50 o  118.720   22.274   11.623   3.8989   11.489   5.4752   11.760   5.5533  115.317   30.537  116.610   30.694 -1.292870 43.29708 
1 1 1    8   20   51 o  218.436   13.366   37.336   4.4474   39.596   6.4589   35.298   6.1328  222.466   19.155  209.890   19.306 12.57561 27.19625 
1 1 1    8   20   52 o  291.978   11.509   66.251   5.1436   57.225   6.8063   78.269   7.8539  268.686   16.632  314.538   16.370 -45.85126 23.33635 
1 1 1    8   20   53 o   92.409   27.727   7.3461   4.2343   10.459   5.5709   3.0868   6.5160  108.381   31.623   79.753   32.919 28.62866 45.64743 
1 1 1    8   20   54 o  148.908   19.048   18.073   4.2420   13.386   5.9443   22.937   6.0554  121.739   31.618  164.818   24.769 -43.07810 40.16487 
1 1 1    8   20   55 o   64.818   26.743   1.7972   4.2976   0.2771   6.4367   3.0199   5.7728   70.433   30.951   75.721   31.088 -5.287926 43.86843 
1 1 1    8   20   56 o   59.281   25.352   0.7407   4.0865  -6.3013   5.7847   7.7562   5.7737   52.628   25.200   93.232   32.710 -40.60401 41.29105 
1 1 1    8   20   57 o   82.108   29.483   5.7546   4.7153   7.2055   8.3830   5.0830   5.7031   93.278   37.777   81.213   31.714 12.06512 49.32404 
1 1 1    8   20   58 o   57.407   24.792   0.6002   3.9807  -7.1197   5.6354   8.2885   5.6238   49.771   24.092   93.621   32.314 -43.85034 40.30620 
1 1 1    8   21    0 f  871.595   14.334  582.201   19.111  582.201   19.111  582.201   19.111  871.595   14.334  871.595   14.334 0.000000 0.000000 
1 1 1    8   21    1 o  238.763   11.107   43.659   4.0593   45.806   5.5829   41.251   5.9128  244.032   15.019  231.372   16.811 12.65997 22.54297 
1 1 1    8   21    2 o  1161.30   11.944  1032.95   21.232  1013.63   29.372  1054.10   30.726  1149.94   16.687  1172.62   17.119 -22.68286 23.90645 
1 1 1    8   21    3 o  554.172   8.8316  235.138   7.4912  239.148   10.672  231.243   10.518  558.754   12.478  549.440   12.507 9.314331 17.66720 
1 1 1    8   21    4 o  1341.34   18.755  1379.74   38.506   0.0000   0.0000  1379.74   38.506  ?   ?   1341.34   18.755 0.000000 18.75521 
1 1 1    8   21    5 o  723.643   7.8842  400.909   8.7327  391.198   10.552  422.016   15.556  714.760   9.6453  742.176   13.694 -27.41602 16.74981 
1 1 1    8   21    6 o  1968.46   14.769  2969.28   44.499  2960.42   54.390  2987.24   77.389  1964.89   18.085  1971.85   25.641 -6.961060 31.37709 
1 1 1    8   21    7 o  603.574   9.3555  278.952   8.6431  278.952   8.6431   0.0000   0.0000  603.574   9.3555  ?   ?  0.000000 9.355529 
1 1 1    8   21    8 f  419.297   9.5940  134.626   6.1573  134.626   6.1573   0.0000   0.0000  419.297   9.5940  ?   ?  0.000000 9.593980 
1 1 1    8   21    9 o  1526.42   14.759  1785.56   34.483  1785.56   34.483   0.0000   0.0000  1526.42   14.759  ?   ?  0.000000 14.75901 
1 1 1    8   21   10 o  664.628   7.9070  338.197   8.0438  338.643   9.8633  337.311   13.899  664.999   9.6902  663.493   13.686 1.506470 16.76954 
1 1 1    8   21   11 o  1256.95   10.497  1210.01   20.196  1196.21   24.467  1239.51   35.777  1249.55   12.793  1271.23   18.387 -21.68604 22.39947 
1 1 1    8   21   12 o  1209.08   10.268  1119.58   19.003  1121.77   23.333  1115.27   32.750  1210.04   12.598  1205.90   17.743 4.139038 21.76054 
1 1 1    8   21   13 o  1174.25   10.127  1056.01   18.202  1048.45   22.093  1071.98   32.117  1169.84   12.339  1182.23   17.749 -12.38843 21.61602 
1 1 1    8   21   14 o  869.495   7.6495  578.836   10.181  574.872   14.261  582.957   14.538  866.336   10.755  872.397   10.887 -6.061768 15.30335 
1 1 1    8   21   15 o  733.337   7.3691  411.738   8.2716  411.410   11.689  412.068   11.706  732.897   10.420  733.482   10.427 -0.5855713 14.74115 
1 1 1    8   21   16 o  461.348   7.6403  162.964   5.3952  162.403   7.4983  163.567   7.7689  460.456   10.639  462.090   10.984 -1.633667 15.29180 
1 1 1    8   21   17 o  1175.45   8.9425  1058.10   16.089  1059.22   22.792  1057.00   22.715  1175.69   12.665  1174.46   12.636 1.230713 17.89068 
1 1 1    8   21   18 o  958.289   8.1141  703.188   11.902  709.498   16.897  696.975   16.767  962.315   11.471  953.782   11.485 8.532104 16.23275 
1 1 1    8   21   19 o  1354.79   11.371  1406.29   23.579  1406.09   40.770  1406.39   28.903  1353.16   19.685  1354.45   13.941 -1.286255 24.12141 
1 1 1    8   21   20 o  459.452   9.5722  161.693   6.7317  148.421   11.263  169.069   8.3965  439.808   16.731  469.717   11.679 -29.90921 20.40353 
1 1 1    8   21   21 o  1125.45   8.9067  970.129   15.343  973.730   21.620  966.475   21.777  1127.10   12.532  1122.87   12.671 4.226196 17.82140 
1 1 1    8   21   22 o  471.834   8.3196  170.506   6.0084  164.173   8.2420  177.689   8.7777  462.826   11.634  481.484   11.910 -18.65894 16.64985 
1 1 1    8   21   23 o  689.857   9.0982  364.565   9.6069  360.652   16.101  366.728   11.971  685.540   15.344  691.721   11.307 -6.180481 19.06017 
1 1 1    8   21   24 o  594.446   9.2820  270.732   8.4455  263.054   13.962  275.162   10.606  585.375   15.583  599.109   11.565 -13.73376 19.40583 
1 1 1    8   21   25 o  357.218   10.092   97.797   5.5180   87.302   7.6131  109.412   8.0093  337.235   14.749  377.600   13.858 -40.36441 20.23769 
1 1 1    8   21   26 o  285.405   12.848   62.498   5.6127   67.827   7.1962   54.220   8.9684  296.704   15.903  264.229   22.385 32.47546 27.45963 
1 1 1    8   21   27 o  442.148   10.263  149.882   6.9457  152.639   8.8308  145.409   11.247  445.962   12.937  434.839   16.899 11.12323 21.28199 
1 1 1    8   21   28 o  710.460   8.5884  386.825   9.3395  385.673   12.868  388.107   13.576  708.961   11.858  711.096   12.473 -2.134583 17.21061 
1 1 1    8   21   29 o  727.197   9.5571  405.464   10.638  396.555   12.989  423.616   18.540  718.812   11.805  741.973   16.325 -23.16101 20.14599 
1 1 1    8   21   30 o  569.568   7.7224  248.606   6.7323  246.600   7.6703  255.336   14.050  567.149   8.8358  575.977   15.937 -8.827942 18.22208 
1 1 1    8   21   31 o  534.442   7.3579  218.886   6.0190  227.952   7.3444  200.342   10.504  545.242   8.8003  510.512   13.442 34.73059 16.06660 
1 1 1    8   21   32 o  661.090   7.8156  335.019   7.9085  326.303   10.072  349.033   12.771  652.078   10.091  673.946   12.380 -21.86768 15.97205 
1 1 1    8   21   33 o  304.157   7.9584   70.930   3.7051   74.835   5.2996   67.197   5.1819  312.147   11.092  295.755   11.447 16.39166 15.93937 
1 1 1    8   21   34 o  184.512   11.922   26.279   3.3490   26.635   4.6824   25.907   4.7920  185.006   16.716  182.316   17.383 2.689453 24.11588 
1 1 1    8   21   35 o   66.448   22.154   3.2562   2.6408   1.5272   3.7047   5.0423   3.7654   62.892   25.238   81.366   26.422 -18.47453 36.53875 
1 1 1    8   21   36 o  244.252   8.4249   45.779   3.1497   43.696   4.3112   48.164   4.6129  238.326   11.818  250.188   12.046 -11.86266 16.87534 
1 1 1    8   21   37 o  218.440   9.2296   36.644   3.0859   41.654   4.4289   31.917   4.3022  232.229   12.506  202.950   13.934 29.27930 18.72290 
1 1 1    8   21   38 o  229.669   9.1837   40.520   3.2284   41.649   4.3914   39.193   4.7625  232.163   12.403  224.914   13.902 7.248978 18.63051 
1 1 1    8   21   39 o  130.971   14.777   13.429   2.9105   15.000   4.1256   11.873   4.1065  137.261   20.244  121.143   22.987 16.11840 30.63094 
1 1 1    8   21   40 o  104.617   18.555   8.7695   2.8625   6.1880   3.8808   11.850   4.2392   87.812   26.588  120.686   23.795 -32.87378 35.68089 
1 1 1    8   21   41 o  311.619   10.573   74.791   5.0432   78.343   6.0255   66.479   9.2158  318.565   12.357  290.451   20.869 28.11444 24.25284 
1 1 1    8   21   42 f  295.794   9.1728   67.300   4.1530   61.937   6.0296   72.141   5.7285  282.833   13.928  305.645   12.245 -22.81180 18.54519 
1 1 1    8   21   43 o  270.335   10.555   56.330   4.3674   63.206   6.3317   50.090   6.0319  285.089   14.559  253.393   15.628 31.69617 21.35890 
1 1 1    8   21   44 o  248.615   15.301   48.231   5.7943   32.508   18.767   49.888   6.0919  182.490   58.962  252.695   15.830 -70.20438 61.05029 
1 1 1    8   21   45 o  115.389   20.212   10.771   3.4398   13.865   5.2403   8.4294   4.5596  128.943   27.396  100.536   28.386 28.40676 39.44991 
1 1 1    8   21   46 f   54.829   24.465  -1.3482   4.1752   0.5089   4.7513  -7.6427   8.7474   64.573   27.468   68.865   32.386 -4.292053 42.46624 
1 1 1    8   21   47 o   48.649   21.772  -1.2309   3.3333   0.0453   4.9845  -2.2634   4.4833   64.341   27.764   54.358   24.702 9.982998 37.16202 
1 1 1    8   21   48 o  246.942   11.775   47.240   4.4509   51.843   6.1200   42.072   6.4848  257.072   15.628  230.318   18.552 26.75400 24.25708 
1 1 1    8   21   49 o   41.121   19.692  -4.6533   3.5345  -8.8947   5.1316  -0.8248   4.8754   45.714   22.322   60.761   26.809 -15.04707 34.88563 
1 1 1    8   21   50 f   65.023   25.269   2.4096   3.6070   8.4398   5.2412  -3.0163   4.9717   99.588   31.037   55.454   25.504 44.13464 40.17143 
1 1 1    8   21   51 o   91.315   26.251   7.0698   3.8645   8.1340   5.5022   6.0337   5.4289   97.800   31.948   88.011   31.631 9.788795 44.95819 
1 1 1    8   21   52 f  125.425   23.100   13.167   4.2713   14.046   5.8703   12.178   6.2266  126.013   30.715  116.352   33.283 9.660675 45.28972 
1 1 1    8   21   53 o  199.938   15.338   31.739   4.6581   31.613   6.2814   31.892   6.9435  196.374   21.236  195.733   23.656 0.6413116 31.78980 
1 1 1    8   21   54 o   92.242   28.245   7.4324   4.3625   9.9827   6.4068   5.2278   5.9567  104.733   34.487   84.484   32.573 20.24937 47.43787 
1 1 1    8   21   55 o  126.407   23.014   13.626   4.2887   9.2678   6.0256   18.100   6.1054  100.441   33.464  142.209   29.031 -41.76772 44.30143 
1 1 1    8   21   56 o  147.382   23.743   18.710   5.1742   3.6815   8.9792   26.181   6.3310   85.899   37.165  174.244   24.408 -88.34497 44.46341 
1 1 1    8   21   57 o   67.011   26.549   2.9187   4.0480   0.2341   5.5849   5.8900   5.8755   64.708   28.615   84.148   32.376 -19.44003 43.20904 
1 1 1    8   22    0 o  661.014   13.002  334.958   13.144  334.958   13.144  334.958   13.144  661.014   13.002  661.014   13.002 0.000000 0.000000 
1 1 1    8   22    1 o  339.418   9.9240   88.221   5.1557   94.963   7.4030   81.871   7.1846  352.049   13.738  326.865   14.360 25.18384 19.87355 
1 1 1    8   22    2 o  904.323   10.364  626.292   14.345  611.283   19.845  642.717   20.760  893.134   14.517  915.786   14.810 -22.65198 20.73825 
1 1 1    8   22    3 o  1377.06   13.505  1452.92   28.466  1508.68   41.909  1405.15   38.787  1402.36   19.524  1353.52   18.722 48.84155 27.04993 
1 1 1    8   22    5 o  1489.50   20.667  1702.56   47.118  1702.56   47.118   0.0000   0.0000  1489.50   20.667  ?   ?  0.000000 20.66711 
1 1 1    8   22    6 o  1014.05   11.305  787.617   17.546  787.617   17.546   0.0000   0.0000  1014.05   11.305  ?   ?  0.000000 11.30479 
1 1 1    8   22    7 o  589.813   7.8387  266.344   7.0767  263.715   8.6628  271.618   12.269  586.833   9.6443  595.391   13.463 -8.557129 16.56122 
1 1 1    8   22    8 o  1002.37   9.1612  769.380   14.056  753.977   16.965  803.091   25.099  992.153   11.172  1023.51   16.021 -31.35486 19.53153 
1 1 1    8   22    9 o  410.135   8.3041  128.795   5.2130  126.537   6.3726  133.362   9.0638  406.475   10.243  417.156   14.195 -10.68112 17.50467 
1 1 1    8   22   10 o  544.770   7.9572  227.226   6.6350  222.047   8.0381  238.301   11.754  538.466   9.7527  557.643   13.771 -19.17731 16.87493 
1 1 1    8   22   11 o  1201.69   10.312  1106.01   18.968  1090.41   22.938  1139.74   33.732  1192.97   12.562  1218.92   18.080 -25.95459 22.01544 
1 1 1    8   22   12 o  778.487   8.5059  464.060   10.135  460.953   12.375  470.391   17.666  775.774   10.421  783.364   14.733 -7.589783 18.04639 
1 1 1    8   22   13 o  678.669   8.3580  352.683   8.6822  346.815   10.454  365.734   15.589  672.914   10.149  690.726   14.745 -17.81177 17.90029 
1 1 1    8   22   14 o  794.512   8.7236  483.392   10.609  485.685   12.975  478.767   18.427  796.278   10.646  790.221   15.235 6.057617 18.58561 
1 1 1    8   22   15 o  555.492   7.4833  236.262   6.3627  231.166   8.8955  241.600   9.1046  549.344   10.579  561.605   10.592 -12.26117 14.97004 
1 1 1    8   22   16 o  1323.86   9.6415  1342.35   19.537  1370.77   28.211  1316.15   27.082  1337.26   13.783  1310.39   13.503 26.86963 19.29466 
1 1 1    8   22   17 o   93.236   28.071   6.7516   4.3346   16.169   7.7980   2.5408   5.2143  141.830   35.891   76.636   30.205 65.19388 46.90948 
1 1 1    8   22   18 o  803.461   9.0105  494.421   11.081  492.885   19.128  495.198   13.595  801.610   15.590  803.939   11.048 -2.329590 19.10765 
1 1 1    8   22   19 o  473.904   7.9627  171.986   5.7759  168.759   8.1311  175.272   8.2062  469.288   11.320  478.264   11.210 -8.976257 15.93114 
1 1 1    8   22   20 o  612.150   7.7216  286.965   7.2350  288.753   10.199  285.153   10.265  613.866   10.854  610.018   10.994 3.848755 15.44938 
1 1 1    8   22   21 o  1060.51   9.9609  861.709   16.169  879.701   28.010  852.718   19.801  1070.35   17.097  1054.66   12.266 15.69519 21.04191 
1 1 1    8   22   22 o  1042.26   9.9744  832.394   15.912  820.973   26.515  838.824   19.893  1033.93   16.754  1045.93   12.426 -11.99500 20.85927 
1 1 1    8   22   23 o  737.044   7.9739  416.101   8.9957  416.605   12.645  415.584   12.800  737.182   11.206  736.261   11.358 0.9204712 15.95619 
1 1 1    8   22   24 o  188.960   16.000   27.624   4.5842   27.588   6.3985   27.662   6.5710  187.811   22.720  187.953   23.344 -0.1425171 32.57512 
1 1 1    8   22   25 o  296.394   12.650   67.406   5.7388   61.705   7.0245   78.850   9.9516  282.878   16.292  319.260   20.473 -36.38242 26.16437 
1 1 1    8   22   26 o  676.335   8.3332  350.506   8.6267  347.074   11.761  354.502   12.692  672.653   11.423  679.703   12.199 -7.050110 16.71265 
1 1 1    8   22   27 o  405.015   9.4842  125.758   5.8795  126.261   8.0811  125.193   8.5702  405.513   13.020  403.705   13.869 1.807343 19.02287 
1 1 1    8   22   28 o  514.248   8.9968  202.733   7.0816  204.406   9.9745  201.033   10.056  515.939   12.631  511.635   12.841 4.304230 18.01149 
1 1 1    8   22   29 o  763.505   8.4636  446.867   9.8909  456.998   14.099  437.051   13.879  771.482   11.940  754.441   12.019 17.04089 16.94155 
1 1 1    8   22   30 o  429.020   9.7548  141.198   6.4057  152.026   9.0301  130.230   9.0882  444.717   13.266  411.439   14.431 33.27777 19.60216 
1 1 1    8   22   31 o  185.899   12.422   26.676   3.5144   27.283   3.8114   23.228   9.0807  187.892   13.339  168.216   36.331 19.67596 38.70197 
1 1 1    8   22   32 o  240.745   11.387   44.525   4.1962   44.525   4.1962   0.0000   0.0000  240.745   11.387  ?   ?  0.000000 11.38739 
1 1 1    8   22   33 o  512.206   9.4761  201.359   7.4293  201.559   8.1497  200.373   18.073  512.313   10.393  507.325   23.274 4.988678 25.48938 
1 1 1    8   22   34 f  493.857   7.3868  187.008   5.5838  182.491   8.9842  189.851   7.1276  487.095   12.050  497.313   9.3636 -10.21835 15.26057 
1 1 1    8   22   35 o  424.644   7.0464  138.260   4.5800  133.309   6.5693  142.942   6.3886  416.532   10.304  431.419   9.6747 -14.88736 14.13401 
1 1 1    8   22   36 o   36.762   17.119  -2.1437   2.3464  -3.6781   3.0654   0.0273   3.6462   39.638   18.800   56.184   23.985 -16.54574 30.47486 
1 1 1    8   22   37 o  486.096   6.7797  181.205   5.0443  179.924   6.9880  182.598   7.2891  483.914   9.4344  487.426   9.7700 -3.512238 13.58162 
1 1 1    8   22   38 o  196.025   10.212   29.635   3.0533   25.504   4.1272   34.629   4.5380  180.962   15.037  211.244   14.116 -30.28238 20.62444 
1 1 1    8   22   39 o  175.302   11.780   23.795   3.1423   25.533   4.4737   22.103   4.4148  180.678   16.354  167.742   17.450 12.93602 23.91584 
1 1 1    8   22   40 o  120.376   20.774   11.659   3.6893   16.138   4.1985  -3.5199   7.7288  142.376   19.802   71.808   32.554 70.56731 38.10382 
1 1 1    8   22   41 o   45.756   20.120  -0.6397   2.7241  -6.3033   3.7062   6.0153   4.0176   39.624   19.263   86.833   27.192 -47.20923 33.32371 
1 1 1    8   22   42 o  137.741   14.753   14.881   3.0621   19.015   4.3935   10.976   4.2701  154.801   18.937  115.461   24.895 39.34087 31.27856 
1 1 1    8   22   43 o  273.079   11.525   57.581   4.8174   42.783   10.741   61.307   5.3899  227.120   31.766  281.555   12.507 -54.43513 34.13942 
1 1 1    8   22   44 f  230.823   10.734   41.112   3.7923   39.429   5.5228   42.614   5.2166  224.331   16.193  233.738   14.655 -9.407333 21.84023 
1 1 1    8   22   45 o   55.671   25.071  -1.8567   4.4961  -0.0207   4.6907 -22.6160   15.773   62.485   26.949   81.011   39.463 -18.52605 47.78693 
1 1 1    8   22   46 o  329.139   13.763   84.187   6.9338   84.187   6.9338   0.0000   0.0000  329.139   13.763  ?   ?  0.000000 13.76333 
1 1 1    8   22   47 o   63.258   24.625   2.1785   3.4300   4.0377   4.6184  -0.1084   5.1222   77.573   28.958   64.597   28.009 12.97644 40.28752 
1 1 1    8   22   48 o  175.316   14.591   24.140   3.8799   29.033   5.6287   19.710   5.3555  190.536   19.579  155.202   23.261 35.33394 30.40369 
1 1 1    8   22   49 o  301.864   10.265   70.473   4.7429   69.981   6.7989   70.939   6.6196  299.106   14.851  301.362   14.351 -2.255402 20.65152 
1 1 1    8   22   50 o  127.467   20.681   13.300   3.8967   21.965   5.6167   5.2591   5.4106  163.374   23.105   84.742   31.401 78.63204 38.98540 
1 1 1    8   22   51 f   81.028   26.151   5.4043   3.6926   5.8345   5.2596   4.9860   5.1856   86.393   31.125   82.483   30.706 3.909859 43.72215 
1 1 1    8   22   52 o  155.968   18.438   19.684   4.3166   21.427   5.8549   17.608   6.3893  159.543   24.780  141.160   30.465 18.38361 39.26983 
1 1 1    8   22   53 o   95.814   27.102   8.0130   4.1525   12.524   6.1994   4.3418   5.5924  116.909   33.130   80.249   31.386 36.66058 45.63680 
1 1 1    8   22   54 o   81.319   27.377   5.5666   4.0328   6.7813   5.9026   4.5031   5.5228   89.939   32.886   79.952   31.213 9.986908 45.33997 
1 1 1    8   22   55 o  163.133   20.880   22.254   5.0941   33.298   6.3091   1.5694   8.6343  199.894   20.931   80.572   35.608 119.3212 41.30388 
1 1 1    8   22   56 o   77.857   29.637   4.7687   4.8909   9.5026   8.9679   2.7645   5.8350  100.333   39.590   73.380   30.786 26.95307 50.15150 
1 1 1    8   22   57 f  100.107   28.639   9.3682   4.6100   16.642   5.6966  -4.4355   7.8475  134.217   28.604   64.818   30.542 69.39833 41.84499 
1 1 1    8   23    3 o  602.570   13.112  278.207   12.093   0.0000   0.0000  278.207   12.093  ?   ?   602.570   13.112 0.000000 13.11160 
1 1 1    8   23    4 o  1043.13   16.063  834.243   25.647   0.0000   0.0000  834.243   25.647  ?   ?   1043.13   16.063 0.000000 16.06285 
1 1 1    8   23    5 f  356.035   10.944   97.093   5.9643   90.935   8.6478  102.680   8.2367  344.379   16.406  366.012   14.702 -21.63351 22.02976 
1 1 1    8   23    6 o  1632.34   12.761  2041.57   31.884  2030.58   38.930  2063.96   55.566  1627.47   15.628  1639.37   22.144 -11.89587 27.10354 
1 1 1    8   23    7 o  718.166   8.2411  394.913   9.0590  398.395   11.256  388.510   15.263  721.231   10.196  711.991   14.005 9.239868 17.32372 
1 1 1    8   23    8 o  1444.95   11.663  1599.47   25.794  1604.08   31.776  1590.56   44.168  1446.66   14.351  1439.51   20.046 7.144043 24.65300 
1 1 1    8   23    9 o  1815.71   13.934  2526.76   38.724  2516.50   47.264  2547.72   67.542  1811.37   17.047  1820.55   24.238 -9.184326 29.63285 
1 1 1    8   23   10 o  717.305   8.3287  393.983   9.1443  388.156   11.099  406.298   16.135  711.887   10.186  728.038   14.479 -16.15161 17.70307 
1 1 1    8   23   11 o  954.756   9.1980  698.093   13.442  684.307   16.185  728.739   24.132  945.131   11.188  974.810   16.173 -29.67932 19.66596 
1 1 1    8   23   12 o  502.687   8.6330  193.507   6.6424  198.911   8.1445  182.773   11.479  509.586   10.442  488.227   15.361 21.35873 18.57389 
1 1 1    8   23   13 o  550.978   8.5801  232.474   7.2359  239.418   8.9974  219.761   12.175  559.060   10.515  535.371   14.857 23.68835 18.20157 
1 1 1    8   23   14 o  904.914   9.1637  627.149   12.693  623.937   15.502  633.682   22.108  902.430   11.223  908.953   15.891 -6.523010 19.45406 
1 1 1    8   23   15 o  935.682   11.488  670.833   16.452   0.0000   0.0000  670.833   16.452  ?   ?   935.682   11.488 0.000000 11.48757 
1 1 1    8   23   16 o   79.401   28.432   4.1190   4.3824   1.4146   7.8927   5.3245   5.2694   86.818   36.065   88.682   31.238 -1.863464 47.71246 
1 1 1    8   23   17 o  1090.44   8.7434  910.703   14.593  904.708   20.565  916.784   20.711  1086.43   12.367  1093.66   12.372 -7.226318 17.49344 
1 1 1    8   23   18 o  530.549   8.9320  215.606   7.2534  216.937   12.216  214.881   9.0145  531.773   15.008  529.533   11.122 2.239990 18.68017 
1 1 1    8   23   19 o  331.571   10.939   84.253   5.5516   77.053   9.1858   88.397   6.9682  316.077   19.076  339.510   13.409 -23.43317 23.31754 
1 1 1    8   23   20 o  465.641   9.4888  166.120   6.7629  155.291   10.967  172.766   8.5908  449.754   15.931  474.717   11.823 -24.96301 19.83877 
1 1 1    8   23   21 o  423.414   8.7318  137.345   5.6590  142.239   8.0693  132.608   7.9383  430.681   12.241  415.828   12.472 14.85257 17.47560 
1 1 1    8   23   22 o  540.602   8.0930  223.876   6.6966  218.325   9.3234  229.792   9.6246  533.607   11.415  547.433   11.486 -13.82648 16.19393 
1 1 1    8   23   23 o  623.979   8.1064  298.283   7.7423  291.661   10.572  305.943   11.370  616.724   11.199  631.579   11.762 -14.85529 16.24075 
1 1 1    8   23   24 o  398.993   10.264  122.054   6.2683  119.582   7.6623  127.056   10.899  394.745   12.682  406.387   17.522 -11.64230 21.62976 
1 1 1    8   23   25 o  309.687   10.868   73.560   5.1515   71.753   7.1281   75.535   7.4534  305.537   15.242  313.458   15.535 -7.921021 21.76330 
1 1 1    8   23   26 o  690.861   8.2811  365.781   8.7569  371.394   12.335  360.078   12.434  695.680   11.584  684.956   11.860 10.72437 16.57836 
1 1 1    8   23   27 o  174.372   17.297   23.648   4.5556   22.582   6.2434   24.862   6.6622  168.897   24.897  177.299   25.264 -8.401840 35.47031 
1 1 1    8   23   28 o  320.535   11.001   78.857   5.3976   72.285   7.4828   85.985   7.7932  305.983   16.033  334.269   15.232 -28.28662 22.11474 
1 1 1    8   23   29 o  313.135   11.459   75.296   5.4923   76.468   7.5762   73.997   7.9737  315.096   15.709  309.359   16.903 5.737762 23.07567 
1 1 1    8   23   30 o  422.968   11.831  137.447   7.6597  138.379   9.0293  135.056   14.466  424.086   13.910  416.506   22.778 7.579865 26.68928 
1 1 1    8   23   31 o  244.448   16.925   46.338   6.2939   40.127   7.1308   68.234   13.389  226.604   20.791  293.172   30.274 -66.56793 36.72524 
1 1 1    8   23   32 o  150.464   14.433   17.600   3.2832   18.071   3.7420   16.024   6.8434  152.160   16.322  139.650   32.607 12.51056 36.46438 
1 1 1    8   23   33 o  264.411   9.9701   53.692   4.0351   53.705   4.4928   53.637   9.1760  264.333   11.104  261.318   23.182 3.014526 25.70407 
1 1 1    8   23   34 o  370.544   8.5781  105.372   4.8652  104.767   5.4257  107.857   10.991  369.349   9.5972  372.295   19.355 -2.946075 21.60396 
1 1 1    8   23   35 o   98.050   17.637   7.6711   2.5496   5.8989   3.3428   10.136   3.9423   85.638   24.348  111.770   23.775 -26.13223 34.03069 
1 1 1    8   23   36 o  469.852   7.1141  169.333   5.1162  173.311   7.5391  165.936   6.9657  474.737   10.375  464.647   9.7942 10.08960 14.26791 
1 1 1    8   23   37 o  315.776   7.9115   76.544   3.8239   74.745   5.4725   78.261   5.3454  311.522   11.477  318.856   10.953 -7.333160 15.86447 
1 1 1    8   23   38 o   89.403   19.378   6.4694   2.5752   6.8499   3.5816   6.0623   3.7052   91.600   24.895   86.819   25.911 4.780762 35.93220 
1 1 1    8   23   39 o  325.133   7.9761   81.192   3.9694   86.585   5.5598   75.584   5.6688  335.255   10.835  313.037   11.831 22.21802 16.04263 
1 1 1    8   23   40 o  136.375   13.778   14.534   2.8366   8.9868   3.8955   20.795   4.1385  104.488   24.740  162.650   16.869 -58.16193 29.94352 
1 1 1    8   23   41 o  187.199   11.073   27.119   3.1586   29.232   4.4304   24.935   4.5043  193.496   15.078  178.202   16.709 15.29445 22.50622 
1 1 1    8   23   42 o  269.236   11.558   55.970   4.7631   46.696   10.364   58.453   5.3630  239.010   28.918  274.882   12.747 -35.87256 31.60269 
1 1 1    8   23   43 o  128.067   15.826   12.957   3.0363   14.429   4.2835   11.470   4.3046  133.557   21.698  117.911   24.645 15.64574 32.83585 
1 1 1    8   23   44 o  143.626   18.892   16.464   4.0523   17.007   4.5782   14.499   8.7084  145.266   21.216  128.929   39.978 16.33775 45.25905 
1 1 1    8   23   45 o  322.220   11.247   80.266   5.5471   55.441   11.692   87.477   6.3015  258.558   30.107  336.069   12.250 -77.51068 32.50354 
1 1 1    8   23   46 o   61.637   24.194   1.9586   3.3329  -2.2394   4.5820   6.6753   4.8568   55.073   25.006   90.998   30.030 -35.92419 39.07798 
1 1 1    8   23   47 o   43.772   20.467  -3.0781   3.4080  -0.5320   4.7029  -5.8937   4.9455   60.631   26.554   49.432   23.568 11.19867 35.50441 
1 1 1    8   23   48 o  246.142   16.176   47.747   6.0604   57.213   7.2275   25.325   11.123  268.802   17.665  164.164   43.550 104.6383 46.99603 
1 1 1    8   23   49 o   55.696   24.045   0.0053   3.7420  -0.1472   5.5651   0.1311   5.0556   66.439   28.997   64.403   27.876 2.035667 40.22308 
1 1 1    8   23   50 o  198.810   13.852   31.072   4.1889   37.584   6.2024   25.611   5.6799  216.368   18.918  177.156   21.379 39.21136 28.54765 
1 1 1    8   23   51 o  321.415   12.970   80.782   6.3809   60.394   10.400   93.090   8.0805  268.868   25.579  343.560   15.366 -74.69205 29.84002 
1 1 1    8   23   52 f  174.366   16.493   24.339   4.3495   28.442   6.7306   21.397   5.6994  184.024   24.504  159.529   24.092 24.49477 34.36381 
1 1 1    8   23   53 o  222.770   13.044   39.111   4.4282   37.135   6.3018   41.038   6.2238  213.291   19.519  225.184   18.213 -11.89258 26.69677 
1 1 1    8   23   54 o   95.945   26.161   8.1722   3.9476   8.9998   5.4507   7.2593   5.7249   98.922   31.756   91.008   32.506 7.914795 45.44360 
1 1 1    8   23   55 o  165.538   25.951   24.074   6.3592   18.570   9.4504   28.628   8.5967  131.064   41.788  173.724   33.544 -42.66002 53.58580 
1 1 1    8   23   56 o  103.387   29.141   10.008   4.8098   13.411   5.9970   3.8705   8.0528  117.565   32.322   82.676   35.478 34.88888 47.99403 
1 1 1    8   24    0 o  714.576   14.014  391.522   15.314  391.522   15.314  391.522   15.314  714.576   14.014  714.576   14.014 0.000000 0.000000 
1 1 1    8   24    1 o  635.431   9.5585  309.224   9.2966  310.677   13.117  307.759   13.178  636.707   13.459  633.702   13.586 3.004944 19.12432 
1 1 1    8   24    2 o  236.407   13.246   42.963   4.7737   45.797   6.8165   40.235   6.6875  243.623   18.416  228.156   19.331 15.46725 26.69928 
1 1 1    8   24    3 o  1064.78   11.564  868.563   18.847  844.878   25.898  895.230   27.480  1049.66   16.119  1080.42   16.617 -30.75903 23.15058 
1 1 1    8   24    4 o  1549.09   21.147  1842.79   50.140   0.0000   0.0000  1842.79   50.140  ?   ?   1549.09   21.147 0.000000 21.14651 
1 1 1    8   24    5 o  1883.13   17.627  2720.44   50.809  2718.07   72.227  2722.77   71.488  1879.99   25.100  1881.72   24.820 -1.727539 35.29955 
1 1 1    8   24    6 o  555.787   10.212  236.598   8.6876  240.466   12.631  233.125   11.968  560.065   14.734  551.484   14.178 8.580566 20.44791 
1 1 1    8   24    7 o  1204.80   10.373  1111.84   19.128  1096.47   23.202  1144.45   33.798  1196.19   12.672  1221.28   18.080 -25.08472 22.07886 
1 1 1    8   24    8 o  718.602   8.4865  395.431   9.3344  389.157   11.361  408.463   16.375  712.774   10.414  729.925   14.657 -17.15137 17.97933 
1 1 1    8   24    9 f  650.809   8.4147  324.341   8.3823  320.929   10.236  331.288   14.605  647.281   10.332  657.361   14.516 -10.08051 17.81704 
1 1 1    8   24   10 o  291.930   10.571   65.284   4.7237   68.266   5.7946   59.378   8.1555  298.460   12.684  277.435   19.326 21.02469 23.11677 
1 1 1    8   24   11 o  219.168   13.201   36.951   4.4078   31.736   5.3047   48.583   7.9222  202.640   17.268  250.620   20.841 -47.98044 27.06494 
1 1 1    8   24   12 o  1750.04   13.613  2347.83   36.464  2349.55   44.782  2344.43   62.812  1749.94   16.719  1745.87   23.505 4.066650 28.84479 
1 1 1    8   24   13 o  189.634   19.627   27.914   5.6143   21.750   8.0375   33.788   7.8457  164.879   33.000  208.008   25.153 -43.12924 41.49308 
1 1 1    8   24   14 o  1384.70   14.217  1470.34   30.132  1418.33   41.483  1528.44   43.842  1358.68   19.947  1410.33   20.310 -51.65527 28.46701 
1 1 1    8   24   15 o  762.299   10.842  445.267   12.650  439.333   17.629  451.568   18.164  756.753   15.219  767.188   15.468 -10.43481 21.69981 
1 1 1    8   24   16 o  164.487   18.613   21.048   4.6036   4.9646   7.2451   31.939   5.9618   94.965   36.090  202.947   19.430 -107.9823 40.98829 
1 1 1    8   24   17 o  421.165   9.5740  135.898   6.1719  154.350   10.761  126.853   7.5342  448.443   15.678  406.778   12.101 41.66504 19.80452 
1 1 1    8   24   18 f  357.073   9.2656   97.684   5.0641  102.389   7.2610   93.227   7.0663  365.383   12.983  348.637   13.242 16.74554 18.54480 
1 1 1    8   24   19 o  471.871   8.2637  170.564   5.9685  166.050   8.2273  175.579   8.6718  465.380   11.550  478.525   11.840 -13.14481 16.54011 
1 1 1    8   24   20 o  565.166   7.9901  244.678   6.9119  237.857   9.5740  252.104   9.9890  556.980   11.230  573.403   11.381 -16.42322 15.98908 
1 1 1    8   24   21 o  283.863   10.892   61.782   4.7323   61.593   6.6163   61.980   6.7714  282.758   15.345  283.608   15.659 -0.8500061 21.92436 
1 1 1    8   24   22 o  307.341   11.738   72.459   5.5218   76.606   6.7988   64.422   9.4645  315.854   14.063  288.205   21.612 27.64835 25.78476 
1 1 1    8   24   23 o  586.593   9.2026  263.746   8.2626  263.664   10.202  263.901   14.086  586.264   11.369  585.901   15.707 0.3637085 19.39008 
1 1 1    8   24   24 o  266.116   11.756   54.345   4.7885   52.414   6.7182   56.339   6.8272  260.423   16.946  270.090   16.595 -9.666992 23.71837 
1 1 1    8   24   25 f  277.570   11.517   59.130   4.8929   58.022   6.8601   60.278   6.9807  274.074   16.429  279.375   16.396 -5.300537 23.21071 
1 1 1    8   24   26 o  295.963   11.119   67.228   5.0372   66.616   7.0859   67.853   7.1620  293.768   15.817  296.489   15.839 -2.720795 22.38429 
1 1 1    8   24   27 o  622.207   8.4537  296.810   8.0510  286.004   11.076  308.916   11.724  610.255   11.857  634.186   12.077 -23.93146 16.92517 
1 1 1    8   24   28 o  283.602   14.298   62.043   6.1864   58.540   7.1005   73.081   12.604  275.012   16.951  304.867   27.300 -29.85443 32.13421 
1 1 1    8   24   29 o  398.068   11.886  121.759   7.2419  109.065   8.2534  164.232   15.097  376.405   14.325  460.239   21.431 -83.83380 25.77821 
1 1 1    8   24   30 o  598.513   8.7988  274.801   8.0606  277.840   11.286  271.636   11.517  601.140   12.265  594.302   12.660 6.838501 17.62745 
1 1 1    8   24   31 o  126.608   29.662   13.110   5.6476   9.9104   10.789   14.317   6.6281  120.427   44.397  131.905   32.931 -11.47752 55.27682 
1 1 1    8   24   32 o  137.937   24.140   15.271   4.9111   13.524   7.1019   16.872   6.7986  128.044   35.162  143.274   31.829 -15.22997 47.42838 
1 1 1    8   24   33 o  205.816   11.031   32.663   3.4624   31.716   3.9391   35.881   7.2607  202.541   12.772  213.322   22.580 -10.78018 25.94166 
1 1 1    8   24   34 f  537.375   7.4641  221.516   6.1394  218.626   7.3442  228.219   11.187  533.579   8.9924  544.034   13.434 -10.45471 16.16590 
1 1 1    8   24   35 o  370.543   8.8004  105.446   4.9913  105.764   5.5461  104.092   11.449  370.951   9.7679  364.781   20.589 6.169434 22.78872 
1 1 1    8   24   36 o  113.233   15.358   10.100   2.5931   10.601   3.5425   9.5226   3.8061  114.784   20.935  108.080   23.663 6.704124 31.59449 
1 1 1    8   24   37 o  130.453   13.644   13.291   2.6840   16.458   3.6518   9.5699   3.9582  144.642   16.808  108.088   24.492 36.55417 29.70422 
1 1 1    8   24   38 o   70.861   21.919   3.9472   2.6196   1.5527   3.5895   6.6758   3.8318   61.845   24.834   90.584   26.168 -28.73870 36.07639 
1 1 1    8   24   39 o  159.151   11.908   19.653   2.8798   21.307   3.9889   17.853   4.1618  164.875   16.008  150.167   18.498 14.70781 24.46266 
1 1 1    8   24   40 o  251.498   8.9576   48.651   3.4482   49.950   4.8890   47.364   4.8642  254.220   12.564  247.160   12.902 7.059647 18.00928 
1 1 1    8   24   41 o  252.910   11.759   49.400   4.5520   46.590   10.476   50.054   5.0540  238.580   29.304  253.991   13.044 -15.41159 32.07576 
1 1 1    8   24   42 o  346.135   8.1293   92.118   4.3070   97.569   6.1579   86.897   6.0261  355.460   11.318  335.342   11.740 20.11804 16.30752 
1 1 1    8   24   43 o  133.523   20.070   14.334   3.9750   12.426   4.4838   21.340   8.5905  122.684   24.732  156.661   36.502 -33.97630 44.09142 
1 1 1    8   24   44 o  194.844   11.887   29.486   3.5281   27.364   4.9571   31.664   5.0225  186.042   17.618  200.616   16.503 -14.57442 24.13977 
1 1 1    8   24   45 o  144.405   17.812   16.609   3.8536   15.760   5.3040   17.559   5.6083  137.661   26.128  145.485   26.146 -7.823608 36.96360 
1 1 1    8   24   46 o  377.383   10.732  110.117   6.1990   75.809   11.682  123.564   7.3137  305.304   25.224  399.268   11.967 -93.96378 27.91903 
1 1 1    8   24   47 o  173.195   14.811   23.603   3.8885   27.086   5.5508   20.247   5.4491  183.619   20.077  157.121   23.369 26.49734 30.80943 
1 1 1    8   24   48 o  165.866   22.669   22.528   5.6044   22.528   5.6044   0.0000   0.0000  165.866   22.669  ?   ?  0.000000 22.66854 
1 1 1    8   24   49 o  231.185   13.083   41.837   4.6104   35.368   6.4798   48.469   6.5612  209.097   20.510  246.784   17.483 -37.68665 26.95050 
1 1 1    8   24   50 o  284.667   16.357   64.309   7.0970   0.0000   0.0000   64.309   7.0970  ?   ?   284.667   16.357 0.000000 16.35678 
1 1 1    8   24   51 o  101.339   26.230   8.9045   4.1002   5.0276   6.3916   11.616   5.3450   85.499   33.522  114.209   30.137 -28.71049 45.07777 
1 1 1    8   24   52 o  212.776   16.450   36.257   5.3158   40.455   6.3709   26.636   9.6446  223.332   18.812  166.315   38.626 57.01666 42.96360 
1 1 1    8   24   53 o  136.986   21.231   15.744   4.3076   13.121   5.6439   19.403   6.6666  119.434   30.704  145.879   30.822 -26.44521 43.50550 
1 1 1    8   24   54 o   53.416   24.564  -2.2339   4.6103  -6.2512   8.8589  -0.7418   5.3991   67.163   31.885   61.709   27.657 5.454834 42.20839 
1 1 1    8   24   55 o  162.307   16.866   21.539   4.1289   18.940   5.8753   24.075   5.8035  144.840   27.508  167.096   23.327 -22.25537 36.06696 
1 1 1    8   25    0 o  394.813   14.777  119.904   8.9012  119.904   8.9012  119.904   8.9012  394.813   14.777  394.813   14.777 0.000000 0.000000 
1 1 1    8   25    1 o  424.374   10.123  137.946   6.5756  141.174   9.2072  134.586   9.3943  429.142   14.017  418.977   14.649 10.16461 20.27483 
1 1 1    8   25    2 o  759.152   10.159  441.441   11.804  438.203   16.442  444.886   16.958  756.050   14.208  761.761   14.544 -5.711914 20.33189 
1 1 1    8   25    3 o  977.816   11.178  732.508   16.730  732.974   23.547  732.033   23.774  977.620   15.736  976.971   15.898 0.6489868 22.36925 
1 1 1    8   25    4 o  989.435   15.939  750.857   24.139   0.0000   0.0000  750.857   24.139  ?   ?   989.435   15.939 0.000000 15.93880 
1 1 1    8   25    5 o  370.880   11.412  105.389   6.4782  114.445   9.8336   98.445   8.6109  386.241   16.633  358.273   15.702 27.96814 22.87439 
1 1 1    8   25    6 o  361.280   11.964  100.018   6.6161   88.347   9.6663  110.304   9.0748  338.727   18.717  379.235   15.634 -40.50784 24.38692 
1 1 1    8   25    7 o  650.694   10.398  324.350   10.357  318.488   14.934  329.782   14.375  644.437   15.140  655.835   14.320 -11.39764 20.83923 
1 1 1    8   25    8 o  535.155   8.5585  219.327   7.0105  224.436   8.7652  210.255   11.679  541.257   10.580  523.636   14.572 17.62042 18.00776 
1 1 1    8   25    9 o  436.037   9.0127  145.619   6.0151  143.304   7.4039  150.115   10.317  432.467   11.185  442.401   15.235 -9.934692 18.90025 
1 1 1    8   25   10 o  543.008   10.293  225.892   8.5546  213.361   11.701  240.278   12.538  527.464   14.494  559.737   14.634 -32.27271 20.59667 
1 1 1    8   25   11 o  618.746   14.725  293.642   13.946   0.0000   0.0000  293.642   13.946  ?   ?   618.746   14.725 0.000000 14.72536 
1 1 1    8   25   12 o  203.838   25.894   32.526   7.8966   0.0000   0.0000   32.526   7.8966  ?   ?   203.838   25.894 0.000000 25.89374 
1 1 1    8   25   13 o  826.639   10.952  523.658   13.857  532.508   19.652  514.908   19.542  833.053   15.412  819.146   15.586 13.90649 21.91953 
1 1 1    8   25   14 o  952.699   9.5354  695.363   13.905  685.250   16.882  716.692   24.518  945.497   11.665  966.164   16.579 -20.66730 20.27184 
1 1 1    8   25   15 o  331.060   11.101   84.006   5.6254   84.575   6.8262   82.803   9.9307  332.061   13.430  327.535   19.903 4.526031 24.01049 
1 1 1    8   25   16 o  605.803   7.8123  281.093   7.2441  281.522   10.302  280.674   10.189  606.018   11.106  605.113   11.001 0.9050903 15.63164 
1 1 1    8   25   17 o  868.852   8.1000  578.270   10.772  583.873   15.270  572.721   15.198  872.654   11.432  864.271   11.489 8.382263 16.20773 
1 1 1    8   25   18 o  189.627   14.876   27.779   4.2832   23.934   6.0266   31.703   6.0886  174.664   23.110  201.965   19.957 -27.30138 30.53423 
1 1 1    8   25   19 o  501.613   8.1903  192.771   6.2884  192.101   8.7258  193.496   9.0704  500.490   11.390  502.267   11.798 -1.776489 16.39949 
1 1 1    8   25   20 o  337.343   11.009   87.273   5.6842   78.694   6.8762  105.786   10.101  320.128   14.033  370.787   17.799 -50.65921 22.66557 
1 1 1    8   25   21 o  356.474   10.794   97.459   5.8894   98.287   7.2913   95.904   9.9897  357.788   13.314  352.404   18.586 5.383942 22.86241 
1 1 1    8   25   22 o  353.292   9.5578   95.694   5.1685   91.794   7.0888  100.120   7.5518  345.721   13.396  361.034   13.666 -15.31342 19.13646 
1 1 1    8   25   23 o  284.094   11.113   61.928   4.8324   61.631   6.7382   62.242   6.9339  282.629   15.637  283.974   16.018 -1.344940 22.38504 
1 1 1    8   25   24 o  417.041   9.0878  133.354   5.8011  127.115   7.9885  140.316   8.4379  406.793   12.830  427.385   12.899 -20.59259 18.19286 
1 1 1    8   25   25 o  516.713   8.5110  204.691   6.7313  203.451   9.4591  205.963   9.5811  514.700   12.007  517.855   12.088 -3.154846 17.03733 
1 1 1    8   25   26 o  552.953   9.8676  234.589   8.3516  230.987   9.9001  243.478   15.553  548.396   11.794  561.670   18.090 -13.27399 21.59565 
1 1 1    8   25   27 o  147.757   24.528   17.415   5.3527   18.355   6.0622   14.089   11.402  151.153   27.203  135.469   46.033 15.68390 53.46958 
1 1 1    8   25   28 o  393.286   9.8525  118.714   5.9310  115.964   8.1218  121.857   8.6814  388.190   13.669  397.835   14.257 -9.645020 19.75087 
1 1 1    8   25   29 o  204.083   15.853   32.318   4.9132   37.738   6.9002   26.744   6.9974  219.623   20.773  183.377   25.630 36.24637 32.99161 
1 1 1    8   25   30 o  494.158   10.997  187.654   8.3175  169.973   14.275  196.743   10.234  468.114   19.922  505.520   13.227 -37.40582 23.91338 
1 1 1    8   25   31 o  451.369   9.8545  156.475   6.8083  153.794   9.4907  159.318   9.7721  446.708   13.881  454.621   14.043 -7.913788 19.74549 
1 1 1    8   25   32 o   52.349   24.317  -3.9722   4.6870  -5.8515   6.6255  -2.0896   6.6313   61.477   28.675   69.540   30.945 -8.062897 42.18830 
1 1 1    8   25   33 o  316.530   12.234   77.167   5.9272   78.216   8.2545   76.050   8.5162  317.286   17.060  312.621   17.872 4.664795 24.70678 
1 1 1    8   25   34 o  501.934   7.6538  193.329   5.8802  189.033   6.9784  203.849   10.919  496.031   9.1914  513.834   13.884 -17.80289 16.65049 
1 1 1    8   25   35 o  233.165   11.077   41.861   3.9533   39.288   4.5414   49.909   8.0329  225.218   13.232  251.799   21.035 -26.58105 24.85075 
1 1 1    8   25   36 o  249.969   10.647   48.109   4.0738   50.334   4.5122   38.296   9.4741  255.553   11.536  217.131   29.251 38.42177 31.44355 
1 1 1    8   25   37 o  173.690   10.746   23.325   2.8429   26.895   3.8799   19.186   4.1773  185.993   13.726  155.994   17.815 29.99905 22.48917 
1 1 1    8   25   38 o  250.739   9.3059   48.361   3.5715   44.790   4.8499   52.592   5.2791  240.329   13.235  260.465   13.286 -20.13562 18.75332 
1 1 1    8   25   39 o  179.912   11.244   25.063   3.0808   27.734   4.4040   22.503   4.3114  188.367   15.409  169.180   16.875 19.18764 22.85187 
1 1 1    8   25   40 o  227.860   12.550   40.266   4.3603   29.232   9.3536   43.329   4.9285  186.106   34.092  236.103   13.697 -49.99634 36.74078 
1 1 1    8   25   41 o  290.939   8.4936   65.107   3.7823   62.345   5.3086   67.956   5.3904  283.939   12.215  296.525   11.876 -12.58560 17.03684 
1 1 1    8   25   42 o  243.108   11.880   45.705   4.4206   44.566   5.0184   49.650   9.3389  239.258   13.761  247.973   24.943 -8.715515 28.48749 
1 1 1    8   25   43 o  266.238   9.9464   54.670   4.0533   51.663   5.3450   58.740   6.2178  257.604   13.604  274.284   14.866 -16.68057 20.15112 
1 1 1    8   25   44 o  250.903   10.922   48.657   4.1946   48.309   5.7148   49.064   6.1764  248.461   15.098  249.979   16.230 -1.517609 22.16696 
1 1 1    8   25   45 o  418.939   9.9127  135.489   6.3564  137.136   7.4817  131.215   12.051  420.801   11.616  407.384   19.327 13.41635 22.54893 
1 1 1    8   25   46 o  183.540   13.385   26.354   3.7343   28.488   5.0521   23.785   5.5442  189.396   17.630  171.335   21.622 18.06085 27.89872 
1 1 1    8   25   47 o  165.307   15.180   21.580   3.7979   18.388   5.1935   25.249   5.5681  149.281   23.507  176.557   21.017 -27.27644 31.53212 
1 1 1    8   25   48 o  169.245   14.592   22.606   3.7432   21.458   5.2178   23.823   5.3730  162.015   21.577  171.131   20.950 -9.115967 30.07474 
1 1 1    8   25   49 o  242.231   12.421   45.882   4.5897   42.026   5.8366   52.131   7.4296  229.825   16.706  254.572   19.209 -24.74712 25.45700 
1 1 1    8   25   50 o  144.462   19.946   17.083   4.2928   17.791   6.5164   16.541   5.7059  141.512   30.946  138.033   27.965 3.479202 41.70987 
1 1 1    8   25   51 o  126.067   30.720   14.325   5.8735   0.0000   0.0000   14.325   5.8735  ?   ?   126.067   30.720 0.000000 30.71985 
1 1 1    8   25   52 o  132.065   21.925   14.710   4.2766   15.855   6.3573   13.763   5.7798  130.887   32.000  122.477   30.848 8.410355 44.44782 
1 1 1    8   25   53 o   61.193   26.899   0.0561   4.8652   15.868   12.136  -2.9719   5.3107  119.938   46.422   56.009   25.971 63.92886 53.19310 
1 1 1    8   25   54 o  107.295   33.606   11.208   6.1362   6.7446   9.0997   14.929   8.3097   92.777   38.647  119.174   39.278 -26.39754 55.10343 
1 1 1    8   26    0 o  141.417   35.863   18.033   6.7123   18.033   6.7123   18.033   6.7123  141.417   35.863  141.417   35.863 0.000000 0.000000 
1 1 1    8   26    1 o  891.346   10.856  608.732   14.812  593.212   20.611  625.306   21.299  879.416   15.312  902.878   15.412 -23.46204 21.72561 
1 1 1    8   26    2 o  982.078   11.313  739.045   17.006  722.904   23.623  756.409   24.501  970.708   15.899  992.914   16.122 -22.20624 22.64253 
1 1 1    8   26    3 o  583.838   10.009  261.125   8.9446  281.783   13.197  243.572   12.165  606.189   14.223  563.601   14.102 42.58820 20.02896 
1 1 1    8   26    4 o  262.178   18.703   53.053   7.4561   0.0000   0.0000   53.053   7.4561  ?   ?   262.178   18.703 0.000000 18.70269 
1 1 1    8   26    5 o  703.156   14.490  379.193   15.595   0.0000   0.0000  379.193   15.595  ?   ?   703.156   14.490 0.000000 14.48999 
1 1 1    8   26    6 o  234.913   22.255   42.823   7.9066   0.0000   0.0000   42.823   7.9066  ?   ?   234.913   22.255 0.000000 22.25462 
1 1 1    8   26    7 o  352.622   16.497   95.434   8.9041   0.0000   0.0000   95.434   8.9041  ?   ?   352.622   16.497 0.000000 16.49717 
1 1 1    8   26    8 o  748.481   10.781  429.287   12.352  416.275   17.717  441.592   17.229  736.530   15.716  758.706   14.836 -22.17682 21.61222 
1 1 1    8   26    9 o  255.880   15.088   50.410   5.8831   52.451   8.6565   48.658   8.0198  260.182   21.942  250.650   21.100 9.531738 30.44077 
1 1 1    8   26   10 o  1010.57   9.7474  782.443   15.077  772.628   18.484  801.961   26.065  1003.92   12.029  1022.02   16.662 -18.09283 20.55028 
1 1 1    8   26   11 o  744.489   8.8519  424.588   10.087  418.257   12.322  437.451   17.564  738.738   10.897  754.986   15.199 -16.24835 18.70180 
1 1 1    8   26   12 o  917.347   9.4200  644.754   13.227  638.073   16.118  658.529   23.144  912.326   11.542  926.056   16.328 -13.72974 19.99596 
1 1 1    8   26   13 o  414.379   9.7676  131.579   6.1952  128.458   7.5046  138.256   10.977  409.305   11.979  424.228   16.905 -14.92352 20.71909 
1 1 1    8   26   14 f  398.073   9.9750  121.442   6.0778  122.439   7.4334  119.433   10.556  399.568   12.154  394.197   17.496 5.370636 21.30312 
1 1 1    8   26   15 o  550.587   9.0934  232.285   7.6634  235.336   9.3567  226.066   13.357  554.032   11.034  542.464   16.087 11.56799 19.50689 
1 1 1    8   26   16 o  419.371   9.9742  134.806   6.4025  136.591   7.7042  130.821   11.511  421.998   11.927  412.378   18.236 9.620026 21.79055 
1 1 1    8   26   17 o  285.341   10.602   62.427   4.6303   59.299   6.3731   65.925   6.7386  277.434   15.064  292.561   15.100 -15.12674 21.32923 
1 1 1    8   26   18 o  452.278   8.4272  156.744   5.8339  162.818   8.1259  150.284   8.3808  460.708   11.523  442.541   12.373 18.16724 16.90753 
1 1 1    8   26   19 o  494.107   9.4482  187.156   7.1456  180.227   8.5212  203.573   13.116  484.682   11.486  514.423   16.658 -29.74152 20.23381 
1 1 1    8   26   20 o  298.380   10.302   68.279   4.7049   75.616   6.5349   60.384   6.7791  313.756   13.608  279.749   15.898 34.00674 20.92599 
1 1 1    8   26   21 o  688.504   7.9740  363.274   8.4033  357.224   11.607  369.939   12.182  682.316   11.114  694.295   11.463 -11.97894 15.96631 
1 1 1    8   26   22 o  231.815   12.507   41.391   4.4215   46.300   6.1151   36.012   6.4004  244.681   16.423  215.115   19.656 29.56654 25.61411 
1 1 1    8   26   23 o  230.174   13.037   40.841   4.5743   40.572   6.3890   41.124   6.5522  228.594   18.416  230.090   18.768 -1.495789 26.29418 
1 1 1    8   26   24 o  690.740   9.5995  366.006   10.149  369.271   12.252  358.864   18.119  693.453   11.543  682.158   17.354 11.29449 20.84183 
1 1 1    8   26   25 f  142.501   25.033   16.246   5.2609   18.664   6.1983   10.014   9.9492  152.387   27.590  119.380   42.830 33.00737 50.94713 
1 1 1    8   26   26 o  497.445   8.8639  189.808   6.7490  184.019   9.3655  196.062   9.7342  489.252   12.506  504.993   12.594 -15.74084 17.74839 
1 1 1    8   26   27 o  427.354   9.4331  140.154   6.1704  145.281   8.6591  134.866   8.7950  434.562   13.018  418.574   13.728 15.98798 18.91871 
1 1 1    8   26   28 o  450.755   11.141  156.133   7.6864  157.268   13.548  155.595   9.3342  450.454   19.649  449.534   13.566 0.9201660 23.87739 
1 1 1    8   26   29 o  202.740   19.155   32.136   5.8738   43.180   10.654   27.312   7.0405  231.875   30.779  185.184   25.517 46.69077 39.98039 
1 1 1    8   26   30 o  222.909   14.965   38.517   5.0764   34.325   7.0381   43.063   7.3291  208.687   22.383  234.468   20.632 -25.78131 30.44167 
1 1 1    8   26   31 o  206.386   16.733   33.179   5.2405   28.006   7.0616   39.519   7.8185  187.324   25.274  223.692   23.171 -36.36771 34.28791 
1 1 1    8   26   32 o  222.695   16.184   38.583   5.4788   36.197   7.6612   41.081   7.8383  213.622   23.837  228.068   22.757 -14.44604 32.95617 
1 1 1    8   26   33 o  266.835   15.869   55.324   6.4522   67.509   10.684   48.329   8.0950  292.125   24.111  247.725   21.564 44.39999 32.34703 
1 1 1    8   26   34 o  819.155   10.561  516.429   13.242  550.672   23.030  499.516   16.185  841.491   17.880  804.394   13.145 37.09735 22.19233 
1 1 1    8   26   35 o  325.214   9.4464   81.330   4.7023   84.650   5.2837   68.686   10.311  331.616   10.410  294.593   23.051 37.02368 25.29214 
1 1 1    8   26   36 o  532.617   7.8338  217.853   6.3864  222.872   7.7090  206.872   11.403  538.323   9.3559  516.906   14.412 21.41644 17.18259 
1 1 1    8   26   37 o  181.499   13.078   25.594   3.6087   23.639   4.0161   33.791   8.2233  173.918   15.240  204.243   26.964 -30.32460 30.97272 
1 1 1    8   26   38 o   96.411   32.847   7.2102   5.8058   32.586   8.7474 -12.7701   7.7620  199.157   29.595   57.042   27.764 142.1157 40.58010 
1 1 1    8   26   39 o  122.852   20.286   12.150   3.6814   9.5738   8.7323   12.707   4.0598  111.515   40.113  125.201   21.987 -13.68561 45.74356 
1 1 1    8   26   40 o  186.648   11.602   27.013   3.2981   33.497   4.7883   21.160   4.5493  207.013   15.218  163.365   18.521 43.64824 23.97123 
1 1 1    8   26   41 o  213.466   13.729   35.500   4.4620   35.561   4.9380   35.228   10.417  213.220   15.231  203.558   34.675 9.662186 37.87269 
1 1 1    8   26   42 o  159.156   13.576   19.802   3.2757   20.989   4.5756   18.554   4.6915  162.399   18.752  151.918   20.716 10.48126 27.94295 
1 1 1    8   26   43 o   40.185   18.816  -2.7492   2.8984  -3.5630   4.0929  -1.9305   4.1050   48.193   22.499   52.529   23.777 -4.335499 32.73476 
1 1 1    8   26   44 o  346.764   11.405   93.081   6.0535   73.695   11.683  100.196   7.0778  300.832   25.615  359.217   12.873 -58.38467 28.66790 
1 1 1    8   26   45 o  307.587   9.4011   73.014   4.4260   69.215   5.9931   77.572   6.5646  298.301   13.126  315.613   13.589 -17.31186 18.89301 
1 1 1    8   26   46 o  357.368   9.0950   98.575   4.9750  107.507   7.3897   91.172   6.7280  371.570   12.993  342.247   12.843 29.32379 18.26957 
1 1 1    8   26   47 o  120.416   20.976   11.933   3.7256   9.3842   5.3491   14.334   5.1920  103.896   31.161  129.607   27.046 -25.71107 41.26165 
1 1 1    8   26   48 o   73.352   25.956   4.0862   3.6420   5.3699   4.9720   2.6001   5.3499   83.507   30.236   73.629   30.044 9.877670 42.62441 
1 1 1    8   26   49 o  122.590   20.788   12.434   3.7612   15.509   5.5295   9.7867   5.1311  133.651   27.930  105.175   30.252 28.47619 41.17354 
1 1 1    8   26   50 o  158.703   17.090   20.297   4.0859   30.050   6.1777   12.714   5.4475  190.836   21.525  119.174   29.911 71.66215 36.85088 
1 1 1    8   26   51 o  169.944   16.587   23.293   4.2597   24.562   5.7056   21.695   6.4027  171.180   22.306  157.246   27.609 13.93442 35.49387 
1 1 1    8   26   52 o   80.535   27.487   5.5282   4.0658   4.4894   5.3321   6.9712   6.2845   78.550   30.668   90.235   33.761 -11.68503 45.61073 
1 1 1    8   26   53 o  105.020   29.394   10.247   4.9115   1.6094   12.438   11.842   5.3459   89.444   40.838  112.337   30.366 -22.89241 50.89001 
1 1 1    8   27    0 f  562.604   14.428  243.007   12.406  243.007   12.406  243.007   12.406  562.604   14.428  562.604   14.428 0.000000 0.000000 
1 1 1    8   27    1 o  958.324   11.266  703.886   16.526  697.681   23.103  710.387   23.648  953.410   15.831  962.012   16.060 -8.601746 22.55129 
1 1 1    8   27    2 o  510.182   10.115  199.438   7.8990  189.361   10.933  210.443   11.426  496.826   14.376  523.763   14.252 -26.93744 20.24341 
1 1 1    8   27    3 o  460.520   10.435  162.514   7.3552  159.244   10.225  166.020   10.588  455.579   14.664  465.155   14.871 -9.575500 20.88465 
1 1 1    8   27    4 o  160.861   31.153   20.696   7.3933   0.0000   0.0000   20.696   7.3933  ?   ?   160.861   31.153 0.000000 31.15283 
1 1 1    8   27    5 o  349.194   12.382   93.493   6.6178   95.528   9.7913   91.782   8.9793  352.126   18.229  345.703   16.969 6.423859 24.90503 
1 1 1    8   27    6 o  598.165   10.732  274.221   9.8256  267.101   14.262  280.654   13.556  589.860   15.796  604.770   14.645 -14.91028 21.54033 
1 1 1    8   27    7 o  507.666   10.961  197.541   8.5170  207.525   12.732  189.455   11.458  519.890   16.000  496.831   15.067 23.05887 21.97795 
1 1 1    8   27    8 o  1358.03   14.057  1415.06   29.220  1413.62   41.806  1416.44   40.857  1355.49   20.150  1357.01   19.670 -1.521484 28.15910 
1 1 1    8   27    9 o  149.349   20.057   17.466   4.4691   19.509   5.3876   12.960   8.0024  157.470   23.034  127.972   38.054 29.49752 44.48170 
1 1 1    8   27   10 o  1311.54   11.200  1318.76   22.484  1302.52   27.252  1353.39   39.792  1302.88   13.665  1326.25   19.602 -23.36682 23.89511 
1 1 1    8   27   11 o  415.622   9.6032  132.379   6.1092  129.302   7.4621  138.633   10.639  410.618   11.873  424.784   16.363 -14.16635 20.21650 
1 1 1    8   27   12 o  676.992   8.8948  351.178   9.2170  351.591   11.390  350.393   15.689  677.177   10.988  675.463   15.175 1.714294 18.73566 
1 1 1    8   27   13 o  503.536   9.1567  194.302   7.0573  187.995   8.4931  208.373   12.685  495.132   11.207  520.751   15.914 -25.61887 19.46430 
1 1 1    8   27   14 o  551.811   8.9736  233.346   7.5792  223.185   9.0286  257.595   13.948  539.489   10.934  578.972   15.739 -39.48370 19.16402 
1 1 1    8   27   15 o   48.600   22.813  -4.4859   4.3062  -7.0587   5.1634   1.3910   7.8038   49.963   23.893   85.868   35.781 -35.90425 43.02533 
1 1 1    8   27   16 o  701.632   9.2597  377.346   9.9443  383.534   11.898  363.005   18.113  707.133   10.992  686.843   17.230 20.29010 20.43747 
1 1 1    8   27   17 o   84.677   30.813   4.6066   5.1729   4.6066   5.1729   0.0000   0.0000   84.677   30.813  ?   ?  0.000000 30.81287 
1 1 1    8   27   18 o  566.669   7.9439  246.069   6.8902  258.608   9.7411  233.514   9.7474  580.589   10.961  551.629   11.544 28.96075 15.91939 
1 1 1    8   27   19 o  643.808   7.9651  317.649   7.8490  308.828   10.762  327.672   11.472  634.401   11.083  653.407   11.471 -19.00604 15.95046 
1 1 1    8   27   20 o  557.981   8.1344  238.635   6.9472  235.960   9.6493  241.514   10.010  554.445   11.370  560.890   11.660 -6.444092 16.28621 
1 1 1    8   27   21 o  681.555   9.3727  356.257   9.7777  352.508   11.834  364.323   17.358  677.613   11.410  687.700   16.490 -10.08685 20.05270 
1 1 1    8   27   22 o  438.243   10.405  147.390   6.9795  150.784   8.4059  139.856   12.524  443.005   12.397  425.483   19.230 17.52151 22.87933 
1 1 1    8   27   23 o  527.357   8.5810  213.261   6.9265  218.567   9.7023  207.745   9.8916  533.393   11.884  519.928   12.429 13.46503 17.19645 
1 1 1    8   27   24 o  554.526   8.5165  235.822   7.2286  223.807   9.8237  250.010   10.675  539.684   11.892  570.337   12.228 -30.65326 17.05725 
1 1 1    8   27   25 o  259.067   12.415   51.605   4.9228   44.553   6.7452   59.643   7.2010  239.331   18.558  277.432   17.040 -38.10107 25.19453 
1 1 1    8   27   26 o  428.811   9.4102  141.129   6.1764  137.077   8.3865  145.931   9.1304  422.067   12.982  435.349   13.702 -13.28198 18.87503 
1 1 1    8   27   27 o  290.507   14.276   65.042   6.3481   67.434   11.073   63.871   7.7477  292.720   24.952  286.808   17.736 5.911926 30.61302 
1 1 1    8   27   28 o  303.098   11.857   70.671   5.5010   68.422   7.8557   72.835   7.7057  296.874   17.364  306.541   16.484 -9.666504 23.94166 
1 1 1    8   27   29 o  404.073   10.261  125.474   6.3462  121.764   8.7571  129.579   9.2098  397.260   14.402  409.743   14.685 -12.48383 20.56838 
1 1 1    8   27   30 o  117.992   27.249   11.404   4.8218   12.568   6.7174   10.167   6.9255  123.208   34.337  112.619   35.758 10.58868 49.57502 
1 1 1    8   27   31 o  333.887   13.217   85.989   6.7544   91.010   10.839   82.801   8.6364  340.914   20.872  326.276   17.356 14.63858 27.14519 
1 1 1    8   27   32 o   95.693   32.021   7.0459   5.5164  -1.0795   9.1732   11.649   6.9043   84.470   37.038  118.683   35.359 -34.21287 51.20612 
1 1 1    8   27   33 o  289.125   13.447   64.572   5.9507   64.498   8.3443   64.648   8.4886  287.016   19.103  287.242   19.421 -0.2261353 27.24174 
1 1 1    8   27   34 o   49.479   23.776  -7.3753   5.2521  -8.7176   6.8740  -5.4926   8.1408   57.722   27.594   70.285   32.437 -12.56370 42.58586 
1 1 1    8   27   35 o  101.827   31.169   8.4543   5.3129   1.4002   7.5769   15.277   7.4517   82.737   34.916  134.130   35.676 -51.39303 49.91845 
1 1 1    8   27   36 o  181.633   13.404   25.654   3.7000   25.223   4.1155   27.472   8.4505  179.709   15.102  181.975   31.478 -2.265259 34.91343 
1 1 1    8   27   37 f  174.649   22.906   24.478   5.9756   31.190   8.7700   18.661   8.1642  194.364   30.481  147.412   36.400 46.95207 47.47751 
1 1 1    8   27   38 o  316.591   14.104   77.721   6.8344   81.157   9.7400   74.387   9.5924  320.870   19.930  306.866   20.541 14.00372 28.62086 
1 1 1    8   27   39 o  190.706   12.996   28.288   3.7709   30.004   4.2269   21.596   8.3464  196.140   14.175  158.559   35.298 37.58144 38.03811 
1 1 1    8   27   40 o  377.365   9.4132  109.700   5.4371  119.203   6.4136   85.426   10.251  393.007   10.662  328.444   20.493 64.56244 23.10050 
1 1 1    8   27   41 o   93.549   22.491   7.2263   3.1807   9.3684   4.1887   4.3086   4.8885  105.867   26.031   80.085   29.813 25.78236 39.57822 
1 1 1    8   27   42 o  125.801   18.017   12.666   3.3702   15.727   5.0007   10.118   4.5619  138.177   24.543  109.599   27.296 28.57780 36.70798 
1 1 1    8   27   43 o  329.686   11.436   84.143   5.7709   74.026   11.567   87.496   6.6589  301.746   25.277  335.647   12.961 -33.90100 28.40634 
1 1 1    8   27   44 o   55.105   22.465   1.1014   2.9879  -2.2978   4.1590   4.7273   4.2954   51.729   23.617   79.495   28.182 -27.76563 36.76927 
1 1 1    8   27   45 o  186.979   16.705   27.724   4.7305  -0.2952   10.401   35.031   5.3117   87.534   38.863  210.367   16.632 -122.8332 42.27227 
1 1 1    8   27   46 o  124.525   19.495   12.629   3.5939   7.1166   4.9398   18.827   5.2383   92.256   30.278  150.798   23.457 -58.54272 38.30128 
1 1 1    8   27   47 o  252.835   17.454   50.957   6.7134   50.957   6.7134   0.0000   0.0000  252.835   17.454  ?   ?  0.000000 17.45437 
1 1 1    8   27   48 o  150.157   16.486   18.059   3.7268   17.959   5.3665   18.152   5.1794  145.782   24.947  147.178   23.804 -1.395432 34.48176 
1 1 1    8   27   49 o   53.866   23.249   0.1336   3.4965   0.6712   4.9215  -0.4143   4.9685   64.379   27.684   61.348   27.066 3.031193 38.71692 
1 1 1    8   27   50 o  178.856   24.921   27.307   6.6371   19.624   9.6828   34.115   9.1153  138.078   42.041  194.419   31.725 -56.34111 52.66840 
1 1 1    8   27   51 o  124.179   21.534   13.061   3.9446   12.227   5.7459   13.804   5.4251  114.248   31.728  123.108   29.227 -8.860237 43.13780 
1 1 1    8   27   52 o   82.110   29.351   5.7576   4.6682   10.984   8.5336   3.5256   5.5766  105.311   39.353   75.242   30.685 30.06826 49.90217 
1 1 1    8   28    0 o   88.360   42.787   8.8892   6.7520   8.8892   6.7520   8.8892   6.7520   88.360   42.787   88.360   42.787 0.000000 0.000000 
1 1 1    8   28    1 o  398.130   11.178  121.521   6.8115  119.339   9.7827  123.574   9.4898  394.159   16.215  401.159   15.455 -7.000671 22.40050 
1 1 1    8   28    2 o  671.269   10.447  345.384   10.734  340.229   14.831  351.052   15.553  665.760   14.554  676.200   15.027 -10.44019 20.91999 
1 1 1    8   28    3 o  399.548   11.104  122.388   6.7905  116.986   9.1431  129.033   10.141  390.323   15.304  409.849   16.165 -19.52600 22.26014 
1 1 1    8   28    4 o  391.815   16.063  117.927   9.6336   0.0000   0.0000  117.927   9.6336  ?   ?   391.815   16.063 0.000000 16.06349 
1 1 1    8   28    5 o  774.731   11.053  460.170   13.107  453.074   18.848  466.815   18.239  767.977   16.034  779.670   15.283 -11.69257 22.15118 
1 1 1    8   28    6 o  977.255   11.909  732.445   17.814  713.681   25.123  751.421   25.264  963.590   17.034  988.825   16.692 -25.23456 23.84911 
1 1 1    8   28    7 o  559.844   11.130  240.324   9.5376  236.984   13.686  243.478   13.299  555.367   16.100  563.015   15.432 -7.648254 22.30137 
1 1 1    8   28    8 o  719.625   11.004  397.080   12.121  401.592   17.732  393.122   16.606  722.934   16.025  715.420   15.165 7.514526 22.06248 
1 1 1    8   28    9 o  582.766   10.879  260.410   9.7043  261.736   14.033  259.195   13.434  583.643   15.709  580.890   15.109 2.753723 21.79597 
1 1 1    8   28   10 o  763.516   8.9947  446.747   10.512  446.019   12.910  448.180   18.106  762.630   11.060  763.727   15.489 -1.097351 19.03209 
1 1 1    8   28   11 o  573.040   8.9117  251.656   7.8165  258.063   9.7299  239.995   13.126  580.085   10.958  558.854   15.345 21.23096 18.85605 
1 1 1    8   28   12 o  412.263   9.7208  130.294   6.1340  124.772   7.4589  141.833   10.782  403.246   12.085  429.459   16.402 -26.21365 20.37297 
1 1 1    8   28   13 o  703.023   9.0190  378.825   9.7051  370.568   11.754  396.510   17.202  695.055   11.049  718.151   15.649 -23.09570 19.15664 
1 1 1    8   28   14 o  306.314   13.760   72.073   6.4512   72.073   6.4512   0.0000   0.0000  306.314   13.760  ?   ?  0.000000 13.75953 
1 1 1    8   28   15 o  458.040   11.494  160.996   8.0584  160.996   8.0584   0.0000   0.0000  458.040   11.494  ?   ?  0.000000 11.49417 
1 1 1    8   28   16 o  241.792   13.658   45.063   5.0339   47.662   6.0298   39.086   9.1444  248.376   15.945  222.616   27.416 25.76042 31.71554 
1 1 1    8   28   17 f  156.434   19.733   19.183   4.6197   16.248   5.4512   26.663   8.7024  142.509   25.947  181.970   32.433 -39.46068 41.53507 
1 1 1    8   28   18 o   59.497   25.838  -0.6341   4.3725   2.0329   5.1864  -7.1886   8.1306   74.052   29.810   68.407   31.860 5.645721 43.63155 
1 1 1    8   28   19 o  503.827   9.6712  194.717   7.4581  193.558   8.9438  197.361   13.513  502.068   11.638  505.926   17.450 -3.857971 20.97479 
1 1 1    8   28   20 f  531.899   9.6094  217.037   7.8234  220.545   9.5095  209.690   13.762  535.889   11.593  521.441   17.243 14.44818 20.77787 
1 1 1    8   28   21 o  514.184   8.5944  202.745   6.7640  207.474   9.5583  198.001   9.5733  519.648   12.017  507.595   12.322 12.05273 17.21160 
1 1 1    8   28   22 o  180.712   16.151   25.376   4.4204   26.301   6.0999   24.353   6.4146  182.793   22.262  175.249   24.590 7.543655 33.17030 
1 1 1    8   28   23 o  642.864   8.3746  316.959   8.2405  310.526   11.436  323.908   11.885  635.652   11.754  649.155   11.961 -13.50330 16.76964 
1 1 1    8   28   24 o   70.169   27.417   2.4046   4.2641   10.442   5.9907  -5.8491   6.0708  113.492   32.701   58.154   27.231 55.33815 42.55386 
1 1 1    8   28   25 o  269.549   14.369   56.152   5.9070   55.585   10.340   56.427   7.1970  265.345   25.784  269.571   17.538 -4.226837 31.18308 
1 1 1    8   28   26 o  484.227   10.634  180.182   7.8817  188.138   14.142  176.598   9.4928  492.687   18.752  478.915   12.950 13.77176 22.78930 
1 1 1    8   28   27 o  185.503   17.278   26.861   4.8494   20.621   6.8278   33.212   6.8889  159.307   29.072  205.226   22.289 -45.91922 36.63312 
1 1 1    8   28   28 o   61.656   26.540  -0.2008   4.5320   2.2251   6.5328  -2.4514   6.2925   80.997   33.142   66.619   29.857 14.37812 44.60767 
1 1 1    8   28   29 o  318.173   12.966   78.046   6.3144   94.022   10.811   69.773   7.7794  346.772   20.458  299.579   17.036 47.19278 26.62226 
1 1 1    8   28   30 o  225.493   16.981   39.653   5.8178   34.512   9.8337   42.422   7.2162  205.253   32.374  232.309   20.505 -27.05640 38.32123 
1 1 1    8   28   31 f   95.579   29.750   7.3080   4.8173  -1.0467   6.8463   15.500   6.7795   72.946   31.991  136.120   32.903 -63.17460 45.89134 
1 1 1    8   28   32 o  168.264   21.913   22.555   5.5098   22.847   7.1161   22.117   8.7063  167.087   28.869  161.755   36.082 5.332413 46.20956 
1 1 1    8   28   33 o  215.405   18.306   36.405   5.9785   48.398   7.8783   20.122   9.1800  247.692   20.977  153.055   39.056 94.63625 44.33342 
1 1 1    8   28   34 o  271.359   14.897   57.238   6.1636   55.160   8.4811   59.563   8.9729  264.317   21.140  274.571   21.523 -10.25433 30.16862 
1 1 1    8   28   35 o  195.999   27.169   31.206   7.9314   31.206   7.9314   0.0000   0.0000  195.999   27.169  ?   ?  0.000000 27.16850 
1 1 1    8   28   36 o  260.215   15.769   52.821   6.2512   53.375   8.8888   52.279   8.7931  259.015   22.648  256.325   22.645 2.690186 32.02711 
1 1 1    8   28   37 o  354.493   9.2519   96.724   5.0200   97.977   5.7954   92.956   10.047  356.460   10.622  343.820   19.167 12.64023 21.91352 
1 1 1    8   28   38 o  293.913   10.200   66.597   4.5888   67.602   5.2818   63.502   9.2665  295.791   11.666  282.706   21.578 13.08572 24.52951 
1 1 1    8   28   39 o  141.349   18.217   15.905   3.8496   16.205   3.9590   10.701   16.494  142.588   18.581  128.518   52.632 14.07066 55.81609 
1 1 1    8   28   40 o   91.325   20.845   6.8476   2.8497   8.2834   3.9904   5.3533   4.0709   99.612   25.922   82.666   27.504 16.94582 37.79439 
1 1 1    8   28   41 o  181.849   12.318   25.738   3.4084   30.273   4.9083   21.515   4.7367  196.044   16.511  164.171   19.213 31.87260 25.33300 
1 1 1    8   28   42 o  213.599   11.067   35.387   3.6059   38.805   5.2104   32.246   4.9953  222.353   15.404  202.300   16.270 20.05304 22.40546 
1 1 1    8   28   43 o  129.156   17.466   13.351   3.3643   15.894   4.9321   11.139   4.6007  138.641   24.118  114.729   26.700 23.91161 35.97995 
1 1 1    8   28   44 o   69.258   25.019   3.4172   3.4013  -0.2859   4.7685   7.2531   4.8531   61.507   26.843   93.218   29.969 -31.71165 40.23320 
1 1 1    8   28   45 o  189.195   13.641   28.104   3.9237   27.504   5.2034   28.896   5.9739  185.168   18.611  188.662   21.046 -3.493835 28.09447 
1 1 1    8   28   46 o  166.145   15.556   21.920   3.9099   24.399   5.4785   19.346   5.5817  172.839   21.150  151.833   24.880 21.00650 32.65451 
1 1 1    8   28   47 o   91.937   24.455   7.2194   3.5012   9.1708   4.9360   5.2434   4.9671  102.154   29.755   82.650   30.176 19.50378 42.37856 
1 1 1    8   28   48 o   67.259   25.488   3.0445   3.6070   5.3338   5.1593   0.8556   5.0449   83.005   30.682   65.629   28.120 17.37614 41.61829 
1 1 1    8   28   49 o  141.603   18.989   16.476   4.0120   15.890   5.7149   17.045   5.6337  133.436   28.824  139.245   27.409 -5.809662 39.77494 
1 1 1    8   28   50 o   52.065   23.114  -0.6010   3.6788  -5.2667   5.2339   3.9549   5.1720   51.098   24.330   76.128   30.057 -25.02969 38.67017 
1 1 1    8   28   51 o  147.136   21.844   18.375   4.7702   2.7543   9.0777   24.334   5.6066   83.830   36.799  169.406   22.153 -85.57572 42.95244 
1 1 1    8   29    0 o  707.390   14.874  384.181   16.089  384.181   16.089  384.181   16.089  707.390   14.874  707.390   14.874 0.000000 0.000000 
1 1 1    8   29    1 o  762.104   10.686  445.350   12.466  431.333   17.193  460.885   18.100  749.320   14.991  774.510   15.268 -25.18982 21.39701 
1 1 1    8   29    2 o  632.247   10.404  306.483   10.068  305.877   14.177  307.100   14.301  631.050   14.677  632.296   14.776 -1.245361 20.82708 
1 1 1    8   29    3 o  558.527   10.525  239.192   8.9975  234.819   12.466  243.948   13.000  552.898   14.730  563.495   15.072 -10.59644 21.07485 
1 1 1    8   29    4 o  209.966   14.020   34.003   4.4798   30.380   5.4510   41.543   7.8629  197.850   18.204  230.906   22.535 -33.05598 28.96895 
1 1 1    8   29    5 o  915.817   11.648  643.409   16.328  645.729   23.680  641.306   22.543  916.272   16.885  913.328   16.126 2.944458 23.34805 
1 1 1    8   29    6 o  464.273   11.447  165.348   8.1346  153.691   11.592  176.656   11.418  446.990   16.943  479.414   15.560 -32.42300 23.00415 
1 1 1    8   29    7 o  456.330   11.575  159.755   8.0850  178.914   12.379  145.503   10.677  482.276   16.770  435.015   16.035 47.26126 23.20217 
1 1 1    8   29    8 o  522.425   11.258  209.368   9.0021  202.161   12.779  216.467   12.683  512.696   16.285  530.631   15.616 -17.93488 22.56183 
1 1 1    8   29    9 o  427.326   11.853  140.127   7.7528  141.080   11.339  139.292   10.624  428.128   17.304  425.541   16.311 2.586914 23.77939 
1 1 1    8   29   10 o  893.238   9.4353  611.695   12.900  608.041   15.834  618.906   22.246  890.164   11.621  896.960   16.203 -6.795776 19.94002 
1 1 1    8   29   11 o  279.268   14.427   60.098   6.1459   60.098   6.1459   0.0000   0.0000  279.268   14.427  ?   ?  0.000000 14.42704 
1 1 1    8   29   12 o  353.409   12.898   95.921   6.9771   95.921   6.9771   0.0000   0.0000  353.409   12.898  ?   ?  0.000000 12.89817 
1 1 1    8   29   13 o  485.057   11.378  180.572   8.4474  180.572   8.4474   0.0000   0.0000  485.057   11.378  ?   ?  0.000000 11.37788 
1 1 1    8   29   14 o  238.486   13.612   43.851   4.9482   42.107   5.9326   47.839   8.9694  233.233   16.729  247.292   23.999 -14.05891 29.25418 
1 1 1    8   29   15 o  241.470   13.712   44.964   5.0471   50.853   6.1074   32.282   8.9629  256.568   15.627  201.191   30.024 55.37648 33.84723 
1 1 1    8   29   16 o  402.876   10.224  124.536   6.3046  125.843   7.6577  121.786   11.108  404.747   12.361  397.294   18.266 7.452484 22.05511 
1 1 1    8   29   17 o  336.566   11.461   86.983   5.9043   86.072   7.1577   88.921   10.444  334.528   13.979  338.511   20.251 -3.983307 24.60681 
1 1 1    8   29   18 o  450.153   10.010  155.496   6.8972  150.410   8.2975  166.867   12.407  442.437   12.253  465.067   17.430 -22.63016 21.30527 
1 1 1    8   29   19 o  797.835   8.3146  488.095   10.154  501.841   14.529  474.973   14.196  808.216   11.745  786.269   11.795 21.94659 16.64549 
1 1 1    8   29   20 o  238.982   12.448   44.025   4.5377   48.721   6.2857   38.914   6.5573  250.790   16.466  223.459   19.363 27.33116 25.41780 
1 1 1    8   29   21 o  545.043   8.5255  227.863   7.1124  231.673   9.9893  223.945   10.129  549.002   11.888  539.693   12.262 9.308838 17.07829 
1 1 1    8   29   22 o  455.758   8.9651  159.382   6.2540  173.194   8.8204  145.417   8.8689  474.581   12.142  434.650   13.331 39.93073 18.03204 
1 1 1    8   29   23 o  740.484   8.4820  420.667   9.6135  408.994   13.339  433.281   13.867  729.257   11.950  750.561   12.071 -21.30383 16.98567 
1 1 1    8   29   24 o  274.359   14.367   58.193   6.0123   60.592   10.831   57.124   7.2284  276.934   25.850  271.160   17.510 5.774048 31.22159 
1 1 1    8   29   25 f  245.427   13.340   46.547   4.9926   44.019   6.8799   49.360   7.2564  237.440   19.092  251.542   18.987 -14.10220 26.92570 
1 1 1    8   29   26 o  228.115   14.238   40.304   4.9464   28.657   6.8691   52.848   7.1286  189.845   24.189  260.478   17.990 -70.63243 30.14519 
1 1 1    8   29   27 o  435.521   11.060  145.929   7.3731  140.327   11.852  149.465   9.4172  425.177   18.212  440.078   13.981 -14.90134 22.95909 
1 1 1    8   29   28 o  111.198   30.419   10.187   5.3272   20.583   8.4549   3.3423   6.8602  156.542   36.033   85.884   34.387 70.65829 49.80773 
1 1 1    8   29   29 o  240.044   14.536   44.709   5.3155   40.238   7.3843   49.517   7.6575  225.779   21.633  251.156   20.087 -25.37766 29.52070 
1 1 1    8   29   30 o   95.370   29.751   7.2787   4.8145   7.2554   6.8669   7.3012   6.7521   99.815   35.607   99.697   35.335 0.1187668 50.16351 
1 1 1    8   29   31 o  249.196   16.187   48.382   6.1406   46.873   7.7187   50.983   10.135  243.836   20.883  252.131   26.667 -8.295776 33.87023 
1 1 1    8   29   32 o  347.402   12.179   93.126   6.4763  103.033   9.0659   82.802   9.2547  364.250   16.261  325.288   18.666 38.96231 24.75529 
1 1 1    8   29   33 o   72.436   29.806   1.7003   5.3210   1.1923   7.4755   2.2221   7.5756   81.595   34.571   84.916   35.308 -3.320587 49.41468 
1 1 1    8   29   34 o  387.323   11.944  115.814   7.0811  121.476   9.9850  110.085   10.044  395.125   16.510  375.779   17.462 19.34695 24.03105 
1 1 1    8   29   35 o  250.514   16.678   49.092   6.3584   50.819   8.8733   47.270   9.1159  252.384   23.230  242.613   24.901 9.771393 34.05450 
1 1 1    8   29   36 o  351.563   12.702   95.621   6.8353   91.092   9.4849  100.514   9.8593  340.734   18.253  358.064   18.047 -17.32971 25.66841 
1 1 1    8   29   37 o  112.903   37.274   10.567   7.4822   1.5366   8.4771   42.409   15.918   86.189   36.677  214.124   49.549 -127.9343 61.64719 
1 1 1    8   29   38 o  202.490   13.899   31.976   4.2816   32.097   4.4433   30.409   16.015  202.733   14.413  177.434   54.077 25.29852 55.96521 
1 1 1    8   29   39 o  231.131   13.162   41.571   4.6371   46.191   5.3027   26.557   9.5600  243.318   14.301  174.530   36.938 68.78804 39.60977 
1 1 1    8   29   40 o  404.952   18.583  129.113   11.518   0.0000   0.0000  129.113   11.518  ?   ?   404.952   18.583 0.000000 18.58262 
1 1 1    8   29   41 o   73.726   23.215   4.3464   2.9239   3.6693   3.8788   5.2375   4.4497   72.826   26.654   82.684   28.732 -9.857948 39.19106 
1 1 1    8   29   42 o   59.798   23.089   2.0218   2.9966  -3.2258   3.8785   9.7934   4.7199   47.183   21.985  107.122   28.346 -59.93947 35.87231 
1 1 1    8   29   43 o   88.967   23.534   6.6335   3.2542   5.6076   4.6790   7.5946   4.5288   84.606   29.459   94.752   28.730 -10.14639 41.14921 
1 1 1    8   29   44 o   39.755   18.964  -3.9433   3.2102  -7.7042   4.6826  -0.6082   4.4095   44.192   21.522   58.021   25.554 -13.82867 33.40948 
1 1 1    8   29   45 o  124.974   20.512   12.838   3.7875   21.729   5.4812   4.7138   5.2397  162.225   22.695   81.453   30.755 80.77193 38.22230 
1 1 1    8   29   46 o  101.929   24.667   8.8925   3.8069   5.7286   5.1878   12.584   5.6039   85.354   30.888  118.950   30.603 -33.59606 43.48117 
1 1 1    8   29   47 o   40.603   19.599  -5.2119   3.6640   0.7750   4.8238 -13.3765   5.6332   64.181   27.498   42.782   21.334 21.39808 34.80359 
1 1 1    8   29   48 o   65.152   25.842   2.4614   3.8392  -3.6256   4.9189   11.949   6.1411   52.647   24.607  113.135   33.257 -60.48796 41.37053 
1 1 1    8   29   49 o  139.489   31.577   18.012   6.5848   23.635   9.4959   12.804   9.1390  152.282   40.163  112.888   40.975 39.39413 57.37578 
1 1 1    8   29   50 o   92.791   28.931   7.8303   4.5535   14.770   9.3821   5.6918   5.2080  118.012   41.670   82.854   30.786 35.15805 51.80933 
1 1 1    8   30    0 o  993.645   16.818  758.386   25.563  758.386   25.563  758.386   25.563  993.645   16.818  993.645   16.818 0.000000 0.000000 
1 1 1    8   30    1 o  280.763   13.622   60.550   5.8539   65.373   8.4511   56.102   8.1163  290.600   19.106  268.984   19.854 21.61569 27.55388 
1 1 1    8   30    2 o  216.051   16.233   36.111   5.3288   45.599   7.5255   26.569   7.5468  242.238   20.489  182.933   27.830 59.30482 34.55864 
1 1 1    8   30    3 o  629.992   10.464  304.415   10.090  299.100   14.028  310.112   14.524  623.802   14.692  635.135   14.939 -11.33240 20.95333 
1 1 1    8   30    4 o  297.288   11.401   67.817   5.1880   68.313   6.4590   66.916   8.7095  298.160   14.153  293.935   19.469 4.224365 24.06939 
1 1 1    8   30    5 o  728.495   11.035  407.176   12.304  422.298   18.347  394.816   16.587  740.833   16.180  716.565   15.123 24.26801 22.14742 
1 1 1    8   30    6 o  824.169   11.290  521.232   14.242  507.661   20.155  534.766   20.127  812.220   16.212  833.744   15.772 -21.52368 22.61798 
1 1 1    8   30    7 o  413.961   12.100  131.557   7.6669  143.244   11.485  122.162   10.297  431.240   17.400  398.318   16.889 32.92227 24.24891 
1 1 1    8   30    8 o  335.386   19.417   87.076   9.9250   87.076   9.9250   0.0000   0.0000  335.386   19.417  ?   ?  0.000000 19.41688 
1 1 1    8   30    9 o  383.432   18.843  113.410   11.059  113.410   11.059   0.0000   0.0000  383.432   18.843  ?   ?  0.000000 18.84324 
1 1 1    8   30   10 o  438.134   17.562  147.950   11.777  147.950   11.777   0.0000   0.0000  438.134   17.562  ?   ?  0.000000 17.56166 
1 1 1    8   30   11 o  883.331   9.5185  598.428   12.870  600.737   15.853  593.965   22.040  884.550   11.709  878.194   16.397 6.356384 20.14805 
1 1 1    8   30   12 o  382.937   10.304  112.515   6.0394  119.883   7.5270   99.198   10.119  395.044   12.448  358.072   18.526 36.97275 22.31996 
1 1 1    8   30   13 o  559.984   9.2772  240.505   7.9517  247.420   9.8635  227.666   13.439  567.675   11.352  543.650   16.151 24.02509 19.74097 
1 1 1    8   30   14 o  594.045   9.2749  270.672   8.4333  267.304   10.341  277.359   14.572  589.995   11.451  600.060   15.866 -10.06470 19.56639 
1 1 1    8   30   15 o  371.025   10.618  105.671   6.0297  112.450   7.4856   93.146   10.175  382.481   12.786  346.632   19.254 35.84872 23.11310 
1 1 1    8   30   16 o   73.783   28.234   2.9672   4.4530   2.2310   5.3847   4.5599   7.9203   75.716   30.412   95.233   37.323 -19.51707 48.14434 
1 1 1    8   30   17 f  242.601   14.139   45.455   5.2274   42.431   6.3476   51.830   9.2150  233.715   17.880  257.118   23.681 -23.40269 29.67273 
1 1 1    8   30   18 o  353.664   11.273   96.093   6.1025   94.356   7.3490   99.951   10.953  350.131   13.713  358.674   20.030 -8.543274 24.27443 
1 1 1    8   30   19 o  585.346   9.6487  262.992   8.6447  258.909   10.406  272.089   15.531  580.380   11.713  593.521   17.096 -13.14063 20.72380 
1 1 1    8   30   20 o  348.025   9.8652   92.995   5.2552   95.333   7.3944   90.608   7.4700  351.844   13.730  342.935   14.231 8.908844 19.77497 
1 1 1    8   30   21 o  109.165   25.820   9.6943   4.2466   12.852   6.0429   6.6136   5.9690  125.062   31.566   95.582   33.274 29.48023 45.86431 
1 1 1    8   30   22 o   55.036   25.388  -3.7495   4.9792  -0.5428   8.4779  -5.4380   6.1520   83.113   36.036   59.373   27.673 23.73994 45.43552 
1 1 1    8   30   23 o  323.937   10.830   80.672   5.3696   83.994   7.5918   77.348   7.5957  329.848   15.037  316.409   15.684 13.43823 21.72768 
1 1 1    8   30   24 o  284.785   13.408   62.523   5.8447   50.079   9.2180   70.889   7.5582  251.740   24.222  302.267   16.398 -50.52715 29.25038 
1 1 1    8   30   25 f   85.613   30.044   5.2486   4.8713   6.6107   8.1684   4.4968   6.0686  101.792   38.408   86.833   33.023 14.95930 50.65285 
1 1 1    8   30   26 o  127.976   24.459   13.274   4.6164   17.877   6.4562   8.4577   6.6033  147.529   29.620  104.485   35.033 43.04406 45.87657 
1 1 1    8   30   27 o  287.370   12.504   63.676   5.4999   69.516   7.7482   57.745   7.8081  298.851   17.009  271.742   18.890 27.10904 25.41905 
1 1 1    8   30   28 o  538.459   9.3403  222.867   7.6981  225.520   10.710  220.031   11.073  540.569   12.944  533.736   13.554 6.833496 18.74163 
1 1 1    8   30   29 o  182.485   20.362   26.336   5.5905   22.668   7.0143   32.724   9.2564  166.543   28.543  199.710   31.311 -33.16719 42.36844 
1 1 1    8   30   30 o  423.617   11.788  138.373   7.6435  138.060   9.5978  138.915   12.638  422.210   14.852  421.677   19.581 0.5329895 24.57583 
1 1 1    8   30   31 o   87.784   31.020   5.6064   5.1998  -0.8677   7.3471   12.104   7.3602   75.728   33.177  120.285   36.660 -44.55727 49.44405 
1 1 1    8   30   32 o  311.272   13.179   74.918   6.2792   75.429   8.9596   74.424   8.8027  310.098   18.968  308.102   18.755 1.995361 26.67467 
1 1 1    8   30   33 o  245.441   16.242   47.057   6.0673   40.185   8.5096   54.162   8.6532  223.463   25.326  261.339   21.832 -37.87589 33.43742 
1 1 1    8   30   34 o  465.384   11.137  167.096   7.9330  175.896   11.146  158.062   11.293  475.784   15.305  450.529   16.377 25.25568 22.41539 
1 1 1    8   30   35 f   96.429   35.639   6.5876   6.9610   4.2748   7.8207   15.407   15.272   91.384   36.670  138.123   52.420 -46.73907 63.97336 
1 1 1    8   30   36 o  280.852   19.032   62.205   8.1330   60.834   9.3165   66.596   16.674  276.259   22.221  277.166   40.499 -0.9067688 46.19442 
1 1 1    8   30   37 o   97.165   32.922   7.5100   5.8322   12.501   8.4106   2.8874   8.0945  121.006   39.498   87.960   36.529 33.04576 53.80064 
1 1 1    8   30   38 f  118.674   36.959   12.115   7.4334   4.2465   14.925   14.711   8.5721  111.947   48.176  129.357   39.591 -17.40958 62.35666 
1 1 1    8   30   39 o  212.109   13.484   35.096   4.3548   35.550   4.9126   33.429   9.4100  212.954   15.171  198.682   32.032 14.27116 35.44298 
1 1 1    8   30   40 o  123.634   21.114   12.466   3.8522   15.291   4.2652  -0.0389   8.9732  137.274   20.964   83.415   36.602 53.85909 42.18069 
1 1 1    8   30   41 o   93.130   24.997   7.2858   3.6378   6.1927   3.9725   12.966   9.0553   86.648   27.023  121.060   41.023 -34.41233 49.12362 
1 1 1    8   30   42 o   67.287   24.462   3.1759   3.2592  -1.2782   4.3481   8.8873   4.9237   55.759   24.917  101.714   29.744 -45.95452 38.80148 
1 1 1    8   30   43 o  247.696   11.235   47.633   4.2594   43.923   5.8752   51.743   6.1839  235.447   16.405  255.910   15.866 -20.46277 22.82211 
1 1 1    8   30   44 o  193.422   13.626   29.415   4.0084   29.694   5.5922   29.121   5.7485  191.822   19.309  189.531   20.123 2.290878 27.88882 
1 1 1    8   30   45 o  290.156   15.101   66.536   6.6835   0.0000   0.0000   66.536   6.6835  ?   ?   290.156   15.101 0.000000 15.10092 
1 1 1    8   30   46 o  169.614   15.234   22.933   3.9129   21.192   5.7925   24.394   5.3068  158.033   24.760  172.277   20.529 -14.24432 32.16389 
1 1 1    8   30   47 f  129.752   19.497   13.924   3.7524   11.309   5.2675   16.618   5.3468  111.492   30.144  138.138   26.247 -26.64638 39.97014 
1 1 1    8   30   48 o  185.546   15.407   27.625   4.3360   21.700   5.8097   35.075   6.5149  158.695   24.723  205.325   21.026 -46.63058 32.45518 
1 1 1    8   30   49 o   79.809   34.295   2.8683   7.5428  -3.2534   9.3758   14.099   12.699   73.659   34.275  114.785   46.492 -41.12641 57.76063 
1 1 1    8   31    0 o  219.999   23.853   38.559   7.7928   38.559   7.7928   38.559   7.7928  219.999   23.853  219.999   23.853 0.000000 0.000000 
1 1 1    8   31    1 o  495.953   10.998  188.771   8.3491  206.114   12.380  174.303   11.308  517.499   15.629  475.909   15.523 41.58929 22.02826 
1 1 1    8   31    2 o  509.115   11.209  198.947   8.7348  211.761   12.086  184.938   12.638  524.642   15.051  489.965   16.851 34.67700 22.59423 
1 1 1    8   31    3 o  230.842   23.073   41.684   8.0432   41.684   8.0432   0.0000   0.0000  230.842   23.073  ?   ?  0.000000 23.07289 
1 1 1    8   31    4 o  454.139   11.667  158.347   8.1097  158.347   8.1097   0.0000   0.0000  454.139   11.667  ?   ?  0.000000 11.66664 
1 1 1    8   31    5 o   84.880   35.258   1.6131   7.5431   1.6131   7.5431   0.0000   0.0000   84.880   35.258  ?   ?  0.000000 35.25795 
1 1 1    8   31    6 o  766.078   16.593  452.133   19.457  452.133   19.457   0.0000   0.0000  766.078   16.593  ?   ?  0.000000 16.59341 
1 1 1    8   31    7 o  299.988   14.521   69.229   6.6678   77.410   9.9415   62.540   8.9895  315.728   20.686  283.611   20.855 32.11691 29.37385 
1 1 1    8   31    8 o  275.875   15.191   58.756   6.3899   62.427   9.5764   55.811   8.5789  283.007   22.288  267.755   21.104 15.25217 30.69377 
1 1 1    8   31    9 o  359.874   13.138   99.553   7.2370   91.245   10.594  106.822   9.9098  342.914   20.274  372.166   17.396 -29.25238 26.71441 
1 1 1    8   31   10 o   83.189   32.279   3.5584   5.8792   1.7553   8.8801   4.9656   7.8448   91.315   38.120   96.374   37.317 -5.058350 53.34523 
1 1 1    8   31   11 o   52.858   25.033  -6.2975   5.3968 -17.1197   8.1134   2.2908   7.2276   54.907   27.062   85.207   34.862 -30.29996 44.13258 
1 1 1    8   31   12 o  271.796   12.628   56.785   5.2533   64.536   6.6028   43.416   8.6719  289.114   14.972  235.034   24.464 54.07974 28.68155 
1 1 1    8   31   13 o  437.481   10.043  146.895   6.7250  146.988   8.3818  146.727   11.267  437.271   12.523  436.090   16.880 1.181213 21.01789 
1 1 1    8   31   14 o   89.468   29.067   6.1019   4.5569   11.110   5.6966  -2.7962   7.5936  116.782   31.253   73.729   32.939 43.05327 45.40610 
1 1 1    8   31   15 o  1034.84   10.291  822.226   16.301  812.586   19.857  842.149   28.547  1027.92   12.621  1043.92   17.866 -15.99695 21.87388 
1 1 1    8   31   16 o  259.829   13.269   52.089   5.2594   59.129   6.4750   38.437   9.0168  276.508   15.359  219.939   27.377 56.56908 31.39126 
1 1 1    8   31   17 o  255.669   13.782   50.482   5.3735   52.623   6.5459   46.060   9.4094  260.547   16.499  241.394   25.869 19.15266 30.68289 
1 1 1    8   31   18 o  630.964   9.6269  305.652   9.2974  294.737   11.165  330.347   16.793  619.108   11.782  653.850   16.780 -34.74194 20.50293 
1 1 1    8   31   19 o  228.828   16.056   40.637   5.5880   39.478   6.7006   43.284   10.126  224.742   19.677  232.683   29.066 -7.940506 35.10029 
1 1 1    8   31   20 f  491.862   13.112  186.348   9.8712  174.491   13.583  199.620   14.371  474.383   18.706  507.465   18.501 -33.08194 26.30998 
1 1 1    8   31   21 o  542.156   10.034  225.842   8.3267  217.596   13.750  230.617   10.463  530.234   16.942  547.265   12.491 -17.03094 21.04900 
1 1 1    8   31   22 o  123.525   27.089   12.471   4.9808   9.8539   7.8345   14.246   6.4527  112.886   38.158  131.135   32.348 -18.24896 50.02455 
1 1 1    8   31   23 f  295.385   11.714   67.174   5.2964   61.583   7.1348   74.035   7.9046  281.507   16.632  308.701   16.792 -27.19479 23.63516 
1 1 1    8   31   24 o  214.053   15.019   35.596   4.8898   38.096   6.7459   32.828   7.0979  220.178   20.243  203.400   23.215 16.77887 30.80113 
1 1 1    8   31   25 o   88.834   28.779   6.1447   4.4689   10.541   6.1390   1.1885   6.5179  113.158   33.248   77.416   32.511 35.74209 46.50154 
1 1 1    8   31   26 o  279.645   12.658   60.326   5.4179   54.348   7.4840   66.908   7.8533  263.579   18.671  292.924   17.597 -29.34488 25.65710 
1 1 1    8   31   27 o  233.408   14.844   42.332   5.2757   47.321   7.5349   37.533   7.3891  245.298   20.249  217.562   22.515 27.73683 30.28139 
1 1 1    8   31   28 o  315.538   13.605   76.954   6.5708   72.271   8.2035   85.335   10.975  304.271   17.691  329.041   21.917 -24.77008 28.16600 
1 1 1    8   31   29 o  125.655   27.473   13.043   5.1365   18.512   7.2083   7.4008   7.3212  148.569   32.594  101.243   36.685 47.32648 49.07322 
1 1 1    8   31   30 o  395.389   11.224  120.522   6.7926  127.958   9.6907  113.340   9.5238  406.029   15.593  381.888   16.293 24.14090 22.55233 
1 1 1    8   31   31 f  568.574   9.8858  248.882   8.6034  244.433   12.120  253.401   12.215  561.753   14.095  572.035   13.951 -10.28186 19.83191 
1 1 1    8   31   32 o  208.861   17.906   34.300   5.6690   33.899   8.0077   34.704   8.0268  204.608   26.168  207.179   25.876 -2.571304 36.80169 
1 1 1    8   31   33 o  230.572   20.509   42.128   7.1626   39.258   8.1194   52.197   15.209  220.955   24.416  244.756   42.116 -23.80101 48.68112 
1 1 1    8   31   34 o  292.979   17.551   67.332   7.8344   67.210   9.0510   67.698   15.645  291.469   20.417  282.426   37.088 9.042175 42.33640 
1 1 1    8   31   35 o   87.861   32.027   5.5032   5.5919   3.9471   7.7516   7.1916   8.0745   89.865   36.350  101.287   38.194 -11.42194 52.72685 
1 1 1    8   31   36 o  127.718   31.450   13.917   6.1073   1.1924   8.4220   28.029   8.8693   84.792   36.332  181.692   33.112 -96.89966 49.15696 
1 1 1    8   31   37 o   76.425   33.098   0.2340   7.1349   7.3806   13.311  -2.6467   8.4515  114.121   47.073   76.130   34.320 37.99152 58.25540 
1 1 1    8   31   38 o  131.438   31.625   14.868   6.2852   7.6444   8.5452   23.382   9.2771  102.986   39.182  162.231   38.023 -59.24513 54.59798 
1 1 1    8   31   39 o  228.479   20.065   41.713   6.9461   30.515   9.6088   53.970   10.053  187.361   34.787  256.646   25.947 -69.28537 43.39758 
1 1 1    8   31   40 o  146.243   18.437   17.157   4.0353   13.443   4.5165   31.856   8.9850  127.126   24.093  192.941   31.513 -65.81505 39.66758 
1 1 1    8   31   41 o  309.956   11.597   74.593   5.5021   87.014   6.7310   49.578   9.5521  334.081   13.163  244.759   25.890 89.32225 29.04419 
1 1 1    8   31   42 o  165.395   18.343   21.980   4.5654   25.551   5.3879   12.890   8.5969  177.614   20.177  118.979   39.972 58.63543 44.77610 
1 1 1    8   31   43 o  186.867   18.083   28.023   5.1075   28.023   5.1075   0.0000   0.0000  186.867   18.083  ?   ?  0.000000 18.08297 
1 1 1    8   31   44 o  142.122   16.300   16.195   3.4816   18.770   4.9360   13.644   4.9116  150.471   22.089  125.875   26.339 24.59672 34.37499 
1 1 1    8   31   45 o  177.672   14.130   25.023   3.8109   26.924   5.7358   23.521   5.0991  180.630   21.146  169.312   20.066 11.31766 29.15158 
1 1 1    8   31   46 o   83.250   25.024   5.9825   3.4467   6.5185   5.1146   5.5366   4.6652   87.487   30.780   82.131   29.343 5.355659 42.52574 
1 1 1    8   31   47 o  210.991   16.179   35.841   5.1853   35.877   14.871   35.836   5.5325  172.643   51.997  210.207   17.350 -37.56392 54.81569 
1 1 1    8   31   48 o   92.439   35.818   7.3232   7.2311 -21.6372   14.532   16.853   8.3364   71.181   35.289  127.860   39.026 -56.67853 52.61537 
1 1 1    8   32    1 o  662.045   15.877  337.688   16.088   0.0000   0.0000  337.688   16.088  ?   ?   662.045   15.877 0.000000 15.87660 
1 1 1    8   32    2 o  422.380   17.070  137.597   11.036   0.0000   0.0000  137.597   11.036  ?   ?   422.380   17.070 0.000000 17.07011 
1 1 1    8   32    3 o  308.608   18.799   73.843   8.8376   0.0000   0.0000   73.843   8.8376  ?   ?   308.608   18.799 0.000000 18.79893 
1 1 1    8   32    4 o  638.368   11.273  312.948   11.015  312.088   16.199  313.688   15.023  636.207   16.635  638.180   15.380 -1.973267 22.65523 
1 1 1    8   32    5 o  227.345   17.324   40.106   5.9830   35.039   8.9747   44.159   8.0269  209.814   28.698  237.589   22.335 -27.77467 36.36502 
1 1 1    8   32    6 o  606.671   11.378  282.685   10.565  285.453   15.492  280.277   14.445  608.399   16.636  603.122   15.648 5.276794 22.83903 
1 1 1    8   32    7 o  494.905   11.640  188.165   8.8172  202.067   13.417  177.597   11.698  511.729   17.129  480.012   15.922 31.71674 23.38621 
1 1 1    8   32    8 o  462.132   11.963  164.117   8.4621  166.867   12.493  161.785   11.503  464.892   17.557  458.012   16.408 6.879974 24.03026 
1 1 1    8   32    9 o  423.268   12.249  137.713   7.9359  134.398   11.623  140.609   10.862  417.038   18.209  426.909   16.622 -9.871124 24.65475 
1 1 1    8   32   10 o  417.690   12.427  134.139   7.9448  142.680   11.843  127.151   10.713  429.695   18.007  405.799   17.248 23.89600 24.93437 
1 1 1    8   32   11 o  439.058   12.614  148.252   8.4771  162.820   12.852  137.033   11.279  458.893   18.297  421.171   17.495 37.72174 25.31564 
1 1 1    8   32   12 o  529.878   9.5147  215.492   7.7169  226.967   9.8031  196.796   12.513  543.390   11.786  505.009   16.188 38.38095 20.02418 
1 1 1    8   32   13 o  368.917   10.743  104.550   6.0662  104.013   7.5828  105.504   10.110  367.575   13.478  369.376   17.883 -1.801697 22.39278 
1 1 1    8   32   14 o  719.571   9.5208  397.471   10.486  384.668   12.677  425.216   18.661  707.338   11.709  742.041   16.430 -34.70276 20.17545 
1 1 1    8   32   15 o  238.407   14.372   43.967   5.2199   42.190   6.3791   47.566   9.0811  232.805   18.043  245.620   24.481 -12.81464 30.41145 
1 1 1    8   32   16 o  514.874   9.9842  203.611   7.8684  202.801   9.6002  205.267   13.733  513.393   12.217  515.083   17.419 -1.689331 21.27645 
1 1 1    8   32   17 o  484.671   17.850  181.926   13.242   0.0000   0.0000  181.926   13.242  ?   ?   484.671   17.850 0.000000 17.84958 
1 1 1    8   32   18 o  463.401   18.713  166.585   13.273   0.0000   0.0000  166.585   13.273  ?   ?   463.401   18.713 0.000000 18.71265 
1 1 1    8   32   19 o  262.027   17.067   53.383   6.8077   55.688   9.2536   50.663   10.051  266.000   22.953  252.492   26.397 13.50702 34.98030 
1 1 1    8   32   20 f  372.255   11.756  106.675   6.6984  105.363   8.0434  109.645   12.100  369.459   14.223  374.384   21.203 -4.925293 25.53135 
1 1 1    8   32   21 o  299.087   13.398   69.006   6.1335   66.275   7.3838   75.086   11.016  292.040   16.587  308.634   23.496 -16.59335 28.76088 
1 1 1    8   32   22 o  367.198   10.551  103.723   5.9303  103.193   8.3665  104.258   8.4071  365.311   14.963  367.193   14.958 -1.881348 21.15741 
1 1 1    8   32   23 o  287.527   12.132   63.718   5.3393   70.762   7.5536   56.685   7.5484  301.692   16.419  269.365   18.419 32.32709 24.67472 
1 1 1    8   32   24 o  283.461   12.414   61.964   5.3859   60.433   7.4964   63.598   7.7433  278.314   17.689  285.499   17.808 -7.185028 25.10067 
1 1 1    8   32   25 o   91.218   29.974   6.4657   4.8404   2.6451   6.6123   10.877   7.1051   82.251   33.463  115.253   36.172 -33.00211 49.27706 
1 1 1    8   32   26 o  227.078   17.191   40.302   5.9308   42.472   7.4734   36.611   9.7475  231.884   21.294  211.467   31.039 20.41693 37.64067 
1 1 1    8   32   27 f  230.895   17.143   41.683   6.0152   37.325   7.4298   49.976   10.248  216.662   22.743  249.119   27.324 -32.45723 35.55078 
1 1 1    8   32   28 o  322.200   12.224   80.133   6.0286   83.445   8.5055   76.789   8.5462  327.055   17.050  313.402   17.890 13.65219 24.71297 
1 1 1    8   32   29 o  250.156   14.886   48.694   5.6741   50.981   8.0556   46.442   7.9934  253.991   20.907  242.007   21.814 11.98409 30.21458 
1 1 1    8   32   30 o  485.437   10.272  181.536   7.6322  192.200   10.965  171.515   10.630  497.922   14.387  470.204   14.770 27.71777 20.61887 
1 1 1    8   32   31 o  272.656   18.296   58.381   7.5912   54.088   8.6890   72.225   15.602  260.930   21.960  293.818   35.405 -32.88794 41.66281 
1 1 1    8   32   32 o  438.586   13.073  148.934   8.7759  154.947   10.368  133.739   16.481  446.459   15.172  407.572   26.564 38.88669 30.59164 
1 1 1    8   32   33 o  261.081   15.988   53.304   6.3583   61.299   9.0676   45.570   8.9184  277.724   21.498  237.708   24.880 40.01614 32.88180 
1 1 1    8   32   34 o   63.361   28.280  -1.6502   5.5831  -7.2394   7.7117   4.5063   8.0936   64.268   30.281   92.687   37.265 -28.41990 48.01695 
1 1 1    8   32   35 o  141.597   35.452   17.448   7.6662   21.581   13.811   15.608   9.2164  152.240   50.660  132.895   41.115 19.34491 65.24460 
1 1 1    8   32   36 o  347.544   16.662   94.572   8.8636   84.940   16.155   98.720   10.602  317.154   33.800  353.013   19.699 -35.85873 39.12196 
1 1 1    8   32   37 o  202.659   20.986   32.956   6.4154   43.153   9.0603   22.704   9.0852  229.353   26.283  159.760   37.752 69.59268 45.99996 
1 1 1    8   32   38 o  114.320   33.929   11.379   6.3663   9.8136   9.2266   12.802   8.7956  110.650   41.004  120.601   40.432 -9.951111 57.58567 
1 1 1    8   32   39 o  101.873   36.073   8.4927   7.0354   16.282   12.056   4.4698   8.6638  132.489   47.187   92.652   38.068 39.83783 60.62837 
1 1 1    8   32   40 o  229.235   22.244   42.731   7.7066   57.590   13.867   36.091   9.2700  254.715   36.621  205.435   30.399 49.27989 47.59353 
1 1 1    8   32   41 o  382.121   13.021  113.965   7.6159  113.965   7.6159   0.0000   0.0000  382.121   13.021  ?   ?  0.000000 13.02123 
1 1 1    8   32   42 o  203.546   15.482   32.832   4.7872   35.192   5.2385   20.875   11.790  210.343   16.400  143.596   46.759 66.74693 49.55179 
1 1 1    8   32   43 o  218.714   20.716   39.064   6.8525   44.865   10.448   34.685   9.0776  226.294   30.978  198.770   30.836 27.52454 43.70862 
1 1 1    8   32   44 o  141.659   21.597   16.741   4.5346  -6.2334   9.0123   24.529   5.2472   69.256   32.663  172.741   20.229 -103.4849 38.41936 
1 1 1    8   32   45 o   86.291   24.359   6.4600   3.3580   11.260   4.8031   1.8702   4.6966  112.140   28.053   66.759   27.783 45.38065 39.48273 
1 1 1    8   32   46 o   99.905   27.183   8.9547   4.2675   5.2071   9.2743   9.9613   4.8066   90.891   38.508  104.522   29.016 -13.63122 48.21564 
1 1 1    8   33    0 o  361.266   17.760  101.080   9.7666  101.080   9.7666  101.080   9.7666  361.266   17.760  361.266   17.760 0.000000 0.000000 
1 1 1    8   33    1 o  935.484   11.891  672.637   17.027  668.693   24.051  676.599   24.107  930.711   16.883  936.225   16.823 -5.514343 23.83365 
1 1 1    8   33    2 o  335.509   13.275   86.613   6.8172   80.883   9.4654   92.789   9.8266  322.714   19.250  345.881   18.630 -23.16687 26.78877 
1 1 1    8   33    3 o  632.637   11.034  307.450   10.685  302.488   15.001  312.559   15.223  626.331   15.647  636.679   15.621 -10.34857 22.10970 
1 1 1    8   33    4 o  416.899   9.9412  133.423   6.3437  135.567   7.8257  129.315   10.833  419.914   12.176  409.166   17.298 10.74847 21.15338 
1 1 1    8   33    5 o  209.020   18.522   34.051   5.8643   56.592   9.4003   19.689   7.5035  268.759   23.075  155.116   32.637 113.6430 39.97052 
1 1 1    8   33    6 f  147.370   26.009   17.448   5.6523   10.005   8.2483   24.037   7.7610  115.049   39.151  172.342   30.539 -57.29292 49.65320 
1 1 1    8   33    7 o  240.201   16.865   44.773   6.1614   53.119   9.3362   38.333   8.2009  260.091   23.712  220.343   24.744 39.74770 34.27132 
1 1 1    8   33    8 o  505.283   11.920  196.303   9.2189  204.796   13.647  189.173   12.503  514.774   17.320  494.971   16.503 19.80283 23.92349 
1 1 1    8   33    9 o  143.685   26.940   16.674   5.7073   19.661   8.6899   14.409   7.5685  153.814   37.296  132.175   36.300 21.63878 52.04474 
1 1 1    8   33   10 o  259.829   16.743   52.373   6.6232   41.373   9.6270   62.258   9.1262  227.840   28.208  282.274   21.279 -54.43460 35.33427 
1 1 1    8   33   11 o  450.892   12.383  156.429   8.5462  154.915   12.321  157.832   11.864  447.375   17.993  451.799   17.157 -4.423828 24.86147 
1 1 1    8   33   12 o  433.773   18.035  145.691   11.974   0.0000   0.0000  145.691   11.974  ?   ?   433.773   18.035 0.000000 18.03526 
1 1 1    8   33   13 o  291.523   15.416   65.793   6.8546   61.571   9.5233   70.333   9.8739  280.196   22.392  299.808   21.663 -19.61188 31.15572 
1 1 1    8   33   14 o  476.782   17.446  175.997   12.731   0.0000   0.0000  175.997   12.731  ?   ?   476.782   17.446 0.000000 17.44573 
1 1 1    8   33   15 o   67.535   31.668  -7.7928   8.2608   0.0000   0.0000  -7.7928   8.2608  ?   ?    67.535   31.668 0.000000 31.66817 
1 1 1    8   33   16 o  568.747   12.519  249.148   10.898  235.572   15.681  261.830   15.157  550.919   18.596  581.468   17.030 -30.54907 25.21553 
1 1 1    8   33   17 o  172.103   20.132   23.355   5.2029   19.856   6.2142   31.557   9.5154  156.675   26.881  196.324   32.824 -39.64839 42.42652 
1 1 1    8   33   18 o  219.863   16.311   37.627   5.4501   41.085   6.6295   30.418   9.5727  229.110   19.078  192.161   33.779 36.94905 38.79432 
1 1 1    8   33   19 o  567.046   10.225  247.257   8.8742  247.178   10.708  247.431   15.859  566.336   12.352  564.263   18.362 2.072754 22.13010 
1 1 1    8   33   20 o   88.101   30.789   5.6451   5.1131   7.8263   6.0602   0.2567   9.5251  100.511   33.562   89.068   38.407 11.44321 51.00526 
1 1 1    8   33   21 o  141.149   26.784   16.249   5.5748   10.995   6.6385   28.818   10.268  115.559   34.727  184.986   37.546 -69.42667 51.14347 
1 1 1    8   33   22 o  218.650   14.986   37.166   4.9852   23.064   7.0158   51.546   7.0849  168.264   28.241  256.812   18.141 -88.54797 33.56551 
1 1 1    8   33   23 o   73.276   28.660   2.7624   4.6630   9.0423   6.6789  -3.2098   6.5132  106.769   35.215   65.856   29.867 40.91344 46.17506 
1 1 1    8   33   24 o  203.667   18.243   32.555   5.6268   34.968   7.0613   28.357   9.3132  209.882   22.323  184.307   34.275 25.57582 40.90346 
1 1 1    8   33   25 f  293.436   13.916   66.604   6.2501   74.061   7.8898   54.041   10.241  308.248   16.786  259.711   26.117 48.53635 31.04587 
1 1 1    8   33   26 f  189.560   17.848   28.235   5.1175   19.801   7.1376   37.157   7.3411  154.134   31.322  216.158   22.519 -62.02344 38.57674 
1 1 1    8   33   27 o  227.251   15.637   40.280   5.4059   37.646   7.5564   43.042   7.7368  217.260   23.076  232.881   21.964 -15.62041 31.85830 
1 1 1    8   33   28 o  433.502   10.726  144.845   7.1172  158.365   10.209  132.058   9.9277  451.857   14.760  412.251   15.733 39.60599 21.57312 
1 1 1    8   33   29 o   99.266   34.628   7.5560   6.4665   4.4498   7.3959   17.637   13.324   90.634   35.893  142.903   49.714 -52.26859 61.31731 
1 1 1    8   33   30 o  297.732   16.892   69.352   7.6661   70.126   8.8983   67.123   15.099  298.279   19.599  282.634   35.698 15.64435 40.72463 
1 1 1    8   33   31 o  236.338   17.001   43.822   6.1090   45.713   8.6784   41.965   8.6008  238.535   24.100  228.023   25.056 10.51241 34.76519 
1 1 1    8   33   32 o  260.466   15.910   53.066   6.3126   61.073   9.0910   45.611   8.7722  277.052   21.609  237.908   24.437 39.14432 32.62032 
1 1 1    8   33   33 o  390.398   12.166  117.956   7.2699  122.491   10.423  113.661   10.145  395.629   17.212  381.013   17.395 14.61667 24.47173 
1 1 1    8   33   34 o  176.183   27.888   25.735   7.2702   25.628   13.688   25.778   8.5807  164.224   49.981  173.538   33.517 -9.314133 60.17942 
1 1 1    8   33   35 f  172.247   24.281   24.237   6.2240   24.811   8.4497   23.556   9.2028  169.687   33.721  163.149   37.621 6.538330 50.52173 
1 1 1    8   33   36 o  416.120   12.377  134.374   7.8833  141.178   11.126  127.513   11.171  423.842   17.150  402.179   18.147 21.66370 24.96926 
1 1 1    8   33   37 o   86.355   33.290   4.9016   6.2214   12.160   9.0775  -1.5280   8.5434  118.176   41.039   78.023   34.892 40.15313 53.86671 
1 1 1    8   33   38 o  310.084   29.895   81.053   14.013   81.053   14.013   0.0000   0.0000  310.084   29.895  ?   ?  0.000000 29.89478 
1 1 1    8   33   39 o  388.670   13.618  118.014   8.1012  115.546   11.885  120.157   11.072  379.206   20.554  388.766   18.606 -9.559784 27.72425 
1 1 1    8   33   40 o  231.273   21.749   43.547   7.6085   44.407   10.154   42.446   11.490  227.814   29.836  217.976   35.672 9.837265 46.50488 
1 1 1    8   33   41 o   98.452   35.990   8.0359   7.0690   8.6718   9.5752   7.2742   10.480  104.634   41.029  102.541   41.969 2.092674 58.69244 
1 1 1    8   33   42 f  251.383   28.355   54.356   10.720   54.356   10.720   0.0000   0.0000  251.383   28.355  ?   ?  0.000000 28.35539 
1 1 1    8   33   43 o   92.017   27.094   7.4249   4.0729   11.164   4.7618  -2.7669   7.8616  112.126   27.867   70.016   32.153 42.10967 42.54853 
1 1 1    8   33   44 o  230.522   14.295   42.220   5.0190   54.920   6.3066   20.282   8.2889  261.982   15.801  144.059   37.298 117.9226 40.50734 
1 1 1    8   33   45 o   91.293   28.177   7.4593   4.3315  -1.1503   8.7323   10.269   4.9885   75.508   34.375  105.783   29.629 -30.27489 45.38167 
1 1 1    8   34    0 o  388.053   17.850  116.610   10.551  116.610   10.551  116.610   10.551  388.053   17.850  388.053   17.850 0.000000 0.000000 
1 1 1    8   34    1 o  774.122   11.525  460.755   13.655  466.156   19.648  455.709   18.992  776.752   16.526  768.161   16.153 8.591064 23.10898 
1 1 1    8   34    2 o  655.043   11.266  329.845   11.296  337.311   16.060  322.535   15.891  660.973   15.875  646.266   16.064 14.70740 22.58467 
1 1 1    8   34    3 o  390.029   12.691  117.084   7.5767  124.609   11.175  110.680   10.308  401.173   18.199  378.179   17.807 22.99329 25.46138 
1 1 1    8   34    4 o  378.945   12.874  110.547   7.4673  106.539   10.340  114.915   10.796  370.925   18.212  385.206   18.310 -14.28137 25.82493 
1 1 1    8   34    5 o  180.172   21.390   25.588   5.7835   22.607   8.2626   28.451   8.0981  165.786   33.709  187.972   29.086 -22.18571 44.52286 
1 1 1    8   34    6 o   91.203   36.089   4.0272   7.4714   0.0000   0.0000   4.0272   7.4714  ?   ?    91.203   36.089 0.000000 36.08916 
1 1 1    8   34    7 o  229.223   24.915   41.580   8.6007   0.0000   0.0000   41.580   8.6007  ?   ?   229.223   24.915 0.000000 24.91470 
1 1 1    8   34    8 o  226.628   26.453   40.837   9.0034   0.0000   0.0000   40.837   9.0034  ?   ?   226.628   26.453 0.000000 26.45294 
1 1 1    8   34    9 o  473.626   17.315  173.644   12.552   0.0000   0.0000  173.644   12.552  ?   ?   473.626   17.315 0.000000 17.31458 
1 1 1    8   34   10 o  229.789   26.395   42.004   9.1150   0.0000   0.0000   42.004   9.1150  ?   ?   229.789   26.395 0.000000 26.39454 
1 1 1    8   34   11 o  398.311   13.512  122.306   8.2376  119.621   11.761  124.892   11.541  392.350   19.585  401.140   18.797 -8.789612 27.14540 
1 1 1    8   34   12 o  288.285   16.398   64.508   7.2056   57.430   10.322   71.236   10.064  269.310   25.338  301.364   21.969 -32.05411 33.53521 
1 1 1    8   34   13 o  461.711   12.827  164.283   9.0649  165.173   13.163  163.479   12.502  461.191   18.647  459.118   17.790 2.072510 25.77215 
1 1 1    8   34   14 o  110.803   28.357   10.087   4.8294   11.901   5.9363   6.5354   8.3048  119.950   31.813  101.941   38.664 18.00848 50.06950 
1 1 1    8   34   15 o   77.240   29.475   3.4396   4.8450  -1.1659   5.9960   12.103   8.2238   67.979   29.872  122.027   38.989 -54.04859 49.11749 
1 1 1    8   34   16 f  410.087   11.250  129.452   7.0615  130.288   8.6746  127.809   12.158  410.812   13.795  405.099   19.608 5.713470 23.97514 
1 1 1    8   34   17 o  235.589   15.622   43.145   5.6012   37.626   6.7199   55.707   10.138  218.738   20.303  264.734   25.329 -45.99640 32.46113 
1 1 1    8   34   18 o  342.358   12.526   90.379   6.5639   93.720   8.0880   83.933   11.235  348.017   15.183  326.444   22.624 21.57291 27.24652 
1 1 1    8   34   19 o  137.625   26.171   15.435   5.3116   13.492   6.3741   19.849   9.6081  127.116   32.603  152.258   40.516 -25.14245 52.00489 
1 1 1    8   34   20 o  392.802   12.072  118.955   7.2581  113.563   8.7214  131.103   13.091  383.069   14.874  408.850   20.990 -25.78122 25.72564 
1 1 1    8   34   21 o  340.573   13.214   89.582   6.8882   78.458   8.0807  119.151   13.175  317.454   16.689  388.984   22.220 -71.52991 27.78945 
1 1 1    8   34   22 o   50.443   24.644 -11.2762   6.2793 -11.2762   6.2793   0.0000   0.0000   50.443   24.644  ?   ?  0.000000 24.64414 
1 1 1    8   34   23 o  166.502   22.070   22.136   5.4861   13.551   6.7230   39.246   9.4909  126.812   33.958  219.787   28.914 -92.97503 44.60031 
1 1 1    8   34   24 o  308.627   12.286   73.531   5.8039   79.252   8.3333   68.141   8.0881  318.672   17.148  295.132   17.990 23.53992 24.85340 
1 1 1    8   34   25 o  200.589   17.241   31.557   5.2419   31.108   7.3644   32.017   7.4629  196.570   25.046  199.479   24.991 -2.909622 35.38104 
1 1 1    8   34   26 o  280.904   16.017   61.534   6.8581   54.766   7.9322   81.570   13.648  263.645   19.801  317.602   28.374 -53.95700 34.59986 
1 1 1    8   34   27 o  143.634   29.488   17.197   6.2658   13.352   7.3235   27.698   12.104  125.143   36.184  176.006   44.810 -50.86350 57.59567 
1 1 1    8   34   28 o   58.950   26.665  -2.3773   5.1523   3.4840   7.0947  -8.9180   7.4946   86.255   34.816   60.681   28.954 25.57425 45.28180 
1 1 1    8   34   29 o  258.823   15.074   52.242   5.9459   44.030   8.1710   61.485   8.6686  234.578   23.055  278.747   20.460 -44.16914 30.82471 
1 1 1    8   34   30 o  315.444   13.415   77.140   6.4770   76.389   9.1724   77.887   9.1474  311.211   19.352  314.378   19.100 -3.167908 27.19009 
1 1 1    8   34   31 o  164.556   23.877   21.992   5.8384   15.859   8.2281   28.212   8.2857  134.567   38.180  183.738   30.534 -49.17036 48.88763 
1 1 1    8   34   32 o  254.644   20.045   51.488   7.7495   44.874   14.675   54.045   9.1256  222.653   44.616  259.350   23.235 -36.69711 50.30376 
1 1 1    8   34   33 o  178.510   27.598   26.416   7.2973   26.145   14.292   26.511   8.4871  164.663   51.241  176.275   32.658 -11.61203 60.76323 
1 1 1    8   34   34 o  210.659   19.330   35.353   6.1633   44.243   8.7240   26.494   8.7085  233.029   24.842  175.204   33.697 57.82527 41.86431 
1 1 1    8   34   35 o  141.749   29.417   17.134   6.1735   4.9355   8.7892   29.013   8.6733   94.826   38.580  184.066   31.944 -89.24049 50.08783 
1 1 1    8   34   36 o   91.149   34.649   5.8810   6.6792  -7.7335   10.743   14.459   8.5275   76.586   35.977  126.248   39.629 -49.66125 53.52409 
1 1 1    8   34   37 o  190.420   23.351   29.740   6.6634   25.682   9.5643   33.567   9.2885  167.913   38.089  197.165   31.865 -29.25243 49.66049 
1 1 1    8   34   38 o   95.652   34.316   7.3937   6.3868   6.2687   9.3852   8.3641   8.7164   98.696   39.971  103.440   39.520 -4.744812 56.20955 
1 1 1    8   34   39 o  148.064   32.471   19.497   7.1563   22.656   9.7412   15.793   10.548  154.165   40.687  128.201   44.254 25.96358 60.11549 
1 1 1    8   34   40 o   57.769   27.238  -5.3942   6.2598   9.5075   9.8855 -15.3696   8.0880  106.995   41.762   54.189   26.766 52.80679 49.60337 
1 1 1    8   34   41 o  188.252   22.001   29.369   6.2199   34.757   9.6635   25.557   8.1272  196.006   33.408  168.016   32.779 27.98953 46.80367 
1 1 1    8   34   42 o   62.580   25.599   1.7883   3.8961   3.8130   4.5320  -3.9462   7.6271   73.990   28.443   66.651   30.981 7.338120 42.05682 
1 1 1    8   34   43 o   91.676   32.822   7.3331   5.8401   11.425   8.8834   4.2186   7.7503  108.820   40.253   85.012   35.561 23.80797 53.71094 
1 1 1    8   35    0 o  270.815   22.574   57.844   9.2077   57.844   9.2077   57.844   9.2077  270.815   22.574  270.815   22.574 0.000000 0.000000 
1 1 1    8   35    1 o  544.193   11.579  227.860   9.6449  235.196   13.866  220.984   13.425  551.395   16.429  534.483   16.410 16.91180 23.22069 
1 1 1    8   35    2 o  223.704   17.253   38.978   5.8618   47.058   8.2947   30.917   8.2849  244.554   22.409  196.003   28.447 48.55028 36.21267 
1 1 1    8   35    3 o  372.966   10.821  106.961   6.1776  109.622   7.7159  102.210   10.311  377.110   13.367  362.454   18.648 14.65601 22.94438 
1 1 1    8   35    4 f  342.352   11.366   90.170   5.9560   91.397   7.5058   88.083   9.7874  344.160   14.249  336.251   19.095 7.908569 23.82545 
1 1 1    8   35    5 o  206.716   16.243   33.254   5.0979   35.930   6.4943   28.959   8.2287  214.018   20.059  189.213   29.364 24.80515 35.56155 
1 1 1    8   35    6 o  379.912   13.572  111.307   7.8919  115.857   11.927  107.763   10.526  385.285   20.295  372.613   18.456 12.67230 27.43208 
1 1 1    8   35    7 o  564.219   12.065  245.128   10.420  245.078   15.316  245.172   14.217  562.147   17.800  562.776   16.504 -0.6286011 24.27400 
1 1 1    8   35    8 o  236.260   18.780   43.623   6.7353   42.747   9.8444   44.394   9.2351  230.816   28.468  236.166   25.977 -5.349884 38.53870 
1 1 1    8   35    9 o  110.866   33.526   9.9946   6.1730   3.0164   9.1234   15.887   8.3834   94.437   38.964  137.550   38.369 -43.11235 54.68397 
1 1 1    8   35   10 o  564.587   12.262  245.576   10.596  231.431   15.129  259.195   14.845  545.957   18.105  578.367   16.769 -32.40985 24.67778 
1 1 1    8   35   11 o  663.061   12.226  338.737   12.408  328.559   17.772  348.417   17.332  650.567   17.847  670.435   16.890 -19.86755 24.57195 
1 1 1    8   35   12 o  118.840   33.363   11.697   6.3174   14.249   9.4414   9.6281   8.5008  131.320   41.757  112.983   39.687 18.33692 57.60802 
1 1 1    8   35   13 o  184.098   24.596   27.095   6.7576   29.835   10.341   25.054   8.9277  188.699   37.124  173.399   34.846 15.30055 50.91629 
1 1 1    8   35   14 o   59.661   27.598  -4.5067   5.9435  -3.6225   8.8043  -5.2470   8.0562   77.508   34.977   70.550   32.454 6.957970 47.71411 
1 1 1    8   35   15 o  110.672   29.765   10.109   5.1519   3.6631   6.2426   23.877   9.1231   84.207   33.094  168.461   36.441 -84.25330 49.22522 
1 1 1    8   35   16 o  122.260   28.244   12.334   5.1791   15.339   6.2412   5.6874   9.2812  135.948   30.717  102.000   40.267 33.94727 50.64566 
1 1 1    8   35   17 o  547.880   10.655  231.050   8.9354  230.771   10.905  231.619   15.587  546.774   13.030  545.329   18.674 1.444946 22.77038 
1 1 1    8   35   18 o  605.573   10.570  282.292   9.7974  275.440   11.895  296.747   17.277  597.286   13.011  617.328   18.284 -20.04218 22.44119 
1 1 1    8   35   19 o  521.985   12.996  210.407   10.384  210.407   10.384   0.0000   0.0000  521.985   12.996  ?   ?  0.000000 12.99627 
1 1 1    8   35   20 o  304.407   17.165   72.279   7.9653   72.279   7.9653   0.0000   0.0000  304.407   17.165  ?   ?  0.000000 17.16539 
1 1 1    8   35   21 f  470.968   11.632  171.054   8.3853  180.714   10.054  148.985   15.197  483.415   13.588  434.245   22.946 49.17004 26.66733 
1 1 1    8   35   22 o  311.874   14.282   75.323   6.8175   75.664   8.1832   74.549   12.326  311.293   17.242  304.823   26.687 6.469818 31.77215 
1 1 1    8   35   23 o  274.565   15.589   58.715   6.5245   56.072   7.7432   65.185   12.116  267.147   19.062  283.923   28.254 -16.77658 34.08314 
1 1 1    8   35   24 o  399.459   12.428  123.293   7.5987  122.905   9.1790  124.139   13.546  397.940   15.070  396.015   22.440 1.924866 27.03027 
1 1 1    8   35   25 o  312.628   14.890   75.867   7.1252   74.972   8.4507   78.069   13.251  309.316   17.926  310.460   28.193 -1.143524 33.40984 
1 1 1    8   35   26 o   62.166   27.377  -0.9673   5.0606  -2.3690   7.0585   0.5151   7.2591   70.313   31.560   78.382   33.661 -8.068367 46.14244 
1 1 1    8   35   27 o  369.957   11.914  105.773   6.7467  113.780   9.5922   97.933   9.4912  382.050   16.403  353.995   17.517 28.05466 23.99800 
1 1 1    8   35   28 o  106.309   31.014   9.4720   5.3589   15.812   7.7863   3.7657   7.3867  134.985   36.714   88.032   35.528 46.95365 51.08919 
1 1 1    8   35   29 o   68.985   29.197   0.8184   5.3227  -7.5668   7.3434   10.100   7.7260   61.716   29.221  111.094   37.891 -49.37802 47.84969 
1 1 1    8   35   30 o   84.714   33.983   3.6581   6.7144   4.1129   12.629   3.4789   7.9277  105.673   44.862   88.831   36.447 16.84210 57.80130 
1 1 1    8   35   31 o  130.788   34.990   14.916   7.1418   35.830   13.774   7.2256   8.3522  196.417   46.531  101.444   38.703 94.97378 60.52290 
1 1 1    8   35   32 o  122.916   31.343   13.009   5.9151   10.255   8.2273   15.956   8.5104  111.323   39.047  133.593   39.116 -22.27067 55.26919 
1 1 1    8   35   33 o   88.462   34.299   5.0458   6.6341  -2.8272   10.437   10.383   8.5936   83.632   37.880  111.819   39.838 -28.18691 54.97249 
1 1 1    8   35   34 o  375.848   15.114  110.570   8.6948   98.633   14.447  117.350   10.888  345.314   27.563  385.090   18.471 -39.77597 33.17958 
1 1 1    8   35   35 o   92.906   33.639   6.7200   6.1542   4.3994   8.8389   8.9034   8.5737   92.765   38.319  105.664   39.453 -12.89949 54.99939 
1 1 1    8   35   36 o  138.119   31.148   16.688   6.4280   25.017   9.4780   9.5933   8.7470  165.273   38.227  107.759   39.926 57.51385 55.27584 
1 1 1    8   35   37 o  105.948   36.408   9.7597   7.1354   24.329   9.6778  -7.5942   10.562  161.245   39.519   75.183   35.428 86.06276 53.07463 
1 1 1    8   35   38 o  132.316   33.993   15.934   6.9211   16.440   8.8416   15.134   11.122  131.095   40.223  125.254   45.242 5.841080 60.53664 
1 1 1    8   35   39 o   78.004   31.633   3.4232   5.8863   13.308   8.7968  -4.5911   7.9209  118.104   40.431   67.524   31.448 50.58015 51.22152 
1 1 1    8   35   40 o  182.131   22.315   27.628   6.0907   20.209   8.9559   34.012   8.3075  143.294   39.542  197.804   28.241 -54.51051 48.59123 
1 1 1    8   35   41 o   50.221   24.252  -7.3421   5.6266 -16.7692   8.2006   1.0436   7.7343   52.766   26.219   77.219   33.930 -24.45313 42.87999 
1 1 1    8   35   42 o  186.923   21.905   29.265   6.1484   31.438   9.2947   27.574   8.1983  183.116   34.426  173.358   32.078 9.757431 47.05452 
1 1 1    8   36    0 o  693.845   16.457  371.287   17.456  371.287   17.456  371.287   17.456  693.845   16.457  693.845   16.457 0.000000 0.000000 
1 1 1    8   36    1 o  157.383   25.296   19.943   5.8872   33.392   8.4845   7.4559   8.1755  203.658   27.955  104.567   38.628 99.09069 47.68281 
1 1 1    8   36    2 o  432.948   12.621  144.480   8.3638  139.762   11.673  149.456   11.989  424.276   17.975  438.786   17.852 -14.51025 25.33351 
1 1 1    8   36    3 o  369.209   11.423  104.937   6.4551  103.217   8.1371  107.857   10.602  365.508   14.545  372.519   18.595 -7.010559 23.60739 
1 1 1    8   36    4 o  173.160   19.298   23.607   5.0279   16.392   6.2362   37.006   8.4990  141.099   29.809  215.089   26.368 -73.98935 39.79747 
1 1 1    8   36    5 o  291.738   12.939   65.633   5.7776   65.390   7.2959   66.041   9.4614  290.060   16.501  289.984   21.469 0.7623291E-01 27.07785 
1 1 1    8   36    6 o  332.155   15.471   85.362   7.8655   97.975   11.938   75.688   10.456  353.176   22.197  310.266   22.162 42.91049 31.36674 
1 1 1    8   36    7 o  265.950   17.781   55.155   7.1965   45.091   10.568   63.858   9.8270  236.263   29.892  284.629   22.747 -48.36646 37.56267 
1 1 1    8   36    8 o   79.989   32.337   2.5786   6.1311   13.506   9.3879  -5.5481   8.0961  128.428   41.721   70.235   32.390 58.19326 52.81813 
1 1 1    8   36    9 o  627.947   12.518  304.008   12.031  308.512   17.582  300.041   16.499  629.994   18.233  621.745   17.337 8.248352 25.16004 
1 1 1    8   36   10 o  122.932   32.742   12.584   6.2711   3.7420   9.0742   20.668   8.6766   95.898   39.129  156.456   36.841 -60.55826 53.74299 
1 1 1    8   36   11 o  102.423   34.448   8.1232   6.3848   22.164   9.7677  -2.3520   8.4367  161.090   39.837   78.224   34.849 82.86659 52.92909 
1 1 1    8   36   12 o  422.978   14.287  138.307   9.2500  146.821   14.031  131.762   12.302  433.224   21.160  411.058   19.552 22.16550 28.81015 
1 1 1    8   36   13 o  173.670   26.769   24.408   6.8873   37.618   10.880   15.576   8.8966  213.144   34.532  135.622   40.075 77.52191 52.89999 
1 1 1    8   36   14 o  166.833   27.123   22.606   6.6883   14.277   10.246   28.790   8.8289  131.509   43.628  186.851   32.022 -55.34192 54.11839 
1 1 1    8   36   15 o  371.539   15.184  106.924   8.6351  117.080   12.963   98.822   11.578  385.656   22.052  354.487   21.439 31.16910 30.75578 
1 1 1    8   36   16 o  390.248   20.669  119.527   12.302   0.0000   0.0000  119.527   12.302  ?   ?   390.248   20.669 0.000000 20.66940 
1 1 1    8   36   17 o  241.834   20.560   46.102   7.5382   46.102   7.5382   0.0000   0.0000  241.834   20.560  ?   ?  0.000000 20.55973 
1 1 1    8   36   18 o  408.777   14.907  129.484   9.3269  129.484   9.3269   0.0000   0.0000  408.777   14.907  ?   ?  0.000000 14.90663 
1 1 1    8   36   19 o  308.151   14.410   73.544   6.7968   68.632   8.2307   84.074   12.051  296.098   18.250  325.081   24.398 -28.98325 30.46828 
1 1 1    8   36   20 o  189.208   21.174   28.445   6.0270   34.180   7.3982   17.129   10.392  206.657   23.825  140.695   43.681 65.96223 49.75582 
1 1 1    8   36   21 o  228.762   18.428   41.129   6.3979   37.600   7.6326   49.467   11.733  216.937   23.354  244.975   32.059 -28.03766 39.66399 
1 1 1    8   36   22 o  152.699   27.322   19.168   6.1513   16.293   7.2417   26.616   11.657  138.275   34.366  173.086   43.925 -34.81142 55.77133 
1 1 1    8   36   23 o   98.251   34.177   7.4103   6.2971   7.1364   7.5000   8.0648   11.593  100.154   36.998  113.590   44.952 -13.43635 58.21999 
1 1 1    8   36   24 o   69.648   30.496  -0.7106   6.1997  -1.7871   7.3125   2.0414   11.691   72.961   32.479   99.613   42.748 -26.65279 53.68662 
1 1 1    8   36   25 o  228.351   16.609   40.870   5.7653   44.187   8.3001   37.777   8.0142  234.847   23.402  216.462   24.627 18.38513 33.97257 
1 1 1    8   36   26 o  208.733   18.006   34.351   5.6966   29.372   7.9539   39.594   8.1625  188.811   28.402  221.590   24.475 -32.77876 37.49228 
1 1 1    8   36   27 o  198.747   19.984   31.415   5.9970   32.620   8.3420   30.126   8.6274  199.023   28.171  189.900   30.731 9.122833 41.68922 
1 1 1    8   36   28 o   96.787   32.982   7.4475   5.8536   4.2986   8.2812   10.592   8.2752   92.474   37.513  113.396   39.194 -20.92226 54.25342 
1 1 1    8   36   29 o  173.784   27.398   25.014   7.0466   37.185   13.876   20.785   8.1797  200.502   46.169  154.427   35.367 46.07494 58.15798 
1 1 1    8   36   30 o  105.776   32.239   9.4997   5.6919   6.2198   8.0692   12.748   8.0299   97.095   37.777  120.813   38.519 -23.71857 53.95219 
1 1 1    8   36   31 o  197.924   23.380   31.852   6.9461   34.493   11.304   30.250   8.8042  196.660   38.932  188.421   31.650 8.238251 50.17402 
1 1 1    8   36   32 o  116.346   34.773   11.889   6.6694   11.586   10.610   12.087   8.5756  117.795   43.907  117.508   39.921 0.2866135 59.34238 
1 1 1    8   36   33 o  293.793   15.509   67.879   6.9493   64.316   9.8671   71.387   9.7890  281.409   23.112  297.597   21.638 -16.18756 31.66026 
1 1 1    8   36   34 o  196.608   22.505   31.548   6.6504   33.721   9.6959   29.617   9.1391  196.468   33.440  183.673   33.751 12.79550 47.51233 
1 1 1    8   36   35 o  279.712   16.766   62.026   7.1449   54.626   10.224   69.088   9.9887  255.934   26.483  291.250   22.583 -35.31557 34.80414 
1 1 1    8   36   36 o  141.136   33.341   17.924   7.0879   21.501   9.2605   12.866   11.013  150.582   39.637  118.888   44.652 31.69402 59.70645 
1 1 1    8   36   37 o  296.165   22.519   72.114   10.132   72.114   10.132   0.0000   0.0000  296.165   22.519  ?   ?  0.000000 22.51903 
1 1 1    8   36   38 o   73.312   30.666   2.2321   5.7633   5.0686   8.2338  -0.4924   8.0697   90.090   37.075   75.829   33.911 14.26155 50.24397 
1 1 1    8   36   39 o  201.017   19.937   33.131   6.0533   30.574   8.5179   35.741   8.6041  184.611   31.260  202.154   28.606 -17.54367 42.37306 
1 1 1    8   36   40 o  144.077   27.427   18.290   5.8276   12.965   8.4570   23.104   8.0416  114.608   39.622  156.736   34.459 -42.12776 52.51007 
1 1 1    8   37    0 o  502.369   17.948  195.385   13.761  195.385   13.761  195.385   13.761  502.369   17.948  502.369   17.948 0.000000 0.000000 
1 1 1    8   37    1 o   74.848   30.908   1.6451   5.7481  -7.0756   8.1189   10.409   8.1391   67.613   31.606  114.984   38.892 -47.37087 50.11558 
1 1 1    8   37    2 o  163.790   24.655   21.561   5.9894   34.230   8.5704   9.4681   8.3736  205.970   27.903  111.897   39.383 94.07285 48.26571 
1 1 1    8   37    3 o  291.211   13.312   65.464   5.9338   69.170   7.2599   58.004   10.299  298.376   15.954  270.079   25.205 28.29691 29.82971 
1 1 1    8   37    4 o  246.074   14.967   47.019   5.6106   47.992   6.9551   45.204   9.4939  247.696   18.478  237.634   26.556 10.06233 32.35182 
1 1 1    8   37    5 o  146.940   23.841   17.384   5.1784   22.709   6.3048   6.3444   9.0779  167.925   25.316  103.289   40.102 64.63606 47.42404 
1 1 1    8   37    6 o  777.189   10.267  464.701   12.213  458.528   14.992  476.885   21.061  770.937   12.705  783.368   17.565 -12.43030 21.67770 
1 1 1    8   37    7 o  183.897   25.591   27.190   7.0080   30.512   10.368   24.395   9.5091  190.557   36.881  169.680   37.602 20.87602 52.66956 
1 1 1    8   37    8 o  297.331   17.250   68.901   7.8169   68.535   11.346   69.232   10.784  293.436   25.517  295.563   24.047 -2.127441 35.06192 
1 1 1    8   37    9 o  119.305   34.981   11.845   6.8021   18.409   9.9345   6.0517   9.3329  146.380   42.091  103.053   40.476 43.32690 58.39472 
1 1 1    8   37   10 o  353.977   15.661   97.117   8.4853   87.932   11.895  106.633   12.108  333.476   23.453  368.256   21.575 -34.77985 31.86732 
1 1 1    8   37   11 o  275.427   17.957   59.282   7.5290   63.293   10.835   55.538   10.469  281.796   25.394  263.448   26.315 18.34848 36.56935 
1 1 1    8   37   12 o   91.261   34.180   5.4255   6.4446  -3.3129   9.1286   14.108   9.0994   79.357   35.732  129.701   40.967 -50.34422 54.36045 
1 1 1    8   37   13 o  242.731   20.545   46.437   7.5615   58.286   10.836   35.190   10.557  269.642   26.601  205.427   34.818 64.21457 43.81681 
1 1 1    8   37   14 o  218.160   34.799   39.632   11.230   39.632   11.230   0.0000   0.0000  218.160   34.799  ?   ?  0.000000 34.79922 
1 1 1    8   37   15 o  208.098   34.762   36.159   10.682   36.159   10.682   0.0000   0.0000  208.098   34.762  ?   ?  0.000000 34.76215 
1 1 1    8   37   16 o  413.749   11.780  132.068   7.4600  134.630   9.1996  127.151   12.748  416.913   14.416  402.095   20.784 14.81775 25.29458 
1 1 1    8   37   17 o  601.862   10.734  279.129   9.8881  281.113   12.230  275.383   16.804  602.921   13.252  593.843   18.487 9.078003 22.74609 
1 1 1    8   37   18 o   65.820   29.187  -1.4662   5.8495  -7.8411   7.1792   11.125   10.089   60.721   28.791  119.647   43.109 -58.92667 51.83911 
1 1 1    8   37   19 o  254.970   17.263   50.900   6.6976   53.544   8.2092   45.637   11.583  260.245   20.782  234.404   33.212 25.84085 39.17803 
1 1 1    8   37   20 o  187.966   22.690   28.291   6.3959   25.256   7.6833   35.143   11.543  174.710   29.801  202.213   38.703 -27.50269 48.84655 
1 1 1    8   37   21 o  183.117   24.038   27.037   6.5748   21.609   7.8244   40.075   12.127  159.874   33.066  216.415   37.997 -56.54129 50.37012 
1 1 1    8   37   22 o  285.014   16.289   63.483   7.0765   61.178   8.3394   69.410   13.375  278.450   19.694  290.827   30.500 -12.37662 36.30552 
1 1 1    8   37   23 o  500.164   12.164  193.433   9.3124  184.210   11.008  216.655   17.466  486.914   14.770  523.447   21.799 -36.53314 26.33150 
1 1 1    8   37   24 o  332.761   14.969   86.124   7.6241   78.636   8.9708  105.598   14.467  316.077   18.625  361.648   26.316 -45.57126 32.24018 
1 1 1    8   37   25 o  313.667   16.022   76.950   7.6666   68.141   9.0419   99.480   14.461  293.223   20.271  349.965   27.210 -56.74252 33.93015 
1 1 1    8   37   26 o  264.146   15.524   54.591   6.2487   55.136   8.7782   54.032   8.8971  262.596   22.044  259.649   22.612 2.947113 31.57933 
1 1 1    8   37   27 o  218.796   22.032   38.447   7.2780   53.994   14.288   32.999   8.4574  248.646   38.809  199.426   28.519 49.21960 48.16093 
1 1 1    8   37   28 o  330.529   15.177   85.297   7.6783   73.392   12.045   93.447   9.9656  299.611   26.540  343.550   19.026 -43.93903 32.65487 
1 1 1    8   37   29 o  186.480   24.235   28.443   6.7538   25.854   11.235   29.908   8.4515  166.648   43.558  188.015   30.406 -21.36687 53.12078 
1 1 1    8   37   30 o  268.716   16.121   56.860   6.6002   61.561   9.2890   52.067   9.3798  276.270   22.153  252.459   24.585 23.81125 33.09383 
1 1 1    8   37   31 o  152.169   26.472   19.423   5.9418   24.084   8.4125   14.783   8.3935  165.347   34.362  127.524   39.201 37.82249 52.12886 
1 1 1    8   37   32 o  198.212   21.349   31.848   6.3749   28.427   8.9989   35.294   9.0321  179.856   33.933  203.664   29.861 -23.80835 45.20066 
1 1 1    8   37   33 o  126.490   32.745   14.230   6.3893   17.868   8.9507   10.450   9.1234  138.077   40.025  110.822   40.830 27.25465 57.17622 
1 1 1    8   37   34 o  250.126   19.555   50.403   7.4270   53.597   9.2299   44.536   12.509  254.871   23.940  220.239   38.510 34.63197 45.34458 
1 1 1    8   37   35 o  103.049   35.443   9.3601   6.7630   13.508   8.4494   1.9651   11.282  119.657   39.615   92.409   40.778 27.24819 56.85214 
1 1 1    8   37   36 o   81.547   31.943   4.5241   5.7992  -2.4688   8.3707   10.978   8.0417   73.243   33.464  109.296   38.581 -36.05230 51.07180 
1 1 1    8   37   37 o  128.322   30.855   14.920   5.9858   12.605   8.7909   16.920   8.1731  114.419   40.343  131.807   38.259 -17.38792 55.59953 
1 1 1    8   37   38 o  179.683   22.867   27.130   6.1467   22.370   8.9426   31.394   8.4627  150.886   38.573  187.350   30.565 -36.46368 49.21463 
1 1 1    8   38    0 o  190.370   37.088   31.491   9.6310   31.491   9.6310   31.491   9.6310  190.370   37.088  190.370   37.088 0.000000 0.000000 
1 1 1    8   38    1 o  249.900   18.127   48.863   6.8865   40.376   9.4200   58.606   10.093  223.529   28.157  271.438   24.558 -47.90924 37.36221 
1 1 1    8   38    2 o  146.356   24.583   17.330   5.3117   12.102   6.3740   29.214   9.6095  120.315   33.419  186.950   34.865 -66.63480 48.29432 
1 1 1    8   38    3 o  114.830   28.545   10.924   4.9956   10.793   6.1062   11.190   8.6871  114.042   33.060  118.392   40.180 -4.349754 52.03215 
1 1 1    8   38    4 o  159.124   23.040   20.300   5.4482   19.379   6.5577   22.353   9.7891  153.495   28.974  161.213   39.889 -7.717697 49.30127 
1 1 1    8   38    5 f  149.902   23.578   18.096   5.2311   20.739   6.2947   12.197   9.4049  159.678   26.697  123.000   41.806 36.67738 49.60379 
1 1 1    8   38    6 o   66.440   28.468   0.1128   5.1712  -1.4522   6.4199   3.0042   8.7260   69.400   30.685   92.101   38.062 -22.70136 48.89067 
1 1 1    8   38    7 o  284.194   18.073   63.153   7.8208   60.921   11.262   65.232   10.869  275.525   27.054  286.099   25.073 -10.57416 36.88592 
1 1 1    8   38    8 o  529.577   13.497  216.791   10.941  218.255   15.499  215.337   15.446  528.703   19.153  525.123   19.217 3.580627 27.13116 
1 1 1    8   38    9 o  377.616   15.884  110.664   9.1811  124.986   13.124   96.939   12.848  398.429   21.601  349.503   24.165 48.92569 32.41265 
1 1 1    8   38   10 o  230.186   30.634   43.312   10.525   43.312   10.525   0.0000   0.0000  230.186   30.634  ?   ?  0.000000 30.63384 
1 1 1    8   38   11 o  586.216   18.949  268.418   17.002  268.418   17.002   0.0000   0.0000  586.216   18.949  ?   ?  0.000000 18.94852 
1 1 1    8   38   12 o  166.875   40.977   24.225   10.390   24.225   10.390   0.0000   0.0000  166.875   40.977  ?   ?  0.000000 40.97672 
1 1 1    8   38   13 o  270.633   18.910   57.506   7.7839   59.886   11.384   55.415   10.667  272.377   27.690  262.279   26.955 10.09784 38.64373 
1 1 1    8   38   14 o  347.900   16.267   94.115   8.6621  104.374   13.286   86.530   11.424  362.261   24.099  330.410   22.727 31.85095 33.12476 
1 1 1    8   38   15 o  364.151   16.299  103.151   9.0845  123.198   13.703   87.434   12.134  394.338   22.801  331.330   24.091 63.00745 33.17020 
1 1 1    8   38   16 o  331.621   17.502   86.011   8.8525   88.563   12.825   83.688   12.235  332.647   25.380  323.584   24.894 9.063232 35.55016 
1 1 1    8   38   17 o  461.893   11.992  164.788   8.4780  165.999   10.440  162.444   14.529  462.500   14.747  454.373   20.891 8.127411 25.57179 
1 1 1    8   38   18 o  430.419   12.607  143.268   8.3056  150.019   10.175  129.786   14.379  439.442   15.127  404.004   23.352 35.43811 27.82341 
1 1 1    8   38   19 o  388.085   13.469  116.675   8.0007  111.259   9.6896  128.280   14.183  377.719   16.760  401.602   23.171 -23.88275 28.59692 
1 1 1    8   38   20 o  501.813   12.062  194.667   9.2646  206.301   11.502  173.173   15.633  515.404   14.580  468.007   21.824 47.39685 26.24591 
1 1 1    8   38   21 o  452.031   12.814  158.227   8.8658  168.731   10.970  138.445   15.054  465.591   15.393  416.378   23.719 49.21368 28.27648 
1 1 1    8   38   22 o  100.584   34.592   8.0191   6.4419   8.6056   7.6844   6.6323   11.815  105.321   37.656  109.503   44.661 -4.181671 58.41771 
1 1 1    8   38   23 o  216.029   20.995   37.242   6.8544   36.799   8.3547   38.155   11.988  212.340   26.266  209.022   38.903 3.317673 46.93951 
1 1 1    8   38   24 o  477.257   16.305  178.070   11.911  183.338   17.837  173.832   16.000  477.456   24.490  467.217   22.373 10.23868 33.17136 
1 1 1    8   38   25 o  248.251   33.897   52.404   12.543   0.0000   0.0000   52.404   12.543  ?   ?   248.251   33.897 0.000000 33.89672 
1 1 1    8   38   26 o  257.333   23.535   53.548   9.1672   51.726   11.755   56.375   14.645  247.648   31.741  252.993   39.079 -5.344986 50.34567 
1 1 1    8   38   27 o  220.899   19.012   38.867   6.3655   25.161   9.0908   52.052   8.9161  168.687   36.286  253.534   23.234 -84.84697 43.08703 
1 1 1    8   38   28 o  224.667   18.556   40.180   6.3239   43.469   8.9056   36.835   8.9815  229.784   25.764  209.560   28.759 20.22430 38.61213 
1 1 1    8   38   29 o  154.304   26.269   19.935   5.9819   15.258   8.5044   24.516   8.4157  129.349   39.404  167.036   34.071 -37.68767 52.09083 
1 1 1    8   38   30 o   90.013   33.082   6.1344   5.9843   19.616   8.7558  -5.6840   8.1978  146.109   38.581   68.204   31.841 77.90411 50.02361 
1 1 1    8   38   31 o  248.718   17.963   49.311   6.7925   45.712   9.3746   53.290   9.8555  233.950   26.655  253.436   25.764 -19.48637 37.07170 
1 1 1    8   38   32 o  100.226   35.756   8.4558   6.9247   18.663   8.9301  -6.9392   10.967  140.317   39.763   77.418   36.362 62.89902 53.88192 
1 1 1    8   38   33 o  274.333   18.579   60.478   7.7554   54.789   9.5192   71.707   13.374  256.585   24.537  287.354   30.892 -30.76889 39.45162 
1 1 1    8   38   34 o  181.084   23.232   27.352   6.2909   26.657   8.9705   28.025   8.8246  169.831   35.645  175.553   34.070 -5.721649 49.30827 
1 1 1    8   38   35 f  153.986   26.434   20.451   6.0059   21.152   8.6767   19.806   8.3217  148.083   38.070  143.638   37.461 4.445328 53.41042 
1 1 1    8   38   36 o   76.788   31.253   3.3974   5.7707  -3.8202   8.2718   10.241   8.0546   69.729   32.361  105.429   38.436 -35.70004 50.24538 
1 1 1    8   39    0 o  315.921   23.851   78.897   11.382   78.897   11.382   78.897   11.382  315.921   23.851  315.921   23.851 0.000000 0.000000 
1 1 1    8   39    1 o  393.720   14.028  119.978   8.4539  133.739   12.206  107.292   11.720  413.634   19.279  369.306   20.818 44.32733 28.37399 
1 1 1    8   39    2 o  309.447   13.327   74.035   6.3125   74.720   7.7883   72.723   10.777  309.625   16.493  302.679   23.446 6.945526 28.66571 
1 1 1    8   39    3 o  161.576   23.607   21.010   5.6660   20.376   6.8817   22.343   9.9835  156.956   29.734  160.417   40.619 -3.461090 50.33838 
1 1 1    8   39    4 f  358.456   15.595   99.727   8.5565   99.727   8.5565   0.0000   0.0000  358.456   15.595  ?   ?  0.000000 15.59515 
1 1 1    8   39    5 o  137.699   31.554   15.905   6.5081   15.905   6.5081   0.0000   0.0000  137.699   31.554  ?   ?  0.000000 31.55444 
1 1 1    8   39    6 f  406.128   14.612  127.820   9.0830  127.820   9.0830   0.0000   0.0000  406.128   14.612  ?   ?  0.000000 14.61151 
1 1 1    8   39    7 o  400.125   22.527  126.586   13.740  126.586   13.740   0.0000   0.0000  400.125   22.527  ?   ?  0.000000 22.52683 
1 1 1    8   39    8 o  326.015   17.417   83.046   8.6597   93.382   12.547   73.646   11.967  342.636   24.078  303.111   26.046 39.52478 35.46996 
1 1 1    8   39    9 o  103.213   36.028   8.1801   7.0003   2.1440   9.9692   14.052   9.8321   94.249   39.927  129.288   42.730 -35.03841 58.48106 
1 1 1    8   39   10 o  387.188   15.817  116.494   9.3737  113.127   13.406  119.715   13.112  377.574   23.310  389.140   22.105 -11.56580 32.12457 
1 1 1    8   39   11 f  299.330   18.609   70.301   8.4837   68.620   12.237   71.857   11.772  291.385   27.774  299.217   25.960 -7.832062 38.01777 
1 1 1    8   39   12 o  262.008   21.046   54.325   8.3691   61.599   12.397   48.234   11.344  274.659   29.975  242.004   31.363 32.65451 43.38415 
1 1 1    8   39   13 o  392.975   15.677  120.056   9.4300  119.904   13.922  120.186   12.818  388.320   23.535  389.952   21.559 -1.631134 31.91667 
1 1 1    8   39   14 o  109.243   36.863   9.6158   7.3117   8.2333   10.461   10.936   10.224  111.210   43.084  118.817   43.305 -7.607727 61.08691 
1 1 1    8   39   15 o  108.636   37.183   9.4359   7.4402   13.317   11.118   6.2879   10.013  127.486   45.325  104.459   41.637 23.02727 61.54692 
1 1 1    8   39   16 o  372.250   16.930  108.130   9.6462  102.398   13.805  113.598   13.484  357.190   25.417  377.586   23.446 -20.39563 34.57977 
1 1 1    8   39   17 o  233.631   24.718   43.985   8.7050   44.950   12.748   43.143   11.916  229.048   37.671  225.498   35.713 3.550232 51.90858 
1 1 1    8   39   18 o  237.635   19.234   44.641   6.9359   49.110   8.4805   35.613   12.054  247.854   22.603  201.427   40.500 46.42738 46.38021 
1 1 1    8   39   19 o  145.164   29.035   17.651   6.2260   18.806   7.5750   15.247   10.930  147.853   34.159  132.459   45.069 15.39403 56.55141 
1 1 1    8   39   20 o  235.628   19.660   44.035   7.0257   50.108   8.6371   32.159   12.078  249.974   22.826  189.125   42.732 60.84926 48.44598 
1 1 1    8   39   22 f  143.119   46.388   18.823   11.610   0.0000   0.0000   18.823   11.610  ?   ?   143.119   46.388 0.000000 46.38821 
1 1 1    8   39   23 f  225.973   38.703   44.950   12.905   0.0000   0.0000   44.950   12.905  ?   ?   225.973   38.703 0.000000 38.70262 
1 1 1    8   39   24 o  244.564   20.778   47.889   7.7042   49.819   9.5199   44.225   13.115  246.745   25.578  222.525   39.974 24.21988 47.45704 
1 1 1    8   39   25 f  259.757   19.746   53.838   7.7919   59.108   9.4599   42.719   13.741  270.257   23.090  215.477   43.167 54.78033 48.95483 
1 1 1    8   39   26 o  263.117   19.195   55.183   7.6770   55.063   9.0886   55.481   14.342  260.588   23.023  249.539   38.812 11.04910 45.12675 
1 1 1    8   39   27 o  307.798   18.010   75.166   8.4480   77.294   9.9411   69.636   16.028  310.140   21.066  279.591   38.471 30.54880 43.86164 
1 1 1    8   39   28 o  362.883   13.533  102.792   7.5166  123.045   11.035   85.262   10.266  393.840   18.306  325.690   20.702 68.15054 27.63463 
1 1 1    8   39   29 o  304.920   15.353   73.275   7.1425   66.855   9.9380   80.135   10.272  286.229   22.875  314.655   21.457 -28.42603 31.36322 
1 1 1    8   39   30 o  237.113   20.623   45.595   7.4103   52.310   9.2420   33.505   12.401  251.406   24.321  184.933   44.375 66.47299 50.60314 
1 1 1    8   39   31 o  166.646   28.813   24.058   7.0834   21.693   8.8055   28.395   11.924  151.696   38.003  167.511   45.380 -15.81487 59.19116 
1 1 1    8   39   32 o  231.252   18.264   43.090   6.4123   50.039   9.5595   37.406   8.6459  243.237   26.083  208.751   27.746 34.48651 38.08149 
1 1 1    8   39   33 o  105.492   32.706   10.128   5.8284   14.922   8.6582   6.1564   7.8817  123.424   40.065   92.288   36.891 31.13651 54.46212 
1 1 1    8   39   34 o  163.205   29.681   23.655   7.1412   25.512   9.0776   20.640   11.568  163.418   37.135  138.467   46.368 24.95062 59.40522 
1 1 1    8   40    2 o  208.471   23.634   34.810   7.4082   30.070   10.667   39.228   10.297  186.969   38.553  217.765   31.831 -30.79617 49.99610 
1 1 1    8   40    3 o  129.729   33.569   14.288   6.7167   13.506   9.7930   14.983   9.2297  127.101   42.663  132.145   41.188 -5.043434 59.30043 
1 1 1    8   40    4 o  165.867   28.824   22.691   7.0523   18.842   10.509   25.844   9.5121  146.367   43.628  173.722   36.911 -27.35512 57.14745 
1 1 1    8   40    5 o  200.937   24.050   32.432   7.2498   37.806   10.583   27.679   9.9513  212.736   33.619  179.657   37.404 33.07855 50.29210 
1 1 1    8   40    6 o  283.001   18.538   62.887   7.9858   72.836   12.014   55.011   10.689  300.905   26.351  260.819   27.174 40.08511 37.85203 
1 1 1    8   40    7 o  325.414   17.348   82.832   8.6097   81.363   12.520   84.149   11.859  318.331   25.920  324.826   24.022 -6.495361 35.34029 
1 1 1    8   40    8 o  351.959   16.914   96.565   9.1119   90.944   12.927  102.116   12.846  336.989   25.244  358.188   23.563 -21.19925 34.53235 
1 1 1    8   40    9 o  126.899   36.094   13.781   7.3443   15.604   10.328   11.915   10.446  134.475   43.763  122.248   43.884 12.22639 61.97544 
1 1 1    8   40   10 o  487.754   14.620  184.674   10.915  184.185   15.757  185.126   15.133  483.297   21.301  485.135   20.380 -1.838165 29.47975 
1 1 1    8   40   11 o  312.817   18.316   76.843   8.7317   78.333   12.635   75.481   12.080  311.440   26.766  306.115   26.029 5.325165 37.33572 
1 1 1    8   40   13 o  167.375   32.286   23.645   7.9715   23.934   11.995   23.416   10.668  162.120   46.133  161.859   42.513 0.2607880 62.73471 
1 1 1    8   40   15 o   67.828   31.447  -5.3872   7.7818   2.8329   11.530 -12.2633   10.546  100.081   42.687   71.116   34.045 28.96519 54.60064 
1 1 1    8   40   16 o  311.872   20.210   77.052   9.5957   78.417   14.542   75.999   12.771  307.530   31.332  305.309   27.627 2.221466 41.77206 
1 1 1    8   40   17 o  293.059   23.154   68.879   10.302   54.314   15.550   80.271   13.753  247.101   42.655  312.504   29.085 -65.40231 51.62776 
1 1 1    8   40   18 o  280.612   31.669   65.796   13.364   0.0000   0.0000   65.796   13.364  ?   ?   280.612   31.669 0.000000 31.66898 
1 1 1    8   40   19 o  211.627   40.302   39.792   12.578   0.0000   0.0000   39.792   12.578  ?   ?   211.627   40.302 0.000000 40.30190 
1 1 1    8   40   20 o  221.817   39.918   43.717   13.054   0.0000   0.0000   43.717   13.054  ?   ?   221.817   39.918 0.000000 39.91755 
1 1 1    8   40   21 o  133.641   33.235   15.584   6.7700   12.616   8.0466   22.776   12.525  119.902   38.594  154.295   47.963 -34.39349 61.56258 
1 1 1    8   40   22 o   90.932   34.808   5.6425   6.7697  -1.1417   8.0430   22.127   12.537   76.761   34.123  151.694   48.106 -74.93311 58.97906 
1 1 1    8   40   23 o  164.501   29.283   22.950   7.1028   24.961   8.4748   18.202   13.021  169.065   33.929  138.914   49.086 30.15099 59.67121 
1 1 1    8   40   24 o  196.616   25.430   31.930   7.4736   36.373   9.1589   23.077   12.929  207.410   29.698  153.219   48.879 54.19083 57.19370 
1 1 1    8   40   25 o   77.395   33.447   0.8239   7.2557  -8.2977   8.5518   24.263   13.709   65.875   31.289  155.136   50.416 -89.26147 59.33646 
1 1 1    8   40   26 o  160.054   31.742   22.366   7.5017   15.311   8.9493   39.039   13.757  128.335   40.638  200.767   45.783 -72.43231 61.21701 
1 1 1    8   40   27 o  216.164   24.308   38.663   7.9032   31.891   9.5270   53.608   14.153  189.510   34.098  241.339   39.693 -51.82890 52.32737 
1 1 1    8   40   28 o  292.724   23.008   70.350   10.226   70.350   10.226   0.0000   0.0000  292.724   23.008  ?   ?  0.000000 23.00805 
1 1 1    8   40   29 o  124.879   36.993   14.625   7.5734   14.057   9.7877   15.473   11.955  121.159   42.583  125.535   46.645 -4.375839 63.15905 
1 1 1    8   40   30 o  248.157   18.168   49.575   6.8530   46.747   10.173   51.925   9.2726  232.189   29.275  248.985   24.655 -16.79582 38.27419 
1 1 1    8   40   31 o  118.128   32.876   12.849   6.1623   14.612   9.4350   11.537   8.1377  121.656   41.862  110.937   38.838 10.71916 57.10360 
1 1 1    8   40   32 o   64.836   29.849  -2.9826   6.8340  -8.5015   8.6290   6.3039   11.193   64.234   30.763   99.193   42.176 -34.95875 52.20332 
1 1 1    8   41    0 o  108.659   51.201   14.268   9.6017   14.268   9.6017   14.268   9.6017  108.659   51.201  108.659   51.201 0.000000 0.000000 
1 1 1    8   41    1 o  265.458   15.940   55.059   6.4466   58.891   7.9742   47.830   10.953  273.339   19.181  240.935   30.374 32.40367 35.92371 
1 1 1    8   41    2 o  138.160   28.447   15.912   5.8153   14.459   7.1643   18.720   9.9565  129.731   35.188  145.403   42.233 -15.67282 54.97144 
1 1 1    8   41    3 o   69.150   29.452   0.5529   5.4747   5.7661   6.6942  -9.9763   9.5134   92.531   34.800   69.521   33.015 23.01073 47.96931 
1 1 1    8   41    4 o  118.325   30.727   11.832   5.6146   15.512   6.8028   3.9689   9.9435  134.786   33.194   97.892   40.557 36.89441 52.40871 
1 1 1    8   41    5 o  105.175   31.652   9.2205   5.5119   5.5511   6.7674   16.451   9.5001   91.927   34.894  136.906   41.633 -44.97946 54.32202 
1 1 1    8   41    6 o  179.105   22.362   25.766   5.9968   29.291   7.4905   19.473   10.008  189.400   26.569  147.964   42.151 41.43562 49.82610 
1 1 1    8   41    7 o   59.936   27.644  -3.9657   5.8994  -9.3717   7.2335   6.7726   10.195   58.410   28.024  105.853   42.071 -47.44228 50.54996 
1 1 1    8   41    8 o  221.348   24.384   39.516   8.1243   45.863   12.106   34.315   10.958  232.755   35.069  199.560   37.246 33.19548 51.15781 
1 1 1    8   41    9 o  171.298   30.701   24.590   7.7539   35.679   11.372   14.955   10.600  202.988   37.997  131.425   44.385 71.56233 58.42776 
1 1 1    8   41   10 o  406.104   16.381  128.756   10.182  155.197   15.344  107.951   13.611  441.283   22.795  366.782   24.383 74.50095 33.37906 
1 1 1    8   41   11 o  280.956   20.838   62.726   8.8973   55.105   12.958   69.523   12.238  255.653   33.954  291.845   27.730 -36.19196 43.83871 
1 1 1    8   41   12 o   81.338   37.371  -5.1990   10.639   0.0000   0.0000  -5.1990   10.639  ?   ?    81.338   37.371 0.000000 37.37076 
1 1 1    8   41   13 o  241.353   33.774   49.307   12.135   0.0000   0.0000   49.307   12.135  ?   ?   241.353   33.774 0.000000 33.77383 
1 1 1    8   41   14 o  108.000   43.957   6.7679   11.416   0.0000   0.0000   6.7679   11.416  ?   ?   108.000   43.957 0.000000 43.95741 
1 1 1    8   41   15 o  479.277   22.220  183.150   16.301   0.0000   0.0000  183.150   16.301  ?   ?   479.277   22.220 0.000000 22.22020 
1 1 1    8   41   16 o  131.667   39.249   15.473   8.5055   15.680   12.470   15.294   11.631  133.015   47.926  131.348   46.394 1.667587 66.70344 
1 1 1    8   41   17 o   77.446   34.338  -1.0344   8.0936 -10.8798   11.185   9.7881   11.727   74.834   35.614  115.443   45.361 -40.60860 57.67135 
1 1 1    8   41   18 o  172.919   34.437   26.035   8.7943   33.148   12.414   18.870   12.460  189.166   43.748  141.811   48.120 47.35579 65.03378 
1 1 1    8   41   19 o  138.954   38.812   17.473   8.5723   29.261   12.114   5.6507   12.132  176.274   44.803  105.845   44.398 70.42962 63.07529 
1 1 1    8   41   20 o  265.360   18.922   56.028   7.6350   62.518   9.2450   42.107   13.540  278.639   21.852  213.818   42.865 64.82080 48.11358 
1 1 1    8   41   21 o  221.885   22.550   39.957   7.5522   40.459   9.1328   38.870   13.431  220.205   27.710  203.386   44.389 16.81900 52.32801 
1 1 1    8   41   22 o  101.201   36.405   8.3159   7.1925   4.2879   8.5388   18.155   13.345   91.509   37.718  137.533   49.576 -46.02460 62.29309 
1 1 1    8   41   23 o   94.762   35.823   6.7213   7.1142   8.7224   8.6751   2.6117   12.432  104.746   39.567   98.786   43.221 5.959572 58.59749 
1 1 1    8   41   24 o  195.655   26.267   32.095   7.6678   26.577   9.2137   44.526   13.829  171.237   36.281  216.454   43.254 -45.21754 56.45582 
1 1 1    8   41   25 o  157.576   31.411   21.863   7.3101   18.110   8.9499   29.383   12.670  137.941   40.034  170.187   47.061 -32.24675 61.78553 
1 1 1    8   41   26 o  249.661   25.171   52.060   9.4876   52.060   9.4876   0.0000   0.0000  249.661   25.171  ?   ?  0.000000 25.17108 
1 1 1    8   41   27 o  324.959   21.411   86.232   10.590   86.232   10.590   0.0000   0.0000  324.959   21.411  ?   ?  0.000000 21.41113 
1 1 1    8   41   28 o  223.235   22.933   41.365   7.7245   44.350   9.8370   36.564   12.475  226.096   29.101  191.523   43.541 34.57281 52.37074 
1 1 1    8   41   29 o  146.083   34.434   19.821   7.5736   17.358   9.8107   23.454   11.915  130.946   42.655  148.038   46.891 -17.09195 63.38942 
1 1 1    8   42    0 o  305.652   25.327   74.690   11.662   74.690   11.662   74.690   11.662  305.652   25.327  305.652   25.327 0.000000 0.000000 
1 1 1    8   42    1 o  176.237   28.941   25.843   7.5358   25.957   10.969   25.741   10.371  169.639   42.370  169.960   40.449 -0.3211060 58.57788 
1 1 1    8   42    2 o  250.292   21.580   50.012   8.1864   42.493   11.363   58.126   11.804  223.726   34.275  265.377   29.563 -41.65146 45.26275 
1 1 1    8   42    3 o  241.109   20.878   46.318   7.6288   47.961   10.889   44.733   10.691  240.370   30.268  231.656   30.924 8.714203 43.27171 
1 1 1    8   42    4 o  108.793   35.800   9.8576   6.9041   6.6323   9.7502   13.101   9.7776  103.593   41.152  123.909   42.617 -20.31580 59.24282 
1 1 1    8   42    5 o  418.845   15.321  136.770   9.8222  146.256   14.251  128.186   13.557  428.633   21.793  400.942   22.176 27.69086 31.09233 
1 1 1    8   42    6 o  146.619   32.729   18.455   7.1591   11.435   10.134   25.449   10.115  118.644   43.134  169.052   39.759 -50.40827 58.66271 
1 1 1    8   42    7 o   86.460   34.683   3.9125   6.9935  -0.5602   9.6523   8.8554   10.147   85.575   37.742  110.663   42.554 -25.08755 56.87992 
1 1 1    8   42    8 o   95.245   39.921   3.5246   9.7966   0.0000   0.0000   3.5246   9.7966  ?   ?    95.245   39.921 0.000000 39.92143 
1 1 1    8   42    9 o  363.293   17.531  103.628   9.7483  102.492   14.511  104.563   13.160  354.408   26.953  360.290   24.001 -5.882690 36.08971 
1 1 1    8   42   10 o  120.082   37.093   12.567   7.5050   20.574   10.987   5.5632   10.276  149.154   44.643  101.570   41.563 47.58339 60.99624 
1 1 1    8   42   11 o  149.732   35.177   19.653   7.9250   21.571   11.486   17.910   10.949  151.919   45.684  139.686   45.025 12.23245 64.14300 
1 1 1    8   42   12 o  346.468   18.084   94.782   9.5570   94.210   13.602   95.339   13.431  339.641   26.370  342.105   25.841 -2.464050 36.92087 
1 1 1    8   42   13 o  360.944   17.856  102.596   9.8647  105.316   13.810   99.763   14.096  359.961   25.224  349.191   26.573 10.76932 36.63866 
1 1 1    8   42   14 o  157.653   34.631   21.774   8.1282   19.774   11.696   23.642   11.304  144.924   46.517  158.639   44.662 -13.71472 64.48635 
1 1 1    8   42   15 o  383.343   17.135  115.595   10.054  107.386   13.796  124.892   14.682  363.303   24.961  392.251   24.578 -28.94867 35.03020 
1 1 1    8   42   16 o  260.556   22.509   54.848   8.8888   59.811   12.309   49.439   12.850  266.332   30.760  237.588   36.503 28.74420 47.73522 
1 1 1    8   42   17 o  104.008   39.050   8.3632   8.4221   21.703   11.451  -7.3552   12.430  150.580   45.691   83.694   39.118 66.88586 60.14846 
1 1 1    8   42   18 o  218.001   27.671   39.715   9.0252   32.395   12.007   49.223   13.684  185.885   43.048  233.458   39.716 -47.57306 58.57071 
1 1 1    8   42   19 o  102.201   39.355   7.8438   8.6872   8.4469   11.522   7.0493   13.224  109.587   44.321  109.839   46.228 -0.2519608 64.04173 
1 1 1    8   42   20 o  121.096   40.532   13.416   8.8389   6.1081   11.539   23.792   13.750  103.516   43.354  152.262   50.542 -48.74561 66.58867 
1 1 1    8   42   21 o  299.878   18.084   71.734   8.2615   67.763   9.8733   81.006   15.087  288.215   22.561  305.242   32.807 -17.02710 39.81590 
1 1 1    8   42   22 o   74.289   32.677   0.0249   7.1897  -1.4618   8.9209   2.7802   12.145   78.354   35.297   97.081   42.591 -18.72687 55.31630 
1 1 1    8   42   23 o  180.313   34.977   29.434   9.3050   29.434   9.3050   0.0000   0.0000  180.313   34.977  ?   ?  0.000000 34.97655 
1 1 1    8   42   24 o  275.174   23.269   62.562   9.7090   62.562   9.7090   0.0000   0.0000  275.174   23.269  ?   ?  0.000000 23.26947 
1 1 1    8   42   25 o   78.641   33.445   2.2180   7.0411  -2.3960   8.6613   11.209   12.091   74.700   34.095  113.489   45.576 -38.78893 56.91764 
1 1 1    8   42   26 o  164.260   29.314   23.699   7.0998   16.204   8.6521   39.152   12.423  128.708   39.839  199.871   41.944 -71.16318 57.84870 
1 1 1    8   43    0 o  292.927   26.125   69.138   11.499   69.138   11.499   69.138   11.499  292.927   26.125  292.927   26.125 0.000000 0.000000 
1 1 1    8   43    1 o  117.781   32.633   12.003   6.0857   14.072   7.6865   8.5260   9.9627  126.198   37.238  108.641   42.058 17.55779 56.17396 
1 1 1    8   43    2 o  207.982   20.460   34.625   6.4290   31.699   7.8675   40.507   11.154  195.824   26.963  216.847   34.780 -21.02359 44.00758 
1 1 1    8   43    3 o  388.229   13.239  117.154   7.8669  114.852   9.8441  121.221   13.087  382.598   16.810  389.082   22.065 -6.483948 27.73886 
1 1 1    8   43    4 o  155.569   26.703   20.149   6.1295   17.062   7.4609   26.559   10.751  139.293   35.029  170.614   41.554 -31.32120 54.34853 
1 1 1    8   43    5 o  325.261   14.587   82.522   7.2620   82.202   9.1778   83.057   11.876  322.200   18.690  320.144   24.419 2.055725 30.75123 
1 1 1    8   43    6 o  134.228   30.172   15.428   6.0481   5.4263   7.2833   37.646   10.855   91.933   35.856  208.327   35.304 -116.3940 50.31955 
1 1 1    8   43    7 o  148.803   27.368   18.568   6.0037   18.316   7.4854   19.021   10.052  144.529   34.344  143.658   42.635 0.8709259 54.74672 
1 1 1    8   43    8 o  107.263   32.312   9.8632   5.7423   11.187   7.0983   7.3570   9.7685  113.638   36.214  104.461   41.288 9.176674 54.91949 
1 1 1    8   43    9 o  241.990   23.046   47.409   8.4332   41.289   11.776   53.853   12.083  216.956   36.775  251.948   32.058 -34.99165 48.78616 
1 1 1    8   43   10 o  102.672   37.051   8.4077   7.4571  -4.0178   10.510   21.007   10.583   81.706   37.393  149.848   43.546 -68.14246 57.39765 
1 1 1    8   43   11 o  100.891   37.196   7.9004   7.5732 -10.1081   10.434   27.952   11.010   72.284   34.399  173.921   41.863 -101.6376 54.18282 
1 1 1    8   43   12 o   91.014   36.387   4.9346   7.6693  -2.3011   10.326   13.835   11.453   83.714   37.819  125.183   45.803 -41.46854 59.39896 
1 1 1    8   43   13 o  128.055   38.094   14.848   8.0183   22.870   10.844   5.1688   11.911  155.239   43.755  103.462   43.725 51.77689 61.85793 
1 1 1    8   43   14 o  184.278   30.415   29.059   8.2794   17.167   11.083   44.074   12.454  134.696   45.386  221.712   38.069 -87.01637 59.23826 
1 1 1    8   43   15 o  403.224   17.049  128.417   10.522  127.809   14.333  129.127   15.496  395.951   23.759  395.942   25.709 0.9735107E-02 35.00644 
1 1 1    8   43   16 o  136.229   38.325   17.167   8.3273   19.680   11.429   14.324   12.158  141.700   46.033  125.201   46.936 16.49915 65.74212 
1 1 1    8   43   17 o  171.508   34.208   26.223   8.6652   37.053   11.970   14.296   12.561  199.272   40.621  124.789   47.497 74.48367 62.49851 
1 1 1    8   43   18 o  127.649   40.210   15.371   8.7706   21.063   12.105   9.0803   12.725  144.207   47.400  111.565   46.022 32.64194 66.06684 
1 1 1    8   43   19 o   72.563   33.181  -2.9403   8.2507   0.7767   11.074  -7.5782   12.370   90.067   40.039   81.381   38.346 8.686661 55.43914 
1 1 1    8   43   20 o  128.658   40.684   15.915   8.9718   20.696   12.244   10.372   13.184  141.500   47.703  114.030   46.919 27.46986 66.91009 
1 1 1    8   43   21 o   90.225   40.584   0.1476   11.741   0.1476   11.741   0.0000   0.0000   90.225   40.584  ?   ?  0.000000 40.58373 
1 1 1    8   43   22 o   93.624   37.707   6.0817   8.3021   6.0817   8.3021   0.0000   0.0000   93.624   37.707  ?   ?  0.000000 37.70699 
1 1 1    8   43   23 f  202.052   23.825   34.161   7.2265   27.885   8.7096   48.027   12.946  175.160   33.709  225.583   38.900 -50.42267 51.47348 
1 1 1    8   44    0 o  256.585   22.922   52.864   8.8371   52.864   8.8371   52.864   8.8371  256.585   22.922  256.585   22.922 0.000000 0.000000 
1 1 1    8   44    1 o   77.460   31.531   2.8135   5.8748   3.1543   7.3547   2.2127   9.7651   84.494   34.933   90.740   39.007 -6.245804 52.36269 
1 1 1    8   44    2 o   88.968   33.459   5.6570   6.1880   1.1928   7.7472   13.524   10.285   80.678   34.714  123.274   43.618 -42.59679 55.74585 
1 1 1    8   44    3 o  234.174   19.442   43.842   6.9058   46.777   9.0256   39.698   10.725  238.652   25.084  213.888   33.891 24.76373 42.16349 
1 1 1    8   44    4 o   87.618   32.696   5.5501   5.8867   8.5952   7.5337   0.7760   9.4330  103.032   37.232   86.244   37.694 16.78864 52.98133 
1 1 1    8   44    5 o   77.415   31.894   2.5433   6.1022   1.4496   7.6528   4.4526   10.112   80.818   34.631   96.843   40.573 -16.02495 53.34303 
1 1 1    8   44    6 o  236.022   18.830   44.468   6.7459   49.412   8.4523   35.792   11.196  246.667   22.640  199.514   38.052 47.15331 44.27750 
1 1 1    8   44    7 o  239.231   19.075   45.755   6.9268   44.248   8.7336   48.310   11.373  231.752   25.018  237.040   32.177 -5.288330 40.75849 
1 1 1    8   44    8 o  246.907   19.285   48.800   7.2303   58.370   8.9255   30.531   12.332  268.490   21.910  177.784   45.213 90.70673 50.24170 
1 1 1    8   44    9 o   72.676   32.765  -1.9880   7.7049  -8.7754   10.665   5.4211   11.143   74.374   35.214  101.281   42.520 -26.90729 55.20906 
1 1 1    8   44   10 o  102.849   37.581   8.6733   7.7063   3.1265   10.813   14.400   10.986   95.090   40.963  124.935   44.987 -29.84523 60.84259 
1 1 1    8   44   11 o  248.479   22.894   50.466   8.6093   57.580   12.203   43.416   12.148  258.577   31.481  219.203   37.559 39.37396 49.00784 
1 1 1    8   44   12 o  163.614   33.832   23.860   8.1928   32.950   11.396   14.136   11.787  187.292   40.898  123.827   46.254 63.46508 61.74208 
1 1 1    8   44   13 o   97.714   38.187   7.0130   8.2735   4.4743   11.646   9.5998   11.756   99.457   42.672  111.380   44.866 -11.92244 61.91799 
1 1 1    8   44   14 o   54.451   26.765 -13.7702   7.7604  -2.9863   10.351 -27.6136   11.728   81.081   37.108   60.155   30.116 20.92607 47.79090 
1 1 1    8   44   15 o   67.718   31.506  -4.7447   7.9181 -14.2115   10.632   7.0446   11.865   67.001   32.585  104.863   43.942 -37.86211 54.70563 
1 1 1    8   44   16 o  110.557   39.419   10.994   8.4152   33.797   12.012 -10.9833   11.793  186.119   43.026   74.923   35.903 111.1957 56.03814 
1 1 1    8   44   17 o   97.650   42.176   4.3387   11.523   4.3387   11.523   0.0000   0.0000   97.650   42.176  ?   ?  0.000000 42.17590 
1 1 1    8   44   18 o  135.098   46.559   18.786   11.673   18.786   11.673   0.0000   0.0000  135.098   46.559  ?   ?  0.000000 46.55913 
1 1 1    8   44   19 o  179.721   47.690   33.853   13.336   33.853   13.336   0.0000   0.0000  179.721   47.690  ?   ?  0.000000 47.68956 
1 1 1    8   45    0 f   72.214   42.001   5.9179   7.6439   5.9179   7.6439   5.9179   7.6439   72.214   42.001   72.214   42.001 0.000000 0.000000 
1 1 1    8   45    1 o   67.396   29.959  -0.9170   6.1993  -4.9546   7.7535   6.2389   10.322   66.861   31.131  100.440   41.443 -33.57929 51.83282 
1 1 1    8   45    2 o  311.533   16.353   76.849   7.7704   82.005   9.8841   68.507   12.573  318.953   20.352  283.810   29.367 35.14221 35.72992 
1 1 1    8   45    3 o   80.718   32.685   3.5446   6.2745   1.0465   7.8056   8.1062   10.548   79.592   34.544  105.627   42.516 -26.03416 54.78020 
1 1 1    8   45    4 o  358.117   14.179  100.546   7.7721  102.079   9.8204   97.975   12.715  358.308   17.906  345.043   24.228 13.26483 30.12690 
1 1 1    8   45    5 o  141.865   30.184   17.606   6.3528   20.764   8.0698   12.461   10.302  151.016   35.509  117.551   43.374 33.46550 56.05515 
1 1 1    8   45    6 o   85.018   33.406   4.7459   6.3600  -0.5626   8.0865   13.355   10.298   76.869   34.191  120.219   43.517 -43.34953 55.34170 
1 1 1    8   45    7 o  407.005   13.594  129.708   8.4686  129.433   10.376  130.256   14.657  404.195   16.771  397.669   24.195 6.526520 29.43896 
1 1 1    8   45    8 f  175.498   26.044   25.993   6.7837   29.384   8.2796   19.068   11.832  183.790   30.501  137.569   46.892 46.22044 55.93874 
1 1 1    8   45    9 o  350.276   18.838   98.426   10.063  108.516   14.508   89.071   13.969  359.905   26.522  323.821   28.473 36.08414 38.91237 
1 1 1    8   45   10 o  223.231   26.015   41.903   8.7222   29.703   11.907   56.027   12.812  172.595   44.713  250.762   34.278 -78.16650 56.34044 
1 1 1    8   45   11 o  148.301   36.095   20.366   8.1159   10.560   11.143   31.444   11.844  111.797   44.126  178.488   43.703 -66.69111 62.10539 
1 1 1    8   45   12 o  206.790   27.586   36.504   8.5136   49.204   12.311   24.865   11.786  233.027   35.650  155.544   46.166 77.48314 58.32839 
1 1 1    8   45   13 o   71.391   32.485  -2.2821   7.7868  -3.1030   10.700  -1.3581   11.353   81.421   37.435   86.458   39.296 -5.036484 54.27279 
1 1 1    8   45   14 o  109.524   43.426   10.108   10.838   10.108   10.838   0.0000   0.0000  109.524   43.426  ?   ?  0.000000 43.42594 
1 1 1    8   46    0 o   88.808   45.235   10.151   7.7272   10.151   7.7272   10.151   7.7272   88.808   45.235   88.808   45.235 0.000000 0.000000 
1 1 1    8   46    1 o  264.818   15.250   55.515   6.1552   56.098   8.6699   54.922   8.7402  261.733   21.841  258.608   22.298 3.125244 31.21291 
1 1 1    8   46    2 o  227.765   20.075   42.125   6.9271   43.010   8.6354   40.526   11.601  226.418   25.352  209.442   37.569 16.97583 45.32312 
1 1 1    8   46    3 o  102.017   34.163   9.1961   6.2792   7.4400   7.8029   12.423   10.578   97.221   37.333  116.234   43.739 -19.01295 57.50526 
1 1 1    8   46    4 o  294.319   16.133   68.818   7.2399   71.727   9.0367   63.604   12.098  297.644   19.951  271.571   29.583 26.07291 35.68156 
1 1 1    9    0    2 f  1692.18   21.686  2195.72   56.147  2195.72   56.147  2195.72   56.147  1692.18   21.686  1692.18   21.686 0.000000 0.000000 
1 1 1    9    0    3 o  149.923   10.084   17.440   2.2899   17.440   2.2899   17.440   2.2899  149.923   10.084  149.923   10.084 0.000000 0.000000 
1 1 1    9    0    4 o  1106.14   10.702  937.001   18.115  937.001   18.115  937.001   18.115  1106.14   10.702  1106.14   10.702 0.000000 0.000000 
1 1 1    9    0    5 o  1369.21   12.741  1435.91   26.697  1435.91   26.697  1435.91   26.697  1369.21   12.741  1369.21   12.741 0.000000 0.000000 
1 1 1    9    0    6 o  395.721   5.1312  119.916   3.1068  119.916   3.1068  119.916   3.1068  395.721   5.1312  395.721   5.1312 0.000000 0.000000 
1 1 1    9    0    7 o  461.500   4.7490  163.063   3.3538  163.063   3.3538  163.063   3.3538  461.500   4.7490  461.500   4.7490 0.000000 0.000000 
1 1 1    9    0    8 o  299.681   5.2047   68.801   2.3858   68.801   2.3858   68.801   2.3858  299.681   5.2047  299.681   5.2047 0.000000 0.000000 
1 1 1    9    0    9 o  506.011   5.6807  196.056   4.3985  196.056   4.3985  196.056   4.3985  506.011   5.6807  506.011   5.6807 0.000000 0.000000 
1 1 1    9    0   10 o  475.431   5.6825  173.086   4.1339  173.086   4.1339  173.086   4.1339  475.431   5.6825  475.431   5.6825 0.000000 0.000000 
1 1 1    9    0   11 o  668.484   6.5473  342.162   6.6978  342.162   6.6978  342.162   6.6978  668.484   6.5473  668.484   6.5473 0.000000 0.000000 
1 1 1    9    0   12 o  244.758   7.9240   46.005   2.9616   46.005   2.9616   46.005   2.9616  244.758   7.9240  244.758   7.9240 0.000000 0.000000 
1 1 1    9    0   13 o  188.593   6.2059   27.313   1.7870   27.313   1.7870   27.313   1.7870  188.593   6.2059  188.593   6.2059 0.000000 0.000000 
1 1 1    9    0   14 o  440.037   5.3218  148.275   3.5832  148.275   3.5832  148.275   3.5832  440.037   5.3218  440.037   5.3218 0.000000 0.000000 
1 1 1    9    0   15 o  109.371   10.052   9.3890   1.6501   9.3890   1.6501   9.3890   1.6501  109.371   10.052  109.371   10.052 0.000000 0.000000 
1 1 1    9    0   16 o  1229.97   8.5363  1158.35   16.069  1158.35   16.069  1158.35   16.069  1229.97   8.5363  1229.97   8.5363 0.000000 0.000000 
1 1 1    9    0   17 o  262.070   6.3490   52.664   2.5434   52.664   2.5434   52.664   2.5434  262.070   6.3490  262.070   6.3490 0.000000 0.000000 
1 1 1    9    0   19 f  764.914   9.1306  448.112   10.687  448.112   10.687  448.112   10.687  764.914   9.1306  764.914   9.1306 0.000000 0.000000 
1 1 1    9    0   20 o  387.936   6.1109  115.276   3.6266  115.276   3.6266  115.276   3.6266  387.936   6.1109  387.936   6.1109 0.000000 0.000000 
1 1 1    9    0   21 o  310.065   6.5964   73.687   3.1274   73.687   3.1274   73.687   3.1274  310.065   6.5964  310.065   6.5964 0.000000 0.000000 
1 1 1    9    0   22 o  1280.08   8.9762  1254.53   17.585  1254.53   17.585  1254.53   17.585  1280.08   8.9762  1280.08   8.9762 0.000000 0.000000 
1 1 1    9    0   23 o  180.439   9.9209   25.149   2.7211   25.149   2.7211   25.149   2.7211  180.439   9.9209  180.439   9.9209 0.000000 0.000000 
1 1 1    9    0   24 o  350.681   8.1021   94.283   4.3437   94.283   4.3437   94.283   4.3437  350.681   8.1021  350.681   8.1021 0.000000 0.000000 
1 1 1    9    0   25 o  850.846   8.3662  554.305   10.893  554.305   10.893  554.305   10.893  850.846   8.3662  850.846   8.3662 0.000000 0.000000 
1 1 1    9    0   26 o  507.454   7.8351  197.250   6.0824  197.250   6.0824  197.250   6.0824  507.454   7.8351  507.454   7.8351 0.000000 0.000000 
1 1 1    9    0   27 o  1136.56   8.5839  988.991   14.931  988.991   14.931  988.991   14.931  1136.56   8.5839  1136.56   8.5839 0.000000 0.000000 
1 1 1    9    0   28 o   48.740   28.245   2.2185   3.4376   2.2185   3.4376   2.2185   3.4376   48.740   28.245   48.740   28.245 0.000000 0.000000 
1 1 1    9    0   29 o  958.916   7.9846  704.017   11.717  704.017   11.717  704.017   11.717  958.916   7.9846  958.916   7.9846 0.000000 0.000000 
1 1 1    9    0   30 o  180.921   15.042   25.586   4.0993   25.586   4.0993   25.586   4.0993  180.921   15.042  180.921   15.042 0.000000 0.000000 
1 1 1    9    0   31 o  809.374   10.965  501.854   13.578  501.854   13.578  501.854   13.578  809.374   10.965  809.374   10.965 0.000000 0.000000 
1 1 1    9    0   32 o  174.823   17.102   24.082   4.4758   24.082   4.4758   24.082   4.4758  174.823   17.102  174.823   17.102 0.000000 0.000000 
1 1 1    9    0   33 o  1015.24   8.5034  789.236   13.212  789.236   13.212  789.236   13.212  1015.24   8.5034  1015.24   8.5034 0.000000 0.000000 
1 1 1    9    0   34 o  134.947   25.511   15.378   4.7203   15.378   4.7203   15.378   4.7203  134.947   25.511  134.947   25.511 0.000000 0.000000 
1 1 1    9    0   35 o  222.085   15.439   38.338   5.1898   38.338   5.1898   38.338   5.1898  222.085   15.439  222.085   15.439 0.000000 0.000000 
1 1 1    9    0   36 o   56.175   35.100   1.4262   6.1843   1.4262   6.1843   1.4262   6.1843   56.175   35.100   56.175   35.100 0.000000 0.000000 
1 1 1    9    0   37 o   52.987   32.002   2.0857   4.7524   2.0857   4.7524   2.0857   4.7524   52.987   32.002   52.987   32.002 0.000000 0.000000 
1 1 1    9    0   38 o  394.532   11.105  119.525   6.6942  119.525   6.6942  119.525   6.6942  394.532   11.105  394.532   11.105 0.000000 0.000000 
1 1 1    9    0   39 o  356.138   10.954   97.450   5.9582   97.450   5.9582   97.450   5.9582  356.138   10.954  356.138   10.954 0.000000 0.000000 
1 1 1    9    0   40 o  207.030   15.962   33.470   4.9889   33.470   4.9889   33.470   4.9889  207.030   15.962  207.030   15.962 0.000000 0.000000 
1 1 1    9    0   41 o  531.221   8.7783  216.346   7.1332  216.346   7.1332  216.346   7.1332  531.221   8.7783  531.221   8.7783 0.000000 0.000000 
1 1 1    9    0   42 o  128.958   26.894   14.366   4.6795   14.366   4.6795   14.366   4.6795  128.958   26.894  128.958   26.894 0.000000 0.000000 
1 1 1    9    0   43 o  417.885   13.374  134.422   8.5346  134.422   8.5346  134.422   8.5346  417.885   13.374  417.885   13.374 0.000000 0.000000 
1 1 1    9    0   44 o   61.969   34.266   4.1518   4.7515   4.1518   4.7515   4.1518   4.7515   61.969   34.266   61.969   34.266 0.000000 0.000000 
1 1 1    9    0   45 o  383.297   10.423  112.920   6.1047  112.920   6.1047  112.920   6.1047  383.297   10.423  383.297   10.423 0.000000 0.000000 
1 1 1    9    0   46 o   35.446   24.562  -3.7795   4.6023  -3.7795   4.6023  -3.7795   4.6023   35.446   24.562   35.446   24.562 0.000000 0.000000 
1 1 1    9    0   47 o  130.862   27.373   14.882   4.8310   14.882   4.8310   14.882   4.8310  130.862   27.373  130.862   27.373 0.000000 0.000000 
1 1 1    9    0   48 o  251.102   17.361   49.321   6.5995   49.321   6.5995   49.321   6.5995  251.102   17.361  251.102   17.361 0.000000 0.000000 
1 1 1    9    0   49 o  350.233   11.455   94.540   6.1256   94.540   6.1256   94.540   6.1256  350.233   11.455  350.233   11.455 0.000000 0.000000 
1 1 1    9    0   50 o   46.084   30.116  -0.4073   5.2271  -0.4073   5.2271  -0.4073   5.2271   46.084   30.116   46.084   30.116 0.000000 0.000000 
1 1 1    9    0   51 o   52.219   32.044   1.9255   4.9329   1.9255   4.9329   1.9255   4.9329   52.219   32.044   52.219   32.044 0.000000 0.000000 
1 1 1    9    0   52 o  141.224   27.487   17.234   5.2960   17.234   5.2960   17.234   5.2960  141.224   27.487  141.224   27.487 0.000000 0.000000 
1 1 1    9    0   53 o  122.432   33.571   14.161   5.4396   14.161   5.4396   14.161   5.4396  122.432   33.571  122.432   33.571 0.000000 0.000000 
1 1 1    9    0   54 o  322.712   14.605   80.926   7.1804   80.926   7.1804   80.926   7.1804  322.712   14.605  322.712   14.605 0.000000 0.000000 
1 1 1    9    0   55 o   60.046   36.409   3.1132   6.2003   3.1132   6.2003   3.1132   6.2003   60.046   36.409   60.046   36.409 0.000000 0.000000 
1 1 1    9    0   56 o  303.497   14.246   71.677   6.5844   71.677   6.5844   71.677   6.5844  303.497   14.246  303.497   14.246 0.000000 0.000000 
1 1 1    9    0   57 f   55.173   34.178   2.1736   5.7383   2.1736   5.7383   2.1736   5.7383   55.173   34.178   55.173   34.178 0.000000 0.000000 
1 1 1    9    0   58 o  191.761   21.621   29.951   6.1384   29.951   6.1384   29.951   6.1384  191.761   21.621  191.761   21.621 0.000000 0.000000 
1 1 1    9    0   59 o  154.133   32.916   21.516   6.8223   21.516   6.8223   21.516   6.8223  154.133   32.916  154.133   32.916 0.000000 0.000000 
1 1 1    9    0   60 o   46.771   30.358   0.2917   5.1844   0.2917   5.1844   0.2917   5.1844   46.771   30.358   46.771   30.358 0.000000 0.000000 
1 1 1    9    0   61 o  276.726   19.934   61.416   8.3428   61.416   8.3428   61.416   8.3428  276.726   19.934  276.726   19.934 0.000000 0.000000 
1 1 1    9    0   62 o   27.123   19.788 -10.8392   4.9084 -10.8392   4.9084 -10.8392   4.9084   27.123   19.788   27.123   19.788 0.000000 0.000000 
1 1 1    9    0   63 o   49.666   30.991   1.9219   4.8050   1.9219   4.8050   1.9219   4.8050   49.666   30.991   49.666   30.991 0.000000 0.000000 
1 1 1    9    0   64 o  136.648   33.350   18.063   6.0430   18.063   6.0430   18.063   6.0430  136.648   33.350  136.648   33.350 0.000000 0.000000 
1 1 1    9    1    0 o  1306.03   17.203  1307.27   34.376  1307.27   34.376  1307.27   34.376  1306.03   17.203  1306.03   17.203 0.000000 0.000000 
1 1 1    9    1    1 o  744.269   11.400  424.274   12.986  424.274   12.986   0.0000   0.0000  744.269   11.400  ?   ?  0.000000 11.39965 
1 1 1    9    1    2 o  657.047   10.699  330.629   10.760  330.629   10.760   0.0000   0.0000  657.047   10.699  ?   ?  0.000000 10.69882 
1 1 1    9    1    3 o  1074.84   10.501  884.770   17.275  849.114   23.350  927.888   25.677  1052.63   14.493  1100.30   15.247 -47.66724 21.03549 
1 1 1    9    1    4 o  704.745   11.266  380.416   12.153   0.0000   0.0000  380.416   12.153  ?   ?   704.745   11.266 0.000000 11.26623 
1 1 1    9    1    5 o  581.138   5.9301  258.524   5.2749  257.080   6.4119  261.548   9.2784  579.480   7.2290  584.387   10.373 -4.906738 12.64344 
1 1 1    9    1    6 o  655.774   4.3796  329.159   4.3960  355.346   7.9420  317.592   5.2784  681.269   7.6162  644.128   5.3537 37.14160 9.309660 
1 1 1    9    1    7 o  755.910   4.4306  437.362   5.1263  446.149   6.9270  426.723   7.6221  763.423   5.9281  746.592   6.6700 16.83020 8.923588 
1 1 1    9    1    8 o  745.919   4.4234  425.881   5.0503  420.837   6.6290  432.858   7.7968  741.448   5.8411  751.930   6.7744 -10.48175 8.944860 
1 1 1    9    1    9 o  831.643   4.7556  529.411   6.0536  524.810   7.9559  535.738   9.3294  827.965   6.2778  836.494   7.2866 -8.529602 9.617945 
1 1 1    9    1   10 o  400.661   3.4648  122.868   2.1249  119.655   2.9805  126.189   3.0301  395.367   4.9251  406.018   4.8758 -10.65167 6.930404 
1 1 1    9    1   11 o  238.771   4.7118   43.641   1.7220   43.915   2.6077   43.428   2.2931  239.490   7.1139  238.170   6.2901 1.319595 9.495959 
1 1 1    9    1   12 o  837.362   5.2363  536.759   6.7113  534.308   9.4328  539.271   9.5508  835.342   7.3775  839.209   7.4353 -3.867371 10.47429 
1 1 1    9    1   13 o  188.371   4.8209   27.162   1.3900   26.270   2.1470   27.806   1.8238  185.221   7.5730  190.575   6.2524 -5.353607 9.820544 
1 1 1    9    1   14 o  601.878   3.9994  277.284   3.6844  278.870   5.2447  275.740   5.1771  603.548   5.6773  600.153   5.6358 3.395020 7.999626 
1 1 1    9    1   15 o  723.618   4.3321  400.809   4.7982  396.770   6.7436  404.951   6.8286  719.897   6.1200  727.280   6.1342 -7.382935 8.665022 
1 1 1    9    1   16 o  701.808   4.3378  377.011   4.6597  388.765   6.7572  366.354   6.4344  712.598   6.1952  691.759   6.0769 20.83868 8.678063 
1 1 1    9    1   17 o  253.384   4.4917   49.144   1.7420   47.789   2.4841   50.456   2.4436  249.841   6.4958  256.722   6.2188 -6.881012 8.992682 
1 1 1    9    1   18 o  358.265   4.7486   98.249   2.6040  103.025   3.7778   93.926   3.5942  366.835   6.7282  350.262   6.7041 16.57300 9.498135 
1 1 1    9    1   19 o  495.278   4.7667  187.764   3.6136  187.352   5.1078  188.177   5.1129  494.692   6.7458  495.781   6.7377 -1.088989 9.534249 
1 1 1    9    1   20 o  340.660   4.4107   88.826   2.2998   91.081   3.2936   86.680   3.2128  344.934   6.2383  336.498   6.2377 8.436646 8.821894 
1 1 1    9    1   21 o  273.559   5.2621   57.282   2.2033   54.725   2.9369   60.573   3.3324  267.365   7.1766  281.279   7.7401 -13.91370 10.55517 
1 1 1    9    1   22 o  846.917   4.9448  549.013   6.4100  551.065   9.1463  547.033   8.9861  848.437   7.0429  845.331   6.9451 3.106201 9.891265 
1 1 1    9    1   23 o  929.181   5.2189  660.852   7.4224  663.749   10.579  658.044   10.416  931.145   7.4228  927.137   7.3401 4.007629 10.43913 
1 1 1    9    1   24 o  358.892   5.6780   98.592   3.1191   96.489   4.4873  100.558   4.3386  355.009   8.2580  362.426   7.8210 -7.416626 11.37376 
1 1 1    9    1   25 o  794.913   5.3656  483.666   6.5284  485.739   8.6730  480.955   9.9165  796.569   7.1133  792.602   8.1740 3.967102 10.83578 
1 1 1    9    1   26 o  1814.28   9.0443  2520.25   25.116  2503.54   38.099  2533.10   33.401  1807.72   13.769  1818.59   11.999 -10.87073 18.26419 
1 1 1    9    1   27 o  864.390   5.2945  571.913   7.0050  572.951   9.9725  570.902   9.8419  865.102   7.5312  863.557   7.4459 1.545288 10.59061 
1 1 1    9    1   28 o  608.319   5.0499  283.250   4.7020  280.486   6.6516  286.012   6.6477  605.294   7.1795  611.230   7.1056 -5.935974 10.10118 
1 1 1    9    1   29 o  1204.06   6.3327  1109.81   11.671  1105.49   16.445  1114.19   16.566  1201.55   8.9419  1206.27   8.9723 -4.715576 12.66723 
1 1 1    9    1   30 o  673.964   5.2152  347.694   5.3800  345.917   7.6512  349.433   7.5663  672.172   7.4367  675.584   7.3171 -3.412354 10.43281 
1 1 1    9    1   31 o  1115.01   8.6597  952.020   14.779  935.591   20.563  969.577   21.256  1105.04   12.157  1124.91   12.345 -19.87195 17.32632 
1 1 1    9    1   32 f  680.421   5.8991  354.422   6.1437  358.053   8.1992  349.773   9.2775  683.823   7.8335  675.816   8.9688 8.006836 11.90810 
1 1 1    9    1   33 f  280.745   8.2515   60.357   3.5458   62.958   4.9680   57.656   5.0624  286.654   11.323  274.296   12.058 12.35770 16.54067 
1 1 1    9    1   34 o  341.637   7.5106   89.373   3.9274   86.893   5.5598   91.843   5.5486  336.765   10.786  346.236   10.470 -9.470886 15.03190 
1 1 1    9    1   35 o  294.959   8.5513   66.635   3.8607   66.619   5.4742   66.651   5.4455  294.806   12.132  294.880   12.065 -0.7427979E-01 17.10958 
1 1 1    9    1   36 o  900.102   6.9213  620.403   9.5356  605.288   13.321  636.286   13.656  888.813   9.7918  911.288   9.7902 -22.47504 13.84657 
1 1 1    9    1   37 o  126.560   18.566   12.575   3.4896   11.421   4.8621   13.802   5.0114  119.210   27.242  131.456   25.828 -12.24578 37.53922 
1 1 1    9    1   38 o  479.048   7.1727  175.774   5.2594  173.695   7.4963  177.790   7.3808  475.998   10.289  481.599   10.013 -5.600922 14.35671 
1 1 1    9    1   39 o  294.013   8.7491   66.250   3.9373   63.278   5.6357   69.084   5.5030  287.108   12.824  300.050   11.982 -12.94193 17.55093 
1 1 1    9    1   40 o   46.642   21.200  -2.0029   3.3048  -0.1456   4.7943  -3.6846   4.5618   64.069   27.431   52.388   24.214 11.68027 36.58910 
1 1 1    9    1   41 o  310.242   8.2321   73.783   3.9091   76.815   5.6199   70.940   5.4412  316.299   11.608  303.954   11.695 12.34506 16.47812 
1 1 1    9    1   42 o  339.274   7.5734   88.232   3.9329   93.107   5.6029   83.497   5.5218  348.267   10.511  329.764   10.940 18.50363 15.17083 
1 1 1    9    1   43 o   89.316   27.565   6.2517   4.1455   9.4462   6.1877   3.6502   5.5839  109.062   33.680   81.991   31.558 27.07155 46.15411 
1 1 1    9    1   44 o  220.205   11.257   37.368   3.7817   42.773   5.0617   30.539   5.6894  235.189   14.126  197.655   19.041 37.53447 23.70894 
1 1 1    9    1   45 o  116.635   19.507   10.836   3.3595   13.530   4.8255   8.3021   4.6798  129.286   25.291  101.214   28.821 28.07275 38.34383 
1 1 1    9    1   46 o  439.134   6.7749  147.872   4.5537  143.643   6.3903  152.236   6.4908  432.371   9.6560  445.139   9.5264 -12.76807 13.56435 
1 1 1    9    1   47 o   99.197   22.489   8.0065   3.3358   11.799   4.8050   4.4783   4.6347  119.888   26.852   80.934   29.209 38.95420 39.67651 
1 1 1    9    1   48 o   99.327   26.968   8.1042   4.2054   7.1069   6.2138   8.9470   5.7125   97.399   33.947  104.859   32.357 -7.460510 46.89739 
1 1 1    9    1   49 o   52.361   22.854  -0.5345   3.4572   0.5407   4.6733  -1.8341   5.1382   64.653   27.360   60.437   27.041 4.215672 38.46783 
1 1 1    9    1   50 o   64.388   25.276   2.0814   3.6378   0.9477   5.2742   3.1102   5.0241   69.418   29.204   76.021   29.744 -6.603127 41.68438 
1 1 1    9    1   51 o  188.361   14.457   27.703   4.1362   29.054   5.4538   25.874   6.3459  191.633   18.837  179.012   23.746 12.62134 30.31033 
1 1 1    9    1   52 o   64.184   25.224   2.0958   3.6267  -0.2759   5.1807   4.3749   5.0786   64.724   28.117   81.176   30.354 -16.45192 41.37526 
1 1 1    9    1   53 o  310.646   9.2326   74.365   4.3899   73.889   6.1944   74.845   6.2222  308.573   13.115  310.572   13.089 -1.998932 18.52939 
1 1 1    9    1   54 o   53.487   24.511  -2.7143   4.5363  -4.8506   6.7029  -0.9091   6.1617   62.512   29.052   68.246   30.124 -5.734695 41.85080 
1 1 1    9    1   55 o  136.239   20.871   15.083   4.2136   10.977   5.4849   20.996   6.5819  112.821   30.867  157.879   28.275 -45.05788 41.86030 
1 1 1    9    1   56 o  182.517   14.835   26.224   4.1086   27.888   5.7711   24.514   5.8508  185.926   20.627  173.308   22.593 12.61740 30.59255 
1 1 1    9    1   57 o   97.369   26.729   8.0903   4.1047   5.6932   5.7102   10.653   5.9046   87.343   32.279  110.108   32.675 -22.76469 45.93052 
1 1 1    9    1   58 f   65.177   26.291   2.0277   4.0430   5.2241   5.7061  -1.1947   5.7293   84.921   32.087   64.102   28.626 20.81892 43.00080 
1 1 1    9    1   59 o  101.028   28.488   8.9574   4.5955   7.4197   6.5653   10.435   6.4348   94.856   34.683  107.445   34.505 -12.58873 48.92386 
1 1 1    9    1   60 o  184.622   14.987   27.136   4.1986   28.282   5.5133   25.554   6.4783  185.983   19.665  173.294   25.159 12.68896 31.93261 
1 1 1    9    1   61 o   42.148   20.298  -5.1725   3.8778  -5.3671   5.8584  -5.0207   5.1732   54.836   26.003   51.365   24.379 3.471146 35.64391 
1 1 1    9    1   62 o  100.033   23.825   8.7838   3.5957   10.897   5.1572   6.7845   5.0159  108.201   30.062   87.521   30.500 20.67970 42.82494 
1 1 1    9    1   63 o   62.448   24.424   2.5670   3.3864   1.0445   4.8066   4.0675   4.7717   63.136   27.254   74.021   28.981 -10.88545 39.78264 
1 1 1    9    1   64 o  150.181   18.616   18.931   4.1874   16.128   5.8513   21.873   5.9952  129.661   30.067  155.421   26.129 -25.75920 39.83395 
1 1 1    9    2    0 o  674.545   10.592  348.605   10.930  348.605   10.930  348.605   10.930  674.545   10.592  674.545   10.592 0.000000 0.000000 
1 1 1    9    2    1 o  555.705   6.7728  236.403   5.7608  243.666   8.4225  230.019   7.8968  564.090   9.7549  548.077   9.4132 16.01263 13.55609 
1 1 1    9    2    2 o  638.555   10.497  312.276   10.259  312.276   10.259   0.0000   0.0000  638.555   10.497  ?   ?  0.000000 10.49667 
1 1 1    9    2    3 o  279.134   6.2000   59.645   2.6490   58.022   3.7560   61.251   3.7365  275.275   8.9142  282.834   8.6311 -7.558563 12.40800 
1 1 1    9    2    4 o  576.503   5.9020  254.415   5.2080  246.764   6.2341  272.089   9.4753  567.738   7.1739  596.049   10.386 -28.31073 12.62265 
1 1 1    9    2    5 o  938.336   7.8149  674.120   11.224  684.473   13.941  655.047   18.923  945.413   9.6342  924.598   13.371 20.81476 16.48019 
1 1 1    9    2    6 o  153.160   7.4905   17.960   1.7560   14.484   2.3031   22.785   2.7139  137.067   11.072  172.173   10.346 -35.10556 15.15379 
1 1 1    9    2    7 o  475.716   5.0107  173.227   3.6485  170.303   4.9962  176.568   5.3407  471.644   6.9208  480.233   7.2656 -8.588531 10.03425 
1 1 1    9    2    8 f  634.258   4.0774  307.913   3.9584  306.743   5.9846  308.822   5.2777  632.999   6.1768  635.162   5.4287 -2.162903 8.223328 
1 1 1    9    2    9 o  417.669   3.6720  133.522   2.3475  126.024   3.0053  145.258   3.7597  405.755   4.8390  435.605   5.6389 -29.85019 7.430533 
1 1 1    9    2   10 o  784.714   5.0137  471.368   6.0219  471.891   8.4721  470.835   8.5611  785.063   7.0505  784.180   7.1326 0.8836670 10.02910 
1 1 1    9    2   11 o  581.230   4.0544  258.584   3.6070  261.501   5.5453  256.444   4.7490  584.440   6.1989  578.787   5.3606 5.653259 8.195264 
1 1 1    9    2   12 o  153.611   5.3472   18.064   1.2572   17.941   1.8295   18.174   1.7307  152.862   7.8456  154.061   7.3392 -1.198273 10.74322 
1 1 1    9    2   13 o  680.451   4.7686  354.431   4.9666  355.649   8.6483  353.831   6.0668  681.464   8.2913  679.837   5.8302 1.626404 10.13589 
1 1 1    9    2   14 o  642.477   4.3622  315.963   4.2898  320.078   6.6192  312.983   5.6328  646.565   6.6884  639.396   5.7555 7.168945 8.823881 
1 1 1    9    2   15 o  317.361   3.9362   77.092   1.9120   76.646   2.7285   77.523   2.6802  316.416   5.6337  318.223   5.5026 -1.807495 7.875103 
1 1 1    9    2   16 o  739.379   4.4212  418.459   5.0035  417.732   7.0970  419.178   7.0553  738.667   6.2771  739.947   6.2294 -1.279907 8.843432 
1 1 1    9    2   17 o  172.322   5.8645   22.733   1.5468   25.757   2.4993   20.855   1.9693  183.392   8.9036  165.031   7.7960 18.36096 11.83436 
1 1 1    9    2   18 o  542.762   4.3883  225.490   3.6456  230.531   4.9697  219.617   5.3644  548.760   5.9166  535.596   6.5435 13.16406 8.821789 
1 1 1    9    2   19 o  896.605   5.7498  615.387   7.8908  611.559   11.075  619.332   11.245  893.706   8.0964  899.363   8.1689 -5.657593 11.50145 
1 1 1    9    2   20 o  1509.45   7.1514  1744.33   16.523  1765.01   23.724  1724.84   23.025  1518.10   10.210  1500.75   10.024 17.35352 14.30771 
1 1 1    9    2   21 o  671.190   4.4775  344.814   4.5999  349.863   6.6325  340.135   6.3851  676.043   6.4096  666.582   6.2581 9.461243 8.958102 
1 1 1    9    2   22 o  1047.11   5.5443  839.263   8.8860  841.128   12.637  837.438   12.497  1048.18   7.8767  1045.88   7.8067 2.298584 11.08993 
1 1 1    9    2   23 o  1196.94   6.5024  1096.69   11.913  1105.09   18.411  1090.65   15.625  1201.33   10.012  1193.54   8.5527 7.787109 13.16803 
1 1 1    9    2   24 o  992.590   6.8900  754.204   10.468  755.363   13.611  752.526   16.377  993.266   8.9529  991.304   10.793 1.962524 14.02324 
1 1 1    9    2   25 o  225.008   7.0305   38.757   2.4213   39.937   3.2933   37.369   3.5722  228.382   9.4210  220.905   10.565 7.476791 14.15529 
1 1 1    9    2   26 o  737.412   5.3162  416.225   6.0004  413.349   9.1989  418.355   7.9165  734.782   8.1792  739.255   6.9963 -4.473022 10.76327 
1 1 1    9    2   27 o  451.675   5.1498  156.156   3.5603  159.804   5.1475  152.811   4.9296  456.883   7.3607  446.777   7.2086 10.10550 10.30265 
1 1 1    9    2   28 o  461.185   5.2433  162.804   3.7013  162.051   5.2618  163.542   5.2075  460.077   7.4719  462.190   7.3610 -2.113892 10.48876 
1 1 1    9    2   29 o  581.131   5.1052  258.502   4.5410  263.005   6.5241  254.270   6.3245  586.119   7.2722  576.306   7.1698 9.813171 10.21230 
1 1 1    9    2   30 o  662.005   5.5784  335.475   5.6525  332.213   8.6425  337.913   7.4724  658.679   8.5722  664.352   7.3484 -5.672913 11.29079 
1 1 1    9    2   31 o  546.847   6.8791  228.944   5.7579  240.533   9.1833  221.438   7.3912  560.370   10.707  537.738   8.9800 22.63226 13.97404 
1 1 1    9    2   32 o  1034.96   6.4582  820.044   10.231  824.894   13.673  813.875   15.422  1037.88   8.6068  1030.83   9.7740 7.047363 13.02334 
1 1 1    9    2   33 o  1245.08   6.6569  1186.89   12.686  1205.47   18.296  1169.68   17.606  1254.53   9.5282  1235.79   9.3079 18.74011 13.32008 
1 1 1    9    2   34 o  414.886   6.7176  131.792   4.2659  137.253   6.2911  127.144   5.8041  423.293   9.7099  407.421   9.3073 15.87216 13.45021 
1 1 1    9    2   35 o  435.546   6.7612  145.252   4.5074  148.904   6.5417  141.950   6.2194  440.873   9.6941  430.466   9.4393 10.40649 13.53053 
1 1 1    9    2   36 f  720.789   6.7788  397.832   7.4787  396.636   10.799  398.934   10.367  719.485   9.8059  721.601   9.3865 -2.115784 13.57426 
1 1 1    9    2   37 o  389.951   7.6288  116.470   4.5534  113.066   6.1824  120.505   6.7315  384.071   10.517  396.469   11.093 -12.39847 15.28544 
1 1 1    9    2   38 o  129.713   18.760   13.214   3.6164   13.885   5.5465   12.718   4.7697  131.371   28.410  126.019   25.601 5.352386 38.24354 
1 1 1    9    2   39 o  627.740   5.9715  301.778   5.7376  301.453   8.1971  302.091   8.0338  627.183   8.5387  627.865   8.3596 -0.6819458 11.94964 
1 1 1    9    2   40 o  222.661   10.688   38.035   3.6427   40.621   5.2386   35.615   5.0687  229.351   15.005  214.615   15.535 14.73579 21.59870 
1 1 1    9    2   41 o  421.872   6.8715  136.365   4.4371  130.676   6.2878  142.008   6.2624  412.718   9.9535  430.287   9.5085 -17.56857 13.76533 
1 1 1    9    2   42 o  156.261   14.841   18.967   3.5071   20.189   5.1131   17.881   4.8196  160.045   21.409  150.425   21.548 9.620331 30.37517 
1 1 1    9    2   43 o  169.398   16.201   22.337   4.1495   22.021   6.3562   22.572   5.4779  166.074   25.846  169.196   21.648 -3.121933 33.71421 
1 1 1    9    2   44 o  220.724   11.360   37.550   3.8250   36.567   5.0603   38.860   5.8422  217.180   15.321  223.553   17.206 -6.373077 23.03834 
1 1 1    9    2   45 o  159.350   13.998   19.727   3.3797   26.200   4.8618   13.675   4.7013  183.128   17.560  130.173   24.494 52.95482 30.13860 
1 1 1    9    2   46 o  476.044   6.6399  173.763   4.8381  180.009   6.9885  168.014   6.7047  484.058   9.4322  467.664   9.3664 16.39444 13.29273 
1 1 1    9    2   47 o   81.009   24.327   5.2277   3.2587   6.6748   4.7001   3.8882   4.5219   92.123   29.480   77.696   28.723 14.42749 41.15925 
1 1 1    9    2   48 o  155.475   18.576   19.093   4.3332   26.591   6.4645   12.975   5.8392  182.285   23.732  124.715   30.777 57.56943 38.86430 
1 1 1    9    2   49 o  345.850   8.2519   91.914   4.3683   94.674   6.0188   88.842   6.3499  350.400   11.222  339.199   12.230 11.20071 16.59879 
1 1 1    9    2   50 o  129.873   19.313   13.488   3.7223   18.593   5.6149   9.4860   4.9718  150.986   25.183  106.611   29.479 44.37560 38.77138 
1 1 1    9    2   51 o  121.825   19.850   11.945   3.5740   12.270   5.1900   11.652   4.9289  120.979   28.497  118.051   27.746 2.927872 39.77364 
1 1 1    9    2   52 o  165.527   15.257   21.509   3.8221   27.253   5.6143   16.547   5.2180  184.889   20.166  141.932   24.929 42.95705 32.06395 
1 1 1    9    2   53 o   70.017   25.880   3.2574   3.6707   1.3495   5.3078   5.0063   5.0819   70.440   29.444   83.745   30.531 -13.30576 42.41538 
1 1 1    9    2   54 o  136.073   23.314   15.200   4.6810   16.400   7.1662   14.307   6.1821  136.990   34.264  128.835   31.592 8.155487 46.60547 
1 1 1    9    2   55 o  111.011   25.773   10.384   4.2951   8.7785   5.5557   12.769   6.7713  101.811   31.992  120.533   34.777 -18.72256 47.25336 
1 1 1    9    2   56 o  148.852   18.536   17.789   4.1317   19.595   5.9404   16.096   5.7504  152.974   26.319  137.454   28.275 15.51970 38.62918 
1 1 1    9    2   57 o  278.216   10.920   60.024   4.6501   54.526   6.6203   65.378   6.5329  262.471   16.564  288.407   14.849 -25.93558 22.24557 
1 1 1    9    2   58 o  133.853   21.462   14.782   4.2486   9.8173   5.8876   20.176   6.1371  105.459   32.900  153.906   27.038 -48.44715 42.58503 
1 1 1    9    2   59 o  125.596   25.375   13.506   4.7103   10.206   6.8806   16.417   6.4617  106.425   35.761  135.141   31.774 -28.71564 47.83702 
1 1 1    9    2   60 o  186.131   14.792   27.555   4.1794   29.310   5.6358   25.410   6.2300  189.297   19.741  173.457   24.118 15.84052 31.16709 
1 1 1    9    2   61 o   40.973   19.910  -6.0932   3.9471  -2.8510   6.0919  -8.4391   5.1819   60.992   28.117   45.772   22.367 15.22018 35.92859 
1 1 1    9    2   62 o   64.033   24.935   2.6729   3.5178  -5.1988   5.0656   10.005   4.8890   49.939   23.821  103.999   29.404 -54.06020 37.84211 
1 1 1    9    2   63 o   72.301   25.033   4.4081   3.3764   3.9945   4.7452   4.8322   4.8053   73.614   28.878   77.316   29.390 -3.702110 41.20305 
1 1 1    9    2   64 f   44.128   21.027  -3.9704   3.9248   4.2842   5.5271 -12.3670   5.5744   76.028   30.715   42.420   21.165 33.60781 37.30062 
1 1 1    9    3    0 o  937.162   9.3243  672.542   13.372  672.542   13.372  672.542   13.372  937.162   9.3243  937.162   9.3243 0.000000 0.000000 
1 1 1    9    3    1 f  693.230   7.6786  367.925   8.1476  376.840   11.766  359.711   11.294  701.440   10.959  685.322   10.766 16.11804 15.36256 
1 1 1    9    3    2 o  181.244   9.4374   25.223   2.6090   25.223   2.6090   0.0000   0.0000  181.244   9.4374  ?   ?  0.000000 9.437386 
1 1 1    9    3    3 o  512.241   9.7204  200.937   7.6213  200.937   7.6213   0.0000   0.0000  512.241   9.7204  ?   ?  0.000000 9.720352 
1 1 1    9    3    4 o  505.034   7.0123  195.266   5.4206  202.537   7.8408  188.608   7.5022  514.264   9.9610  496.268   9.8765 17.99600 14.02736 
1 1 1    9    3    5 o  377.196   5.4121  108.909   3.1247  108.729   3.8260  109.269   5.4147  376.866   6.6327  377.741   9.3651 -0.8752136 11.47595 
1 1 1    9    3    6 o  577.032   7.3568  254.924   6.4977  247.431   8.9112  263.430   9.4948  568.383   10.243  586.457   10.577 -18.07410 14.72413 
1 1 1    9    3    7 o  967.999   7.0100  717.385   10.386  723.193   14.737  711.652   14.641  971.729   9.9079  963.943   9.9231 7.786194 14.02260 
1 1 1    9    3    8 o  499.721   4.0315  191.140   3.0836  185.286   4.2639  197.559   4.4649  491.978   5.6622  508.009   5.7421 -16.03116 8.064281 
1 1 1    9    3    9 o  1042.99   6.0056  832.793   9.5876  800.501   12.955  871.893   14.256  1022.43   8.2784  1067.01   8.7286 -44.58350 12.02999 
1 1 1    9    3   10 o  648.302   4.2068  321.710   4.1744  321.429   6.3674  321.922   5.5282  647.950   6.4203  648.477   5.5696 -0.5270386 8.499421 
1 1 1    9    3   11 o  181.230   4.4656   25.141   1.2387   25.442   1.9845   24.949   1.5856  182.285   7.1126  180.526   5.7382 1.758835 9.138723 
1 1 1    9    3   12 o  811.566   4.7839  504.177   5.9426  502.156   7.8683  506.861   9.0668  809.869   6.3474  813.604   7.2807 -3.734802 9.659098 
1 1 1    9    3   13 o  505.831   3.7675  195.845   2.9170  195.003   4.1485  196.668   4.1023  504.707   5.3701  506.858   5.2878 -2.151581 7.536508 
1 1 1    9    3   14 o  660.694   4.7643  334.146   4.8180  334.745   8.4180  333.855   5.8755  661.135   8.3186  660.370   5.8128 0.7650146 10.14827 
1 1 1    9    3   15 o  212.105   4.6896   34.438   1.5225   34.525   2.3995   34.379   1.9698  212.341   7.3826  211.908   6.0730 0.4327545 9.559517 
1 1 1    9    3   16 o  381.673   4.4206  111.507   2.5825  112.603   4.4611  110.954   3.1672  383.478   7.6003  380.709   5.4351 2.769653 9.343697 
1 1 1    9    3   17 o  389.507   4.2251  116.128   2.5189  118.017   3.4258  113.904   3.7166  392.638   5.7003  385.724   6.2951 6.914368 8.492414 
1 1 1    9    3   18 o  637.049   4.5412  310.639   4.4281  319.512   6.0396  300.326   6.5115  646.040   6.1077  626.322   6.7922 19.71826 9.134491 
1 1 1    9    3   19 o  911.431   5.7962  635.905   8.0861  637.750   11.462  634.076   11.409  912.641   8.2051  910.010   8.1910 2.631226 11.59385 
1 1 1    9    3   20 o  694.776   4.8143  369.484   5.1197  370.373   6.8080  368.327   7.7673  695.571   6.3945  693.618   7.3161 1.953125 9.716709 
1 1 1    9    3   21 o  906.391   5.0847  628.838   7.0542  629.672   10.051  628.028   9.9029  906.920   7.2406  905.739   7.1431 1.181030 10.17108 
1 1 1    9    3   22 o  512.503   4.3577  201.039   3.4184  208.356   5.0235  194.728   4.6650  521.717   6.2907  504.371   6.0427 17.34677 8.722824 
1 1 1    9    3   23 o  691.336   4.9791  365.827   5.2688  377.414   8.3751  358.238   6.7781  702.132   7.7929  684.096   6.4732 18.03534 10.13074 
1 1 1    9    3   24 f  1262.74   8.0189  1220.72   15.499  1243.77   20.486  1189.88   23.701  1274.45   10.502  1246.39   12.423 28.06201 16.26757 
1 1 1    9    3   25 o  1402.87   6.8763  1506.55   14.765  1540.29   21.458  1476.20   20.349  1418.30   9.8842  1388.50   9.5747 29.79724 13.76128 
1 1 1    9    3   26 o  783.893   5.3992  470.353   6.4782  461.847   9.8772  476.774   8.5819  776.686   8.3084  789.179   7.1046 -12.49219 10.93184 
1 1 1    9    3   27 o  304.531   6.0246   70.990   2.8082   72.200   4.1593   69.976   3.8068  307.078   8.8493  302.320   8.2267 4.757294 12.08253 
1 1 1    9    3   28 o  597.756   5.0732  273.501   4.6417  274.000   6.6913  273.038   6.4443  598.250   7.3073  597.205   7.0498 1.044739 10.15368 
1 1 1    9    3   29 o  422.808   5.5184  136.841   3.5713  140.027   5.1993  133.995   4.9139  427.655   7.9430  418.348   7.6740 9.307190 11.04450 
1 1 1    9    3   30 o  672.386   6.0402  346.093   6.2164  348.326   8.8918  343.958   8.6941  674.460   8.6132  670.223   8.4749 4.236511 12.08354 
1 1 1    9    3   31 o  484.803   6.4970  179.934   4.8211  186.560   7.0216  174.025   6.6312  493.563   9.2945  476.701   9.0882 16.86261 12.99935 
1 1 1    9    3   32 o  855.909   6.0608  560.828   7.9401  564.296   10.609  556.411   11.973  858.448   8.0738  852.362   9.1770 6.086487 12.22307 
1 1 1    9    3   33 o  852.213   5.7177  555.987   7.4582  567.503   10.838  545.628   10.279  860.856   8.2252  844.118   7.9559 16.73834 11.44337 
1 1 1    9    3   34 o  288.316   8.3943   63.662   3.7045   63.533   5.4024   63.777   5.0894  287.910   12.259  288.487   11.526 -0.5768433 16.82644 
1 1 1    9    3   35 o  294.203   8.4487   66.294   3.8046   65.730   5.5859   66.782   5.1962  292.815   12.463  295.186   11.501 -2.371033 16.95859 
1 1 1    9    3   36 o  634.691   6.9019  308.475   6.7051  311.980   9.9478  305.558   9.0767  638.065   10.186  631.524   9.3901 6.540649 13.85364 
1 1 1    9    3   37 o  256.612   10.150   50.470   3.9867   48.339   5.4906   52.846   5.7980  250.543   14.378  261.984   14.516 -11.44150 20.43099 
1 1 1    9    3   38 o  358.103   7.9503   98.245   4.3577   92.380   6.6721  102.607   5.7547  346.981   12.563  365.840   10.277 -18.85913 16.23086 
1 1 1    9    3   39 o  331.630   8.0067   84.271   4.0642   87.809   6.0106   81.290   5.5165  338.295   11.608  325.533   11.071 12.76208 16.04112 
1 1 1    9    3   40 o  617.754   5.9824  292.286   5.6566  296.668   8.1818  288.274   7.8292  622.110   8.5924  613.274   8.3405 8.835083 11.97466 
1 1 1    9    3   41 o  340.445   7.7151   88.833   4.0203   92.442   5.9365   85.775   5.4640  347.012   11.177  334.310   10.678 12.70233 15.45769 
1 1 1    9    3   42 o   89.685   24.599   6.4577   3.4783   8.8359   5.3255   4.6886   4.5933  105.109   30.990   82.454   29.152 22.65545 42.54724 
1 1 1    9    3   43 f  435.900   7.6362  145.682   5.0949  145.493   7.2709  145.865   7.1413  435.203   10.915  435.790   10.706 -0.5872192 15.28915 
1 1 1    9    3   44 o  273.485   10.967   57.482   4.5907   63.331   5.6484   46.101   7.8791  286.836   12.865  242.591   21.440 44.24500 25.00389 
1 1 1    9    3   45 o  263.406   9.4667   53.285   3.8168   45.244   5.4140   61.231   5.3816  241.687   14.705  282.002   12.468 -40.31490 19.27906 
1 1 1    9    3   46 o  285.670   8.9140   62.671   3.8977   58.487   5.5293   66.804   5.4952  275.417   13.116  294.498   12.191 -19.08102 17.90673 
1 1 1    9    3   47 o  176.316   13.059   24.117   3.4993   16.350   5.0028   31.557   4.8966  142.461   23.781  201.196   16.033 -58.73491 28.68123 
1 1 1    9    3   48 o  238.048   12.450   43.847   4.5205   40.380   6.8426   46.533   6.0217  226.460   19.944  244.342   16.193 -17.88217 25.68993 
1 1 1    9    3   49 o   85.734   25.226   5.9553   3.5317   6.4014   4.7893   5.4236   5.2288   90.431   29.820   86.916   31.064 3.514305 43.06004 
1 1 1    9    3   50 o  188.948   13.358   27.776   3.8383   38.710   5.9845   20.135   5.0029  221.941   17.765  158.622   21.131 63.31961 27.60703 
1 1 1    9    3   51 o   93.302   24.219   7.1903   3.4890   5.1190   4.9874   9.1753   4.8826   84.369   30.319  104.741   29.304 -20.37209 42.16573 
1 1 1    9    3   52 o   82.711   25.758   5.5126   3.6105   10.226   5.2048   1.1405   5.0127  109.995   30.059   68.276   28.583 41.71944 41.47905 
1 1 1    9    3   53 o  214.681   11.956   35.792   3.9130   37.919   5.8169   34.033   5.2884  219.218   17.481  207.869   16.764 11.34946 24.22025 
1 1 1    9    3   54 o  133.340   23.141   14.599   4.5516   21.506   6.8774   9.2152   6.0716  159.729   29.206  104.600   33.510 55.12890 44.45125 
1 1 1    9    3   55 o  292.536   10.663   66.203   4.7745   69.654   6.2756   61.460   7.3570  299.019   13.711  278.936   17.317 20.08286 22.08826 
1 1 1    9    3   56 o   79.616   26.989   4.9892   3.9195  -4.3504   5.5883   14.032   5.4988   56.495   26.346  127.899   28.784 -71.40403 39.02052 
1 1 1    9    3   57 o  248.265   11.933   47.924   4.5344   52.841   6.3296   42.739   6.4990  258.592   16.071  231.258   18.516 27.33391 24.51744 
1 1 1    9    3   58 o  271.988   11.030   57.469   4.5921   48.306   6.5018   66.590   6.4867  246.135   17.370  291.180   14.554 -45.04514 22.66115 
1 1 1    9    3   59 o  256.495   12.981   51.648   5.0796   50.295   7.4166   52.842   6.9712  249.154   19.606  256.614   17.860 -7.460220 26.52116 
1 1 1    9    3   60 o  245.594   11.669   47.128   4.3865   50.158   5.9138   43.423   6.5405  251.003   15.468  231.478   18.617 19.52521 24.20474 
1 1 1    9    3   61 o   59.862   25.190   1.1132   3.9253  -4.5089   5.9980   5.3251   5.1915   57.146   26.857   82.103   30.692 -24.95763 40.78322 
1 1 1    9    3   62 o  160.899   15.246   20.873   3.7100   21.650   5.3190   20.137   5.1774  159.434   22.415  153.474   22.727 5.959396 31.92097 
1 1 1    9    3   63 o   82.059   24.991   6.0168   3.4212  -0.9076   4.7351   13.580   4.9488   56.980   25.688  121.744   27.238 -64.76453 37.44017 
1 1 1    9    3   64 o   54.194   24.035  -0.1909   3.9676  -6.3520   5.3952   7.0652   5.8551   49.133   23.732   87.107   32.588 -37.97441 40.31366 
1 1 1    9    4    0 o  869.413   8.8403  578.816   11.761  578.816   11.761  578.816   11.761  869.413   8.8403  869.413   8.8403 0.000000 0.000000 
1 1 1    9    4    1 o  173.453   6.4655   23.032   1.7165   20.978   2.4148   25.129   2.4406  165.235   9.5891  181.156   8.8017 -15.92148 13.01614 
1 1 1    9    4    2 f  349.285   4.8986   93.384   2.6189   92.812   3.1439   94.681   4.7336  348.201   5.8989  351.638   8.7948 -3.437500 10.58994 
1 1 1    9    4    3 o  459.981   6.7292  161.978   4.7377  170.820   6.8946  154.068   6.5213  472.294   9.5373  448.539   9.4987 23.75568 13.46054 
1 1 1    9    4    4 o  241.273   10.029   44.583   3.7036   44.583   3.7036   0.0000   0.0000  241.273   10.029  ?   ?  0.000000 10.02885 
1 1 1    9    4    5 o  1006.49   10.120  775.867   15.591  775.867   15.591   0.0000   0.0000  1006.49   10.120  ?   ?  0.000000 10.12032 
1 1 1    9    4    6 o  718.081   8.2239  394.831   9.0390  395.851   12.695  393.781   12.873  718.830   11.539  716.935   11.731 1.894531 16.45432 
1 1 1    9    4    7 o  456.810   4.9966  159.734   3.4936  158.856   4.9447  160.610   4.9368  455.507   7.0921  458.016   7.0420 -2.509247 9.994374 
1 1 1    9    4    8 o  844.245   5.1654  545.600   6.6748  554.943   9.6121  536.899   9.2760  851.343   7.3764  837.394   7.2371 13.94836 10.33376 
1 1 1    9    4    9 o  409.961   3.9530  128.643   2.4805  131.163   3.5422  126.219   3.4747  413.927   5.5909  406.052   5.5907 7.875916 7.906619 
1 1 1    9    4   10 o  582.976   4.3820  260.147   3.9101  259.825   5.5136  260.471   5.5460  582.565   6.1834  583.288   6.2119 -0.7229614 8.764823 
1 1 1    9    4   11 o  327.049   4.0776   81.872   2.0412   78.584   2.8649   85.261   2.9089  320.389   5.8420  333.725   5.6948 -13.33572 8.158442 
1 1 1    9    4   12 o  390.633   4.0989  116.802   2.4508  118.856   3.5625  114.956   3.3769  394.017   5.9071  387.505   5.6934 6.511932 8.204132 
1 1 1    9    4   13 o  421.448   3.9195  135.955   2.5284  135.832   3.9020  136.043   3.3195  421.215   6.0522  421.563   5.1445 -0.3481445 7.943284 
1 1 1    9    4   14 o  338.747   4.0703   87.834   2.1104   89.128   3.3896   87.015   2.6969  341.191   6.4906  337.147   5.2262 4.044556 8.333076 
1 1 1    9    4   15 f  104.342   7.5538   8.3802   1.1982   6.7584   1.8732   9.5035   1.5589   92.919   13.571  111.005   9.2596 -18.08611 16.42894 
1 1 1    9    4   16 o  556.681   4.2463  237.204   3.6181  243.169   5.6221  232.987   4.7271  563.575   6.5174  551.678   5.5981 11.89709 8.591612 
1 1 1    9    4   17 o  378.096   4.5078  109.425   2.6088  110.143   3.7197  108.730   3.6597  379.302   6.4070  376.862   6.3444 2.439758 9.016732 
1 1 1    9    4   18 o  516.043   4.1094  203.830   3.2459  201.334   4.6609  206.180   4.5230  512.838   5.9377  518.979   5.6939 -6.140381 8.226583 
1 1 1    9    4   19 o  298.553   5.1023   68.228   2.3316   69.129   3.3103   67.340   3.2846  300.492   7.1973  296.577   7.2357 3.915405 10.20570 
1 1 1    9    4   20 o  517.422   4.9023  204.925   3.8825  206.078   5.5316  203.806   5.4508  518.835   6.9655  515.968   6.9018 2.867126 9.805794 
1 1 1    9    4   21 o  803.176   4.7867  493.764   5.8846  494.540   8.3942  493.014   8.2519  803.752   6.8232  802.514   6.7179 1.237427 9.575281 
1 1 1    9    4   22 o  1172.59   5.9692  1052.49   10.714  1054.16   15.219  1050.84   15.084  1173.40   8.4739  1171.56   8.4117 1.841797 11.93998 
1 1 1    9    4   23 o  635.373   5.2787  309.002   5.1336  306.288   7.3524  311.584   7.1710  632.526   7.5942  637.977   7.3435 -5.451111 10.56407 
1 1 1    9    4   24 o  512.549   4.8661  201.078   3.8176  196.270   5.1062  207.173   5.7483  506.357   6.5883  520.220   7.2192 -13.86227 9.773498 
1 1 1    9    4   25 o  1189.95   6.1327  1083.89   11.170  1084.37   15.864  1083.42   15.730  1190.09   8.7088  1189.57   8.6393 0.5187988 12.26709 
1 1 1    9    4   26 o  287.515   6.2954   63.279   2.7705   59.106   4.4214   65.977   3.5550  277.819   10.397  293.561   7.9116 -15.74219 13.06522 
1 1 1    9    4   27 o  258.533   6.5765   51.166   2.6024   51.259   3.7925   51.084   3.5776  258.729   9.5767  258.296   9.0492 0.4328003 13.17577 
1 1 1    9    4   28 o  833.646   5.3000  531.963   6.7629  537.344   9.7633  526.998   9.3767  837.772   7.6138  829.677   7.3836 8.095032 10.60602 
1 1 1    9    4   29 o  670.293   5.8863  343.932   6.0392  334.674   8.5101  353.324   8.5716  661.128   8.4096  679.305   8.2438 -18.17706 11.77632 
1 1 1    9    4   30 o  500.947   5.9073  192.104   4.5295  188.952   6.0803  196.033   6.7897  496.768   7.9966  505.967   8.7672 -9.198700 11.86626 
1 1 1    9    4   31 o  615.963   5.6980  290.443   5.3721  291.697   8.3569  289.560   7.0132  617.180   8.8464  614.970   7.4506 2.209900 11.56591 
1 1 1    9    4   32 o  391.586   7.0475  117.403   4.2241  125.504   5.7883  108.173   6.1783  404.806   9.3419  375.773   10.742 29.03302 14.23573 
1 1 1    9    4   33 o  659.685   5.6257  333.151   5.6805  328.156   8.1926  337.775   7.8831  654.616   8.1764  664.161   7.7545 -9.544983 11.26886 
1 1 1    9    4   34 o  370.289   7.0786  104.988   4.0120  107.704   5.9310  102.698   5.4474  374.941   10.335  366.145   9.7200 8.795746 14.18742 
1 1 1    9    4   35 o  1033.00   6.1443  817.003   9.7149  805.316   13.707  828.799   13.771  1025.36   8.7339  1040.21   8.6489 -14.85071 12.29169 
1 1 1    9    4   36 o  702.105   7.3726  377.523   7.9230  373.041   10.727  382.903   11.753  697.719   10.045  706.805   10.863 -9.086121 14.79557 
1 1 1    9    4   37 o  834.394   5.8967  533.092   7.5310  546.789   10.966  520.865   10.361  844.816   8.4803  824.573   8.2089 20.24304 11.80267 
1 1 1    9    4   38 o  511.004   6.6167  199.991   5.1753  206.016   8.2958  196.151   6.6219  518.358   10.456  505.950   8.5508 12.40787 13.50704 
1 1 1    9    4   39 o  311.283   8.5919   74.263   4.0937   75.725   6.4453   73.275   5.3000  314.010   13.410  309.049   11.204 4.960419 17.47461 
1 1 1    9    4   40 o  145.785   15.053   16.519   3.3107   15.186   4.9195   17.622   4.4759  138.030   24.166  149.786   20.024 -11.75629 31.38345 
1 1 1    9    4   41 o  276.992   8.5172   58.826   3.6110   61.373   5.2784   56.585   4.9509  282.655   12.200  271.427   11.917 11.22778 17.05466 
1 1 1    9    4   42 o  123.913   19.612   12.161   3.5959   11.742   4.9672   12.623   5.2125  120.251   27.575  124.669   28.000 -4.418480 39.29859 
1 1 1    9    4   43 o  401.059   7.2701  123.307   4.4629  132.491   7.0445  117.149   5.7681  415.265   11.083  390.667   9.6463 24.59833 14.69293 
1 1 1    9    4   44 o   50.862   22.438  -0.9510   3.4139  -4.2685   4.5155   3.4755   5.2159   50.450   23.579   79.422   30.517 -28.97166 38.56529 
1 1 1    9    4   45 f  120.113   17.837   11.414   3.1797   9.3949   4.5317   13.372   4.4627  107.192   27.489  128.895   23.485 -21.70271 36.15529 
1 1 1    9    4   46 o  343.582   7.6985   90.580   4.0486   81.434   5.8095   99.216   5.6452  325.224   11.670  359.223   10.267 -33.99945 15.54385 
1 1 1    9    4   47 o  382.955   7.3427  112.535   4.3040  106.293   6.2456  118.181   5.9396  371.574   10.981  392.019   9.8987 -20.44434 14.78428 
1 1 1    9    4   48 o  182.513   16.832   26.097   4.6493   21.729   6.7750   29.985   6.3919  162.955   28.183  194.283   21.875 -31.32758 35.67587 
1 1 1    9    4   49 o  303.694   8.7283   70.913   4.0573   72.373   5.8201   69.533   5.6591  306.078   12.423  300.035   12.323 6.043182 17.49791 
1 1 1    9    4   50 o  335.314   8.7252   86.483   4.4781   91.474   6.8917   82.836   5.8914  343.773   13.097  327.499   11.753 16.27441 17.59743 
1 1 1    9    4   51 o   98.121   23.625   7.9504   3.5057   8.0328   5.0052   7.8711   4.9117   98.724   30.259   97.793   29.975 0.9315643 42.59220 
1 1 1    9    4   52 o   40.897   19.548  -4.4859   3.4478  -3.1989   4.9226  -5.7253   4.8306   55.183   25.378   49.144   23.392 6.039330 34.51475 
1 1 1    9    4   53 o  173.711   14.289   23.633   3.7655   16.339   5.2044   31.645   5.4548  140.698   25.087  199.936   18.018 -59.23811 30.88670 
1 1 1    9    4   54 o  100.925   27.075   8.5917   4.2691   6.1739   6.1114   10.896   5.9662   91.402   33.456  112.472   32.700 -21.06953 46.78232 
1 1 1    9    4   55 o  233.343   12.689   42.432   4.5151   38.119   5.7411   49.425   7.3099  219.458   17.230  249.041   19.328 -29.58246 25.89289 
1 1 1    9    4   56 o  220.576   12.462   37.946   4.1902   37.309   5.9886   38.556   5.8650  216.421   18.248  220.357   17.534 -3.936417 25.30688 
1 1 1    9    4   57 o   68.905   26.577   2.9075   3.9669   2.3521   5.5739   3.4776   5.6470   74.105   30.501   78.389   31.262 -4.283585 43.67642 
1 1 1    9    4   58 o  111.895   24.030   10.605   3.9927   12.559   5.6463   8.6508   5.6467  119.045   30.765   99.746   32.354 19.29859 44.64622 
1 1 1    9    4   59 o  270.422   11.132   56.940   4.6076   55.219   6.1588   59.128   6.9438  263.900   15.313  272.192   16.748 -8.291260 22.69326 
1 1 1    9    4   60 o  143.415   19.206   16.879   4.1101   20.817   5.5693   12.169   6.0907  156.772   23.971  114.701   32.950 42.07143 40.74722 
1 1 1    9    4   61 o  157.111   17.607   20.101   4.1613   19.265   6.2544   20.764   5.5741  146.789   28.865  155.809   24.155 -9.019440 37.63882 
1 1 1    9    4   62 o   99.889   24.003   8.7982   3.6242   9.8985   5.1319   7.7035   5.1188  102.776   30.454   91.739   30.844 11.03753 43.34501 
1 1 1    9    4   63 o  128.936   18.495   13.909   3.5455   11.762   4.8606   16.351   5.1832  112.262   28.296  134.750   26.073 -22.48768 38.47694 
1 1 1    9    4   64 o  172.900   24.516   26.569   6.3063   0.0000   0.0000   26.569   6.3063  ?   ?   172.900   24.516 0.000000 24.51604 
1 1 1    9    5    0 o  615.161   7.1780  289.784   6.7566  289.784   6.7566  289.784   6.7566  615.161   7.1780  615.161   7.1780 0.000000 0.000000 
1 1 1    9    5    1 o  1005.48   6.9780  773.999   10.739  745.137   14.573  808.304   15.887  986.401   9.6520  1027.33   10.104 -40.92682 13.97296 
1 1 1    9    5    2 o  819.659   8.6486  514.447   10.851  503.896   15.004  526.014   15.710  811.001   12.087  828.587   12.387 -17.58539 17.30713 
1 1 1    9    5    3 o  295.822   4.9921   66.985   2.2604   62.871   2.6001   79.716   4.5738  286.583   5.9274  322.639   9.2617 -36.05542 10.99611 
1 1 1    9    5    4 o  613.519   6.0137  288.147   5.6473  281.966   6.6983  303.336   10.501  606.867   7.2111  629.285   10.902 -22.41754 13.07125 
1 1 1    9    5    5 o  1195.28   9.4400  1094.15   17.271  1113.27   21.542  1059.74   28.896  1205.45   11.675  1175.56   16.059 29.89148 19.85466 
1 1 1    9    5    6 o  732.163   11.826  410.722   13.253  410.722   13.253   0.0000   0.0000  732.163   11.826  ?   ?  0.000000 11.82631 
1 1 1    9    5    7 o  438.312   5.8274  147.073   3.9096  162.118   5.0824  125.268   6.1186  460.149   7.2161  404.408   9.8847 55.74164 12.23847 
1 1 1    9    5    8 o  708.489   5.1998  384.248   5.6388  384.860   7.2209  383.291   9.0271  708.998   6.6539  707.471   8.3362 1.526978 10.66617 
1 1 1    9    5    9 o  774.854   5.4831  459.620   6.5030  459.314   8.3359  460.097   10.394  774.526   7.0315  775.089   8.7616 -0.5621948 11.23417 
1 1 1    9    5   10 o  565.593   6.1557  244.908   5.3290  244.908   5.3290   0.0000   0.0000  565.593   6.1557  ?   ?  0.000000 6.155674 
1 1 1    9    5   11 o  600.368   4.8711  275.915   4.4763  270.795   5.7519  283.777   7.1279  594.725   6.3187  608.758   7.6498 -14.03333 9.921937 
1 1 1    9    5   12 o  274.670   4.6268   57.750   1.9452   61.719   2.6842   53.361   2.8228  283.929   6.1765  263.990   6.9860 19.93872 9.324856 
1 1 1    9    5   13 o  268.836   4.9105   55.324   2.0206   52.016   3.3142   57.282   2.5492  260.618   8.3081  273.533   6.0886 -12.91568 10.30031 
1 1 1    9    5   14 o  498.067   4.8895  189.895   3.7276  182.303   8.9382  191.494   4.1012  487.730   11.973  500.148   5.3573 -12.41739 13.11684 
1 1 1    9    5   15 f  163.359   5.4934   20.429   1.3736   21.935   2.2471   19.530   1.7356  169.014   8.7159  159.712   7.0996 9.301941 11.24152 
1 1 1    9    5   16 o  384.012   4.4785  112.877   2.6324  113.539   3.8047  112.268   3.6459  385.102   6.4547  382.945   6.2201 2.156219 8.963991 
1 1 1    9    5   17 o  850.952   4.7862  554.279   6.2340  560.381   8.9439  548.515   8.6937  855.542   6.8300  846.441   6.7102 9.100830 9.574739 
1 1 1    9    5   18 o  825.116   5.0459  521.135   6.3727  527.691   9.8292  516.381   8.3703  830.187   7.7352  821.288   6.6585 8.898621 10.20636 
1 1 1    9    5   19 o  440.279   4.7404  148.375   3.1946  152.928   4.5042  143.766   4.5315  446.952   6.5840  433.352   6.8317 13.60037 9.487965 
1 1 1    9    5   20 o  350.573   5.2074   94.074   2.7943   87.685   3.9838  100.260   3.9203  338.427   7.6907  361.891   7.0774 -23.46378 10.45163 
1 1 1    9    5   21 o  342.218   4.8253   89.640   2.5275   92.779   4.0745   87.677   3.2225  348.123   7.6466  338.434   6.2208 9.688751 9.857414 
1 1 1    9    5   22 o  1256.45   7.2534  1208.51   13.949  1196.76   19.516  1220.79   19.945  1250.15   10.199  1262.63   10.320 -12.48169 14.50977 
1 1 1    9    5   23 o  855.404   5.4032  560.078   7.0744  559.492   10.882  560.507   9.3101  854.865   8.3168  855.683   7.1084 -0.8175659 10.94062 
1 1 1    9    5   24 o  450.381   4.8899  155.258   3.3709  154.889   4.5733  155.697   4.9881  449.821   6.6423  450.984   7.2261 -1.162506 9.815070 
1 1 1    9    5   25 o  876.425   5.2011  587.941   6.9772  580.821   9.8477  595.118   9.8870  871.037   7.3864  881.694   7.3261 -10.65686 10.40338 
1 1 1    9    5   26 o  1119.61   6.3804  959.562   10.934  979.440   17.229  946.156   14.149  1130.96   9.9525  1111.67   8.3152 19.28687 12.96905 
1 1 1    9    5   27 o  666.280   4.9617  339.796   5.0600  343.162   7.2927  336.671   7.0266  669.519   7.1164  663.162   6.9224 6.357422 9.927854 
1 1 1    9    5   28 o  886.724   5.7641  601.882   7.8233  605.493   12.040  599.243   10.292  889.250   8.8457  884.708   7.6004 4.542053 11.66244 
1 1 1    9    5   29 o  669.138   5.4495  342.737   5.5814  351.311   8.7316  336.813   7.2577  677.358   8.4218  663.280   7.1488 14.07782 11.04680 
1 1 1    9    5   30 o  920.747   6.0545  648.992   8.5328  643.883   11.321  655.712   12.984  917.018   8.0654  925.337   9.1671 -8.319580 12.21012 
1 1 1    9    5   31 f  702.114   5.7359  377.373   6.1643  384.049   9.7175  372.877   7.9739  708.162   8.9651  697.856   7.4651 10.30676 11.66621 
1 1 1    9    5   32 o  221.975   12.161   37.871   4.1160   32.558   6.3418   41.737   5.4102  204.870   20.499  232.796   15.268 -27.92531 25.56020 
1 1 1    9    5   33 o  146.624   14.382   16.643   3.1862   23.590   4.8225   11.261   4.2446  174.338   18.348  118.850   24.156 55.48833 30.33428 
1 1 1    9    5   34 o  261.178   8.9722   52.248   3.5868   45.068   5.2936   58.343   4.8770  241.990   14.356  275.915   11.548 -33.92531 18.42406 
1 1 1    9    5   35 o  346.323   8.2172   91.863   4.3559   86.042   7.4041   94.944   5.3867  334.900   14.444  352.018   9.9975 -17.11731 17.56635 
1 1 1    9    5   36 o  167.941   15.103   21.823   3.8407   22.013   5.0461   21.561   5.9213  167.987   20.019  165.534   24.076 2.453369 31.31178 
1 1 1    9    5   37 o  540.341   6.1368  223.575   5.0755  222.036   7.3921  224.947   6.9813  538.305   8.9716  541.862   8.4174 -3.556641 12.30209 
1 1 1    9    5   38 o  682.764   6.2646  357.008   6.5468  354.554   10.293  358.675   8.4843  680.067   9.8880  684.199   8.1015 -4.132080 12.78309 
1 1 1    9    5   39 o  279.283   9.0238   59.791   3.8575   60.155   6.0834   59.545   4.9886  279.432   14.271  278.555   11.700 0.8768005 18.45415 
1 1 1    9    5   40 o  223.962   10.023   38.475   3.4360   39.235   5.0587   37.825   4.6816  225.388   14.745  221.400   13.885 3.988251 20.25351 
1 1 1    9    5   41 o  422.716   6.9204  136.922   4.4777  135.220   6.8221  138.210   5.9349  419.729   10.619  424.505   9.1340 -4.776031 14.00686 
1 1 1    9    5   42 o  294.888   8.9841   66.708   4.0551   67.979   5.3922   65.053   6.1523  297.427   11.844  290.740   13.825 6.686096 18.20491 
1 1 1    9    5   43 o   45.507   20.795  -2.1273   3.2339  -3.1759   4.9414  -1.3418   4.2771   56.215   25.695   56.393   24.985 -0.1778336 35.83925 
1 1 1    9    5   44 o  522.855   6.7941  209.570   5.4373  214.628   7.2236  202.958   8.2588  528.807   8.9246  513.947   10.499 14.86047 13.77931 
1 1 1    9    5   45 o  403.407   6.8856  124.784   4.2516  131.568   6.1630  118.624   5.8729  413.834   9.7296  392.944   9.7645 20.88937 13.78446 
1 1 1    9    5   46 o  422.983   6.8362  137.213   4.4260  146.707   6.5676  129.314   5.9907  436.884   9.8213  410.221   9.5408 26.66373 13.69257 
1 1 1    9    5   47 o  280.495   9.5911   60.491   4.1178   64.930   6.9500   58.090   5.1115  289.060   15.768  274.487   12.166 14.57275 19.91586 
1 1 1    9    5   48 o   85.251   25.631   5.8406   3.6157   1.9847   4.7030   11.414   5.6542   70.226   28.346  116.924   31.065 -46.69834 42.05401 
1 1 1    9    5   49 o  167.439   13.479   21.833   3.4253   26.214   5.0205   18.018   4.6852  182.354   18.232  150.079   20.968 32.27470 27.78595 
1 1 1    9    5   50 o  126.033   19.414   12.729   3.6249   18.370   5.6430   8.7656   4.7299  149.877   25.512  102.643   28.887 47.23449 38.53975 
1 1 1    9    5   51 o  230.852   10.914   41.135   3.8565   41.982   5.5874   40.364   5.3295  231.617   15.856  227.229   15.415 4.388489 22.11386 
1 1 1    9    5   52 o  113.814   21.050   10.547   3.5320   10.829   5.0829   10.283   4.9116  113.194   29.158  110.405   28.773 2.788589 40.96414 
1 1 1    9    5   53 o  182.034   14.796   25.983   4.0870   29.647   6.2286   23.212   5.4160  192.076   21.558  169.798   21.308 22.27798 30.31163 
1 1 1    9    5   54 o  227.046   13.157   40.194   4.5528   33.385   6.2937   47.669   6.5942  204.165   20.413  245.568   17.661 -41.40320 26.99317 
1 1 1    9    5   55 o  137.217   21.631   15.372   4.3927   20.544   5.6786   7.6663   6.9316  157.891   24.274   98.792   35.711 59.09942 43.18016 
1 1 1    9    5   56 o  273.817   10.515   58.040   4.4071   65.761   6.3577   50.898   6.1145  290.057   14.320  254.158   15.796 35.89917 21.32084 
1 1 1    9    5   57 o  185.719   14.793   27.215   4.1704   30.859   5.9276   23.644   5.8683  195.450   20.101  169.330   23.256 26.11955 30.73877 
1 1 1    9    5   58 o   92.469   28.638   7.3341   4.4701   8.7457   7.6228   6.5943   5.5186  102.029   37.362   90.059   31.942 11.97028 49.15502 
1 1 1    9    5   59 f  251.880   11.414   49.456   4.4004   43.143   5.6478   59.210   7.0200  232.759   15.949  272.176   16.934 -39.41759 23.26248 
1 1 1    9    5   60 o  128.900   19.946   13.760   3.8082   7.7479   5.2311   20.538   5.5547   93.766   31.176  155.552   24.110 -61.78690 39.41151 
1 1 1    9    5   61 o  138.451   20.500   16.002   4.2130   10.120   6.2404   20.927   5.7108  103.884   34.028  155.920   24.756 -52.03645 42.08088 
1 1 1    9    5   62 o  133.760   18.706   14.877   3.7251   18.091   5.2138   11.526   5.3240  143.899   24.553  110.632   30.471 33.26734 39.13169 
1 1 1    9    5   63 o   55.521   23.463   0.9974   3.4292   2.7071   4.7139  -0.9245   4.9978   68.261   28.067   58.262   26.317 9.998550 38.47508 
1 1 1    9    5   64 o   63.780   26.499   2.1435   4.2624   16.891   6.2925 -10.3602   5.7940  130.920   31.732   45.831   22.641 85.08960 38.98154 
1 1 1    9    6    0 o  446.058   6.3521  152.389   4.3349  152.389   4.3349  152.389   4.3349  446.058   6.3521  446.058   6.3521 0.000000 0.000000 
1 1 1    9    6    1 o  587.150   4.9982  263.889   4.4919  262.255   6.3032  265.576   6.4030  585.274   7.0361  588.966   7.1027 -3.691772 9.997773 
1 1 1    9    6    2 o  953.637   7.8032  696.325   11.390  687.875   13.695  715.281   20.512  947.729   9.4411  966.036   13.872 -18.30646 16.78030 
1 1 1    9    6    3 o  870.586   7.3535  580.295   9.7989  569.241   11.685  606.483   17.986  862.170   8.8549  889.588   13.209 -27.41785 15.90240 
1 1 1    9    6    4 o  292.279   7.0133   65.405   3.1375   65.326   4.2927   65.495   4.5972  292.052   9.6030  292.414   10.271 -0.3626099 14.06120 
1 1 1    9    6    5 o  403.344   7.1205  124.559   4.3960  121.786   6.1143  127.527   6.3248  398.745   10.018  408.031   10.127 -9.286530 14.24497 
1 1 1    9    6    6 o  682.223   6.6772  356.339   6.9725  358.555   8.5681  351.993   11.997  684.274   8.1806  677.784   11.564 6.490051 14.16524 
1 1 1    9    6    7 o  301.187   6.2113   69.449   2.8634   71.578   3.4082   64.338   5.2799  305.750   7.2826  289.757   11.905 15.99271 13.95565 
1 1 1    9    6    8 o  637.160   5.5225  310.784   5.3859  307.688   6.1461  321.029   11.180  633.950   6.3339  647.288   11.284 -13.33813 12.94031 
1 1 1    9    6    9 o  605.782   5.4495  280.928   5.0529  285.517   5.8899  268.136   9.8339  610.681   6.3012  591.583   10.860 19.09827 12.55588 
1 1 1    9    6   10 o  800.281   5.6546  490.298   6.9265  501.701   9.0519  474.189   10.759  809.449   7.3060  786.841   8.9332 22.60803 11.54039 
1 1 1    9    6   11 o  303.341   5.8424   70.445   2.7126   69.968   3.2922   71.453   4.7870  302.288   7.1154  305.398   10.241 -3.109802 12.47004 
1 1 1    9    6   12 o  765.938   6.2712  449.151   7.3522  464.533   10.564  434.702   10.239  778.796   8.8621  753.373   8.8790 25.42242 12.54482 
1 1 1    9    6   13 f  903.339   6.1736  624.740   8.5361  611.355   13.359  633.974   11.097  893.366   9.7699  909.881   7.9678 -16.51483 12.60700 
1 1 1    9    6   14 o  674.825   4.8395  348.590   4.9987  355.035   7.1815  342.532   6.9621  680.959   6.8901  668.865   6.8004 12.09369 9.680830 
1 1 1    9    6   15 o  444.560   4.4155  151.277   3.0046  150.401   4.2941  152.118   4.2055  443.231   6.3295  445.758   6.1639 -2.527496 8.834937 
1 1 1    9    6   16 o  513.078   4.5795  201.503   3.5964  200.312   5.1551  202.631   5.0198  511.513   6.5843  514.471   6.3746 -2.957855 9.164560 
1 1 1    9    6   17 o  644.811   4.5322  318.252   4.4731  320.448   6.9404  316.692   5.8503  646.963   7.0087  643.193   5.9425 3.769592 9.188847 
1 1 1    9    6   18 o  886.481   5.6550  601.553   7.6731  593.776   13.059  605.654   9.4828  880.545   9.6890  889.447   6.9654 -8.902039 11.93288 
1 1 1    9    6   19 o  511.107   4.8818  199.953   3.8191  192.907   5.3379  207.343   5.4664  501.982   6.9473  520.427   6.8624 -18.44504 9.765074 
1 1 1    9    6   20 o  890.043   5.7818  606.382   7.8767  605.262   11.040  607.542   11.241  889.137   8.1124  890.805   8.2443 -1.667847 11.56629 
1 1 1    9    6   21 o  638.353   5.0711  311.906   4.9548  316.689   7.0542  307.248   6.9611  643.184   7.1654  633.524   7.1787 9.659302 10.14284 
1 1 1    9    6   22 o  740.065   5.4076  419.224   6.1255  441.948   10.982  408.961   7.3802  759.737   9.4437  730.922   6.5967 28.81488 11.51958 
1 1 1    9    6   23 o  457.786   4.4792  160.402   3.1386  162.204   4.5383  158.751   4.3452  460.323   6.4411  455.401   6.2337 4.922852 8.963608 
1 1 1    9    6   24 o  683.461   4.9923  357.540   5.2225  357.392   7.0149  357.725   7.8224  683.283   6.7074  683.581   7.4762 -0.2976074 10.04402 
1 1 1    9    6   25 o  723.395   4.8863  400.542   5.4104  403.732   7.7667  397.534   7.5412  726.220   6.9871  720.628   6.8369 5.592285 9.775643 
1 1 1    9    6   26 o  1089.49   6.3055  908.634   10.515  907.743   16.196  909.283   13.825  1088.78   9.7183  1089.79   8.2882 -1.005493 12.77260 
1 1 1    9    6   27 o  1176.08   6.1924  1058.80   11.147  1060.80   15.872  1056.86   15.660  1177.04   8.8096  1174.86   8.7082 2.184570 12.38720 
1 1 1    9    6   28 o  1415.44   7.4994  1533.86   16.247  1543.42   25.076  1526.94   21.331  1419.48   11.541  1412.05   9.8693 7.432739 15.18560 
1 1 1    9    6   29 o  724.032   5.6829  401.288   6.2979  416.905   8.6464  383.640   9.1917  737.917   7.6552  707.832   8.4839 30.08484 11.42715 
1 1 1    9    6   30 o  476.142   5.5850  173.547   4.0704  175.695   6.0179  171.736   5.5262  479.013   8.2078  473.603   7.6233 5.409851 11.20193 
1 1 1    9    6   31 o   81.861   22.273   5.3161   2.8651  -3.2506   4.3041   12.132   3.8392   51.669   23.751  123.991   20.978 -72.32200 31.68843 
1 1 1    9    6   32 o  406.829   6.8897  126.721   4.2903  126.325   5.7487  127.218   6.4457  406.125   9.2478  407.519   10.334 -1.393738 13.86741 
1 1 1    9    6   33 o  744.542   5.6427  424.377   6.4306  433.347   9.3580  416.352   8.8515  752.245   8.1274  737.363   7.8427 14.88177 11.29437 
1 1 1    9    6   34 o  1021.97   6.0956  799.625   9.5351  805.917   13.720  793.746   13.261  1025.77   8.7384  1018.01   8.5106 7.753906 12.19796 
1 1 1    9    6   35 o  135.762   18.675   14.427   3.7779   18.221   6.3454   12.344   4.7021  151.161   28.470  124.277   25.572 26.88401 38.26811 
1 1 1    9    6   36 o  632.901   6.1557  306.715   5.9633  308.003   8.1680  305.245   8.7264  634.087   8.4158  631.195   9.0323 2.892029 12.34542 
1 1 1    9    6   37 o  760.922   5.7706  443.350   6.7209  444.935   9.6906  441.882   9.3294  762.067   8.3078  759.476   8.0254 2.591187 11.55109 
1 1 1    9    6   38 o  575.509   6.3833  253.666   5.6230  248.356   8.9801  257.091   7.2117  569.117   10.309  579.248   8.1340 -10.13062 13.13147 
1 1 1    9    6   39 o   63.331   23.582   2.3741   3.0589   1.4435   4.5004   3.1732   4.1703   67.877   27.610   73.493   27.501 -5.616058 38.96956 
1 1 1    9    6   40 o  349.240   7.3919   93.464   3.9514   89.033   5.8059   97.288   5.3931  340.583   11.137  356.132   9.8938 -15.54919 14.89711 
1 1 1    9    6   41 o  273.798   8.7485   57.489   3.6663   57.981   5.7223   57.146   4.7752  274.570   13.616  272.784   11.437 1.786499 17.78183 
1 1 1    9    6   42 o  485.880   7.1992  180.955   5.3541  194.377   7.7123  168.469   7.4386  503.212   10.013  468.427   10.375 34.78555 14.41868 
1 1 1    9    6   43 o  243.299   9.6161   45.442   3.5811   45.676   5.5572   45.275   4.6830  242.936   15.019  242.255   12.673 0.6810455 19.65138 
1 1 1    9    6   44 o  269.710   9.6343   55.863   3.9773   52.803   5.2469   59.996   6.0980  261.839   13.092  278.567   14.350 -16.72864 19.42498 
1 1 1    9    6   45 f  163.743   13.172   20.797   3.2734   13.828   4.7355   27.174   4.5298  130.809   24.553  186.784   15.999 -55.97530 29.30570 
1 1 1    9    6   46 o  230.464   9.8759   40.831   3.4838   40.686   5.0628   40.961   4.8012  229.016   14.518  229.959   13.703 -0.9435425 19.96332 
1 1 1    9    6   47 o  386.133   8.5910  114.539   5.0775  129.169   8.3041  105.803   6.4167  408.987   13.265  370.604   11.312 38.38235 17.43337 
1 1 1    9    6   48 o   69.787   25.341   3.2594   3.4962   3.1918   4.5770   3.3541   5.4173   74.524   28.598   79.071   30.901 -4.546143 42.10370 
1 1 1    9    6   49 o  239.971   9.7638   44.336   3.5863   44.266   5.2053   44.400   4.9481  238.550   14.322  239.105   13.576 -0.5547638 19.73420 
1 1 1    9    6   50 o   81.192   25.437   5.2561   3.5152   6.7660   5.5040   4.2160   4.5681   93.476   31.981   78.799   28.913 14.67683 43.11308 
1 1 1    9    6   51 o  238.969   10.442   44.051   3.8195   50.831   5.7272   38.621   5.1259  255.305   14.718  222.298   15.155 33.00665 21.12601 
1 1 1    9    6   52 o  281.868   9.3562   61.220   4.0366   71.041   6.0384   53.286   5.4275  302.668   13.034  261.644   13.599 41.02405 18.83710 
1 1 1    9    6   53 o  221.555   12.991   38.226   4.3863   39.223   6.0617   37.130   6.3550  222.726   17.933  216.066   19.423 6.660294 26.43601 
1 1 1    9    6   54 o   65.266   25.327   2.3970   3.6197   5.9961   5.2787  -0.7974   4.9730   88.395   31.252   61.525   27.115 26.86926 41.37537 
1 1 1    9    6   55 o  201.178   14.146   31.726   4.3282   29.855   5.5230   34.705   6.9677  193.335   18.905  206.925   22.355 -13.59024 29.27694 
1 1 1    9    6   56 o  256.909   11.120   51.172   4.3728   50.894   6.4305   51.411   5.9641  253.693   16.653  255.614   15.314 -1.921173 22.62377 
1 1 1    9    6   57 o   75.630   27.019   4.2953   3.9555   5.7598   5.7351   2.9667   5.4627   87.449   32.344   75.677   30.549 11.77177 44.48959 
1 1 1    9    6   58 o  280.549   13.258   61.605   5.6933   63.248   9.6302   60.723   7.0589  277.488   22.878  276.246   16.774 1.242065 28.36810 
1 1 1    9    6   59 o   54.395   23.923  -0.4092   3.8523  -2.8677   5.0628   2.9714   5.9369   55.562   25.620   76.529   31.486 -20.96724 40.59281 
1 1 1    9    6   60 o  193.773   13.882   29.752   4.0901   22.110   5.6939   37.899   5.8791  161.658   23.717  216.460   17.905 -54.80199 29.71663 
1 1 1    9    6   61 o  125.385   22.190   13.376   4.1028   10.465   6.1102   15.765   5.5365  105.298   33.604  132.611   28.147 -27.31315 43.83473 
1 1 1    9    6   62 o  261.337   11.294   53.647   4.5179   49.635   6.7669   56.874   6.0685  245.938   18.103  266.158   14.957 -20.21942 23.48264 
1 1 1    9    6   63 o   49.417   22.098  -0.6562   3.4266  -1.2145   4.6715  -0.0059   5.0416   55.632   25.255   60.879   27.041 -5.246758 37.00081 
1 1 1    9    7    0 o  596.325   7.1918  272.326   6.5622  272.326   6.5622  272.326   6.5622  596.325   7.1918  596.325   7.1918 0.000000 0.000000 
1 1 1    9    7    1 o  910.601   6.5320  634.823   9.1042  636.223   12.879  633.424   12.872  911.440   9.2317  909.432   9.2468 2.007996 13.06633 
1 1 1    9    7    2 f  958.977   7.8642  704.183   11.543  685.342   13.676  750.857   21.525  945.949   9.4457  989.653   14.210 -43.70435 17.06279 
1 1 1    9    7    3 o  568.550   5.8665  247.462   5.1053  245.713   6.1166  251.478   9.2695  566.500   7.0541  572.951   10.570 -6.451538 12.70753 
1 1 1    9    7    4 o  734.375   8.1355  412.983   9.1448  402.534   12.305  425.874   13.668  724.842   11.091  745.493   11.978 -20.65076 16.32404 
1 1 1    9    7    5 o  789.021   8.8542  476.787   10.693  451.286   14.460  507.567   15.886  767.377   12.311  813.782   12.754 -46.40479 17.72579 
1 1 1    9    7    6 f  694.443   6.7639  369.229   7.1896  368.369   8.7582  371.005   12.589  693.564   8.2501  695.812   11.821 -2.248169 14.41494 
1 1 1    9    7    7 o  251.754   6.5774   48.525   2.5345   47.705   3.0170   50.493   4.6725  249.594   7.8971  256.690   11.892 -7.096252 14.27563 
1 1 1    9    7    8 o  1517.37   11.552  1764.31   26.831  1752.44   46.035  1770.41   33.018  1510.36   19.913  1519.50   14.197 -9.137207 24.45562 
1 1 1    9    7    9 o  241.122   8.1927   44.524   3.0237   44.969   4.6040   44.187   4.0096  241.896   12.477  240.146   10.908 1.749222 16.57321 
1 1 1    9    7   10 o  151.955   7.0736   17.680   1.6452   20.868   2.0002   11.012   2.8928  165.077   7.9162  118.689   16.358 46.38881 18.17287 
1 1 1    9    7   11 o  327.902   5.0824   82.307   2.5508   82.245   2.9416   82.493   5.1221  327.766   5.8633  328.148   10.198 -0.3823242 11.76332 
1 1 1    9    7   12 o  812.518   6.5492  505.456   8.1450  514.904   11.695  496.555   11.351  819.906   9.3187  805.173   9.2100 14.73340 13.10196 
1 1 1    9    7   13 o  364.857   5.6838  101.909   3.1742  103.276   4.5344  100.596   4.4449  367.240   8.0668  362.446   8.0121 4.793304 11.36954 
1 1 1    9    7   14 f  385.121   5.6228  113.541   3.3145  113.644   3.7008  113.127   7.4515  385.281   6.2755  384.203   12.671 1.078278 14.13994 
1 1 1    9    7   15 o  810.209   6.6089  502.562   8.1959  501.067   9.3409  507.567   17.085  808.958   7.5439  813.748   13.717 -4.790039 15.65440 
1 1 1    9    7   16 o  599.570   4.4264  275.159   4.0622  287.538   6.4034  266.822   5.2550  612.846   6.8264  590.385   5.8152 22.46106 8.967555 
1 1 1    9    7   17 o  592.616   4.4508  268.811   4.0372  264.393   6.1626  272.133   5.3436  587.671   6.8511  596.236   5.8553 -8.565552 9.012321 
1 1 1    9    7   18 o  417.110   5.1723  133.173   3.3022  130.773   5.0072  135.021   4.3929  413.286   7.9155  419.967   6.8338 -6.680542 10.45735 
1 1 1    9    7   19 o  474.469   4.8649  172.312   3.5330  169.955   4.9376  174.785   5.0575  471.179   6.8464  477.827   6.9151 -6.647583 9.730925 
1 1 1    9    7   20 o  598.911   5.0084  274.552   4.5912  285.352   6.7207  265.102   6.2869  610.531   7.1918  588.474   6.9797 22.05640 10.02192 
1 1 1    9    7   21 o  504.167   4.6269  194.553   3.5705  189.635   5.4977  198.141   4.6957  497.714   7.2165  508.775   6.0298 -11.06116 9.404093 
1 1 1    9    7   22 o  775.809   5.4929  460.700   6.5226  438.784   10.774  473.379   8.1949  757.019   9.2986  786.379   6.8084 -29.35950 11.52466 
1 1 1    9    7   23 o  117.456   9.8671   10.638   1.7575   7.8355   2.6454   12.853   2.3515   99.572   18.020  128.982   12.050 -29.40981 21.67826 
1 1 1    9    7   24 o  420.651   4.9278  135.438   3.1728  134.118   4.3430  136.950   4.6464  418.571   6.7788  422.961   7.1771 -4.390045 9.872343 
1 1 1    9    7   25 o  479.898   4.7276  176.276   3.4726  176.835   5.0241  175.764   4.8053  480.626   6.8294  479.172   6.5518 1.453644 9.463927 
1 1 1    9    7   26 o  218.240   7.4805   36.463   2.4988   32.142   4.0957   39.025   3.1538  204.406   13.161  225.758   9.1269 -21.35202 16.01576 
1 1 1    9    7   27 o  671.587   5.2824  345.241   5.4301  340.951   8.2721  348.488   7.1979  667.321   8.0987  674.693   6.9700 -7.372131 10.68499 
1 1 1    9    7   28 o  495.119   5.1285  187.645   3.8866  193.594   5.7363  182.596   5.2845  502.855   7.4528  488.373   7.0693 14.48218 10.27226 
1 1 1    9    7   29 o  1002.40   6.1862  769.204   9.4914  774.613   12.697  762.354   14.289  1005.80   8.2474  997.743   9.3567 8.062622 12.47271 
1 1 1    9    7   30 o  682.612   5.5689  356.692   5.8185  352.724   8.9094  359.644   7.6833  678.690   8.5764  685.369   7.3241 -6.679077 11.27818 
1 1 1    9    7   31 o  250.398   7.9225   48.010   3.0364   43.977   4.5400   51.274   4.0844  239.234   12.441  258.723   10.314 -19.48863 16.16047 
1 1 1    9    7   32 o  529.873   6.2141  214.949   5.0398  215.995   6.7770  213.656   7.5385  531.085   8.3369  528.159   9.3250 2.926025 12.50837 
1 1 1    9    7   33 o   93.878   21.523   7.0463   3.0267   7.4668   4.5482   6.7120   4.0549   97.551   28.605   92.470   26.979 5.081543 39.32034 
1 1 1    9    7   34 o  206.632   10.847   32.809   3.4186   38.614   4.8938   27.276   4.7776  223.911   14.355  187.750   16.803 36.16125 22.09940 
1 1 1    9    7   35 o  642.946   6.7003  316.542   6.5938  321.718   10.025  312.595   8.7535  647.951   10.109  638.786   8.9528 9.165466 13.50318 
1 1 1    9    7   36 o  234.314   9.8588   42.076   3.5358   39.952   4.9646   44.263   5.0370  227.702   14.317  239.774   13.783 -12.07156 19.87339 
1 1 1    9    7   37 o  729.736   5.7731  407.764   6.4483  409.900   9.3161  405.800   8.9345  731.429   8.3213  727.791   8.0203 3.637939 11.55724 
1 1 1    9    7   38 o  368.614   7.5085  104.099   4.2364  102.142   6.8078  105.335   5.4119  364.817   12.192  370.676   9.5386 -5.858459 15.47967 
1 1 1    9    7   39 o  392.147   6.7865  117.806   4.0735  117.300   5.8866  118.271   5.6426  391.092   9.8337  392.742   9.3865 -1.650391 13.59440 
1 1 1    9    7   40 f  258.982   9.0559   51.434   3.5898   53.193   5.4446   50.080   4.7747  262.701   13.587  255.344   12.217 7.357635 18.27144 
1 1 1    9    7   41 f  483.273   6.8200  178.970   5.0448  176.444   6.7253  182.221   7.6287  479.603   9.1613  487.253   10.229 -7.649292 13.73172 
1 1 1    9    7   42 o  253.279   10.020   49.247   3.8845   50.132   5.2732   48.197   5.7439  254.864   13.566  249.629   15.104 5.234955 20.30218 
1 1 1    9    7   43 o  343.757   7.2847   90.601   3.8329   81.664   5.4492   99.352   5.3925  325.995   10.921  359.715   9.7940 -33.71960 14.66910 
1 1 1    9    7   44 o  302.433   8.5373   70.194   3.9520   72.528   5.2374   67.108   6.0226  307.121   11.141  295.121   13.332 11.99945 17.37478 
1 1 1    9    7   45 o  429.801   6.5299  141.631   4.2958  138.070   6.0972  145.141   6.0533  423.953   9.3960  434.725   9.0973 -10.77173 13.07845 
1 1 1    9    7   46 o  459.378   6.5525  161.830   4.6073  154.766   6.5771  168.637   6.4560  448.724   9.5760  468.518   9.0025 -19.79431 13.14327 
1 1 1    9    7   47 o  129.166   21.404   13.396   4.0835   3.5752   6.4498   19.966   5.2755   84.592   33.513  157.999   22.445 -73.40694 40.33478 
1 1 1    9    7   48 o  228.831   9.9854   40.309   3.4974   36.688   5.0070   43.759   4.8874  216.982   15.171  237.482   13.501 -20.49983 20.30901 
1 1 1    9    7   49 o  266.115   9.6490   54.521   3.9303   56.339   5.3958   52.467   5.7363  269.848   13.064  259.701   14.488 10.14767 19.50830 
1 1 1    9    7   50 o  139.417   16.985   15.379   3.5497   7.7316   5.4026   21.187   4.7086   97.815   31.639  163.301   19.205 -65.48678 37.01115 
1 1 1    9    7   51 o  154.212   14.979   18.667   3.4910   23.504   5.0935   14.382   4.7941  171.761   19.732  132.286   24.582 39.47527 31.52199 
1 1 1    9    7   52 o  159.002   15.328   19.880   3.6842   23.131   5.4838   17.206   4.9739  169.520   21.627  145.316   23.138 24.20341 31.67177 
1 1 1    9    7   53 o  178.538   14.580   24.993   3.9496   27.147   5.2599   22.209   5.9805  184.678   18.873  164.685   24.469 19.99272 30.90176 
1 1 1    9    7   54 o  109.751   22.777   9.9764   3.7010   4.9022   5.3308   14.698   5.1422   83.679   31.136  132.442   26.294 -48.76257 40.75313 
1 1 1    9    7   55 o  263.639   11.385   53.878   4.5944   57.882   5.8761   47.581   7.3693  271.969   14.165  243.873   19.916 28.09653 24.43946 
1 1 1    9    7   56 o   76.661   26.470   4.5463   3.7738   10.200   5.3966  -0.8636   5.2792  108.278   30.990   62.798   27.793 45.48034 41.62721 
1 1 1    9    7   57 o   56.893   24.390   0.2786   3.7990   0.4621   5.4450   0.1045   5.3030   67.251   29.019   65.418   28.432 1.833603 40.62649 
1 1 1    9    7   58 o  151.841   22.458   19.132   5.0621   20.386   7.4878   18.078   6.8697  150.281   33.417  141.964   32.338 8.317001 46.50167 
1 1 1    9    7   59 o   33.633   16.844  -9.8578   3.6849 -14.3855   5.1474  -5.0984   5.2774   38.784   19.491   52.208   24.734 -13.42464 31.49111 
1 1 1    9    7   60 o   59.722   24.727   1.3726   3.6928   0.0834   5.1303   2.7587   5.3196   63.302   27.729   72.816   29.863 -9.514717 40.75178 
1 1 1    9    7   61 o   95.045   26.761   8.0854   4.0583   13.232   5.9437   3.5899   5.5547  118.528   32.010   75.845   30.739 42.68346 44.37895 
1 1 1    9    7   62 o  121.774   20.187   12.563   3.6309   11.108   4.8408   14.433   5.4898  109.368   28.595  124.550   29.289 -15.18233 40.93292 
1 1 1    9    7   63 o   74.688   25.835   4.8270   3.5957   1.9099   5.0230   7.8930   5.1496   66.493   28.263   91.107   30.935 -24.61429 41.90204 
1 1 1    9    8    0 o   35.576   18.158   1.4199   1.2467   1.4199   1.2467   1.4199   1.2467   35.576   18.158   35.576   18.158 0.000000 0.000000 
1 1 1    9    8    1 o  763.554   5.8669  446.329   6.8568  434.092   9.4395  459.998   9.9766  752.903   8.1911  775.031   8.4100 -22.12738 11.73974 
1 1 1    9    8    2 o  168.137   6.0266   21.643   1.5510   20.191   1.7940   25.938   3.0861  162.389   7.2177  183.667   11.029 -21.27855 13.18067 
1 1 1    9    8    3 o  420.314   6.6070  135.258   4.2506  132.139   5.6600  139.292   6.4370  415.372   8.9025  426.431   9.8620 -11.05899 13.28586 
1 1 1    9    8    4 o  311.237   6.5510   74.164   3.1208   75.839   4.0827   71.810   4.8403  314.689   8.4762  306.168   10.329 8.520721 13.36138 
1 1 1    9    8    5 o  537.613   7.4591  221.313   6.1380  224.466   8.6185  218.066   8.7438  541.297   10.402  533.508   10.708 7.788574 14.92842 
1 1 1    9    8    6 o  761.084   8.6725  443.626   10.103  446.486   14.261  440.745   14.315  763.265   12.207  758.331   12.333 4.934204 17.35210 
1 1 1    9    8    7 o  223.967   6.8658   38.407   2.3537   38.881   2.8057   37.279   4.3244  225.326   8.1349  220.152   12.889 5.173477 15.24182 
1 1 1    9    8    8 f  301.655   6.4828   69.669   2.9933   70.437   3.5615   67.820   5.5236  303.289   7.6720  297.473   12.131 5.816132 14.35362 
1 1 1    9    8    9 o  503.914   5.4559  194.392   4.2082  200.054   6.0029  188.921   5.9009  511.129   7.6729  496.699   7.7616 14.42963 10.91406 
1 1 1    9    8   10 o  271.983   6.5095   56.637   2.7099   57.720   3.4183   54.804   4.4459  274.541   8.1346  267.449   10.860 7.091858 13.56911 
1 1 1    9    8   11 o  463.537   6.2725  164.501   4.4504  165.850   5.5113  161.973   7.5446  465.388   7.7370  459.798   10.720 5.590454 13.22052 
1 1 1    9    8   12 o  239.955   7.1344   44.086   2.6204   43.839   3.3006   44.507   4.3095  239.249   9.0131  241.006   11.682 -1.757507 14.75498 
1 1 1    9    8   13 o  255.222   5.7152   49.865   2.2326   51.997   2.5889   43.679   4.4101  260.610   6.4902  238.443   12.123 22.16739 13.75143 
1 1 1    9    8   14 o  1390.13   8.4239  1479.80   17.924  1505.00   23.523  1444.91   27.678  1401.63   10.964  1373.07   13.169 28.56628 17.13635 
1 1 1    9    8   15 o  230.892   5.9023   40.811   2.0859   42.850   2.5970   37.103   3.5015  236.576   7.1720  220.093   10.394 16.48312 12.62822 
1 1 1    9    8   16 o  928.691   6.4152  660.248   9.1191  651.323   11.511  675.289   14.943  922.311   8.1538  938.989   10.397 -16.67792 13.21311 
1 1 1    9    8   17 o  877.281   6.9524  589.188   9.3356  589.100   12.957  589.283   13.462  877.089   9.6516  877.204   10.026 -0.1154785 13.91700 
1 1 1    9    8   18 o  836.331   6.1580  535.421   7.8829  525.296   9.9234  552.738   12.978  828.328   7.8269  849.591   9.9796 -21.26379 12.68277 
1 1 1    9    8   19 o  580.293   8.9684  257.828   7.9659  257.828   7.9659   0.0000   0.0000  580.293   8.9684  ?   ?  0.000000 8.968442 
1 1 1    9    8   20 o  612.612   4.6691  287.251   4.3781  287.090   6.7625  287.367   5.7444  612.390   7.2145  612.710   6.1252 -0.3197632 9.464021 
1 1 1    9    8   21 o  431.622   4.6329  142.592   3.0607  149.937   4.8826  137.837   3.9284  442.563   7.2079  424.348   6.0481 18.21524 9.409212 
1 1 1    9    8   22 o  338.305   5.0919   87.602   2.6367   88.602   4.2237   86.963   3.3751  340.196   8.1115  337.055   6.5421 3.141083 10.42090 
1 1 1    9    8   23 o  1033.81   6.9606  818.145   11.014  822.542   17.590  815.309   14.127  1036.38   11.089  1031.93   8.9438 4.448120 14.24594 
1 1 1    9    8   24 o  369.456   5.4925  104.481   3.1060  108.016   5.4742  102.803   3.7719  375.590   9.5222  366.461   6.7246 9.128998 11.65733 
1 1 1    9    8   25 o  480.617   5.4185  176.812   3.9861  174.846   6.9935  177.759   4.8513  477.851   9.5616  481.882   6.5773 -4.031250 11.60540 
1 1 1    9    8   26 o  967.260   7.7420  716.289   11.462   0.0000   0.0000  716.289   11.462  ?   ?   967.260   7.7420 0.000000 7.742048 
1 1 1    9    8   27 o  595.128   4.9195  271.101   4.4813  267.484   6.3959  274.589   6.2807  591.094   7.0692  598.899   6.8514 -7.804993 9.844604 
1 1 1    9    8   28 o  615.144   5.4571  289.658   5.1381  293.354   6.9676  285.251   7.6073  619.004   7.3539  610.368   8.1428 8.636108 10.97199 
1 1 1    9    8   29 o  488.163   5.3111  182.416   3.9685  188.501   5.8633  177.272   5.3909  496.179   7.7203  481.185   7.3195 14.99475 10.63853 
1 1 1    9    8   30 o  607.847   5.6109  282.839   5.2203  292.616   8.1832  276.130   6.7788  618.154   8.6488  600.539   7.3746 17.61523 11.36606 
1 1 1    9    8   31 f  695.385   5.9086  370.188   6.2889  372.198   8.3945  367.617   9.4945  697.188   7.8664  692.828   8.9532 4.360046 11.91803 
1 1 1    9    8   32 o  549.066   6.1325  230.804   5.1538  230.877   6.8704  230.710   7.7938  549.077   8.1749  548.828   9.2778 0.2487793 12.36553 
1 1 1    9    8   33 o  197.118   10.540   29.856   3.1685   33.941   4.6609   26.345   4.3205  209.855   14.601  184.671   15.426 25.18475 21.24054 
1 1 1    9    8   34 o  623.668   6.6530  297.829   6.3509  301.168   9.7224  295.345   8.3878  626.943   10.132  620.940   8.8253 6.002686 13.43633 
1 1 1    9    8   35 o  140.628   14.830   15.346   3.1440   13.532   4.4740   17.116   4.4191  130.596   23.233  147.829   20.047 -17.23279 30.68667 
1 1 1    9    8   36 o  306.170   7.5650   71.802   3.5452   74.637   5.1774   69.300   4.8646  312.014   10.841  300.664   10.571 11.35013 15.14137 
1 1 1    9    8   37 o  286.722   8.0567   62.987   3.5358   63.433   5.2614   62.619   4.7747  287.542   11.955  285.750   10.917 1.791840 16.18906 
1 1 1    9    8   38 o  222.072   10.373   37.823   3.5259   42.073   5.7794   35.303   4.4499  233.296   16.287  213.951   13.660 19.34471 21.25685 
1 1 1    9    8   39 o  479.168   6.1526  175.867   4.5125  185.323   6.7539  168.242   6.0648  491.646   8.9749  468.488   8.4577 23.15756 12.33212 
1 1 1    9    8   40 o  431.455   6.5964  142.623   4.3562  148.217   6.8082  138.745   5.6685  439.506   10.120  425.375   8.7061 14.13187 13.34990 
1 1 1    9    8   41 o  412.348   7.1820  130.319   4.5329  131.507   6.1420  128.898   6.7177  413.973   9.6932  409.724   10.712 4.249084 14.44642 
1 1 1    9    8   42 o  354.765   7.2384   96.481   3.9305  102.353   6.0563   92.209   5.1664  365.023   10.840  346.587   9.7388 18.43640 14.57200 
1 1 1    9    8   43 o  168.165   11.835   21.856   3.0268   18.764   4.3135   24.855   4.2484  154.568   18.606  178.769   15.685 -24.20175 24.33498 
1 1 1    9    8   44 o   72.183   24.825   3.7505   3.3177   0.8821   4.3704   7.6511   5.0966   64.454   26.811   98.235   30.604 -33.78113 40.68712 
1 1 1    9    8   45 o  166.783   12.153   21.537   3.0811   15.634   4.3493   27.484   4.3655  140.151   20.915  187.941   15.309 -47.79045 25.91868 
1 1 1    9    8   46 o  171.304   14.209   22.830   3.6920   22.940   6.3504   22.774   4.5376  168.816   25.360  170.344   17.660 -1.527710 30.90337 
1 1 1    9    8   47 o  131.667   16.128   13.646   3.1823   17.392   4.4766   9.8188   4.5247  147.822   20.323  109.032   27.202 38.78979 33.95510 
1 1 1    9    8   48 o  202.521   10.918   31.704   3.3718   32.741   4.9053   30.775   4.6423  204.730   15.775  198.550   15.396 6.179688 22.04300 
1 1 1    9    8   49 o   62.048   23.372   2.3181   3.0216   6.4910   4.4965  -1.1179   4.0802   90.141   28.833   55.055   24.397 35.08519 37.76984 
1 1 1    9    8   50 o  196.889   12.173   30.084   3.6506   32.549   5.8447   28.508   4.6746  202.859   19.046  190.627   16.174 12.23199 24.98717 
1 1 1    9    8   51 o   57.416   23.276   1.2398   3.1860   1.0998   4.5862   1.3704   4.4291   65.716   27.411   65.794   27.147 -0.7781982E-01 38.57902 
1 1 1    9    8   52 o  201.420   12.020   31.519   3.6888   29.626   5.4822   33.086   4.9865  193.183   18.777  205.225   16.001 -12.04237 24.67024 
1 1 1    9    8   53 o  192.685   13.953   29.038   4.0873   31.659   5.6310   26.120   5.9422  199.602   18.647  179.808   22.053 19.79381 28.87982 
1 1 1    9    8   54 o  277.076   9.6475   59.267   4.0915   69.355   5.8793   49.793   5.6975  298.729   12.858  252.076   14.832 46.65318 19.62961 
1 1 1    9    8   55 o  176.559   16.205   24.676   4.3306   21.938   5.4414   29.405   7.1524  164.007   22.250  188.622   25.421 -24.61536 33.78319 
1 1 1    9    8   56 o  112.421   23.079   10.559   3.8383   7.9993   5.5160   12.961   5.3444   97.311   31.998  122.429   28.971 -25.11838 43.16469 
1 1 1    9    8   57 o  111.155   23.128   10.384   3.8068   12.528   5.5869   8.5254   5.2010  119.213   30.495   99.178   30.919 20.03527 43.42752 
1 1 1    9    8   58 o  162.939   20.189   21.703   4.9274   5.1622   7.1650   36.546   6.7872   88.220   35.204  211.281   21.277 -123.0611 41.13445 
1 1 1    9    8   59 o   87.276   25.854   6.5760   3.6991   4.8318   5.2187   8.3371   5.2439   80.823   30.651   96.943   31.151 -16.11968 43.70197 
1 1 1    9    8   60 o  310.181   11.006   75.107   5.2256   62.772   7.9482   84.497   6.9351  277.870   18.798  327.133   13.850 -49.26279 23.34973 
1 1 1    9    8   61 o   66.139   26.057   2.7742   3.8792   4.8459   5.7605   1.0551   5.2475   80.793   31.778   66.036   28.491 14.75732 42.68018 
1 1 1    9    8   62 o   46.128   21.211  -1.8147   3.4365  -0.1728   4.7194  -3.6680   5.0140   59.083   26.207   52.236   24.551 6.846893 35.91055 
1 1 1    9    8   63 o   97.810   25.746   8.7842   3.9071   8.7827   5.3077   8.7859   5.7725   95.094   31.394   94.731   32.736 0.3634033 45.35632 
1 1 1    9    9    0 o  903.118   9.3129  624.663   12.870  624.663   12.870  624.663   12.870  903.118   9.3129  903.118   9.3129 0.000000 0.000000 
1 1 1    9    9    1 o  648.694   6.2929  322.168   6.2482  327.988   7.7590  311.429   10.539  654.464   7.7455  637.559   10.800 16.90533 13.28990 
1 1 1    9    9    2 o  753.947   8.3116  435.319   9.5917  440.745   13.583  429.921   13.547  758.387   11.701  749.008   11.816 9.379272 16.62943 
1 1 1    9    9    3 o  344.770   5.4324   90.996   2.8668   88.861   3.4147   96.092   5.2766  340.681   6.5484  354.183   9.7332 -13.50201 11.73104 
1 1 1    9    9    4 o  1093.04   10.822  915.382   18.106  927.982   25.892  903.324   25.329  1099.90   15.380  1085.21   15.249 14.69067 21.65777 
1 1 1    9    9    5 f  734.741   8.4792  413.440   9.5358  412.886   13.354  414.016   13.622  734.002   11.886  734.986   12.108 -0.9841919 16.96716 
1 1 1    9    9    6 o  314.850   7.5580   75.908   3.6423   69.363   4.8003   84.789   5.5920  300.897   10.423  332.657   10.982 -31.76044 15.14083 
1 1 1    9    9    7 o  361.155   7.6314   99.878   4.2186   91.471   5.6814  110.210   6.2982  345.527   10.742  379.267   10.849 -33.73987 15.26782 
1 1 1    9    9    8 o  631.318   6.7569  305.158   6.5292  296.452   7.8159  325.264   11.878  622.184   8.2071  651.487   11.912 -29.30359 14.46542 
1 1 1    9    9    9 o  527.788   6.4162  213.268   5.1833  214.282   6.3748  211.290   8.9041  528.989   7.8732  525.133   11.078 3.856140 13.59058 
1 1 1    9    9   10 o  1030.81   10.650  814.039   16.803  814.039   16.803   0.0000   0.0000  1030.81   10.650  ?   ?  0.000000 10.65010 
1 1 1    9    9   11 o  1598.02   10.528  1956.26   25.752  1949.49   36.232  1963.16   36.609  1594.48   14.846  1600.04   14.948 -5.559448 21.06778 
1 1 1    9    9   12 o  981.085   10.422  737.311   15.650  737.311   15.650   0.0000   0.0000  981.085   10.422  ?   ?  0.000000 10.42182 
1 1 1    9    9   13 o  1182.43   8.2740  1070.60   14.975  1057.93   17.047  1113.39   31.335  1175.31   9.4763  1204.76   16.992 -29.45300 19.45617 
1 1 1    9    9   14 o  496.140   6.6176  188.447   5.0254  191.796   6.2812  182.491   8.3772  500.486   8.1994  488.087   11.213 12.39850 13.89123 
1 1 1    9    9   15 o  854.442   6.7523  558.910   8.8309  560.674   10.214  553.684   17.575  855.744   7.7978  850.035   13.508 5.709778 15.59738 
1 1 1    9    9   16 o  883.475   6.2573  597.500   8.4616  619.101   11.168  568.388   12.965  899.226   8.1141  861.524   9.8319 37.70160 12.74770 
1 1 1    9    9   17 o  1874.33   12.136  2691.01   34.817  2718.37   49.548  2664.34   48.934  1883.00   17.191  1864.20   17.149 18.79993 24.28241 
1 1 1    9    9   18 o  746.801   5.8917  426.908   6.7347  424.365   8.5045  431.184   11.029  744.529   7.4627  750.410   9.6018 -5.880920 12.16092 
1 1 1    9    9   19 o  455.004   5.4531  158.467   3.7978  160.860   4.8041  154.479   6.2011  458.406   6.8469  449.180   9.0194 9.225677 11.32385 
1 1 1    9    9   20 o  1264.16   7.2880  1223.38   14.102  1224.50   19.866  1222.24   20.021  1264.56   10.264  1263.39   10.353 1.177368 14.57861 
1 1 1    9    9   21 o  1196.54   7.0416  1095.98   12.896  1083.02   17.946  1109.82   18.545  1189.29   9.8583  1203.91   10.064 -14.61304 14.08793 
1 1 1    9    9   22 o  247.088   5.7000   46.732   2.1557   48.981   3.4270   45.260   2.7731  252.931   8.8520  243.150   7.4511 9.781860 11.57053 
1 1 1    9    9   23 o  1123.20   6.7444  965.745   11.595  965.697   16.535  965.791   16.264  1123.03   9.6192  1123.09   9.4611 -0.6347656E-01 13.49224 
1 1 1    9    9   24 o  1308.30   6.9962  1310.32   14.010  1324.18   21.695  1300.40   18.349  1314.95   10.779  1303.21   9.1988 11.74377 14.17063 
1 1 1    9    9   25 o  236.505   7.9034   42.824   2.8610   44.046   8.9061   42.683   3.0212  238.186   24.792  236.111   8.3597 2.074966 26.16358 
1 1 1    9    9   26 o  177.070   9.1479   24.073   2.4709   26.822   4.5699   22.937   2.9372  186.353   16.182  172.689   11.172 13.66379 19.66413 
1 1 1    9    9   27 o  819.719   6.6599  514.401   8.3560  534.110   13.589  502.418   10.596  835.078   10.631  810.035   8.5462 25.04285 13.64052 
1 1 1    9    9   28 o  577.285   6.1208  255.117   5.4084  253.912   7.9583  256.151   7.3726  575.827   9.0293  578.386   8.3278 -2.558777 12.28339 
1 1 1    9    9   29 o  677.661   5.2511  351.527   5.4467  360.098   8.0149  344.172   7.4244  685.790   7.6355  670.469   7.2346 15.32147 10.51859 
1 1 1    9    9   30 o  552.774   5.5944  233.910   4.7334  234.129   7.3052  233.752   6.2144  552.932   8.6315  552.534   7.3481 0.3984985 11.33568 
1 1 1    9    9   31 o  907.155   6.2239  630.021   8.6420  640.533   11.603  616.927   12.951  914.567   8.2888  897.474   9.4278 17.09271 12.55340 
1 1 1    9    9   32 o  408.500   6.1258  127.757   3.8302  131.343   5.7268  124.854   5.1521  414.103   9.0351  403.769   8.3365 10.33453 12.29355 
1 1 1    9    9   33 o  666.746   5.8990  340.349   6.0201  333.966   8.1588  347.978   8.9194  660.356   8.0720  674.031   8.6455 -13.67505 11.82799 
1 1 1    9    9   34 o  204.051   11.057   32.006   3.4404   30.113   5.9804   32.943   4.2060  196.863   20.130  206.818   13.358 -9.955841 24.15914 
1 1 1    9    9   35 o  462.631   6.5583  163.896   4.6440  166.396   6.8310  161.748   6.3325  465.988   9.5773  459.467   9.0043 6.520721 13.14544 
1 1 1    9    9   36 o  308.311   7.3046   72.809   3.4471   73.297   5.0373   72.380   4.7274  309.193   10.644  307.284   10.051 1.909607 14.63941 
1 1 1    9    9   37 o  117.378   16.795   10.810   2.9314   14.156   4.2287   7.7157   4.0672  133.824   21.363   98.136   26.469 35.68739 34.01456 
1 1 1    9    9   38 o  812.971   6.2638  506.226   7.7944  494.727   12.189  514.182   10.138  803.191   9.9147  819.112   8.0861 -15.92065 12.79404 
1 1 1    9    9   39 o  731.234   6.0026  409.563   6.7184  404.745   10.195  413.261   8.9320  726.509   9.1683  734.293   7.9471 -7.784058 12.13320 
1 1 1    9    9   40 o  603.819   6.0169  279.300   5.5609  291.090   8.6033  270.840   7.2880  616.046   9.1239  594.382   8.0108 21.66418 12.14158 
1 1 1    9    9   41 o  189.727   11.469   27.756   3.3151   30.229   4.3685   24.399   5.0904  197.595   14.546  176.592   19.139 21.00278 24.03921 
1 1 1    9    9   42 o  117.737   16.753   10.915   2.9340   13.674   4.4133   8.7307   3.9277  130.727   22.890  103.716   25.028 27.01107 33.91698 
1 1 1    9    9   43 o  402.583   6.5933  124.235   4.0628  124.135   5.7823  124.332   5.7098  402.092   9.3952  402.428   9.2696 -0.3351135 13.19827 
1 1 1    9    9   44 o  444.824   7.0338  151.737   4.7890  148.822   6.2371  155.924   7.4751  440.206   9.2568  450.296   10.845 -10.08978 14.25876 
1 1 1    9    9   45 o  221.591   9.6244   37.736   3.2644   39.407   4.6645   36.133   4.5700  225.580   13.572  215.907   13.902 9.673523 19.42908 
1 1 1    9    9   46 o  143.458   16.611   16.173   3.5800   11.532   6.1129   18.595   4.4166  117.750   32.734  153.322   19.244 -35.57249 37.97165 
1 1 1    9    9   47 o  250.921   9.2646   48.417   3.5582   40.763   4.9684   56.476   5.0984  229.064   14.241  270.507   12.314 -41.44273 18.82629 
1 1 1    9    9   48 f  194.697   10.903   29.313   3.2361   27.590   4.6648   30.912   4.4930  187.635   16.408  199.092   14.851 -11.45712 22.13036 
1 1 1    9    9   49 o  165.121   12.592   21.204   3.1584   16.678   4.5964   25.253   4.3473  143.998   21.514  179.458   15.994 -35.46033 26.80770 
1 1 1    9    9   50 o  314.743   8.6932   76.223   4.1880   70.622   6.7092   79.798   5.3606  301.512   14.538  321.551   10.892 -20.03888 18.16519 
1 1 1    9    9   51 o  142.116   16.032   15.947   3.4264   12.915   5.1708   18.321   4.5751  124.050   27.908  151.147   20.288 -27.09724 34.50280 
1 1 1    9    9   52 o   97.793   23.234   7.9310   3.4262   11.414   4.9377   4.6972   4.7581  116.240   28.070   81.240   29.553 34.99979 40.75908 
1 1 1    9    9   53 o  478.117   7.9447  175.928   5.8141  172.890   7.9706  179.383   8.4995  472.758   11.015  481.304   11.537 -8.546509 15.95119 
1 1 1    9    9   54 o  145.442   16.689   16.816   3.6479   19.367   5.2743   14.478   5.0508  153.768   23.125  131.411   26.031 22.35689 34.81948 
1 1 1    9    9   55 o  416.921   10.258  134.461   6.5461  125.510   9.5374  142.434   9.0011  400.032   15.576  427.288   13.763 -27.25565 20.78544 
1 1 1    9    9   56 o  267.926   10.655   55.638   4.3694   54.833   6.4032   56.340   5.9773  263.488   15.952  267.747   14.641 -4.259460 21.65220 
1 1 1    9    9   57 o   96.060   27.770   7.9617   4.3139   2.6758   7.7955   10.295   5.1792   83.522   35.340  108.139   30.155 -24.61742 46.45707 
1 1 1    9    9   58 o  242.009   11.936   45.713   4.4213   45.345   5.8660   46.198   6.7273  238.622   16.156  239.434   18.500 -0.8121338 24.56131 
1 1 1    9    9   59 o  165.855   15.246   21.964   3.8270   20.654   5.4100   23.277   5.4144  156.632   23.273  167.411   21.636 -10.77917 31.77660 
1 1 1    9    9   60 o   64.156   25.384   2.4244   3.6961   2.4897   4.9929   2.3453   5.4975   70.234   28.883   71.840   29.992 -1.606354 41.63828 
1 1 1    9    9   61 o  183.575   17.136   27.470   4.7593   23.596   8.4929   29.243   5.7463  154.332   36.521  187.150   20.390 -32.81741 41.82764 
1 1 1    9    9   62 o   79.590   25.554   5.6154   3.5292   5.4023   4.8761   5.8498   5.1146   79.935   29.772   82.277   30.521 -2.341835 42.63686 
1 1 1    9    9   63 o   81.397   27.020   6.0225   3.9298   9.8663   5.2511   1.1288   5.9249  100.346   31.033   67.566   29.693 32.77959 42.94970 
1 1 1    9   10    0 o  574.729   10.389  253.172   9.1326  253.172   9.1326  253.172   9.1326  574.729   10.389  574.729   10.389 0.000000 0.000000 
1 1 1    9   10    1 o  261.636   5.5982   52.404   2.2419   49.602   2.7013   58.606   4.0187  254.524   6.9339  276.607   9.4918 -22.08316 11.75473 
1 1 1    9   10    2 o  401.010   5.5602  123.106   3.4129  125.178   4.1648  118.868   5.9546  404.344   6.7293  393.922   9.8759 10.42142 11.95059 
1 1 1    9   10    3 o  747.878   6.8744  428.249   7.8693  437.304   9.7552  411.380   13.315  755.656   8.4342  732.673   11.873 22.98352 14.56409 
1 1 1    9   10    4 o  486.435   7.3252  181.180   5.4540  181.549   7.6426  180.797   7.7856  486.811   10.257  485.791   10.471 1.020721 14.65728 
1 1 1    9   10    5 o   59.884   19.297   2.6731   2.0113   1.4644   2.5473   4.6738   3.2774   54.934   21.267   78.363   24.563 -23.42940 32.49000 
1 1 1    9   10    6 o  586.126   6.4826  263.022   5.8158  258.651   7.0455  272.371   10.304  581.179   7.9201  596.213   11.291 -15.03400 13.79144 
1 1 1    9   10    7 o  342.417   6.3838   89.766   3.3458   85.134   3.9869  100.798   6.1524  333.432   7.8119  362.709   11.082 -29.27615 13.55860 
1 1 1    9   10    8 o  442.243   10.590  149.833   7.1685  149.833   7.1685   0.0000   0.0000  442.243   10.590  ?   ?  0.000000 10.59006 
1 1 1    9   10    9 o  438.547   7.6591  147.264   5.1412  158.021   7.4923  137.691   7.0677  454.167   10.778  423.943   10.892 30.22379 15.32303 
1 1 1    9   10   10 o  1222.23   8.5273  1143.96   15.953  1108.46   21.744  1185.34   23.476  1202.78   11.811  1243.72   12.332 -40.94446 17.07576 
1 1 1    9   10   11 o  492.302   5.7320  185.532   4.3192  186.040   6.0480  185.004   6.1705  492.912   8.0163  491.532   8.2016 1.379944 11.46853 
1 1 1    9   10   12 o  313.745   6.0197   75.355   2.8908   72.738   4.0180   78.165   4.1624  308.204   8.5173  319.495   8.5115 -11.29071 12.04114 
1 1 1    9   10   13 o  612.316   6.0420  287.015   5.6627  287.356   7.9151  286.658   8.1048  612.603   8.4412  611.850   8.6542 0.7529297 12.08926 
1 1 1    9   10   14 o  533.686   5.1781  218.017   4.2299  226.443   5.4258  204.962   6.7538  543.872   6.5177  517.381   8.5284 26.49103 10.73380 
1 1 1    9   10   15 o  1171.92   9.5407  1051.68   17.114  1051.68   17.114   0.0000   0.0000  1171.92   9.5407  ?   ?  0.000000 9.540704 
1 1 1    9   10   17 o  167.848   7.5555   21.568   1.9411   22.153   2.3324   20.251   3.5011  169.858   9.0034  161.949   14.270 7.908829 16.87249 
1 1 1    9   10   18 o  781.681   6.0054  467.716   7.1853  471.930   9.2128  461.172   11.480  785.146   7.6660  776.075   9.6647 9.071594 12.33587 
1 1 1    9   10   19 o  694.117   5.8222  368.792   6.1858  364.303   7.7643  376.592   10.235  689.844   7.3533  701.316   9.5343 -11.47192 12.04057 
1 1 1    9   10   20 o  1511.98   9.1538  1750.32   21.185  1730.24   26.878  1783.25   34.422  1503.08   11.683  1525.61   14.741 -22.53296 18.80891 
1 1 1    9   10   21 o  561.238   5.2326  241.099   4.4950  244.182   6.2735  237.847   6.4437  564.777   7.2572  557.397   7.5527 7.380127 10.47424 
1 1 1    9   10   22 o  1001.27   6.9371  767.451   10.632  772.649   13.848  759.989   16.593  1004.56   9.0059  996.199   10.882 8.363708 14.12520 
1 1 1    9   10   23 o  341.675   6.5396   89.366   3.4200   92.156   4.3971   85.093   5.4415  346.943   8.2801  333.340   10.665 13.60367 13.50196 
1 1 1    9   10   24 o  1180.69   7.7706  1067.25   14.043  1041.19   21.470  1086.74   18.565  1165.89   12.031  1191.27   10.181 -25.37146 15.76112 
1 1 1    9   10   25 o  473.642   5.7302  171.724   4.1542  162.895   7.8190  175.196   4.9036  461.175   11.077  478.389   6.6967 -17.21408 12.94377 
1 1 1    9   10   26 o  1205.86   6.7174  1113.18   12.399  1132.18   19.394  1100.05   16.124  1215.85   10.421  1198.60   8.7888 17.25049 13.63234 
1 1 1    9   10   27 o  186.156   10.124   26.619   2.8739   22.551   4.3419   29.792   3.8340  170.658   16.842  196.769   12.799 -26.11108 21.15334 
1 1 1    9   10   28 o  659.074   5.8390  332.522   5.8904  332.099   10.309  332.728   7.1775  658.477   10.228  659.236   7.1131 -0.7587891 12.45857 
1 1 1    9   10   29 o  573.812   5.9516  252.061   5.2273  269.270   9.6263  244.864   6.2250  592.891   10.608  565.524   7.1915 27.36688 12.81554 
1 1 1    9   10   30 o  525.413   5.9024  211.336   4.7468  210.473   7.8399  211.836   5.9642  524.200   9.7712  525.987   7.4081 -1.787964 12.26196 
1 1 1    9   10   31 o  417.833   7.3124  133.679   4.6766  142.112   6.9929  126.856   6.2903  430.689   10.608  406.936   10.099 23.75284 14.64620 
1 1 1    9   10   32 f  173.985   12.711   23.329   3.3616   28.577   5.7179   20.556   4.1557  191.847   19.754  162.778   16.927 29.06871 26.01447 
1 1 1    9   10   33 o  945.795   6.3694  684.914   9.2208  682.117   14.508  686.810   11.943  943.534   10.046  946.954   8.2398 -3.420349 12.99295 
1 1 1    9   10   34 o  191.319   10.390   28.135   3.0313   30.893   4.4842   25.813   4.1136  200.092   14.745  182.797   14.830 17.29465 20.91311 
1 1 1    9   10   35 o  783.031   5.9892  469.492   7.1783  482.739   10.069  455.804   10.236  793.807   8.2874  771.306   8.6701 22.50073 11.99386 
1 1 1    9   10   36 o  252.018   8.1488   48.662   3.1434   52.298   4.6510   45.606   4.2648  261.108   11.637  243.840   11.427 17.26765 16.30953 
1 1 1    9   10   37 o  286.769   7.5492   63.006   3.3136   59.632   4.8151   66.043   4.5671  278.793   11.284  293.465   10.168 -14.67215 15.18886 
1 1 1    9   10   38 o  365.147   7.3920  102.164   4.1314  107.985   7.3853   99.512   4.9842  374.948   12.868  360.270   9.0386 14.67816 15.72556 
1 1 1    9   10   39 o  398.859   6.7299  121.890   4.1086  116.557   5.7889  127.304   5.8323  389.799   9.7025  407.408   9.3528 -17.60825 13.47641 
1 1 1    9   10   40 o  186.498   11.264   26.810   3.2003   27.796   4.2979   25.582   4.7947  189.410   14.946  181.234   17.502 8.175964 23.01529 
1 1 1    9   10   41 o  564.855   6.0441  244.458   5.2257  247.436   7.9906  242.233   6.9076  567.862   9.1931  562.035   8.0296 5.827026 12.20606 
1 1 1    9   10   42 o   64.967   22.328   3.0073   2.6837   7.2751   3.9002  -0.8306   3.6985   94.892   26.057   53.593   23.508 41.29918 35.09414 
1 1 1    9   10   43 o  328.324   7.8199   82.691   3.9298   78.092   5.0325   89.878   6.2910  318.789   10.314  341.750   12.027 -22.96140 15.84326 
1 1 1    9   10   44 o  262.626   7.9609   52.927   3.2001   51.448   4.5842   54.333   4.4694  258.544   11.584  265.771   10.987 -7.226715 15.96553 
1 1 1    9   10   45 o  182.496   10.952   25.723   3.0452   27.479   4.2767   23.917   4.3370  187.916   14.993  174.941   16.388 12.97519 22.21174 
1 1 1    9   10   46 o  341.870   8.4990   89.783   4.4473   93.195   7.4949   87.929   5.5252  347.164   14.105  337.954   10.681 9.210480 17.69259 
1 1 1    9   10   47 o   63.859   23.012   2.7460   2.8751   1.6786   4.1310   3.7487   4.0040   65.675   26.546   74.547   27.112 -8.871826 37.94397 
1 1 1    9   10   48 o  134.216   14.520   14.126   2.9353   15.982   4.2735   12.469   4.0388  141.342   20.339  124.044   22.081 17.29769 30.02118 
1 1 1    9   10   49 o  158.158   13.053   19.491   3.1317   22.530   4.6020   16.869   4.2739  168.823   18.091  145.352   19.719 23.47098 26.76098 
1 1 1    9   10   50 o  122.434   18.516   12.001   3.3616   15.754   5.3077   9.4875   4.3438  138.115   26.063  106.590   26.686 31.52491 37.30121 
1 1 1    9   10   51 o  351.335   8.0140   94.942   4.3097  101.805   6.6241   89.905   5.6749  362.712   11.932  341.174   10.867 21.53738 16.13866 
1 1 1    9   10   52 o  298.308   9.4024   68.609   4.2931   71.462   5.7199   64.927   6.4968  303.652   12.307  288.284   14.773 15.36844 19.22751 
1 1 1    9   10   53 o  213.537   11.481   35.412   3.7389   36.495   5.5718   34.525   5.0428  214.925   17.078  209.467   15.846 5.457520 23.29675 
1 1 1    9   10   54 o  280.645   9.7413   60.833   4.1845   58.551   6.0769   62.891   5.7705  273.426   14.573  284.245   13.263 -10.81949 19.70488 
1 1 1    9   10   55 o   88.812   27.280   6.5915   4.0658   10.602   5.2404   0.5260   6.4444  110.592   30.136   72.920   31.518 37.67221 43.60676 
1 1 1    9   10   56 o  125.599   20.477   12.931   3.8009   16.638   5.6985   9.9594   5.1016  139.479   27.669  106.879   29.972 32.60016 40.79114 
1 1 1    9   10   57 o  116.692   26.911   11.771   4.7085   8.4838   7.4290   13.978   6.0872  100.724   36.884  125.018   31.751 -24.29346 48.66782 
1 1 1    9   10   58 o  124.878   20.658   12.935   3.8105   11.903   5.4979   13.888   5.2860  115.053   30.664  125.708   28.170 -10.65525 41.63930 
1 1 1    9   10   59 o   46.901   21.658  -2.3310   3.6378  -3.2465   5.1308  -1.4057   5.1584   54.910   25.485   59.475   26.812 -4.564838 36.99162 
1 1 1    9   10   60 o   78.829   25.979   5.2868   3.6351   4.1385   4.9244   6.6618   5.3886   76.152   29.544   88.010   31.526 -11.85832 43.20588 
1 1 1    9   10   61 o  155.069   17.058   19.681   3.9818   17.871   5.7979   21.297   5.4779  140.450   27.953  157.069   23.508 -16.61859 36.52396 
1 1 1    9   10   62 o  170.227   15.303   23.516   3.9446   24.823   5.7583   22.360   5.4145  169.375   22.790  160.788   22.627 8.587463 32.11445 
1 1 1    9   11    0 o   66.088   20.101   4.1552   1.7753   4.1552   1.7753   4.1552   1.7753   66.088   20.101   66.088   20.101 0.000000 0.000000 
1 1 1    9   11    1 o  826.381   7.3151  522.898   9.2527  533.231   11.527  504.179   15.515  834.398   9.0256  811.068   12.497 23.33020 15.41556 
1 1 1    9   11    2 o  463.353   5.8029  164.361   4.1156  166.889   5.0460  159.338   7.1129  466.868   7.0613  456.069   10.189 10.79822 12.39697 
1 1 1    9   11    3 o   59.657   15.704   2.8285   1.4535   2.4400   1.7209   3.7957   2.7154   56.734   17.801   70.832   22.380 -14.09708 28.59631 
1 1 1    9   11    4 o  530.251   7.5740  215.293   6.1472  215.902   8.6696  214.678   8.7175  530.862   10.670  529.351   10.759 1.510986 15.15259 
1 1 1    9   11    5 o  600.172   7.9179  275.827   7.2737  283.006   10.412  268.983   10.165  607.762   11.193  592.512   11.209 15.24988 15.84021 
1 1 1    9   11    6 f  789.093   7.3789  476.765   8.9123  484.009   11.071  463.427   15.022  794.967   9.0986  777.618   12.621 17.34857 15.55898 
1 1 1    9   11    7 o  1103.47   11.126  932.872   18.792  932.872   18.792   0.0000   0.0000  1103.47   11.126  ?   ?  0.000000 11.12630 
1 1 1    9   11    8 o  845.912   7.7329  547.906   10.012  553.568   12.327  536.931   17.163  850.165   9.4732  836.979   13.397 13.18634 16.40801 
1 1 1    9   11    9 f  270.174   7.2463   55.887   2.9966   55.087   3.5618   57.825   5.5437  268.209   8.6761  274.683   13.186 -6.474304 15.78405 
1 1 1    9   11   10 o  455.991   6.5263  159.182   4.5550  161.503   7.8173  157.989   5.6048  459.159   11.123  454.240   8.0613 4.919556 13.73703 
1 1 1    9   11   11 o  849.068   7.8765  551.977   10.236  562.813   17.850  546.667   12.495  856.978   13.608  844.878   9.6623 12.10046 16.68939 
1 1 1    9   11   12 o  618.189   7.0427  292.571   6.6639  283.077   7.8664  316.700   12.541  608.031   8.4525  642.927   12.743 -34.89673 15.29186 
1 1 1    9   11   13 o  798.873   7.7232  488.611   9.4437  492.965   11.565  479.897   16.360  802.349   9.4170  791.403   13.506 10.94672 16.46476 
1 1 1    9   11   14 o  966.454   7.4566  715.071   11.030  726.917   15.678  703.459   15.522  974.263   10.513  958.410   10.581 15.85309 14.91607 
1 1 1    9   11   15 o  578.129   7.0728  255.867   6.2587  249.689   10.516  259.255   7.7882  570.952   12.034  581.900   8.7441 -10.94830 14.87509 
1 1 1    9   11   16 o  279.803   6.2718   59.929   2.6860   60.498   3.4587   59.066   4.2636  281.107   8.0384  277.733   10.030 3.373932 12.85334 
1 1 1    9   11   17 o  1025.97   7.6419  805.825   12.001  791.680   13.602  855.513   25.493  1016.88   8.7391  1056.60   15.763 -39.72345 18.02372 
1 1 1    9   11   18 f  474.591   7.1615  172.422   5.2023  168.322   6.4515  180.044   8.7961  468.879   8.9894  484.855   11.853 -15.97662 14.87588 
1 1 1    9   11   19 o  400.921   5.6977  123.035   3.4965  125.486   4.3573  118.603   5.8594  404.877   7.0312  393.571   9.7265 11.30536 12.00175 
1 1 1    9   11   20 o  692.712   5.4097  367.291   5.7359  374.003   8.0720  360.446   8.1521  698.962   7.5450  686.171   7.7619 12.79095 10.82465 
1 1 1    9   11   21 o  343.122   6.1576   90.121   3.2339   88.071   3.9673   94.181   5.5829  339.179   7.6417  350.700   10.401 -11.52148 12.90609 
1 1 1    9   11   22 o  694.563   7.5147  369.317   7.9890  372.992   9.8729  362.346   13.597  697.954   9.2416  687.765   12.916 10.18878 15.88198 
1 1 1    9   11   23 o  167.735   9.6707   21.616   2.4723   21.546   3.7472   21.669   3.2900  167.029   14.811  167.689   12.918 -0.6598053 19.65246 
1 1 1    9   11   24 o  588.895   6.2861  265.474   5.6662  266.005   9.3341  265.164   7.1302  589.360   10.347  588.509   7.9155 0.8507080 13.02763 
1 1 1    9   11   25 o  280.545   7.0516   60.254   3.0280   56.883   4.2368   63.773   4.3293  272.537   10.156  288.577   9.8013 -16.04077 14.11450 
1 1 1    9   11   26 o  996.392   7.2803  760.084   11.103  769.621   14.390  746.054   17.454  1002.50   9.3781  986.875   11.555 15.62616 14.88169 
1 1 1    9   11   27 o  739.195   6.0871  418.290   6.8872  425.462   9.8553  411.444   9.6286  745.401   8.6379  733.021   8.5817 12.37927 12.17621 
1 1 1    9   11   28 o  350.204   6.7178   93.894   3.6009   98.154   6.3202   91.846   4.3817  357.935   11.536  346.332   8.2657 11.60297 14.19162 
1 1 1    9   11   29 o  583.957   5.9893  261.056   5.3533  270.249   9.6509  256.971   6.4339  593.955   10.616  579.328   7.2557 14.62732 12.85829 
1 1 1    9   11   30 o  254.288   10.006   49.533   3.8945   50.488   6.1181   48.882   5.0497  256.079   15.685  252.188   13.127 3.890839 20.45307 
1 1 1    9   11   31 o  133.311   20.117   13.959   3.9771   15.409   5.6422   12.527   5.6070  138.982   27.496  124.915   29.751 14.06718 40.51139 
1 1 1    9   11   32 f  245.637   8.7361   46.216   3.2846   57.487   5.6705   40.525   4.0294  273.798   13.531  229.947   11.448 43.85118 17.72408 
1 1 1    9   11   33 o  292.710   7.9902   65.623   3.5799   77.653   6.3205   59.941   4.3438  318.206   12.977  279.684   10.147 38.52206 16.47302 
1 1 1    9   11   34 o  426.813   6.9470  139.511   4.5385  146.003   7.4790  135.727   5.7099  436.395   11.197  420.896   8.8631 15.49945 14.28014 
1 1 1    9   11   35 o  436.670   6.6817  146.035   4.4659  146.689   7.6334  145.695   5.5067  437.346   11.403  436.079   8.2501 1.267151 14.07457 
1 1 1    9   11   36 o  346.664   7.3810   92.064   3.9165   88.511   6.5692   94.023   4.8782  339.583   12.638  350.242   9.0997 -10.65927 15.57354 
1 1 1    9   11   37 o  532.917   6.5238  217.542   5.3214  234.752   9.8580  210.464   6.3216  553.064   11.645  524.071   7.8808 28.99377 14.06110 
1 1 1    9   11   38 o  101.823   18.038   8.2285   2.7084   5.2564   3.9591   10.843   3.7133   83.446   27.093  116.590   21.603 -33.14379 34.65144 
1 1 1    9   11   39 o  224.273   8.6621   38.570   2.9735   45.236   4.3992   32.963   4.0348  242.674   11.844  206.697   12.816 35.97710 17.45073 
1 1 1    9   11   40 o  259.309   9.0507   51.584   3.5923   47.021   4.8297   57.235   5.3744  246.948   12.822  272.807   12.871 -25.85968 18.16718 
1 1 1    9   11   41 o  525.962   6.0869  211.968   4.9003  219.168   7.5323  206.684   6.4524  534.407   9.2084  519.122   8.1205 15.28455 12.27754 
1 1 1    9   11   42 o  375.718   7.1528  108.234   4.1134  110.372   5.4470  105.396   6.2751  379.159   9.3857  370.286   11.072 8.873505 14.51453 
1 1 1    9   11   43 o  333.848   7.7933   85.505   3.9823   83.819   5.1191   88.088   6.3378  330.266   10.127  338.255   12.241 -7.988892 15.88693 
1 1 1    9   11   44 o  214.043   9.5619   35.204   3.1327   35.168   4.3599   35.243   4.5042  213.105   13.435  213.247   13.875 -0.1418610 19.31379 
1 1 1    9   11   45 o  224.938   10.789   38.945   3.7146   40.403   6.5627   38.257   4.5059  226.988   19.066  222.228   13.308 4.759872 23.25103 
1 1 1    9   11   46 o  251.159   8.5922   48.471   3.3031   46.668   4.6624   50.287   4.6802  245.600   12.443  255.341   11.975 -9.740952 17.26955 
1 1 1    9   11   47 o  377.438   6.7843  109.328   3.9194  108.626   5.6376  109.984   5.4527  375.661   9.8046  378.084   9.4222 -2.423248 13.59809 
1 1 1    9   11   48 o  246.957   8.6794   46.903   3.2808   52.122   4.8134   42.374   4.4836  259.740   12.107  233.780   12.576 25.96011 17.45711 
1 1 1    9   11   49 o  188.636   12.126   27.620   3.4825   36.063   5.9884   23.305   4.2808  213.822   18.479  172.159   16.445 41.66356 24.73702 
1 1 1    9   11   50 o  202.055   10.961   31.615   3.3772   31.280   5.0748   31.881   4.5246  199.426   16.781  201.961   14.738 -2.535538 22.33456 
1 1 1    9   11   51 o  278.688   8.8121   59.809   3.7590   59.607   5.4357   59.994   5.2038  277.265   12.808  278.327   12.215 -1.062378 17.69923 
1 1 1    9   11   52 o  149.542   16.570   17.716   3.7290   18.727   5.0844   16.540   5.4856  151.701   22.586  140.909   26.404 10.79248 34.74616 
1 1 1    9   11   53 o   48.110   21.533  -1.1799   3.2612  -0.4125   4.7614  -1.8579   4.4758   61.323   26.791   55.232   24.930 6.090435 36.59643 
1 1 1    9   11   54 o   76.457   24.778   4.6746   3.3124   7.1108   4.7020   2.2745   4.6670   92.473   29.475   69.952   28.237 22.52106 40.81742 
1 1 1    9   11   55 o  110.722   24.587   10.337   4.0584   13.606   5.2031   5.2571   6.4854  126.099   27.714   87.984   33.969 38.11464 43.83996 
1 1 1    9   11   56 o  286.553   9.9426   63.582   4.3609   63.940   6.1447   63.217   6.1900  285.708   14.051  283.639   14.304 2.068756 20.05079 
1 1 1    9   11   57 o  203.147   14.671   32.639   4.5312   28.256   7.2563   35.440   5.8013  182.274   26.810  209.923   18.236 -27.64862 32.42407 
1 1 1    9   11   58 o  129.059   18.812   13.642   3.6068   11.312   5.2082   15.790   4.9998  112.375   29.795  135.917   24.953 -23.54148 38.86383 
1 1 1    9   11   59 o   90.786   24.761   7.1687   3.5358   9.0272   4.9586   5.2461   5.0434  100.081   29.999   81.729   30.310 18.35223 42.64549 
1 1 1    9   11   60 o  113.277   21.784   10.955   3.6399   10.834   4.9776   11.095   5.3361  108.636   29.274  109.208   30.664 -0.5717163 42.39384 
1 1 1    9   11   61 o  146.931   18.886   17.981   4.1491   15.815   6.5327   19.446   5.3718  127.370   33.178  149.100   24.381 -21.73016 41.17279 
1 1 1    9   11   62 o  129.474   20.217   14.287   3.8755   11.827   5.1357   17.540   5.9064  111.282   29.626  136.796   29.103 -25.51443 41.52921 
1 1 1    9   12    0 o  719.965   11.869  397.263   13.071  397.263   13.071  397.263   13.071  719.965   11.869  719.965   11.869 0.000000 0.000000 
1 1 1    9   12    1 o  1089.51   8.8573  909.058   14.771  916.844   18.253  894.289   25.141  1093.97   10.901  1079.92   15.210 14.05920 18.71267 
1 1 1    9   12    2 o  670.388   6.6431  344.077   6.8166  344.539   8.3393  343.147   11.833  670.776   8.1223  669.227   11.552 1.549133 14.12177 
1 1 1    9   12    3 o  340.452   5.9958   88.732   3.1245   89.598   3.7968   86.916   5.4993  342.085   7.2512  336.839   10.666 5.246185 12.89781 
1 1 1    9   12    4 o  275.432   7.7398   58.088   3.2630   58.371   4.5130   57.778   4.7233  276.040   10.681  274.620   11.237 1.419495 15.50343 
1 1 1    9   12    5 o  1143.22   16.009  1002.33   28.013  1002.33   28.013   0.0000   0.0000  1143.22   16.009  ?   ?  0.000000 16.00905 
1 1 1    9   12    6 o  253.175   8.3770   49.082   3.2462   49.082   3.2462   0.0000   0.0000  253.175   8.3770  ?   ?  0.000000 8.377010 
1 1 1    9   12    7 o  507.665   6.4721  197.303   5.0291  197.787   6.1474  196.326   8.7450  508.245   7.9022  506.237   11.286 2.007965 13.77741 
1 1 1    9   12    8 o  517.765   6.5861  205.232   5.2195  200.713   6.2526  215.620   9.4799  511.994   7.9785  530.523   11.674 -18.52841 14.14024 
1 1 1    9   12    9 f   77.395   17.895   4.7792   2.0775   5.3409   2.3878   3.0296   4.2144   81.795   19.371   73.404   27.611 8.391373 33.72843 
1 1 1    9   12   10 o  563.328   6.8290  242.941   5.8883  239.203   7.0372  251.666   10.753  558.938   8.2256  573.153   12.257 -14.21478 14.76115 
1 1 1    9   12   11 o  1110.65   11.379  944.833   19.344  920.641   26.340  973.158   28.501  1095.92   15.702  1126.65   16.528 -30.72742 22.79743 
1 1 1    9   12   12 o  1328.98   10.570  1352.62   21.500  1361.86   37.355  1348.04   26.292  1332.60   18.314  1326.50   12.949 6.095703 22.42934 
1 1 1    9   12   13 o  1186.01   8.4831  1076.96   15.400  1054.96   21.345  1100.85   22.240  1173.60   11.882  1198.83   12.120 -25.23071 16.97304 
1 1 1    9   12   14 o  1017.52   8.9010  792.716   13.863  788.503   23.831  794.871   17.043  1014.37   15.349  1018.79   10.929 -4.416443 18.84259 
1 1 1    9   12   15 o  651.080   7.3551  324.514   7.3298  315.759   12.366  329.256   9.1010  642.058   12.583  655.771   9.0670 -13.71234 15.50931 
1 1 1    9   12   16 o  1426.91   9.7695  1559.00   21.337  1561.27   30.169  1556.72   30.182  1427.60   13.806  1425.52   13.833 2.083862 19.54386 
1 1 1    9   12   17 o  1103.46   7.2707  932.116   12.280  936.349   15.777  925.609   19.560  1105.87   9.3206  1099.37   11.624 6.495605 14.89939 
1 1 1    9   12   18 o  513.309   5.5842  201.682   4.3875  203.827   5.4605  197.774   7.3699  516.010   6.9136  508.237   9.4738 7.773376 11.72825 
1 1 1    9   12   19 o  299.472   6.5621   68.651   3.0079   70.271   3.4733   63.792   6.0159  302.974   7.4897  288.572   13.620 14.40213 15.54340 
1 1 1    9   12   20 o  928.642   8.4662  660.240   12.034  668.956   14.850  643.564   20.540  934.662   10.380  916.493   14.642 18.16919 17.94772 
1 1 1    9   12   21 o  749.268   7.7945  429.794   8.9391  439.039   11.064  412.416   15.170  757.219   9.5461  733.716   13.508 23.50330 16.54052 
1 1 1    9   12   22 o  544.726   5.9216  227.135   4.9373  224.796   6.2106  231.152   8.1387  541.881   7.4879  549.428   9.6778 -7.547058 12.23636 
1 1 1    9   12   23 o  1318.93   9.4775  1332.06   19.133  1305.59   26.430  1361.20   27.733  1305.42   13.227  1332.89   13.594 -27.47070 18.96725 
1 1 1    9   12   24 o  372.869   8.1149  106.448   4.6313  104.247   6.8176  108.335   6.3111  368.897   12.074  376.092   10.963 -7.195374 16.30889 
1 1 1    9   12   25 o  336.486   7.3871   86.684   3.8046   86.570   4.7173   86.895   6.4354  336.232   9.1661  336.779   12.484 -0.5468445 15.48779 
1 1 1    9   12   26 o  1014.27   6.6975  787.571   10.398  807.175   14.928  769.100   14.490  1026.65   9.5000  1002.14   9.4468 24.50275 13.39744 
1 1 1    9   12   27 o  1014.64   6.7635  788.171   10.504  795.988   14.935  780.519   14.776  1019.48   9.5708  1009.52   9.5627 9.953674 13.52943 
1 1 1    9   12   28 o  403.156   7.1939  124.444   4.4392  124.081   6.8221  124.711   5.8463  402.449   11.075  403.524   9.4655 -1.074982 14.56870 
1 1 1    9   12   29 o  993.801   6.8593  756.174   10.434  775.997   15.051  737.832   14.477  1006.52   9.7693  981.472   9.6371 25.05219 13.72269 
1 1 1    9   12   30 o  236.866   10.895   42.988   3.9502   39.020   5.2287   48.263   6.0294  225.031   15.271  250.326   15.817 -25.29425 21.98597 
1 1 1    9   12   31 o  168.205   13.230   21.827   3.3786   23.319   4.8426   20.411   4.7161  173.262   18.548  161.841   19.426 11.42091 26.85940 
1 1 1    9   12   32 o  345.828   7.3133   91.587   3.8712   96.393   6.8125   89.295   4.7046  354.567   12.553  341.418   9.0025 13.14954 15.44719 
1 1 1    9   12   33 f  349.829   7.2694   93.726   3.8925   94.605   6.9999   93.332   4.6833  351.194   13.022  349.037   8.7662 2.156311 15.69775 
1 1 1    9   12   34 o  519.904   7.4657  207.040   5.9410  214.787   8.4234  199.371   8.3805  529.331   10.397  509.953   10.737 19.37772 14.94541 
1 1 1    9   12   35 o  316.913   7.5139   76.939   3.6448   83.578   6.3800   73.722   4.4408  330.010   12.631  310.134   9.3550 19.87549 15.71787 
1 1 1    9   12   36 o  1067.52   7.1314  873.025   11.652  892.005   20.750  864.283   14.083  1077.93   12.577  1061.91   8.6641 16.01807 15.27221 
1 1 1    9   12   37 o  449.574   7.5826  154.880   5.2178  157.832   15.246  154.488   5.5532  451.701   22.051  448.967   8.0808 2.734222 23.48532 
1 1 1    9   12   38 o  396.078   6.8711  120.202   4.1656  128.014   7.1744  116.229   5.1164  408.316   11.479  389.349   8.5852 18.96771 14.33462 
1 1 1    9   12   39 o  183.636   12.586   26.042   3.5162   24.414   5.5431   27.138   4.5485  176.341   20.946  186.964   16.050 -10.62366 26.38836 
1 1 1    9   12   40 o  173.907   12.403   23.372   3.2797   32.941   6.4500   20.035   3.8089  205.083   20.837  160.439   15.712 44.64447 26.09679 
1 1 1    9   12   41 o   50.368   20.546   0.7508   2.5012  -1.2813   3.6495   2.5507   3.4347   51.694   22.982   66.181   24.920 -14.48650 33.89998 
1 1 1    9   12   42 o  247.085   8.0766   46.838   3.0545   43.704   4.4384   49.659   4.2102  237.987   12.226  254.167   10.822 -16.18010 16.32741 
1 1 1    9   12   43 o  396.134   7.1774  120.353   4.3519  120.049   5.6596  120.793   6.8071  395.336   9.3529  396.243   11.224 -0.9063110 14.60975 
1 1 1    9   12   44 o  468.574   6.6575  168.379   4.7748  162.390   6.8149  174.155   6.6920  459.639   9.6866  476.102   9.1831 -16.46347 13.34765 
1 1 1    9   12   45 o  327.637   8.1473   82.433   4.0858   79.769   6.8952   83.874   5.0722  321.231   14.024  330.199   10.036 -8.967987 17.24470 
1 1 1    9   12   46 o  163.540   12.080   20.748   3.0024   24.992   4.2817   16.643   4.2111  178.774   15.811  144.690   19.512 34.08354 25.11386 
1 1 1    9   12   47 o  186.555   10.554   26.903   3.0012   24.067   4.2893   29.624   4.2008  175.205   16.177  195.034   14.169 -19.82893 21.50481 
1 1 1    9   12   48 o  139.538   13.641   15.223   2.8761   10.427   4.2186   19.388   3.9315  112.331   25.161  156.906   16.623 -44.57462 30.15598 
1 1 1    9   12   49 o  276.702   9.0786   58.941   3.8450   63.460   6.5066   56.516   4.7663  285.316   14.951  270.468   11.513 14.84787 18.87022 
1 1 1    9   12   50 o  273.786   8.4355   57.679   3.5350   50.926   5.0083   64.383   4.9904  256.369   12.763  288.643   11.295 -32.27490 17.04350 
1 1 1    9   12   51 o  102.158   21.946   8.5926   3.3292   3.8855   4.2934   15.691   5.2724   75.731   27.989  137.485   26.007 -61.75403 38.20690 
1 1 1    9   12   52 o  272.713   9.4337   57.366   3.9378   52.862   5.7625   61.312   5.3937  260.016   14.537  281.098   12.536 -21.08203 19.19590 
1 1 1    9   12   53 o  153.835   14.776   18.644   3.4364   24.304   5.0571   13.788   4.6839  174.215   19.288  128.722   24.671 45.49295 31.31579 
1 1 1    9   12   54 o   73.390   30.558   1.8647   5.6854   3.2387   7.0632  -0.6639   9.5817   83.589   34.362   83.842   37.258 -0.2528076 50.68438 
1 1 1    9   12   55 o  248.170   10.416   47.705   3.9568   38.326   5.6635   56.648   5.5303  219.687   16.974  269.375   13.413 -49.68771 21.63415 
1 1 1    9   12   56 o  130.300   21.332   14.016   4.1073   5.9602   6.8794   18.477   5.1199   90.791   35.004  149.098   23.188 -58.30713 41.98817 
1 1 1    9   12   57 o   58.105   24.198   1.0656   3.5661   0.7816   4.7821   1.4213   5.3524   64.162   27.431   69.173   29.277 -5.010574 40.12009 
1 1 1    9   12   58 o   69.625   25.021   3.6680   3.3967   7.2464   4.7842   0.0308   4.8234   91.254   29.790   61.695   26.959 29.55880 40.17760 
1 1 1    9   12   59 o   57.176   23.870   1.0872   3.4822  -5.5388   4.8711   8.0126   4.9800   48.461   23.183   94.563   30.354 -46.10196 38.19453 
1 1 1    9   12   60 o  172.074   15.017   23.804   3.9156   22.186   5.7109   25.239   5.3788  160.380   24.002  173.663   20.639 -13.28320 31.65567 
1 1 1    9   12   61 o  114.039   21.576   11.222   3.6282   8.9189   5.2312   13.357   5.0363   96.814   31.114  120.434   27.873 -23.62048 41.77256 
1 1 1    9   12   62 o   98.076   24.856   8.7412   3.7362   6.0116   5.0428   12.063   5.5628   82.225   30.345  110.830   31.375 -28.60509 43.64867 
1 1 1    9   13    0 o  795.741   12.618  485.262   15.359  485.262   15.359  485.262   15.359  795.741   12.618  795.741   12.618 0.000000 0.000000 
1 1 1    9   13    1 o  370.729   5.9284  105.213   3.3640  105.729   4.1235  104.186   5.8172  371.612   7.2494  368.815   10.305 2.797333 12.59927 
1 1 1    9   13    2 o  619.402   6.5034  293.714   6.1657  297.590   7.5924  286.206   10.566  623.426   7.9565  611.237   11.294 12.18945 13.81485 
1 1 1    9   13    3 o  594.735   7.8305  270.824   7.1282  270.824   7.1282   0.0000   0.0000  594.735   7.8305  ?   ?  0.000000 7.830462 
1 1 1    9   13    4 o  567.806   11.008  246.960   9.5668  246.960   9.5668   0.0000   0.0000  567.806   11.008  ?   ?  0.000000 11.00766 
1 1 1    9   13    5 o  904.417   9.7395  626.431   13.483  626.153   18.938  626.718   19.200  903.916   13.688  904.307   13.871 -0.3911133 19.48736 
1 1 1    9   13    6 o  547.368   6.5690  229.367   5.5036  224.711   6.6759  239.243   9.7234  541.744   8.0509  558.860   11.367 -17.11658 13.92930 
1 1 1    9   13    7 o  682.952   7.0768  357.082   7.3977  352.854   8.9941  365.922   13.007  678.841   8.6560  691.118   12.296 -12.27783 15.03708 
1 1 1    9   13    8 o  579.193   6.7808  256.813   6.0114  255.348   7.3557  259.760   10.431  577.495   8.3216  582.333   11.703 -4.838501 14.35983 
1 1 1    9   13    9 o  162.150   10.087   20.213   2.4912   22.371   3.0082   15.501   4.4444  170.506   11.595  140.539   21.331 29.96764 24.27883 
1 1 1    9   13   10 o  926.827   8.3104  657.684   11.789  656.304   14.387  660.505   20.569  925.759   10.153  928.420   14.474 -2.661072 17.68038 
1 1 1    9   13   11 o  1574.67   10.479  1898.86   25.256  1896.58   35.635  1901.16   35.801  1573.23   14.798  1575.12   14.850 -1.890381 20.96425 
1 1 1    9   13   12 o  1098.20   8.0547  923.343   13.540  902.372   18.689  946.505   19.642  1085.48   11.249  1111.68   11.543 -26.20630 16.11776 
1 1 1    9   13   13 o  716.239   9.2600  392.784   10.152   0.0000   0.0000  392.784   10.152  ?   ?   716.239   9.2600 0.000000 9.259995 
1 1 1    9   13   14 o  1552.49   14.741  1846.65   35.030   0.0000   0.0000  1846.65   35.030  ?   ?   1552.49   14.741 0.000000 14.74133 
1 1 1    9   13   15 o  986.218   7.6409  744.585   11.534  732.757   16.040  757.250   16.598  978.213   10.713  994.417   10.905 -16.20410 15.28648 
1 1 1    9   13   16 o  539.348   6.3754  222.673   5.2631  220.252   7.2796  225.325   7.6184  536.357   8.8671  542.491   9.1749 -6.134399 12.75947 
1 1 1    9   13   17 o  809.269   7.0251  501.341   8.7019  502.199   12.240  500.465   12.373  809.862   9.8744  808.457   9.9991 1.405090 14.05299 
1 1 1    9   13   18 o  994.495   9.0121  757.229   13.718  778.150   24.234  747.364   16.641  1007.71   15.711  987.893   11.005 19.81409 19.18244 
1 1 1    9   13   19 o  353.859   6.6168   95.852   3.5838   94.969   4.6751   97.111   5.5810  352.196   8.6724  356.117   10.239 -3.921661 13.41798 
1 1 1    9   13   20 o  825.620   8.0358  521.862   10.155  528.691   12.499  508.602   17.418  830.930   9.8275  814.768   13.967 16.16235 17.07775 
1 1 1    9   13   21 o  1053.90   7.9912  850.355   12.891  844.928   14.785  867.560   26.324  1050.47   9.1952  1063.90   16.165 -13.42834 18.59766 
1 1 1    9   13   22 o  800.256   8.3625  490.325   10.243  487.287   12.659  496.085   17.432  797.681   10.368  804.620   14.154 -6.938904 17.54539 
1 1 1    9   13   23 o  1003.29   8.2349  770.701   12.646  801.885   18.274  742.043   17.518  1023.16   11.669  984.247   11.628 38.91437 16.47348 
1 1 1    9   13   24 o  1144.00   8.6955  1002.11   15.226  994.350   17.240  1029.63   32.462  1139.47   9.8849  1158.57   18.306 -19.09314 20.80410 
1 1 1    9   13   25 o  828.927   6.7562  526.037   8.5721  535.867   11.115  511.612   13.465  836.545   8.6810  817.274   10.764 19.27118 13.82843 
1 1 1    9   13   26 f  231.006   8.6008   40.863   3.0411   39.348   4.2134   42.512   4.3939  226.287   12.210  235.232   12.246 -8.944626 17.29279 
1 1 1    9   13   27 o  183.741   11.278   25.962   3.1563   21.990   4.5712   29.582   4.3635  168.328   18.022  195.884   14.660 -27.55537 23.23160 
1 1 1    9   13   28 o  1044.53   8.4555  835.521   13.519  826.075   18.640  846.002   19.635  1038.31   11.729  1050.70   12.209 -12.39563 16.92992 
1 1 1    9   13   29 o  602.617   7.0295  278.052   6.4839  276.843   8.3436  279.895   10.302  601.212   9.0668  604.397   11.136 -3.184937 14.36047 
1 1 1    9   13   30 o  1254.28   7.7520  1204.76   14.883  1226.65   21.423  1184.34   20.690  1265.22   11.062  1243.23   10.873 21.98657 15.51105 
1 1 1    9   13   31 o  850.607   6.6334  554.008   8.6364  548.141   12.170  559.959   12.258  845.876   9.3998  854.950   9.3671 -9.073120 13.27017 
1 1 1    9   13   32 o  511.867   6.7977  200.637   5.3258  197.524   7.7028  203.489   7.3718  507.710   9.9121  515.356   9.3454 -7.646027 13.62295 
1 1 1    9   13   33 o  317.241   8.9003   77.112   4.3218   71.870   6.1023   82.387   6.1216  306.067   13.026  327.747   12.203 -21.68005 17.84882 
1 1 1    9   13   34 o  203.289   12.275   31.822   3.8016   34.020   5.8891   30.251   4.9777  209.430   18.564  197.675   16.605 11.75473 24.90686 
1 1 1    9   13   35 o  560.010   7.8554  240.290   6.7334  248.936   12.031  236.345   8.1252  569.308   13.806  555.240   9.5606 14.06854 16.79320 
1 1 1    9   13   36 o  244.483   10.419   45.850   3.8991   48.037   13.759   45.659   4.0657  244.187   38.054  243.947   10.889 0.2397461 39.58099 
1 1 1    9   13   37 o  968.784   7.1438  719.151   10.593  748.886   20.782  708.714   12.313  986.989   13.757  961.511   8.3662 25.47742 16.10078 
1 1 1    9   13   38 o  330.491   8.3134   83.745   4.2054   87.727   6.3587   80.649   5.6067  337.889   12.295  324.072   11.303 13.81693 16.70104 
1 1 1    9   13   39 o  319.970   7.4896   78.483   3.6681   78.236   6.2298   78.614   4.5381  318.964   12.760  320.098   9.2624 -1.133362 15.76768 
1 1 1    9   13   40 o  312.130   7.9580   74.714   3.8020   68.673   6.7887   77.475   4.5892  298.483   14.859  317.711   9.4370 -19.22836 17.60266 
1 1 1    9   13   41 o  226.947   9.2552   39.539   3.2150   39.850   5.5136   39.379   3.9574  226.597   16.000  226.013   11.477 0.5843658 19.69040 
1 1 1    9   13   42 o  226.482   11.309   39.456   3.9205   40.411   5.8874   38.695   5.2552  227.869   17.002  223.277   15.472 4.592163 22.98863 
1 1 1    9   13   43 o  260.761   8.9947   52.224   3.5900   55.363   6.0244   50.495   4.4705  267.283   14.783  256.132   11.403 11.15048 18.66996 
1 1 1    9   13   44 o  120.180   16.531   11.402   2.9603   14.974   5.2660   9.7511   3.5795  135.476   26.344  109.726   22.078 25.74995 34.37164 
1 1 1    9   13   45 o  153.229   13.818   18.296   3.2060   18.616   5.6321   18.143   3.8994  151.588   25.156  151.871   17.071 -0.2834015 30.40074 
1 1 1    9   13   46 o  240.458   8.5543   44.443   3.1484   40.688   4.7064   47.485   4.2358  228.955   13.489  248.175   11.151 -19.22029 17.50152 
1 1 1    9   13   47 o  236.641   8.7907   43.069   3.1841   48.008   4.8897   39.432   4.1955  248.820   12.883  225.599   12.195 23.22037 17.73972 
1 1 1    9   13   48 o   38.249   17.910  -2.5454   2.6265  -0.8000   3.8950  -4.0009   3.5569   54.657   24.046   42.995   20.351 11.66237 31.50196 
1 1 1    9   13   49 o  144.921   14.376   16.469   3.1468   14.720   5.3213   17.409   3.9022  133.044   27.052  148.200   17.543 -15.15593 32.24253 
1 1 1    9   13   50 o  168.363   11.986   22.045   3.0685   20.776   4.4546   23.192   4.2330  161.691   18.322  171.568   16.316 -9.876938 24.53403 
1 1 1    9   13   51 o  193.736   12.209   29.197   3.6019   32.708   4.7127   24.265   5.5856  204.223   15.185  173.552   21.486 30.67110 26.31009 
1 1 1    9   13   52 o  296.103   8.8061   67.572   3.9911   65.932   5.9649   68.901   5.3704  291.161   13.385  298.185   11.767 -7.023956 17.82126 
1 1 1    9   13   53 o  248.865   9.8637   47.846   3.7573   49.931   5.3757   45.855   5.2535  252.686   13.953  242.012   14.245 10.67374 19.94021 
1 1 1    9   13   54 o  153.893   16.924   18.874   3.9206   18.835   4.9483   18.940   6.4261  151.754   21.940  148.705   29.275 3.048370 36.58395 
1 1 1    9   13   55 o  200.714   12.776   31.533   3.9047   31.153   5.4033   31.949   5.6490  197.321   18.092  199.547   18.714 -2.225998 26.02916 
1 1 1    9   13   56 o  210.677   15.405   35.171   4.9330   17.399   9.4411   41.845   5.7856  134.097   41.634  229.274   16.599 -95.17711 44.82055 
1 1 1    9   13   57 o   82.075   26.895   5.6395   3.8982  -0.9754   6.6884   9.0425   4.7973   68.927   30.845  101.059   29.305 -32.13184 42.54607 
1 1 1    9   13   58 o   64.761   24.709   2.7688   3.4045   3.3257   4.7592   2.1851   4.8721   72.912   28.818   69.001   28.472 3.910355 40.51116 
1 1 1    9   13   59 o   60.795   24.260   2.0440   3.4026   1.9375   4.7327   2.1581   4.8956   66.900   27.870   68.424   28.412 -1.524117 39.79901 
1 1 1    9   13   60 o   50.287   22.744  -1.2140   3.7467   2.9770   6.0233  -3.8591   4.7851   74.699   31.306   50.656   23.863 24.04290 39.36390 
1 1 1    9   13   61 o  127.533   18.046   13.561   3.4243   18.813   4.8693   8.4226   4.8166  147.667   22.233   94.421   29.804 53.24657 37.18288 
1 1 1    9   14    1 o  456.382   10.790  159.526   7.5377  159.526   7.5377   0.0000   0.0000  456.382   10.790  ?   ?  0.000000 10.79047 
1 1 1    9   14    2 o  956.107   10.019  700.068   14.663  700.068   14.663   0.0000   0.0000  956.107   10.019  ?   ?  0.000000 10.01940 
1 1 1    9   14    3 o  1489.16   11.392  1698.60   25.966  1704.26   31.901  1687.50   44.695  1491.32   13.976  1483.04   19.690 8.279053 24.14527 
1 1 1    9   14    4 o  1062.16   10.812  864.056   17.577  841.772   24.118  889.301   25.670  1048.01   15.035  1077.13   15.570 -29.12378 21.64468 
1 1 1    9   14    5 o  901.476   9.7734  622.312   13.486  606.953   18.553  639.517   19.637  890.032   13.618  913.562   14.043 -23.53033 19.56196 
1 1 1    9   14    6 f  281.217   7.1167   60.542   3.0633   63.279   3.7389   54.954   5.3428  287.483   8.4968  267.828   13.033 19.65564 15.55807 
1 1 1    9   14    7 o  482.808   6.6256  178.444   4.8963  181.064   6.0668  173.550   8.2925  486.307   8.1504  476.020   11.381 10.28723 13.99864 
1 1 1    9   14    8 o  964.196   8.5042  711.789   12.551  696.452   15.081  746.339   22.635  953.657   10.332  986.888   14.985 -33.23016 18.20140 
1 1 1    9   14    9 o  750.594   7.5017  431.307   8.6185  428.061   10.498  438.015   15.094  747.707   9.1730  756.169   13.041 -8.462463 15.94427 
1 1 1    9   14   10 o  926.579   8.3612  657.308   11.858  687.165   15.125  609.683   19.103  947.289   10.432  892.076   13.991 55.21307 17.45144 
1 1 1    9   14   11 o  1004.84   7.6108  772.983   11.706  780.474   16.686  765.724   16.426  1009.55   10.798  999.964   10.732 9.581482 15.22426 
1 1 1    9   14   12 o  391.785   7.2579  117.504   4.3524  115.198   7.4851  118.682   5.3498  387.816   12.610  393.717   8.8773 -5.901367 15.42102 
1 1 1    9   14   13 o  1444.47   11.393  1597.87   25.190  1599.97   43.767  1596.83   30.803  1444.46   19.796  1443.76   13.939 0.7011719 24.21058 
1 1 1    9   14   14 o  810.793   8.0016  503.268   9.9302  497.685   16.763  506.286   12.326  806.040   13.587  813.152   9.9032 -7.111816 16.81290 
1 1 1    9   14   15 o  965.685   8.7483  713.965   12.931  721.963   22.315  709.921   15.866  970.719   15.018  962.852   10.766 7.866394 18.47858 
1 1 1    9   14   16 o  1103.29   9.5003  932.011   16.043  943.982   27.922  926.111   19.602  1109.85   16.437  1099.67   11.646 10.17969 20.14434 
1 1 1    9   14   17 o  1072.82   9.3955  881.237   15.428  877.254   26.497  883.281   18.977  1069.91   16.180  1073.94   11.545 -4.026978 19.87632 
1 1 1    9   14   18 f  373.517   7.1067  106.801   4.0630  106.861   5.5807  106.734   5.9268  373.576   9.7598  373.342   10.372 0.2339172 14.24161 
1 1 1    9   14   19 o  970.917   8.9026  721.767   13.230  707.688   15.941  752.927   23.716  961.298   10.834  991.196   15.632 -29.89758 19.01919 
1 1 1    9   14   20 o  527.894   5.8634  213.315   4.7376  215.968   5.9518  208.725   7.8271  531.137   7.3210  522.090   9.7946 9.046936 12.22827 
1 1 1    9   14   21 o  471.634   10.023  170.341   7.2352  170.341   7.2352   0.0000   0.0000  471.634   10.023  ?   ?  0.000000 10.02256 
1 1 1    9   14   22 o  1254.97   9.2336  1206.00   17.737  1205.18   24.924  1206.84   25.246  1254.20   12.983  1255.05   13.142 -0.8494873 18.47362 
1 1 1    9   14   23 o  774.910   8.6075  459.794   10.209  437.116   12.195  512.932   18.667  755.462   10.546  818.047   14.908 -62.58521 18.26147 
1 1 1    9   14   24 o  755.922   7.2321  437.480   8.3678  432.091   9.5304  455.615   17.483  751.207   8.2886  770.964   14.815 -19.75629 16.97609 
1 1 1    9   14   25 o  702.525   6.8342  377.850   7.3489  398.088   11.952  365.547   9.3187  720.898   10.831  690.911   8.8118 29.98688 13.96305 
1 1 1    9   14   26 o  840.712   6.9023  541.133   8.8820  547.393   11.422  531.555   14.127  845.457   8.8263  832.983   11.080 12.47369 14.16583 
1 1 1    9   14   27 o  591.682   7.3587  268.053   6.6644  261.701   9.0191  275.693   9.8909  584.508   10.081  599.893   10.772 -15.38489 14.75333 
1 1 1    9   14   28 o  799.217   6.9592  489.065   8.5132  487.736   10.860  491.183   13.712  798.016   8.8909  800.659   11.188 -2.642578 14.29084 
1 1 1    9   14   29 o   53.941   22.136   0.7143   2.9250   2.4854   4.1180  -1.0890   4.1554   70.270   27.085   56.674   24.887 13.59531 36.78307 
1 1 1    9   14   30 o  361.109   7.4372   99.859   4.1107  103.628   5.7664   95.964   5.8617  367.759   10.244  353.874   10.822 13.88449 14.90142 
1 1 1    9   14   31 o   64.893   23.756   2.6022   3.0813   3.5908   4.4505   1.6921   4.2704   77.074   28.495   67.664   27.117 9.410004 39.33523 
1 1 1    9   14   32 o  469.535   6.9528  168.839   4.9969  169.280   7.1691  168.423   6.9685  469.978   9.9659  468.804   9.7114 1.174469 13.91506 
1 1 1    9   14   33 o  351.859   8.3836   94.857   4.5151   97.792   6.3046   91.766   6.4692  357.082   11.535  345.860   12.220 11.22134 16.80461 
1 1 1    9   14   34 o  256.215   9.9862   50.331   3.9163   43.134   5.8643   56.124   5.2615  236.280   16.315  270.407   12.712 -34.12669 20.68292 
1 1 1    9   14   35 f  275.297   9.7000   58.114   4.0874   69.003   6.3987   50.607   5.3124  299.677   13.950  256.311   13.590 43.36652 19.47512 
1 1 1    9   14   36 o  174.726   16.908   23.732   4.4654   26.089   13.762   23.455   4.7208  176.982   49.085  173.505   18.040 3.477051 52.29495 
1 1 1    9   14   37 o  390.806   8.0534  117.080   4.8174  123.884   7.6200  112.550   6.2176  401.546   12.398  382.937   10.608 18.60846 16.31669 
1 1 1    9   14   38 o  426.167   8.9217  139.310   5.8197  134.680   7.2391  147.769   9.7853  418.741   11.295  438.086   14.593 -19.34552 18.45325 
1 1 1    9   14   39 o  260.985   10.159   52.296   4.0583   46.097   6.2537   56.806   5.3341  243.776   16.864  271.746   12.824 -27.97026 21.18597 
1 1 1    9   14   40 o  280.351   8.2863   60.294   3.5557   58.064   6.5614   61.221   4.2309  273.838   15.720  282.365   9.7892 -8.527313 18.51889 
1 1 1    9   14   41 o  395.842   7.8432  120.199   4.7521  118.026   6.8009  122.273   6.6428  391.746   11.342  398.810   10.882 -7.063599 15.71828 
1 1 1    9   14   42 f  299.724   9.8320   69.031   4.5106   73.022   6.0688   64.106   6.7420  307.820   12.881  287.597   15.371 20.22357 20.05464 
1 1 1    9   14   43 o  372.382   7.2235  106.382   4.1172  102.959   6.8401  108.328   5.1559  365.515   12.226  375.525   8.9701 -10.00925 15.16372 
1 1 1    9   14   44 o  120.309   16.512   11.432   2.9605   8.5282   5.5093   12.611   3.5104  102.677   31.792  125.930   18.787 -23.25368 36.92757 
1 1 1    9   14   45 o  406.081   7.4289  126.597   4.6175  120.465   7.6003  130.185   5.8133  394.975   12.572  411.446   9.2309 -16.47092 15.59666 
1 1 1    9   14   46 o  321.095   7.8993   79.209   3.8823   94.633   7.0352   72.455   4.6553  349.785   13.140  306.762   9.9147 43.02341 16.46106 
1 1 1    9   14   47 o  153.256   13.498   18.325   3.1341   26.921   6.0581   15.184   3.6622  183.477   22.011  138.390   17.694 45.08656 28.24121 
1 1 1    9   14   48 o  391.372   8.7830  117.865   5.2614   97.222   17.511  119.913   5.5163  341.499   33.950  394.672   9.1315 -53.17337 35.15677 
1 1 1    9   14   49 o  103.721   22.639   8.8568   3.4932 -12.0782   11.600   10.945   3.6633   75.862   36.149  115.923   21.436 -40.06031 42.02624 
1 1 1    9   14   50 o  420.984   8.7394  136.473   5.6314  143.736   8.9540  131.720   7.2433  430.169   13.599  412.676   11.467 17.49347 17.78855 
1 1 1    9   14   51 o   65.572   24.986   2.5919   3.4783   8.9432   7.6391   0.9307   3.9068  105.612   37.568   60.653   25.299 44.95852 45.29235 
1 1 1    9   14   52 o  248.956   9.3573   47.820   3.5657   46.828   5.1739   48.718   4.9209  244.810   13.865  250.056   12.901 -5.246094 18.93832 
1 1 1    9   14   53 o  137.049   16.059   14.928   3.3048   18.880   4.8745   11.566   4.4957  152.306   21.508  117.092   25.782 35.21449 33.57537 
1 1 1    9   14   54 o  174.112   16.204   24.053   4.2687   28.484   5.3434   16.235   7.0968  188.503   18.769  134.770   34.313 53.73337 39.11081 
1 1 1    9   14   55 o  177.056   15.079   24.813   4.0476   22.930   6.6532   25.920   5.1000  164.145   27.450  179.359   18.860 -15.21407 33.30450 
1 1 1    9   14   56 f  243.514   13.244   46.582   4.9180   26.873   9.2621   54.321   5.8038  170.459   36.593  262.354   14.509 -91.89558 39.36457 
1 1 1    9   14   57 o   71.062   24.755   3.9554   3.3041   2.7773   4.7529   5.0571   4.5963   70.941   28.545   80.260   29.070 -9.318542 40.74112 
1 1 1    9   14   58 o   68.746   24.548   3.6291   3.2646   9.2299   4.6738  -1.7066   4.5618  101.421   28.775   54.942   24.948 46.47963 38.08394 
1 1 1    9   14   59 o   65.382   24.757   3.0114   3.4013   2.2717   4.7551   3.7865   4.8673   67.933   28.087   74.194   29.201 -6.260704 40.51692 
1 1 1    9   14   60 o  231.282   14.920   43.015   5.2536   0.0000   0.0000   43.015   5.2536  ?   ?   231.282   14.920 0.000000 14.91997 
1 1 1    9   14   61 o  206.138   13.080   33.936   4.1057   41.368   5.7200   26.038   5.8968  224.756   16.747  173.323   22.779 51.43346 28.27305 
1 1 1    9   15    0 o  335.076   11.250   86.248   5.7552   86.248   5.7552   86.248   5.7552  335.076   11.250  335.076   11.250 0.000000 0.000000 
1 1 1    9   15    1 o  1140.52   11.391  996.247   19.886  976.923   27.510  1017.39   28.778  1129.00   15.920  1152.10   16.319 -23.10461 22.79823 
1 1 1    9   15    2 o  1260.48   10.045  1216.64   19.379  1216.49   23.761  1216.92   33.491  1260.22   12.318  1259.90   17.367 0.3220215 21.29215 
1 1 1    9   15    3 o  1188.40   11.766  1081.71   21.403  1046.57   29.151  1122.80   31.526  1168.52   16.298  1210.25   17.018 -41.72827 23.56411 
1 1 1    9   15    4 o  412.664   7.8255  130.371   4.9428  134.115   6.9713  126.586   7.0093  418.480   10.884  406.554   11.264 11.92609 15.66285 
1 1 1    9   15    5 o  972.663   10.301  724.467   15.335  713.869   21.291  735.892   22.107  965.253   14.411  980.003   14.738 -14.75031 20.61243 
1 1 1    9   15    6 o  509.079   6.7157  198.388   5.2330  194.227   6.3777  206.961   9.1544  503.680   8.2725  519.838   11.505 -16.15811 14.17049 
1 1 1    9   15    7 o  365.150   6.8578  102.068   3.8329   98.439   4.6256  110.021   6.8470  358.576   8.4278  379.016   11.802 -20.44049 14.50266 
1 1 1    9   15    8 o  1670.94   12.703  2138.58   32.489  2151.58   40.130  2113.84   55.349  1675.65   15.647  1659.89   21.785 15.75439 26.82182 
1 1 1    9   15    9 o  1553.78   11.980  1849.00   28.492  1851.20   34.978  1844.67   49.115  1554.41   14.702  1550.83   20.691 3.579956 25.38210 
1 1 1    9   15   10 o  502.666   6.9654  193.421   5.3591  193.242   6.5496  193.785   9.3221  502.402   8.5172  503.014   12.108 -0.6115112 14.80339 
1 1 1    9   15   11 o  892.218   14.524  609.871   19.835  609.871   19.835   0.0000   0.0000  892.218   14.524  ?   ?  0.000000 14.52388 
1 1 1    9   15   12 o  1018.52   7.7644  794.153   12.104  790.414   16.977  798.019   17.263  1015.97   10.917  1020.83   11.048 -4.868042 15.53218 
1 1 1    9   15   13 o  616.248   7.3739  290.715   6.9554  303.053   12.070  284.582   8.5104  629.029   12.537  609.670   9.1198 19.35944 15.50289 
1 1 1    9   15   14 o  153.397   12.907   18.151   3.0023   26.625   5.0426   13.497   3.7368  185.503   17.986  131.309   19.156 54.19377 26.27641 
1 1 1    9   15   15 o  952.262   8.7128  694.259   12.699  690.340   21.665  696.310   15.675  949.214   14.911  953.571   10.739 -4.357056 18.37610 
1 1 1    9   15   16 o  1152.10   9.7864  1016.35   17.258  1027.74   30.039  1010.73   21.085  1157.96   16.948  1148.77   11.991 9.189941 20.76141 
1 1 1    9   15   17 o  1104.32   9.5759  933.784   16.186  936.924   27.942  932.198   19.857  1105.63   16.511  1103.24   11.759 2.386719 20.27069 
1 1 1    9   15   18 o  1257.64   10.471  1211.23   20.156  1184.14   24.208  1272.45   36.394  1243.32   12.721  1288.19   18.458 -44.86963 22.41660 
1 1 1    9   15   19 o  509.758   6.9946  198.928   5.4575  199.338   7.6324  198.498   7.8068  510.214   9.7732  509.130   10.018 1.084015 13.99545 
1 1 1    9   15   20 o  795.953   7.3366  485.021   8.9383  488.230   12.595  481.766   12.686  798.451   10.306  793.140   10.450 5.310913 14.67712 
1 1 1    9   15   21 o  399.474   7.7688  122.177   4.7502  119.879   6.6287  124.603   6.8107  395.622   10.947  403.340   11.032 -7.718781 15.54123 
1 1 1    9   15   22 f  872.802   6.7500  583.187   9.0176  582.208   11.367  584.851   14.812  871.988   8.5164  873.813   11.075 -1.825867 13.97056 
1 1 1    9   15   23 o  547.387   6.3317  229.380   5.3050  220.923   6.4451  247.148   9.3418  537.159   7.8389  568.036   10.745 -30.87701 13.30010 
1 1 1    9   15   24 o  415.378   7.0041  132.096   4.4531  136.253   5.4485  123.732   7.7285  421.827   8.4387  401.844   12.565 19.98309 15.13586 
1 1 1    9   15   25 o  302.210   9.9529   69.953   4.6039   69.953   4.6039   0.0000   0.0000  302.210   9.9529  ?   ?  0.000000 9.952851 
1 1 1    9   15   26 o  494.958   7.9681  187.593   6.0366  179.506   7.3796  203.949   10.495  484.097   9.9593  515.831   13.292 -31.73352 16.60944 
1 1 1    9   15   27 o  239.842   11.804   44.081   4.3335   44.081   4.3335   0.0000   0.0000  239.842   11.804  ?   ?  0.000000 11.80449 
1 1 1    9   15   28 o  378.855   7.4809  109.908   4.3381  110.043   5.5519  109.698   6.9513  379.019   9.5699  378.323   12.004 0.6957092 15.35202 
1 1 1    9   15   29 o  294.263   8.1590   66.318   3.6749   71.642   5.1654   60.861   5.2294  305.754   11.037  281.771   12.125 23.98361 16.39625 
1 1 1    9   15   30 o  739.163   6.4410  418.353   7.2872  418.510   10.274  418.194   10.338  739.115   9.0815  738.831   9.1412 0.2836304 12.88548 
1 1 1    9   15   31 o  183.348   11.787   25.883   3.2904   33.852   4.8440   19.056   4.4835  209.432   15.215  156.247   19.148 53.18500 24.45687 
1 1 1    9   15   32 o  346.622   8.2163   92.048   4.3591   92.804   5.9737   91.186   6.3754  347.884   11.219  344.784   12.081 3.100189 16.48637 
1 1 1    9   15   33 o  317.518   8.6914   77.260   4.2240   74.561   6.5264   79.206   5.5412  311.615   13.683  321.346   11.266 -9.731567 17.72405 
1 1 1    9   15   34 o  482.189   6.9165  178.109   5.1048  183.879   7.4295  172.949   7.0258  489.692   9.9122  474.938   9.6648 14.75409 13.84406 
1 1 1    9   15   35 o  213.207   13.393   35.064   4.3484   19.339   9.1101   39.703   4.9484  153.503   38.765  226.806   14.328 -73.30280 41.32798 
1 1 1    9   15   36 o  332.179   8.3177   84.592   4.2290   80.276   6.1350   88.499   5.8377  323.255   12.399  339.525   11.233 -16.26987 16.73089 
1 1 1    9   15   37 o  197.062   13.759   30.018   4.1239   30.802   4.8590   27.999   7.7982  199.277   16.066  187.320   28.062 11.95743 32.33612 
1 1 1    9   15   38 o  311.319   11.008   74.446   5.2456   82.937   6.7201   61.204   8.3921  328.309   13.373  280.491   19.672 47.81735 23.78667 
1 1 1    9   15   39 f  220.757   11.010   37.447   3.7203   36.810   5.5864   37.956   4.9869  217.640   16.902  221.407   14.801 -3.766602 22.46660 
1 1 1    9   15   40 o  114.561   20.544   10.496   3.4701   6.8138   5.4562   12.997   4.4967   94.994   31.845  127.003   24.012 -32.00810 39.88299 
1 1 1    9   15   41 o  213.960   12.005   35.348   3.9156   36.595   5.3741   33.938   5.7168  216.914   16.306  208.451   18.097 8.463074 24.35944 
1 1 1    9   15   42 o  177.766   12.865   24.488   3.4768   26.689   5.0195   22.457   4.8206  184.577   17.996  168.939   18.970 15.63797 26.14795 
1 1 1    9   15   43 o  357.253   8.5618   98.029   4.6818   98.328   6.6256   97.732   6.6164  357.152   12.120  356.063   12.140 1.089142 17.15456 
1 1 1    9   15   44 o  606.729   7.8705  282.676   7.3091  281.034   9.8512  284.687   10.902  604.121   10.654  607.642   11.721 -3.521179 15.83949 
1 1 1    9   15   45 o  350.524   7.6878   94.363   4.1247   95.585   7.4540   93.824   4.9519  351.402   13.858  349.245   9.2635 2.157074 16.66943 
1 1 1    9   15   46 o   91.548   21.122   6.8475   2.8996   4.8943   5.0876   7.7871   3.5287   83.940   30.556   97.255   23.880 -13.31504 38.78034 
1 1 1    9   15   47 o  326.961   8.3165   82.199   4.1620   88.200   7.6457   79.672   4.9616  336.973   14.824  321.543   10.081 15.42999 17.92676 
1 1 1    9   15   48 o  285.375   9.9653   62.776   4.3529   44.212   12.229   65.470   4.6579  227.674   36.311  291.330   10.446 -63.65508 37.78354 
1 1 1    9   15   49 o  135.962   16.245   14.629   3.3139   22.156   6.1450   11.543   3.9351  164.513   25.207  118.736   22.475 45.77731 33.77156 
1 1 1    9   15   50 o  264.482   11.190   54.095   4.5299   61.111   7.1091   49.299   5.8777  278.867   16.733  250.890   15.380 27.97748 22.72703 
1 1 1    9   15   51 o  166.406   14.881   21.773   3.7502   18.165   7.2500   23.092   4.3820  144.506   33.440  170.731   16.994 -26.22461 37.51087 
1 1 1    9   15   52 o   75.585   25.572   4.4307   3.5186   0.4019   6.7256   5.9489   4.1287   74.288   32.153   85.539   27.657 -11.25087 42.41167 
1 1 1    9   15   53 o  189.491   16.373   28.437   4.7023   28.843   7.0062   28.105   6.3432  186.749   25.150  185.513   22.820 1.236420 33.96016 
1 1 1    9   15   54 o  274.574   11.044   58.500   4.6417   45.775   7.6144   66.026   5.8554  237.785   21.141  290.867   13.152 -53.08194 24.89854 
1 1 1    9   15   55 o  229.574   11.867   41.156   4.1559   35.430   6.8891   44.432   5.2108  207.969   21.975  237.456   14.405 -29.48674 26.27525 
1 1 1    9   15   56 o   71.516   26.182   3.7561   3.7429   12.013   6.5179  -0.3063   4.5718  114.293   34.424   59.432   26.101 54.86135 43.20076 
1 1 1    9   15   57 o   83.701   26.226   5.9926   3.7366   10.266   6.7494   4.1038   4.4871  105.679   35.418   75.364   28.459 30.31477 45.43558 
1 1 1    9   15   58 o   59.003   24.694   1.1824   3.7397  -9.9162   6.5514   6.5466   4.5546   51.720   25.247   86.718   29.095 -34.99790 38.52171 
1 1 1    9   15   59 o  109.733   22.080   10.377   3.5801   14.596   5.4719   7.2192   4.7339  126.100   28.961   89.342   29.656 36.75798 41.45086 
1 1 1    9   15   60 o  124.102   18.693   12.904   3.4407   10.517   5.2504   14.701   4.5552  104.758   30.738  129.306   23.896 -24.54787 38.93365 
1 1 1    9   16    0 o  470.527   11.286  169.785   8.1179  169.785   8.1179  169.785   8.1179  470.527   11.286  470.527   11.286 0.000000 0.000000 
1 1 1    9   16    1 o  654.820   8.4558  328.280   8.4751  329.688   11.968  326.864   12.003  656.103   11.918  653.284   12.004 2.819092 16.91513 
1 1 1    9   16    2 o  536.515   6.5794  220.344   5.4031  219.952   6.5568  221.172   9.5372  536.009   7.9918  537.397   11.595 -1.387451 14.08212 
1 1 1    9   16    3 o  1064.88   8.9267  868.204   14.550  864.445   17.703  876.031   25.544  1062.47   10.886  1069.22   15.608 -6.753540 19.02916 
1 1 1    9   16    4 o  1449.39   13.780  1609.27   30.571  1553.85   41.465  1675.26   45.249  1423.59   19.029  1478.02   20.001 -54.42786 27.60748 
1 1 1    9   16    5 o  813.258   9.3915  506.394   11.690  492.038   16.048  522.625   17.064  801.480   13.082  825.994   13.497 -24.51367 18.79628 
1 1 1    9   16    6 o  1563.13   12.032  1871.29   28.786  1841.83   34.652  1936.91   51.709  1550.51   14.601  1589.08   21.259 -38.57324 25.79059 
1 1 1    9   16    7 o  469.451   6.8376  168.702   4.9132  169.517   6.0665  167.150   8.3763  470.555   8.4228  467.181   11.714 3.373749 14.42756 
1 1 1    9   16    8 o  707.358   12.822  383.240   13.883   0.0000   0.0000  383.240   13.883  ?   ?   707.358   12.822 0.000000 12.82242 
1 1 1    9   16    9 o  1148.47   16.552  1010.80   29.097   0.0000   0.0000  1010.80   29.097  ?   ?   1148.47   16.552 0.000000 16.55236 
1 1 1    9   16   10 o  570.968   12.571  249.689   10.987   0.0000   0.0000  249.689   10.987  ?   ?   570.968   12.571 0.000000 12.57140 
1 1 1    9   16   11 o  1215.30   12.251  1131.17   22.789  1125.63   31.938  1136.92   32.527  1211.88   17.218  1217.92   17.448 -6.040405 24.51302 
1 1 1    9   16   12 o  351.125   7.6449   94.382   4.1087   90.690   6.9676   96.351   5.0874  344.088   13.230  354.742   9.3694 -10.65405 16.21128 
1 1 1    9   16   13 f  375.269   6.6783  107.801   3.8360  103.476   5.2677  112.684   5.5970  367.622   9.3617  383.629   9.5318 -16.00632 13.36021 
1 1 1    9   16   14 o  341.204   6.9233   89.120   3.6158   87.916   5.0574   90.380   5.1715  338.849   9.7510  343.562   9.8342 -4.713562 13.84892 
1 1 1    9   16   15 o  591.986   6.5245  268.264   5.9119  275.421   8.4693  261.463   8.2562  599.762   9.2257  584.367   9.2305 15.39520 13.05049 
1 1 1    9   16   16 o  695.585   6.8135  370.384   7.2542  370.815   10.241  369.951   10.277  695.899   9.6141  695.087   9.6599 0.8123169 13.62885 
1 1 1    9   16   17 o  799.767   8.3028  489.712   10.164  483.602   12.434  502.014   17.643  794.680   10.223  809.434   14.241 -14.75494 17.52984 
1 1 1    9   16   18 o  643.523   7.9503  317.055   7.8310  321.970   13.365  314.485   9.6635  648.259   13.470  640.843   9.8518 7.415405 16.68808 
1 1 1    9   16   19 o  375.375   8.8792  107.892   5.1017  109.551   8.4932  106.956   6.3811  378.086   14.676  373.689   11.156 4.397064 18.43506 
1 1 1    9   16   20 o  590.176   7.1233  266.655   6.4347  268.701   8.9950  264.511   9.2090  592.342   9.9211  587.693   10.237 4.649414 14.25599 
1 1 1    9   16   21 o  275.359   9.9214   58.068   4.1816   58.107   5.7356   58.024   6.1095  275.367   13.608  274.761   14.579 0.6065369 19.94334 
1 1 1    9   16   22 o  405.110   8.2975  125.662   5.1450  121.829   7.1253  129.839   7.4371  398.784   11.673  411.681   11.803 -12.89719 16.60019 
1 1 1    9   16   23 o  670.933   6.4965  344.620   6.6716  351.391   8.4532  333.436   10.864  677.428   8.1524  659.767   10.758 17.66046 13.49834 
1 1 1    9   16   24 o   73.273   24.106   3.9406   3.1305   4.5598   3.2832  -2.2550   10.385   77.688   24.616   90.256   39.496 -12.56771 46.53882 
1 1 1    9   16   25 o  1612.29   11.104  1991.56   27.403  2018.33   38.773  1964.86   38.733  1622.23   15.615  1600.56   15.810 21.67651 22.22159 
1 1 1    9   16   26 o  1130.73   7.9570  979.072   13.771  972.373   17.352  990.474   22.636  1126.66   10.062  1136.73   13.010 -10.07764 16.44715 
1 1 1    9   16   27 o  821.741   6.8248  517.028   8.5841  510.247   11.082  527.199   13.572  816.202   8.8708  829.501   10.690 -13.29901 13.89091 
1 1 1    9   16   28 o  530.420   8.8401  215.503   7.1771  215.503   7.1771   0.0000   0.0000  530.420   8.8401  ?   ?  0.000000 8.840149 
1 1 1    9   16   29 o  280.547   8.8684   60.293   3.8082   61.878   4.8999   57.875   6.0519  284.126   11.267  274.265   14.468 9.861420 18.33717 
1 1 1    9   16   30 o  496.445   7.1916  188.752   5.4647  187.754   7.0179  190.290   8.7099  495.015   9.2623  498.193   11.422 -3.178589 14.70560 
1 1 1    9   16   31 o  682.743   6.8684  357.003   7.1777  362.970   9.6293  349.543   10.767  688.230   9.1410  675.250   10.418 12.98047 13.85948 
1 1 1    9   16   32 o  302.591   8.4524   70.160   3.9147   77.786   5.6808   63.264   5.4023  318.433   11.655  287.135   12.292 31.29773 16.93918 
1 1 1    9   16   33 o  191.449   11.468   28.223   3.3451   27.585   4.6359   28.915   4.8316  188.686   16.209  193.171   16.499 -4.485748 23.12937 
1 1 1    9   16   34 o   95.154   20.928   7.2649   2.9652   4.4185   4.1252   10.308   4.2651   79.494   27.662  113.095   25.274 -33.60153 37.46978 
1 1 1    9   16   35 o  204.640   13.223   32.318   4.1195   35.074   8.4769   31.466   4.7136  210.623   26.909  201.612   15.391 9.010635 30.99981 
1 1 1    9   16   36 o  357.214   9.2409   97.879   5.0525  100.574   6.1667   92.377   8.8126  361.911   11.132  346.142   16.633 15.76907 20.01494 
1 1 1    9   16   37 o  482.767   7.0165  178.626   5.1848  175.661   7.3570  181.552   7.3080  478.379   10.047  486.367   9.8167 -7.987396 14.04707 
1 1 1    9   16   38 o   85.280   23.748   5.8341   3.2145   5.9131   4.8705   5.7731   4.2786   89.253   30.086   86.900   28.161 2.352150 41.20955 
1 1 1    9   16   39 o  372.244   9.3574  106.377   5.3315  113.551   6.6457   93.423   8.9307  384.317   11.297  347.645   16.783 36.67209 20.23160 
1 1 1    9   16   40 o   76.701   24.740   4.5017   3.3052   4.3573   4.5202   4.6675   4.8453   80.191   28.859   82.915   29.874 -2.723648 41.53659 
1 1 1    9   16   41 o  405.960   8.0771  126.481   5.0189  130.276   7.7494  123.740   6.5870  411.241   12.311  401.106   10.729 10.13483 16.33029 
1 1 1    9   16   42 o  585.112   7.4952  262.710   6.7126  263.188   10.554  262.386   8.6987  584.493   11.797  584.218   9.7277 0.2750244 15.29063 
1 1 1    9   16   43 o  543.120   7.3076  226.383   6.0749  230.627   8.8826  222.653   8.3268  547.346   10.602  537.941   10.113 9.404297 14.65204 
1 1 1    9   16   44 o  158.484   15.325   19.656   3.6711   17.065   5.2119   22.206   5.1717  145.111   24.326  167.132   20.656 -22.02103 31.91330 
1 1 1    9   16   45 o  282.443   10.120   61.438   4.3749   62.436   6.3642   60.544   6.0238  283.367   14.724  279.201   14.142 4.166382 20.41529 
1 1 1    9   16   46 f  470.398   8.2427  170.099   5.9348  165.829   8.9991  173.385   7.8950  463.048   12.697  474.141   10.879 -11.09241 16.72007 
1 1 1    9   16   47 o  324.029   9.9078   80.910   4.9139   78.447   6.9776   83.334   6.9215  317.863   14.341  327.789   13.795 -9.926361 19.89953 
1 1 1    9   16   48 o  507.014   9.6192  198.106   7.4650  201.765   14.683  196.830   8.6690  506.659   18.933  504.749   11.221 1.910217 22.00827 
1 1 1    9   16   49 o  159.838   23.393   20.779   5.5538   21.050   6.6296   20.141   10.170  158.847   28.305  149.117   42.495 9.730011 51.05890 
1 1 1    9   16   50 o  173.394   17.584   23.846   4.6022   16.387   7.3177   28.727   5.9194  136.791   34.851  189.231   20.779 -52.43983 40.57555 
1 1 1    9   16   51 o   47.555   21.517  -1.5967   3.3577   3.4133   6.3610  -3.5318   3.9533   81.849   32.991   47.064   22.017 34.78537 39.66346 
1 1 1    9   16   52 o  163.187   15.077   21.004   3.7233   27.349   6.4984   17.904   4.5428  182.701   23.803  148.661   20.511 34.03966 31.42126 
1 1 1    9   16   53 o  284.045   12.906   62.863   5.6112   54.497   7.5491   73.191   8.3880  261.164   19.015  303.393   18.146 -42.22809 26.28411 
1 1 1    9   16   54 o  235.077   12.037   43.133   4.3166   35.158   6.9166   48.220   5.5244  207.369   22.133  247.448   14.651 -40.07913 26.54294 
1 1 1    9   16   55 o  120.440   21.380   12.064   3.7970   14.481   6.2717   10.665   4.7706  126.730   32.252  110.324   28.157 16.40617 42.81303 
1 1 1    9   16   56 o  149.728   17.057   18.083   3.8394   9.6018   6.6882   22.251   4.6890  103.300   35.254  165.376   18.861 -62.07578 39.98272 
1 1 1    9   16   57 o   88.282   25.866   6.7888   3.7202   1.2147   6.6351   9.3446   4.4929   73.525   31.880  102.411   27.903 -28.88594 42.36597 
1 1 1    9   16   58 o  127.849   21.204   13.810   4.0039   13.404   7.9749   13.947   4.6297  115.368   38.501  126.402   24.815 -11.03402 45.80486 
1 1 1    9   16   59 o   69.687   26.527   3.5934   3.9182   6.1982   8.3184   2.8507   4.4418   89.711   37.125   68.321   27.558 21.39044 46.23556 
1 1 1    9   16   60 o   52.406   23.417  -0.5998   3.8397   1.2492   5.9619  -1.9104   5.0193   68.527   29.958   55.928   25.686 12.59920 39.46215 
1 1 1    9   17    0 o  528.817   11.590  214.396   9.3707  214.396   9.3707  214.396   9.3707  528.817   11.590  528.817   11.590 0.000000 0.000000 
1 1 1    9   17    1 o  429.943   8.1018  141.514   5.3317  145.503   7.5747  137.597   7.5060  435.893   11.353  423.880   11.569 12.01236 16.20912 
1 1 1    9   17    2 o  747.678   9.0560  427.999   10.364  428.886   14.599  427.098   14.715  748.306   12.746  746.738   12.875 1.567688 18.11645 
1 1 1    9   17    3 o  527.784   6.6676  213.229   5.3864  216.003   6.6224  207.808   9.2586  531.177   8.1452  520.917   11.612 10.26050 14.18396 
1 1 1    9   17    4 o  451.000   8.1758  155.717   5.6439  163.385   8.1375  148.609   7.8344  461.898   11.510  440.514   11.619 21.38412 16.35504 
1 1 1    9   17    5 o  1412.09   13.538  1527.39   29.260  1508.68   40.772  1547.27   42.016  1402.81   18.989  1420.59   19.323 -17.78223 27.09179 
1 1 1    9   17    6 o  595.736   8.5171  271.707   7.7663  263.713   10.687  280.654   11.306  586.809   11.898  605.353   12.202 -18.54419 17.04254 
1 1 1    9   17    7 o  1071.26   11.411  878.836   18.710  871.984   26.903  885.254   26.038  1066.71   16.478  1074.85   15.827 -8.141479 22.84721 
1 1 1    9   17    8 o  801.470   9.7417  491.833   11.951  469.732   16.560  515.849   17.263  783.071   13.817  820.615   13.744 -37.54388 19.48817 
1 1 1    9   17    9 o  201.236   9.6972   31.007   2.9869   34.927   3.6752   23.378   5.1264  213.264   11.299  173.507   19.649 39.75685 22.66642 
1 1 1    9   17   10 o  408.806   7.3838  127.936   4.6202  126.643   5.6875  130.445   7.9225  406.705   9.1364  412.687   12.542 -5.982025 15.51711 
1 1 1    9   17   11 o  695.429   7.6510  370.233   8.1441  360.392   9.7884  392.369   14.681  686.074   9.3212  715.694   13.401 -29.62030 16.32415 
1 1 1    9   17   12 o  1483.09   14.319  1685.16   32.504  1685.16   32.504   0.0000   0.0000  1483.09   14.319  ?   ?  0.000000 14.31870 
1 1 1    9   17   13 o  1110.27   8.2823  943.759   14.075  954.249   20.120  933.704   19.697  1116.22   11.776  1104.14   11.655 12.07336 16.56855 
1 1 1    9   17   14 f  1101.52   8.2843  928.945   13.967  922.027   19.617  936.058   19.891  1097.20   11.681  1105.51   11.755 -8.311768 16.57214 
1 1 1    9   17   15 o  456.386   6.8086  159.448   4.7562  163.744   6.6303  154.895   6.8265  462.437   9.3673  449.755   9.9163 12.68210 13.64112 
1 1 1    9   17   16 o  671.151   7.8775  344.860   8.0924  349.706   10.027  335.806   13.705  675.786   9.6937  662.042   13.525 13.74432 16.63994 
1 1 1    9   17   17 o  795.057   7.2225  483.926   8.7894  482.697   12.344  485.189   12.518  793.921   10.158  795.962   10.275 -2.041016 14.44840 
1 1 1    9   17   18 o  407.628   7.4743  127.212   4.6634  124.043   6.3332  130.965   6.8924  402.454   10.281  413.513   10.890 -11.05896 14.97608 
1 1 1    9   17   19 o  1585.28   12.508  1925.37   30.350  1950.08   53.059  1913.35   37.002  1593.70   21.751  1579.91   15.301 13.79700 26.59371 
1 1 1    9   17   20 o  829.146   8.7701  526.429   11.130  517.637   18.707  531.246   13.848  821.771   14.873  832.809   10.863 -11.03760 18.41773 
1 1 1    9   17   21 o  763.357   7.6787  446.156   8.9720  431.134   12.403  462.645   12.994  750.233   10.801  777.159   10.924 -26.92548 15.36186 
1 1 1    9   17   22 o  501.060   9.1987  192.268   7.0548  193.983   8.3924  188.138   13.025  503.221   10.896  495.236   17.183 7.984894 20.34670 
1 1 1    9   17   23 o  906.930   9.4214  629.953   13.078  634.222   15.914  621.071   22.955  909.839   11.427  899.805   16.667 10.03381 20.20806 
1 1 1    9   17   24 o  268.029   9.7248   55.026   3.9896   54.330   4.8455   56.491   7.0300  266.273   11.889  270.809   17.047 -4.535522 20.78325 
1 1 1    9   17   25 o  309.803   8.2419   73.500   3.9083   72.860   4.6603   75.017   7.1751  308.409   9.8722  312.751   14.989 -4.342438 17.94768 
1 1 1    9   17   26 o  685.440   6.8400  359.737   7.1762  359.702   8.9386  359.803   12.036  685.316   8.5213  685.206   11.476 0.1101074 14.29408 
1 1 1    9   17   27 o  619.975   6.9043  294.319   6.5519  290.269   8.0422  302.313   11.298  615.608   8.5349  628.021   11.754 -12.41290 14.52561 
1 1 1    9   17   28 o  402.223   6.7864  123.886   4.1781  127.984   5.8383  119.584   5.9817  408.718   9.3324  395.051   9.8924 13.66696 13.59971 
1 1 1    9   17   29 o  555.000   6.7096  235.883   5.6998  243.152   7.5908  226.486   8.6304  563.361   8.8031  543.599   10.372 19.76154 13.60445 
1 1 1    9   17   30 o  672.858   8.2175  346.850   8.4632  347.788   10.619  345.217   14.012  673.566   10.300  670.654   13.650 2.911560 17.10015 
1 1 1    9   17   31 o  251.483   10.188   48.488   3.9215   46.427   5.0581   51.594   6.2087  245.544   13.510  258.616   15.760 -13.07176 20.75823 
1 1 1    9   17   32 o  636.471   6.5505  310.282   6.3815  324.162   9.0772  296.719   8.9732  650.298   9.1195  622.129   9.4232 28.16901 13.11343 
1 1 1    9   17   33 o  198.703   10.564   30.374   3.2014   31.642   4.5190   29.097   4.5360  202.340   14.692  193.889   15.412 8.451309 21.29230 
1 1 1    9   17   34 o  363.574   8.9765  101.358   4.9954  115.323   9.5912   96.160   5.8517  386.977   16.193  353.976   10.800 33.00055 19.46404 
1 1 1    9   17   35 o  256.961   10.861   50.690   4.2716   54.344   5.0922   42.013   7.8469  265.927   12.511  231.735   22.402 34.19189 25.65866 
1 1 1    9   17   36 o  297.760   8.2832   67.988   3.7751   67.597   5.3830   68.367   5.2958  296.595   11.857  298.304   11.599 -1.709442 16.58685 
1 1 1    9   17   37 o  585.792   6.7756  263.002   6.0752  259.323   8.6695  266.551   8.5157  581.230   9.7449  589.328   9.4405 -8.098145 13.56783 
1 1 1    9   17   38 o  264.710   9.4621   53.794   3.8338   49.832   5.5992   57.291   5.2602  253.844   14.471  272.851   12.595 -19.00746 19.18447 
1 1 1    9   17   39 o  168.887   13.540   22.120   3.4708   24.492   4.5548   18.836   5.3596  177.127   17.009  153.607   23.546 23.51971 29.04734 
1 1 1    9   17   40 o  264.297   9.3892   53.657   3.7983   48.482   5.3417   58.950   5.4021  250.286   14.000  276.595   12.760 -26.30930 18.94213 
1 1 1    9   17   41 o  206.465   11.036   32.899   3.4751   30.214   4.9635   35.481   4.8671  196.763   16.637  213.705   14.974 -16.94243 22.38285 
1 1 1    9   17   42 o  196.247   11.928   29.794   3.5658   37.914   5.3955   23.496   4.7514  220.572   16.092  172.859   18.233 47.71265 24.31896 
1 1 1    9   17   43 o  288.838   10.163   64.216   4.4931   60.017   6.6742   67.696   6.0764  277.691   15.767  295.933   13.415 -18.24188 20.70174 
1 1 1    9   17   44 o  163.738   14.653   20.942   3.6336   21.265   5.5664   20.703   4.7964  162.675   22.997  161.453   19.826 1.222382 30.36279 
1 1 1    9   17   45 o   57.078   23.524   0.9200   3.3209  -0.1926   4.9969   1.8002   4.4444   64.160   27.742   67.840   27.495 -3.680717 39.05900 
1 1 1    9   17   46 o  310.996   9.6252   74.491   4.5818   72.716   6.6052   76.137   6.3610  306.164   14.095  313.526   13.255 -7.362000 19.34841 
1 1 1    9   17   47 o  246.714   14.302   47.429   5.3775   51.759   12.445   46.435   5.9629  248.354   33.601  243.530   16.087 4.823212 37.25363 
1 1 1    9   17   48 o  136.825   24.738   15.407   4.9901   16.673   5.8027   11.811   9.7772  141.292   27.822  119.647   42.508 21.64491 50.80305 
1 1 1    9   17   49 f  118.832   23.102   11.629   4.0506   7.5363   5.7254   15.731   5.7314   96.693   32.620  136.685   28.325 -39.99229 43.20184 
1 1 1    9   17   50 o   79.564   27.552   4.8270   4.0901   5.4462   6.2724   4.3690   5.3948   88.976   33.636   81.796   31.129 7.179962 45.83049 
1 1 1    9   17   51 o  174.273   16.695   24.061   4.3989   18.404   6.3305   29.342   6.1170  147.135   29.140  190.683   21.324 -43.54764 36.10873 
1 1 1    9   17   52 o  217.002   15.108   37.058   4.9868   52.468   7.0467   21.599   7.0581  256.959   18.031  158.645   30.169 98.31435 35.14653 
1 1 1    9   17   53 o  111.216   26.487   10.585   4.4444   9.5416   6.3351   11.596   6.2367  104.792   34.284  114.236   33.496 -9.444458 47.93063 
1 1 1    9   17   54 o  155.510   19.471   19.646   4.5331   27.372   6.4351   12.035   6.3869  181.580   23.720  115.419   33.912 66.16104 41.38468 
1 1 1    9   17   55 o   47.699   22.616  -4.5788   4.4301  -0.5117   6.3871  -8.3494   6.1499   68.717   30.484   52.232   25.255 16.48527 39.58635 
1 1 1    9   17   56 f  146.241   20.542   17.682   4.4712   15.866   6.5152   19.298   6.1474  131.492   32.546  148.436   28.086 -16.94383 42.98919 
1 1 1    9   17   57 o   54.593   24.816  -1.6974   4.5289  -0.1062   6.6634  -3.0636   6.1743   69.866   31.058   60.893   28.154 8.972458 41.91938 
1 1 1    9   17   58 o   84.551   26.147   6.3320   3.7278   1.1784   7.3812   8.0966   4.3191   74.872   33.014   94.352   27.934 -19.48001 43.24582 
1 1 1    9   17   59 o   52.388   23.301  -0.4831   3.7552 -11.5242   7.9819   2.6554   4.2556   55.921   27.418   66.539   26.927 -10.61795 38.42888 
1 1 1    9   18    0 f  1442.70   19.495  1595.26   43.032  1595.26   43.032  1595.26   43.032  1442.70   19.495  1442.70   19.495 0.000000 0.000000 
1 1 1    9   18    1 o  763.040   9.1841  445.773   10.726  450.156   15.265  441.498   15.075  766.623   13.009  759.216   12.973 7.406921 18.37197 
1 1 1    9   18    2 f  1474.44   14.018  1665.39   31.637  1684.67   45.306  1647.03   44.197  1482.22   19.970  1465.61   19.702 16.61670 28.05249 
1 1 1    9   18    3 o  737.891   7.4249  416.814   8.3860  406.567   10.070  439.992   15.146  728.718   9.0286  757.915   13.056 -29.19690 15.87372 
1 1 1    9   18    4 o  349.284   12.335   93.438   6.5944   0.0000   0.0000   93.438   6.5944  ?   ?   349.284   12.335 0.000000 12.33465 
1 1 1    9   18    5 o  557.918   12.129  238.395   10.358   0.0000   0.0000  238.395   10.358  ?   ?   557.918   12.129 0.000000 12.12874 
1 1 1    9   18    6 o  1160.00   11.969  1030.54   21.251  1014.57   30.029  1046.57   30.078  1150.55   17.052  1168.57   16.816 -18.02649 23.94887 
1 1 1    9   18    7 o  1101.46   9.4374  928.907   15.911  929.333   19.579  928.077   27.301  1101.58   11.612  1100.48   16.208 1.100830 19.93833 
1 1 1    9   18    8 o  1090.97   9.3891  911.301   15.679  912.113   19.298  909.724   26.891  1091.33   11.553  1089.54   16.125 1.784668 19.83638 
1 1 1    9   18    9 o  278.485   8.4656   59.375   3.6085   57.801   4.3705   62.747   6.3962  274.742   10.393  285.800   14.671 -11.05780 17.97902 
1 1 1    9   18   10 o  1181.68   9.9105  1069.22   17.925  1070.21   22.012  1067.27   30.885  1182.07   12.166  1179.99   17.100 2.076294 20.98641 
1 1 1    9   18   11 o  428.118   7.5671  140.314   4.9586  139.271   6.0746  142.397   8.5842  426.489   9.3055  431.151   13.008 -4.662323 15.99354 
1 1 1    9   18   12 o  884.593   8.4776  599.104   11.479  600.271   14.077  596.789   19.828  885.364   10.388  882.525   14.679 2.839355 17.98263 
1 1 1    9   18   13 o  347.346   7.2436   92.363   3.8511   96.378   5.4524   88.364   5.4403  354.767   10.041  339.688   10.463 15.07840 14.50180 
1 1 1    9   18   14 o  922.642   8.7567  651.788   12.366  654.517   15.173  646.388   21.343  924.465   10.723  918.387   15.183 6.077942 18.58775 
1 1 1    9   18   15 o  1115.90   9.7307  953.557   16.620  944.804   20.145  972.217   29.413  1110.61   11.850  1126.08   17.065 -15.46777 20.77575 
1 1 1    9   18   16 o  489.406   7.0141  183.365   5.2542  185.714   7.3655  180.930   7.4975  492.458   9.7716  486.064   10.078 6.394135 14.03707 
1 1 1    9   18   17 o  911.872   7.6756  636.619   10.713  654.873   15.441  619.673   14.877  924.667   10.910  899.479   10.805 25.18781 15.35502 
1 1 1    9   18   18 o  652.890   7.1242  326.343   7.1194  332.107   10.068  320.579   10.068  658.518   9.9891  646.980   10.167 11.53760 14.25308 
1 1 1    9   18   19 o  320.173   8.9223   78.499   4.3725   75.463   5.8796   82.256   6.5404  313.841   12.240  327.637   13.042 -13.79642 17.88573 
1 1 1    9   18   20 o  977.133   9.4834  731.217   14.184  708.653   16.742  788.597   26.697  961.793   11.372  1013.95   17.202 -52.15332 20.62143 
1 1 1    9   18   21 o  1015.55   11.906  790.210   18.507  792.079   25.775  788.221   26.590  1016.21   16.571  1013.66   17.138 2.556335 23.83934 
1 1 1    9   18   22 o  1032.27   9.7677  816.164   15.433  824.737   26.675  811.851   18.921  1036.85   16.808  1029.32   12.010 7.528564 20.65790 
1 1 1    9   18   23 o  328.533   11.758   82.706   5.9124   75.377   10.367   86.239   7.1978  312.414   21.816  335.389   14.021 -22.97556 25.93322 
1 1 1    9   18   24 o  1017.90   8.6023  793.519   13.403  750.740   17.929  847.710   20.179  989.765   11.834  1051.66   12.536 -61.89496 17.23938 
1 1 1    9   18   25 o  286.961   11.402   63.106   5.0079   65.716   6.9276   60.249   7.2479  292.255   15.542  279.646   17.014 12.60974 23.04414 
1 1 1    9   18   26 o  509.497   6.9839  198.776   5.4464  194.319   6.6349  207.983   9.5367  503.680   8.6061  520.884   11.962 -17.20398 14.73580 
1 1 1    9   18   27 o  934.369   7.3785  668.612   10.553  662.298   13.186  679.858   17.598  929.763   9.2658  941.633   12.210 -11.87036 15.32767 
1 1 1    9   18   28 o  1057.71   8.9704  857.167   14.523  863.659   20.638  850.799   20.440  1061.11   12.707  1053.19   12.680 7.924316 17.95093 
1 1 1    9   18   29 o   94.155   23.945   7.1079   3.4588   6.0609   3.8596   11.379   7.7950   88.106   26.479  120.979   37.875 -32.87320 46.21333 
1 1 1    9   18   30 o  470.351   6.8875  169.450   4.9585  169.976   6.5979  168.767   7.5164  470.932   9.1533  469.148   10.467 1.783264 13.90486 
1 1 1    9   18   31 o  536.344   6.7636  220.349   5.5525  221.233   7.3341  219.162   8.4990  537.244   8.9187  534.577   10.387 2.666748 13.69061 
1 1 1    9   18   32 o  812.076   7.7516  505.350   9.6352  501.664   11.326  515.002   18.330  808.906   9.1478  818.448   14.632 -9.542725 17.25620 
1 1 1    9   18   33 o  317.690   11.184   77.470   5.4385   89.946   8.9271   70.107   6.8580  341.646   17.071  301.877   14.842 39.76904 22.62109 
1 1 1    9   18   34 o  545.248   7.6149  227.869   6.3552  231.475   7.8144  220.826   10.922  549.342   9.2936  535.922   13.314 13.41992 16.23705 
1 1 1    9   18   35 o  146.885   13.793   16.746   3.0648   17.291   4.2411   16.149   4.4338  148.351   19.123  142.930   20.883 5.420898 28.31549 
1 1 1    9   18   36 o  132.236   14.290   13.622   2.8464   16.260   3.8787   10.543   4.1901  143.950   17.997  114.169   24.696 29.78159 30.55745 
1 1 1    9   18   37 f  204.494   11.166   32.235   3.4819   31.252   5.0924   33.097   4.7715  200.440   16.752  206.599   15.196 -6.158615 22.61722 
1 1 1    9   18   38 o  603.034   7.3338  278.867   6.7693  275.982   8.8371  282.964   10.530  599.469   9.6311  606.598   11.342 -7.128723 14.87910 
1 1 1    9   18   39 o   65.992   22.760   3.1078   2.7897   4.8433   4.0807   1.5851   3.8223   81.028   27.538   63.763   25.619 17.26513 37.61197 
1 1 1    9   18   40 o  583.700   6.9492  261.314   6.2086  267.920   8.9930  255.299   8.5819  590.357   9.9522  576.341   9.7282 14.01593 13.91707 
1 1 1    9   18   41 o  324.885   8.2960   81.053   4.1254   82.011   5.8371   80.097   5.8313  326.257   11.689  322.403   11.817 3.853638 16.62114 
1 1 1    9   18   42 o  224.740   10.663   38.893   3.6682   36.675   5.0232   41.428   5.3692  217.037   15.217  230.715   15.291 -13.67778 21.57257 
1 1 1    9   18   43 o  380.953   8.0396  111.489   4.6879  112.035   6.6471  110.948   6.6124  381.159   11.393  379.306   11.389 1.853058 16.10991 
1 1 1    9   18   44 o  130.016   17.668   13.415   3.4250   12.941   5.1967   13.779   4.5542  124.780   27.908  130.072   23.750 -5.291634 36.64578 
1 1 1    9   18   45 o  333.425   11.479   85.829   5.8583   93.476   7.1057   69.601   10.352  347.424   13.362  295.573   23.064 51.85104 26.65478 
1 1 1    9   18   46 o  216.226   16.064   36.625   5.2786   16.583   19.058   38.290   5.4935  144.822   57.533  221.020   16.355 -76.19804 59.81265 
1 1 1    9   18   47 o  176.213   18.603   24.635   4.9417  -4.0338   12.178   30.287   5.4069   89.447   40.671  195.683   18.263 -106.2363 44.58364 
1 1 1    9   18   48 o   81.107   29.046   4.7902   4.5739   5.7688   5.2495   1.7055   9.3204   87.693   31.148   89.313   38.243 -1.620880 49.32277 
1 1 1    9   18   49 o  183.790   15.971   26.608   4.4482   25.523   6.8656   27.394   5.8396  175.829   26.320  184.626   21.040 -8.796890 33.69607 
1 1 1    9   18   50 o  174.243   16.406   24.008   4.3241   30.252   6.4377   18.875   5.8368  193.389   22.148  150.503   26.294 42.88602 34.37904 
1 1 1    9   18   51 o  151.163   20.001   18.459   4.5140   17.254   6.2449   19.778   6.5322  141.844   29.715  152.452   29.054 -10.60767 41.55886 
1 1 1    9   18   52 o  319.839   10.718   79.271   5.2470   80.467   7.5122   78.131   7.3319  320.180   15.329  315.573   15.179 4.606750 21.57262 
1 1 1    9   18   53 o  108.173   25.598   10.003   4.1722   14.606   6.0753   5.8948   5.7399  128.532   31.196   87.820   32.381 40.71217 44.96350 
1 1 1    9   18   54 o  166.532   18.378   22.414   4.6064   24.539   6.1919   19.780   6.8932  171.110   24.327  149.281   31.174 21.82927 39.54264 
1 1 1    9   18   55 o  100.448   27.085   8.8428   4.2593   3.5476   6.1008   13.878   5.9492   79.051   32.150  123.852   31.353 -44.80035 44.90683 
1 1 1    9   18   56 o  136.214   21.700   15.562   4.3726   13.650   6.3574   17.278   6.0236  120.863   33.300  139.081   29.224 -18.21721 44.30518 
1 1 1    9   18   57 o  136.851   23.654   16.123   4.7756   12.626   7.7944   18.225   6.0427  112.499   38.060  142.117   28.766 -29.61700 47.70781 
1 1 1    9   18   58 o   98.961   29.630   9.1445   4.8392   3.2601   7.9511   12.607   6.0989   81.229   35.059  113.774   33.056 -32.54446 48.18565 
1 1 1    9   18   59 o  110.100   28.390   11.344   4.8152   7.5487   5.9111   18.829   8.3016   90.065   32.913  132.703   38.569 -42.63721 50.70383 
1 1 1    9   19    0 o  1155.42   16.548  1023.04   29.253  1023.04   29.253  1023.04   29.253  1155.42   16.548  1155.42   16.548 0.000000 0.000000 
1 1 1    9   19    1 f  1534.41   14.510  1803.81   34.078  1768.44   47.067  1842.79   49.405  1518.51   20.250  1550.01   20.824 -31.49915 29.04666 
1 1 1    9   19    2 o  562.612   8.4492  242.336   7.2761  245.642   10.385  239.148   10.198  566.332   11.980  558.797   11.923 7.534119 16.90176 
1 1 1    9   19    3 o  611.398   8.6549  286.192   8.0995  281.501   11.327  291.100   11.586  606.250   12.206  616.498   12.278 -10.24774 17.31352 
1 1 1    9   19    4 o  929.538   10.332  661.632   14.701  653.164   20.618  670.387   20.966  923.314   14.589  935.404   14.643 -12.09033 20.67052 
1 1 1    9   19    5 o  777.586   9.5224  462.961   11.333  465.968   16.143  460.038   15.916  779.917   13.522  774.944   13.418 4.972229 19.04993 
1 1 1    9   19    6 o  1924.90   14.458  2838.84   42.598  2831.97   52.116  2852.65   73.942  1922.03   17.715  1927.42   25.064 -5.388184 30.69229 
1 1 1    9   19    7 o  1342.27   10.845  1379.74   22.281  1381.19   27.409  1376.92   38.257  1342.76   13.336  1340.06   18.652 2.699585 22.92896 
1 1 1    9   19    8 o  1080.59   9.3996  894.069   15.547  899.329   19.224  884.125   26.431  1083.62   11.590  1074.06   16.078 9.567749 19.81977 
1 1 1    9   19    9 o  838.693   8.2722  538.534   10.619  540.307   13.104  535.143   18.126  839.988   10.192  835.735   14.170 4.252197 17.45442 
1 1 1    9   19   10 o  776.133   8.0202  461.183   9.5278  459.264   11.666  465.027   16.510  774.443   9.8419  779.073   13.845 -4.629700 16.98701 
1 1 1    9   19   11 o  502.042   7.6232  192.961   5.8580  188.158   7.1008  203.196   10.365  495.710   9.3585  515.009   13.149 -19.29898 16.13913 
1 1 1    9   19   12 o  633.894   9.4809  307.689   9.1989  307.689   9.1989   0.0000   0.0000  633.894   9.4809  ?   ?  0.000000 9.480892 
1 1 1    9   19   13 o  1234.49   12.616  1167.48   23.839  1167.48   23.839   0.0000   0.0000  1234.49   12.616  ?   ?  0.000000 12.61631 
1 1 1    9   19   14 o  306.495   8.0452   71.923   3.7743   78.297   5.2799   65.263   5.3973  319.734   10.789  291.881   12.081 27.85281 16.19696 
1 1 1    9   19   15 o  540.734   6.9463  223.845   5.7492  225.374   8.0500  222.254   8.2136  542.494   9.6946  538.716   9.9610 3.777893 13.89990 
1 1 1    9   19   16 o  618.580   7.0488  292.943   6.6739  298.207   9.4061  287.605   9.4709  624.011   9.8480  612.808   10.097 11.20355 14.10440 
1 1 1    9   19   17 o  515.819   8.4855  203.733   6.6995  204.645   8.0026  201.596   12.249  516.915   10.114  512.788   15.606 4.126709 18.59680 
1 1 1    9   19   18 f  780.080   8.6841  465.978   10.369  469.542   12.609  458.533   18.225  782.953   10.521  773.350   15.396 9.602844 18.64778 
1 1 1    9   19   19 o  763.539   7.5620  446.374   8.8377  455.454   12.543  437.421   12.455  771.096   10.627  755.667   10.768 15.42841 15.12878 
1 1 1    9   19   20 o  791.278   7.7271  479.416   9.3587  474.092   12.985  485.171   13.501  786.687   10.784  795.804   11.084 -9.116821 15.46389 
1 1 1    9   19   21 o  943.121   8.1765  681.127   11.803  664.455   16.261  699.690   17.159  931.250   11.408  955.591   11.732 -24.34161 16.36409 
1 1 1    9   19   22 o  139.263   29.124   15.512   6.0084   0.0000   0.0000   15.512   6.0084  ?   ?   139.263   29.124 0.000000 29.12407 
1 1 1    9   19   23 o  216.255   15.804   36.070   5.1949   36.997   8.6287   35.543   6.5061  217.545   26.458  214.147   20.084 3.398849 33.21737 
1 1 1    9   19   24 o  340.843   11.284   89.031   5.8867   86.615   9.7481   90.418   7.3853  335.224   19.077  343.358   14.052 -8.133972 23.69408 
1 1 1    9   19   25 o  105.934   26.924   8.9939   4.3749   4.1479   6.1429   13.982   6.2323   87.268   33.216  131.803   31.349 -44.53530 45.67364 
1 1 1    9   19   26 o  648.420   8.1860  322.054   8.1245  315.987   11.112  329.023   11.909  642.030   11.307  655.084   11.877 -13.05426 16.39893 
1 1 1    9   19   27 o  387.195   8.3330  114.850   4.9386  117.881   6.1729  109.461   8.2317  392.168   10.284  377.639   14.241 14.52881 17.56598 
1 1 1    9   19   28 o  775.915   7.9715  461.220   9.4673  459.421   12.325  463.810   14.785  774.125   10.402  777.528   12.424 -3.403503 16.20337 
1 1 1    9   19   29 o  378.119   8.4506  109.558   4.8909  114.824   5.5748   91.961   10.191  387.041   9.4103  344.965   19.379 42.07605 21.54286 
1 1 1    9   19   30 o  178.889   12.551   24.686   3.4148   22.426   3.8748   32.545   7.2260  170.152   15.033  203.792   23.602 -33.64023 27.98294 
1 1 1    9   19   31 o   75.635   21.387   4.5366   2.5863   5.9289   3.5017   2.8656   3.8363   86.515   25.022   70.244   26.359 16.27109 36.34433 
1 1 1    9   19   32 o  173.860   13.816   23.383   3.6464   35.725   7.4802   19.536   4.1762  213.474   23.270  158.245   17.537 55.22852 29.13779 
1 1 1    9   19   33 o  168.757   15.956   22.132   4.0725   22.132   4.0725   0.0000   0.0000  168.757   15.956  ?   ?  0.000000 15.95554 
1 1 1    9   19   34 o  394.851   7.8726  119.528   4.7580  124.149   5.9267  111.151   7.9799  402.236   9.6264  380.083   13.717 22.15320 16.75755 
1 1 1    9   19   35 f  381.423   8.1953  111.572   4.7845  105.625   5.8074  124.139   8.4418  370.903   10.229  401.577   13.734 -30.67352 17.12486 
1 1 1    9   19   36 o  378.033   8.4611  109.635   4.8958  104.138   6.6045  116.342   7.2944  368.024   11.724  388.909   12.254 -20.88495 16.95931 
1 1 1    9   19   37 o  302.091   8.7173   70.038   4.0308   62.795   5.2362   80.574   6.3150  285.689   11.974  323.500   12.754 -37.81158 17.49396 
1 1 1    9   19   38 o  276.507   8.4834   58.683   3.5904   56.514   5.0050   60.983   5.1535  270.947   12.069  281.471   11.962 -10.52399 16.99226 
1 1 1    9   19   39 o  470.743   7.0047  169.962   5.0471  170.680   7.1611  169.252   7.1146  471.222   9.9285  469.251   9.9055 1.971161 14.02477 
1 1 1    9   19   40 o  404.933   7.4518  125.826   4.6186  131.318   6.6673  120.760   6.4041  413.120   10.544  396.162   10.561 16.95825 14.92368 
1 1 1    9   19   41 o  328.235   8.3236   82.757   4.1818   82.373   5.9624   83.129   5.8667  326.845   11.918  328.389   11.672 -1.544891 16.68151 
1 1 1    9   19   42 o  142.963   15.437   16.033   3.3244   22.911   4.8433   9.9065   4.5712  170.296   18.900  109.357   27.373 60.93880 33.26413 
1 1 1    9   19   43 o  504.402   7.6680  195.413   5.9201  183.429   8.5787  206.309   8.1801  487.602   11.494  517.520   10.327 -29.91812 15.45195 
1 1 1    9   19   44 o   43.986   20.023  -1.7295   2.9622  -3.1398   4.0659  -0.1343   4.3243   49.260   22.800   59.969   25.869 -10.70920 34.48251 
1 1 1    9   19   45 o  188.885   13.303   27.771   3.8214   29.076   5.4428   26.503   5.3666  191.730   18.788  182.746   19.486 8.984543 27.06855 
1 1 1    9   19   46 o  120.669   26.703   12.143   4.8015  -9.4586   17.132   13.984   5.0020   98.891   46.121  129.900   26.064 -31.00864 52.97614 
1 1 1    9   19   47 o  100.632   28.673   8.4879   4.6305   10.107   5.3643   3.7544   9.1719  109.198   30.774   94.014   38.951 15.18384 49.64079 
1 1 1    9   19   48 o  218.532   13.285   37.225   4.4227   40.840   6.8686   34.664   5.7805  226.400   20.027  209.173   18.237 17.22722 27.08665 
1 1 1    9   19   49 o  102.425   25.683   8.8200   4.0191   7.0429   6.1381   10.154   5.3176   95.007   33.688  108.919   30.620 -13.91209 45.52461 
1 1 1    9   19   50 o  157.310   18.797   19.831   4.4363   14.913   5.8446   26.516   6.8141  131.841   29.678  179.109   25.582 -47.26857 39.18231 
1 1 1    9   19   51 o  136.930   20.023   15.224   4.0726   18.819   5.9236   12.001   5.6085  149.423   26.889  117.342   30.827 32.08122 40.90577 
1 1 1    9   19   52 o  105.231   26.389   9.4889   4.2428   15.837   6.2791   4.1556   5.7556  134.224   31.162   81.197   31.818 53.02749 44.53577 
1 1 1    9   19   53 o   84.708   31.654   5.3591   5.5211 -11.3087   10.224   12.221   6.5599   68.575   33.008  115.980   34.446 -47.40484 47.70796 
1 1 1    9   19   54 o   70.678   27.356   3.2073   4.2142  -0.2334   5.9888   6.5819   5.9311   67.443   29.738   90.186   32.967 -22.74328 44.39766 
1 1 1    9   19   55 o  142.897   20.917   16.948   4.4396   21.442   6.3819   12.733   6.1801  156.907   27.580  117.350   33.017 39.55698 43.02038 
1 1 1    9   19   56 o   74.346   28.551   3.9662   4.5640   3.5163   7.0922   4.2842   5.9627   80.969   33.954   79.940   32.040 1.029083 46.68450 
1 1 1    9   19   57 o  164.295   17.686   22.131   4.3774   22.177   6.2994   22.089   6.0873  157.905   27.036  158.378   26.014 -0.4724579 37.51901 
1 1 1    9   19   58 o   59.502   26.168   0.1777   4.6092   0.8019   7.9950  -0.1330   5.6411   75.199   33.682   63.792   28.453 11.40641 44.09125 
1 1 1    9   20    0 o  1171.73   16.858  1052.22   30.220  1052.22   30.220  1052.22   30.220  1171.73   16.858  1171.73   16.858 0.000000 0.000000 
1 1 1    9   20    1 f  491.239   8.6271  184.759   6.4867  178.255   8.9942  191.808   9.3642  482.417   12.181  500.418   12.226 -18.00159 17.25785 
1 1 1    9   20    2 o  831.149   9.7572  528.966   12.413  527.990   17.450  529.966   17.661  830.165   13.733  831.708   13.873 -1.543274 19.52056 
1 1 1    9   20    3 o  1120.01   11.569  960.744   19.832  971.276   28.293  950.570   27.808  1125.70   16.420  1113.65   16.314 12.05237 23.14654 
1 1 1    9   20    4 o  1484.70   14.263  1688.97   32.413  1720.44   46.906  1660.20   44.841  1497.56   20.463  1471.20   19.913 26.35669 28.55287 
1 1 1    9   20    5 o  1298.57   12.909  1291.78   25.658  1275.27   35.830  1309.15   36.760  1289.65   18.151  1306.64   18.380 -16.98828 25.83218 
1 1 1    9   20    6 o  985.502   8.9355  743.629   13.479  741.386   16.559  748.033   23.205  983.897   10.995  987.969   15.345 -4.072083 18.87744 
1 1 1    9   20    7 o  828.049   8.2423  524.960   10.447  523.750   12.840  527.331   17.968  827.009   10.143  829.594   14.150 -2.584595 17.41018 
1 1 1    9   20    8 o  771.777   8.0706  456.030   9.5339  449.841   11.632  468.697   16.642  766.446   9.9152  782.121   13.901 -15.67560 17.07488 
1 1 1    9   20    9 o  582.385   7.6312  259.666   6.8026  258.334   8.3468  262.301   11.739  580.835   9.3885  585.128   13.108 -4.292664 16.12301 
1 1 1    9   20   10 o  1634.56   15.530  2047.85   38.854  2047.85   38.854   0.0000   0.0000  1634.56   15.530  ?   ?  0.000000 15.52971 
1 1 1    9   20   11 o  351.990   10.322   94.885   5.5611   94.885   5.5611   0.0000   0.0000  351.990   10.322  ?   ?  0.000000 10.32200 
1 1 1    9   20   12 o  1347.75   10.986  1391.24   22.663  1446.52   28.934  1303.51   36.455  1373.95   13.759  1303.64   18.270 70.30835 22.87099 
1 1 1    9   20   13 o  313.515   9.3410   75.269   4.4825   72.771   5.4065   80.761   8.0173  308.223   11.460  324.561   16.139 -16.33759 19.79350 
1 1 1    9   20   14 o  762.174   8.3289  444.795   9.7165  438.644   11.704  458.438   17.430  756.799   10.104  773.374   14.725 -16.57526 17.85757 
1 1 1    9   20   15 o  126.127   20.843   12.535   3.8833   10.343   4.5087   18.833   7.6425  113.705   26.411  153.309   33.504 -39.60394 42.66272 
1 1 1    9   20   16 f  539.867   7.3129  223.146   6.0429  232.086   8.5865  214.372   8.5060  550.471   10.191  529.034   10.504 21.43738 14.63548 
1 1 1    9   20   17 o  446.074   7.7981  152.357   5.3244  146.666   7.2945  158.846   7.7894  437.564   10.891  455.360   11.176 -17.79575 15.60517 
1 1 1    9   20   18 o  671.891   7.5287  345.653   7.7426  344.495   10.819  346.868   11.086  670.615   10.540  672.908   10.763 -2.292419 15.06424 
1 1 1    9   20   19 o  215.189   12.424   35.604   4.0749   37.711   5.7420   33.466   5.7837  221.043   17.105  208.011   18.354 13.03256 25.08837 
1 1 1    9   20   20 o  780.799   7.7618  466.827   9.2763  455.159   12.914  479.263   13.333  770.772   10.947  790.912   11.013 -20.14020 15.52822 
1 1 1    9   20   21 o  1097.98   10.178  923.555   17.104  959.041   30.873  907.839   20.546  1117.68   18.046  1088.34   12.334 29.33704 21.85843 
1 1 1    9   20   22 o  1304.41   9.6715  1303.43   19.310  1277.32   26.650  1332.27   28.017  1290.69   13.490  1318.09   13.887 -27.39673 19.36043 
1 1 1    9   20   23 o  299.209   10.989   68.608   5.0329   68.773   7.0045   68.433   7.2363  298.984   15.358  298.185   15.912 0.7994385 22.11479 
1 1 1    9   20   24 o  361.770   11.095  100.313   6.1437  102.210   10.341   99.279   7.6377  364.206   18.613  359.747   13.871 4.458374 23.21281 
1 1 1    9   20   25 o  289.393   13.075   64.241   5.7916   59.707   9.6102   66.827   7.2575  277.422   22.835  294.544   16.160 -17.12137 27.97429 
1 1 1    9   20   26 o  638.245   9.4605  312.172   9.2421  308.700   15.184  314.215   11.648  633.953   15.648  640.083   11.889 -6.129883 19.65234 
1 1 1    9   20   27 o  304.651   12.772   71.220   5.9556   64.988   7.5193   81.711   9.7561  290.228   17.001  325.136   19.697 -34.90842 26.01887 
1 1 1    9   20   28 o  727.326   7.6781  405.285   8.5478  414.044   9.8789  379.193   17.050  735.023   8.7809  702.304   15.861 32.71881 18.12964 
1 1 1    9   20   29 o  731.523   8.4082  410.116   9.4146  422.473   13.405  398.085   13.226  741.957   11.803  720.190   11.998 21.76691 16.83054 
1 1 1    9   20   30 o  357.471   8.1489   97.938   4.4587   95.480   5.1637  105.141   8.8400  352.861   9.5606  369.668   15.623 -16.80634 18.31639 
1 1 1    9   20   31 f  226.469   15.167   39.642   5.2272   38.626   7.4679   40.618   7.3192  222.272   22.249  228.202   21.196 -5.930801 30.72968 
1 1 1    9   20   32 o  167.222   13.534   21.642   3.4343   22.451   3.9214   18.980   7.1151  170.091   15.223  152.868   31.458 17.22372 34.94742 
1 1 1    9   20   33 o  454.087   6.7588  158.009   4.6976  157.658   6.5660  158.378   6.7236  453.300   9.4634  454.307   9.6691 -1.007538 13.52946 
1 1 1    9   20   34 o  344.271   7.3600   90.859   3.8783   89.593   5.2924   92.328   5.6998  341.609   10.122  346.715   10.740 -5.106537 14.75821 
1 1 1    9   20   35 o  330.106   8.9224   83.620   4.5082   79.516   5.8253   89.749   7.1186  321.577   11.835  341.381   13.623 -19.80392 18.04614 
1 1 1    9   20   36 o  129.116   15.154   13.038   2.9379   13.137   3.8708   12.903   4.5123  128.540   20.352  126.497   24.186 2.043198 31.60956 
1 1 1    9   20   37 o  290.674   8.2188   64.838   3.6567   62.007   4.8770   68.472   5.5263  283.928   11.222  298.240   12.106 -14.31128 16.50714 
1 1 1    9   20   38 o  195.124   10.656   29.369   3.1706   25.247   4.3915   33.858   4.5824  179.911   16.118  208.900   14.420 -28.98933 21.62661 
1 1 1    9   20   39 o  208.729   9.9219   33.500   3.1699   29.375   4.3580   38.134   4.6192  194.363   14.759  221.824   13.671 -27.46086 20.11811 
1 1 1    9   20   40 o  422.280   7.2419  136.846   4.6808  144.885   6.6971  129.168   6.5449  433.951   10.083  409.659   10.438 24.29120 14.51239 
1 1 1    9   20   41 o  321.744   8.5724   79.555   4.2217   83.450   5.7952   75.151   6.1624  328.977   11.509  311.892   12.909 17.08472 17.29405 
1 1 1    9   20   42 f   55.819   22.277   1.3192   2.8692   2.0632   4.1694   0.6499   3.9545   67.459   26.875   60.397   25.342 7.062065 36.93905 
1 1 1    9   20   43 o  160.931   13.520   20.188   3.2994   17.828   4.6528   22.576   4.6794  149.221   20.948  169.006   18.386 -19.78426 27.87213 
1 1 1    9   20   44 o  214.065   14.421   35.720   4.6976   41.375   5.4580   19.560   9.2265  230.114   15.588  149.329   39.687 80.78525 42.63887 
1 1 1    9   20   45 f   60.087   25.882  -0.0362   4.3157   10.532   11.234  -1.8658   4.6744  118.634   44.975   56.952   25.613 61.68283 51.75724 
1 1 1    9   20   46 o  133.025   21.418   14.334   4.2129   16.067   4.8021   8.5440   8.7777  140.396   23.154  107.183   39.940 33.21342 46.16563 
1 1 1    9   20   47 o  235.563   11.362   42.920   4.0966   44.899   5.9102   41.091   5.6835  239.104   16.245  228.658   16.347 10.44586 23.04617 
1 1 1    9   20   48 o  130.061   20.359   13.700   3.9201   12.570   5.8395   14.627   5.2889  120.824   31.318  131.980   27.089 -11.15652 41.40769 
1 1 1    9   20   49 o   92.666   27.327   7.1900   4.1406   5.2115   6.0218   8.9643   5.7026   87.088   32.949  102.860   32.425 -15.77158 46.22832 
1 1 1    9   20   50 o   66.376   26.167   2.3540   3.9141   9.0078   6.0883  -2.3331   5.1099  102.908   33.606   58.025   26.369 44.88354 42.71673 
1 1 1    9   20   51 o  103.105   31.938   9.2127   5.5593   0.0000   0.0000   9.2127   5.5593  ?   ?   103.105   31.938 0.000000 31.93762 
1 1 1    9   20   52 o  110.247   24.868   10.350   4.0964   4.3545   5.6304   17.093   5.9710   81.228   31.569  140.471   28.739 -59.24253 42.69165 
1 1 1    9   20   53 o  280.689   11.973   61.467   5.1441   54.210   6.8749   70.699   7.7541  260.383   17.349  297.674   17.090 -37.29135 24.35278 
1 1 1    9   20   54 o   46.776   22.046  -3.8257   4.0926  -1.1223   6.0227  -6.1449   5.5784   65.152   29.204   52.195   24.925 12.95660 38.39486 
1 1 1    9   20   55 o  182.751   17.074   26.991   4.7206   29.286   7.2116   25.270   6.2444  184.104   26.343  172.245   24.365 11.85849 35.88279 
1 1 1    9   20   56 o  121.614   23.274   12.773   4.1746   17.844   5.9785   7.9476   5.8318  140.412   28.784   93.546   32.871 46.86642 43.69214 
1 1 1    9   20   57 o   83.479   29.444   6.1250   4.6831   12.857   8.3067   2.9885   5.6701  110.964   39.207   73.319   30.522 37.64522 49.68626 
1 1 1    9   20   58 o   89.055   29.793   7.3710   4.7756   7.9533   5.7907   6.1329   8.4441   91.759   32.701   88.613   37.098 3.145927 49.45293 
1 1 1    9   21    0 o  609.370   12.780  284.701   11.908  284.701   11.908  284.701   11.908  609.370   12.780  609.370   12.780 0.000000 0.000000 
1 1 1    9   21    1 o  590.950   8.9529  267.395   8.0982  268.230   11.375  266.536   11.531  591.733   12.560  589.852   12.772 1.881287 17.91275 
1 1 1    9   21    2 o  1010.36   10.938  781.823   16.915  766.950   23.464  797.914   24.407  1000.35   15.324  1020.32   15.628 -19.96460 21.88759 
1 1 1    9   21    3 f  217.257   12.329   36.273   4.0830   37.872   5.6615   34.541   5.8938  221.627   16.815  211.429   18.396 10.19838 24.92249 
1 1 1    9   21    4 o  1006.81   15.476  776.927   23.849   0.0000   0.0000  776.927   23.849  ?   ?   1006.81   15.476 0.000000 15.47599 
1 1 1    9   21    5 o  517.052   9.0267  204.706   7.1439  203.855   10.124  205.549   10.082  515.843   12.823  517.987   12.716 -2.143372 18.05872 
1 1 1    9   21    6 o  786.951   8.1562  474.152   9.8244  462.107   11.899  499.944   17.412  776.808   10.008  807.733   14.084 -30.92511 17.27742 
1 1 1    9   21    7 o  1305.39   10.720  1305.09   21.419  1310.93   26.502  1294.09   36.372  1308.05   13.237  1298.96   18.294 9.093140 22.58025 
1 1 1    9   21    8 o  390.284   10.072  116.651   6.0169  116.651   6.0169   0.0000   0.0000  390.284   10.072  ?   ?  0.000000 10.07211 
1 1 1    9   21    9 o  1041.75   11.468  831.285   18.286  831.285   18.286   0.0000   0.0000  1041.75   11.468  ?   ?  0.000000 11.46765 
1 1 1    9   21   10 o  318.414   9.0788   77.637   4.4247   75.084   5.3892   82.916   7.7509  313.089   11.246  328.888   15.397 -15.79935 19.06651 
1 1 1    9   21   11 o  835.018   8.5181  533.890   10.887  523.438   13.165  556.507   19.364  826.700   10.404  852.080   14.848 -25.38013 18.12973 
1 1 1    9   21   12 o  325.613   9.3849   81.193   4.6774   80.291   5.6359   83.189   8.3843  323.751   11.373  328.943   16.707 -5.192322 20.21098 
1 1 1    9   21   13 o  812.218   8.5884  505.152   10.677  494.284   12.841  529.496   19.219  803.328   10.444  831.082   15.108 -27.75391 18.36621 
1 1 1    9   21   14 o  357.842   9.3496   98.065   5.1210   90.573   6.0504  116.986   9.6155  343.843   11.496  390.586   16.084 -46.74289 19.76987 
1 1 1    9   21   15 o  826.351   7.6364  522.841   9.6587  524.803   13.553  520.816   13.768  827.715   10.698  824.550   10.909 3.164795 15.27917 
1 1 1    9   21   16 o  1243.64   9.2547  1184.51   17.617  1175.68   24.619  1193.77   25.219  1238.58   12.986  1248.04   13.202 -9.463379 18.51854 
1 1 1    9   21   17 o  461.350   7.8000  162.977   5.5080  164.960   7.7282  160.931   7.8524  464.033   10.881  458.317   11.193 5.715881 15.61041 
1 1 1    9   21   18 o  1247.04   9.3420  1191.08   17.832  1193.50   25.233  1188.66   25.202  1247.81   13.212  1245.28   13.222 2.533813 18.69142 
1 1 1    9   21   19 o  695.780   8.9718  370.780   9.5547  376.934   16.899  367.889   11.584  700.970   15.751  692.933   10.922 8.036499 19.16694 
1 1 1    9   21   20 o  980.709   9.6766  736.772   14.526  724.033   25.039  743.234   17.833  971.257   16.843  984.768   11.831 -13.51135 20.58285 
1 1 1    9   21   21 o  330.880   9.7785   83.876   4.9524   90.999   7.2050   77.496   6.8184  344.473   13.665  317.874   14.014 26.59906 19.57339 
1 1 1    9   21   22 o  262.267   11.822   52.728   4.7459   49.543   6.6532   56.029   6.7717  253.402   17.256  269.639   16.487 -16.23730 23.86606 
1 1 1    9   21   23 o  298.714   12.337   68.424   5.6408   70.869   9.1861   66.943   7.1469  302.882   19.926  294.850   15.895 8.032684 25.48887 
1 1 1    9   21   24 o  206.197   16.584   32.875   5.1900   30.362   8.2554   34.517   6.6738  196.115   28.322  210.692   20.973 -14.57654 35.24238 
1 1 1    9   21   25 f  457.051   10.056  160.122   7.0346  159.150   11.819  160.656   8.7542  455.001   16.970  457.616   12.498 -2.614655 21.07595 
1 1 1    9   21   26 o  346.085   13.033   91.931   6.9038   86.841   9.8031   96.939   9.7243  335.266   19.183  354.477   17.981 -19.21124 26.29267 
1 1 1    9   21   27 o  1051.95   12.403  849.327   19.971  812.126   27.208  892.783   29.406  1027.26   17.304  1076.88   17.840 -49.61609 24.85359 
1 1 1    9   21   28 o  359.456   10.729   99.117   5.9030   90.229   8.0917  109.229   8.6304  342.530   15.434  376.929   14.959 -34.39935 21.49353 
1 1 1    9   21   29 o  161.998   19.704   20.549   4.7851   21.248   6.5046   19.725   7.0644  163.251   26.973  156.349   30.615 6.902100 40.80243 
1 1 1    9   21   30 o  521.250   8.9549  208.344   7.1445  199.762   9.7471  218.309   10.503  509.932   12.488  533.015   12.874 -23.08301 17.93556 
1 1 1    9   21   31 o  524.352   7.3354  210.720   5.8873  206.097   7.0926  220.962   10.557  518.389   8.9388  536.149   12.864 -17.76019 15.66491 
1 1 1    9   21   32 o  240.778   10.042   44.497   3.7010   44.286   4.2528   45.155   7.5134  240.094   11.572  240.592   20.601 -0.4983978 23.62905 
1 1 1    9   21   33 o  237.633   9.3642   43.335   3.4060   43.669   4.4153   42.844   5.3526  238.020   12.160  235.324   14.938 2.695709 19.26129 
1 1 1    9   21   34 o   63.118   22.290   2.7200   2.6845   6.8809   3.7220  -1.7917   3.8757   92.378   25.491   51.914   23.337 40.46433 34.56022 
1 1 1    9   21   35 o  213.760   9.2575   35.080   3.0289   38.070   4.2122   31.878   4.3587  222.060   12.443  202.868   14.125 19.19159 18.82393 
1 1 1    9   21   36 o  331.822   7.9998   84.481   4.0631   86.789   5.2435   81.013   6.4276  336.057   10.194  324.271   12.950 11.78616 16.48092 
1 1 1    9   21   37 o   73.508   21.973   4.2755   2.6630   4.6464   3.4158   3.7006   4.2524   77.805   25.156   75.770   27.881 2.034943 37.55265 
1 1 1    9   21   38 o  442.844   8.0057  150.542   5.4265  152.292   6.8828  147.668   8.8215  445.010   10.105  437.466   13.174 7.544250 16.60329 
1 1 1    9   21   39 o  167.917   11.953   21.846   3.0520   18.849   4.0693   25.699   4.6141  154.779   17.483  181.178   16.831 -26.39952 24.26807 
1 1 1    9   21   40 o  346.691   8.1766   92.332   4.3390   82.175   5.7984  105.257   6.5410  326.450   11.604  369.472   11.566 -43.02185 16.38408 
1 1 1    9   21   41 o  207.488   10.807   33.264   3.4204   30.583   4.9786   35.662   4.7072  197.624   16.613  214.071   14.451 -16.44716 22.01832 
1 1 1    9   21   42 o  241.827   9.8702   45.030   3.6534   55.056   5.4351   36.765   4.9346  266.734   13.312  217.168   14.936 49.56584 20.00753 
1 1 1    9   21   43 o  243.437   9.9501   45.655   3.7075   45.822   5.2327   45.486   5.2538  242.671   14.149  241.744   14.262 0.9265289 20.08967 
1 1 1    9   21   44 o   59.302   25.165   0.3875   3.9711   13.246   10.590  -1.7162   4.2836  126.066   44.296   54.635   24.550 71.43088 50.64397 
1 1 1    9   21   45 o  268.784   18.661   56.997   7.6297   40.487   11.689   69.253   10.071  217.243   36.443  294.453   22.516 -77.20999 42.83757 
1 1 1    9   21   46 f  347.256   8.9797   92.889   4.7729   96.234   6.8253   89.688   6.6769  352.327   12.656  340.074   12.827 12.25272 18.01991 
1 1 1    9   21   47 o  226.763   12.102   39.958   4.1851   42.224   6.2355   38.101   5.6457  231.143   17.761  219.835   16.908 11.30777 24.52177 
1 1 1    9   21   48 o  134.482   19.490   14.584   3.8950   9.6211   5.1606   21.153   5.9374  106.141   30.279  160.139   25.043 -53.99811 39.29379 
1 1 1    9   21   49 o   97.407   25.231   7.9998   3.7919   5.7028   5.4252   10.194   5.3019   87.124   31.578  108.696   30.581 -21.57217 43.95874 
1 1 1    9   21   50 o  181.547   14.848   25.984   4.0900   25.653   5.9786   26.275   5.6074  177.087   22.570  180.143   20.713 -3.055771 30.63408 
1 1 1    9   21   51 o  174.740   16.442   24.310   4.3459   20.471   5.9062   28.842   6.4177  155.995   25.626  187.270   22.864 -31.27515 34.34309 
1 1 1    9   21   52 o  225.433   14.157   40.062   4.8601   34.558   6.7307   46.058   7.0252  205.275   21.753  238.819   19.386 -33.54407 29.13774 
1 1 1    9   21   53 o  127.341   22.684   13.628   4.2592   5.0758   6.1847   21.343   5.8742   84.833   33.054  158.673   25.015 -73.83979 41.45312 
1 1 1    9   21   54 o  147.874   21.050   18.181   4.6301   28.086   7.2687   11.418   6.0062  179.986   27.236  111.049   32.955 68.93734 42.75324 
1 1 1    9   21   55 o  244.712   14.356   47.675   5.3538   55.848   6.5497   31.219   9.2938  263.453   16.323  181.766   34.670 81.68701 38.32034 
1 1 1    9   21   56 o   74.121   27.379   4.3612   4.1071   9.7554   5.6522  -1.6728   5.9780  101.269   32.320   62.150   28.351 39.11962 42.99247 
1 1 1    9   21   57 o   56.968   26.613  -3.3312   5.7414   3.0163   8.1263  -9.6578   8.1129   80.502   35.090   58.647   28.509 21.85447 45.21125 
1 1 1    9   22    0 o  125.575   31.918   14.202   5.3043   14.202   5.3043   14.202   5.3043  125.575   31.918  125.575   31.918 0.000000 0.000000 
1 1 1    9   22    1 o  742.764   9.5819  422.480   10.894  419.380   15.277  425.686   15.538  739.814   13.491  745.346   13.620 -5.532593 19.17048 
1 1 1    9   22    2 o  301.685   10.394   69.704   4.7996   68.441   6.7201   71.020   6.8573  298.832   14.692  304.409   14.717 -5.576965 20.79550 
1 1 1    9   22    3 o  522.571   9.1396  209.109   7.3104  213.078   10.360  205.173   10.317  527.364   12.834  517.480   13.026 9.884277 18.28632 
1 1 1    9   22    4 f  917.732   14.918  645.541   20.956   0.0000   0.0000  645.541   20.956  ?   ?   917.732   14.918 0.000000 14.91837 
1 1 1    9   22    6 o  1323.69   13.378  1342.61   27.105  1342.61   27.105   0.0000   0.0000  1323.69   13.378  ?   ?  0.000000 13.37799 
1 1 1    9   22    7 o  714.076   10.015  390.512   10.947  390.512   10.947   0.0000   0.0000  714.076   10.015  ?   ?  0.000000 10.01526 
1 1 1    9   22    8 f  487.723   8.0065  182.132   5.9770  184.648   7.4528  177.597   10.006  491.020   9.9164  481.406   13.579 9.614777 16.81454 
1 1 1    9   22    9 o  193.022   13.132   28.681   3.8567   27.216   4.7332   31.576   6.6528  187.655   16.652  201.592   21.913 -13.93692 27.52236 
1 1 1    9   22   10 o  1038.56   9.4304  826.025   14.991  824.581   18.398  828.878   25.858  1037.48   11.586  1039.68   16.249 -2.196533 19.95658 
1 1 1    9   22   11 o  731.620   8.3341  409.866   9.3328  416.348   11.624  398.110   15.655  737.279   10.301  720.688   14.192 16.59131 17.53604 
1 1 1    9   22   12 o  1322.54   11.007  1339.91   22.281  1319.26   26.868  1385.39   39.875  1312.02   13.379  1343.45   19.391 -31.43933 23.55868 
1 1 1    9   22   13 o  1672.45   13.082  2143.63   33.489  2129.14   40.684  2174.08   58.979  1666.22   15.952  1681.87   22.910 -15.64746 27.91698 
1 1 1    9   22   14 o  939.689   9.2292  676.269   13.275  703.799   16.728  629.447   21.815  958.445   11.403  905.958   15.732 52.48651 19.42981 
1 1 1    9   22   15 o  402.638   8.1755  124.143   5.0385  125.107   7.0043  123.109   7.2532  404.090   11.324  400.830   11.822 3.260468 16.37094 
1 1 1    9   22   16 o  1146.26   8.8831  1006.28   15.585  1004.73   21.923  1007.87   22.162  1144.97   12.509  1146.74   12.626 -1.767212 17.77339 
1 1 1    9   22   17 o  661.671   7.5670  335.246   7.6637  321.609   10.554  350.457   11.146  647.899   10.642  676.325   10.767 -28.42517 15.13925 
1 1 1    9   22   18 o  303.930   11.393   70.788   5.3001   71.792   9.1628   70.284   6.4974  305.044   19.730  302.742   14.022 2.301880 24.20503 
1 1 1    9   22   19 f  564.213   7.7858  243.788   6.7238  244.104   9.4728  243.467   9.5453  564.395   10.965  563.652   11.064 0.7437744 15.57731 
1 1 1    9   22   20 o  147.521   21.024   17.073   4.6129   20.602   7.7211   15.115   5.7523  160.256   32.587  137.421   28.290 22.83511 43.15410 
1 1 1    9   22   21 o  182.182   17.481   25.731   4.8148   26.823   7.9575   25.101   6.0474  184.023   29.228  179.140   22.555 4.883789 36.91895 
1 1 1    9   22   22 o  412.440   10.072  130.368   6.3585  144.939   10.764  122.559   7.8803  434.397   16.189  399.719   12.880 34.67780 20.68768 
1 1 1    9   22   23 f  610.381   8.1458  285.415   7.6103  281.687   10.598  289.383   10.935  606.090   11.424  614.291   11.630 -8.201721 16.30225 
1 1 1    9   22   24 o  458.505   8.8357  161.096   6.2009  164.782   8.6993  157.288   8.8413  463.448   12.263  452.740   12.758 10.70746 17.69664 
1 1 1    9   22   25 o  497.414   9.8010  189.680   7.4620  190.702   9.2398  187.761   12.653  498.529   12.109  494.083   16.731 4.445679 20.65332 
1 1 1    9   22   26 o  875.631   11.871  588.398   15.910  588.398   15.910   0.0000   0.0000  875.631   11.871  ?   ?  0.000000 11.87115 
1 1 1    9   22   27 o  168.229   21.036   22.192   5.2982   25.355   8.5891   20.249   6.7314  177.349   32.851  158.957   28.724 18.39221 43.63739 
1 1 1    9   22   28 o  146.782   24.575   17.151   5.3260   3.2997   8.5134   26.059   6.8270   94.170   38.093  181.536   25.254 -87.36607 45.70395 
1 1 1    9   22   29 o  245.863   13.840   46.629   5.1870   40.181   7.0654   54.167   7.6393  227.040   20.554  264.182   19.019 -37.14261 28.00369 
1 1 1    9   22   30 o  180.232   12.255   25.075   3.3608   26.305   3.8121   20.782   7.1207  184.442   13.599  160.391   30.111 24.05069 33.03941 
1 1 1    9   22   31 o  199.078   11.208   30.537   3.4014   31.889   3.8804   26.053   7.0674  203.282   12.532  180.926   26.290 22.35585 29.12416 
1 1 1    9   22   32 o  361.951   9.1089  100.525   5.0465  100.635   5.3969   99.763   14.236  362.080   9.7381  356.276   26.291 5.804321 28.03625 
1 1 1    9   22   33 o  231.423   22.127   42.033   7.7424   0.0000   0.0000   42.033   7.7424  ?   ?   231.423   22.127 0.000000 22.12720 
1 1 1    9   22   34 o  210.437   9.2593   33.999   2.9824   33.937   4.0801   34.069   4.3704  209.564   12.781  209.825   13.683 -0.2605438 18.72375 
1 1 1    9   22   35 o  228.230   8.8477   39.990   3.0908   37.312   4.1966   43.163   4.5694  219.762   12.528  236.392   12.675 -16.62997 17.82114 
1 1 1    9   22   36 o  282.038   8.0833   61.051   3.4895   58.525   4.7866   63.917   5.0981  275.761   11.340  288.154   11.559 -12.39349 16.19279 
1 1 1    9   22   37 o   64.723   21.329   3.1422   2.4503   5.2622   3.3997   0.8505   3.5347   81.500   24.931   58.560   24.214 22.94054 34.75467 
1 1 1    9   22   38 f  145.568   12.877   16.480   2.8396   14.374   3.6536   19.694   4.5127  134.749   18.178  157.865   19.062 -23.11674 26.33990 
1 1 1    9   22   39 o  238.478   10.302   43.782   3.7603   44.950   4.9341   42.164   5.8078  240.778   13.442  232.425   16.431 8.352829 21.22889 
1 1 1    9   22   40 o  159.919   17.915   20.175   4.3098   20.175   4.3098   0.0000   0.0000  159.919   17.915  ?   ?  0.000000 17.91483 
1 1 1    9   22   41 o   89.849   20.757   6.5865   2.7972   6.3037   3.7956   6.9227   4.1382   88.125   26.208   92.138   27.357 -4.013268 37.88514 
1 1 1    9   22   42 o  312.459   8.5950   75.084   4.1107   74.371   5.6723   75.872   5.9655  310.270   11.944  313.262   12.441 -2.991852 17.24664 
1 1 1    9   22   43 o  381.286   13.556  112.698   7.9115  118.422   12.021  108.323   10.508  387.281   20.350  371.792   18.465 15.48959 27.47882 
1 1 1    9   22   44 o  157.007   28.688   20.535   6.6402   33.817   10.650   12.087   8.4934  198.310   36.427  119.579   39.724 78.73080 53.89765 
1 1 1    9   22   45 o  257.588   12.738   51.436   5.0222   58.965   5.8675   30.806   9.7129  275.100   13.981  189.489   34.770 85.61107 37.47518 
1 1 1    9   22   46 o  244.697   11.668   46.352   4.3703   52.948   6.9102   41.955   5.6419  259.139   17.524  231.116   16.048 28.02385 23.76244 
1 1 1    9   22   47 o  376.700   13.526  110.386   7.7989  110.386   7.7989   0.0000   0.0000  376.700   13.526  ?   ?  0.000000 13.52595 
1 1 1    9   22   48 o  254.180   10.937   50.020   4.2550   49.068   6.0339   50.961   6.0013  249.705   15.869  254.669   15.469 -4.964203 22.16146 
1 1 1    9   22   49 o   81.617   25.980   5.4453   3.6539  -1.3073   5.0969   12.585   5.2410   60.532   27.019  120.898   28.744 -60.36579 39.44869 
1 1 1    9   22   50 o  121.050   22.190   12.163   3.9600   11.226   5.6136   13.091   5.5870  112.878   31.365  122.327   30.055 -9.449539 43.44041 
1 1 1    9   22   51 f  393.756   9.9637  120.167   6.0051  133.776   8.6974  107.770   8.3014  413.109   13.755  370.198   14.650 42.91031 20.09542 
1 1 1    9   22   52 o  217.114   16.286   37.584   5.3729   29.344   10.252   40.704   6.3086  175.806   39.109  224.705   18.507 -48.89893 43.26685 
1 1 1    9   22   53 o   66.174   26.774   2.2353   4.2066  -1.1228   6.5214   4.6283   5.5050   67.475   30.307   80.760   31.264 -13.28471 43.54259 
1 1 1    9   22   54 o  211.365   30.638   40.147   9.6231   0.0000   0.0000   40.147   9.6231  ?   ?   211.365   30.638 0.000000 30.63790 
1 1 1    9   22   55 f   49.032   22.837  -2.8535   4.1778  -4.2762   6.1951  -1.6667   5.6581   58.111   27.305   60.721   27.653 -2.609787 38.86243 
1 1 1    9   22   56 f   74.533   30.929   3.2670   5.7962 -11.1028   8.5383   15.549   7.8937   58.961   28.791  121.831   38.109 -62.86972 47.76221 
1 1 1    9   23    1 o  541.798   13.141  224.937   10.897  224.937   10.897   0.0000   0.0000  541.798   13.141  ?   ?  0.000000 13.14057 
1 1 1    9   23    2 o  345.016   14.292   91.236   7.5476   91.236   7.5476   0.0000   0.0000  345.016   14.292  ?   ?  0.000000 14.29221 
1 1 1    9   23    3 o  383.875   13.999  112.939   8.2253  112.939   8.2253   0.0000   0.0000  383.875   13.999  ?   ?  0.000000 13.99890 
1 1 1    9   23    4 o  1181.67   17.410  1071.04   31.490   0.0000   0.0000  1071.04   31.490  ?   ?   1181.67   17.410 0.000000 17.41042 
1 1 1    9   23    5 o  1505.52   20.656  1740.20   47.600   0.0000   0.0000  1740.20   47.600  ?   ?   1505.52   20.656 0.000000 20.65642 
1 1 1    9   23    6 f  413.075   8.6257  130.660   5.4537  133.122   6.7968  126.209   9.1383  416.887   10.652  405.760   14.714 11.12759 18.16469 
1 1 1    9   23    7 o  792.465   8.4553  480.883   10.256  479.639   12.636  483.285   17.558  791.326   10.432  794.021   14.447 -2.695679 17.81980 
1 1 1    9   23    8 o  868.684   8.7569  577.863   11.643  580.696   14.441  572.601   19.682  870.671   10.836  864.228   14.879 6.442932 18.40681 
1 1 1    9   23    9 f  1134.66   9.9785  986.100   17.330  975.550   21.098  1007.98   30.384  1128.35   12.216  1146.26   17.318 -17.90930 21.19301 
1 1 1    9   23   10 o  132.463   20.002   13.773   3.9291   10.591   4.8260   20.028   6.7668  114.995   27.739  158.803   28.904 -43.80698 40.06087 
1 1 1    9   23   11 o  662.269   8.3865  335.866   8.5013  329.620   10.341  348.888   14.931  655.983   10.299  674.589   14.461 -18.60620 17.75349 
1 1 1    9   23   12 o  144.537   19.604   16.333   4.2251   17.708   5.1713   13.572   7.3276  150.017   23.275  130.380   35.680 19.63609 42.60066 
1 1 1    9   23   13 o  681.396   8.5640  355.572   8.9320  353.575   10.875  359.711   15.657  679.369   10.458  684.886   14.935 -5.516846 18.23293 
1 1 1    9   23   14 o  506.319   8.8465  196.340   6.8559  200.845   8.3908  187.291   11.892  512.007   10.707  494.120   15.723 17.88748 19.02229 
1 1 1    9   23   15 o  783.437   8.8485  470.093   10.611  484.474   13.236  444.227   17.751  795.173   10.875  760.999   15.239 34.17352 18.72125 
1 1 1    9   23   16 o  372.041   10.381  106.050   5.9114   86.041   10.002  116.792   7.3284  334.054   19.648  390.342   12.266 -56.28827 23.16191 
1 1 1    9   23   17 o  692.896   10.919  367.917   11.580   0.0000   0.0000  367.917   11.580  ?   ?   692.896   10.919 0.000000 10.91904 
1 1 1    9   23   18 f  809.235   9.0579  501.663   11.219  506.155   19.255  499.354   13.805  812.089   15.491  807.165   11.174 4.923706 19.10048 
1 1 1    9   23   19 o  649.023   8.8753  322.698   8.8168  323.006   14.873  322.531   10.948  648.731   14.979  648.678   11.026 0.5242920E-01 18.59936 
1 1 1    9   23   20 o  195.031   14.408   29.352   4.2705   25.895   5.9839   32.940   6.0964  182.059   21.914  206.005   19.569 -23.94624 29.37966 
1 1 1    9   23   21 f  197.174   14.645   30.012   4.3884   35.652   6.1681   24.230   6.2449  214.434   18.989  175.623   23.848 38.81035 30.48481 
1 1 1    9   23   22 o  369.471   9.4776  104.623   5.3598   99.591   7.3203  110.439   7.8692  360.225   13.277  379.315   13.554 -19.08960 18.97292 
1 1 1    9   23   23 o  494.329   8.4922  187.248   6.4255  190.945   8.9678  183.348   9.2110  498.899   11.744  488.817   12.311 10.08234 17.01392 
1 1 1    9   23   24 o  559.991   9.3248  240.388   7.9926  237.663   9.7368  246.019   13.995  556.578   11.429  565.584   16.166 -9.005188 19.79796 
1 1 1    9   23   25 o  140.486   21.384   15.583   4.4532   12.311   6.1758   19.127   6.4272  123.288   32.329  154.533   28.212 -31.24561 42.90783 
1 1 1    9   23   26 o  511.081   8.6980  200.236   6.8042  211.562   9.6980  189.256   9.5489  524.931   12.070  496.421   12.567 28.51044 17.42467 
1 1 1    9   23   27 o  625.342   8.4445  299.788   8.0828  319.199   11.641  281.717   11.232  644.749   11.796  605.657   12.116 39.09210 16.90945 
1 1 1    9   23   28 o  303.909   12.691   70.979   5.9037   73.966   9.6133   69.170   7.4805  308.561   20.471  299.158   16.399 9.402802 26.22937 
1 1 1    9   23   29 o  254.659   14.719   50.093   5.7127   46.493   9.0576   52.470   7.3615  243.253   24.668  259.948   18.625 -16.69588 30.90952 
1 1 1    9   23   30 o  154.163   31.933   19.384   7.2873   26.174   9.1423   7.5537   12.068  178.994   34.621  117.709   46.087 61.28572 57.64222 
1 1 1    9   23   31 o  133.019   16.227   13.853   3.2355   14.945   3.3477  -1.6207   12.601  138.255   16.122   99.044   43.419 39.21068 46.31601 
1 1 1    9   23   32 o  315.811   9.4200   76.565   4.5535   77.183   5.4036   75.050   8.4575  316.890   11.140  310.943   17.845 5.946625 21.03694 
1 1 1    9   23   33 o  272.962   9.2597   57.205   3.8687   57.534   4.4300   56.149   7.9412  273.612   10.578  268.289   19.471 5.322906 22.15847 
1 1 1    9   23   34 o  224.320   10.548   38.684   3.6216   38.828   4.1247   38.201   7.5669  224.263   12.060  220.009   22.801 4.254166 25.79447 
1 1 1    9   23   35 o  493.011   6.6326  186.377   5.0051  183.852   6.8291  189.307   7.3568  489.239   9.1196  496.329   9.6838 -7.089874 13.30201 
1 1 1    9   23   36 o  183.461   10.269   25.968   2.8722   25.166   3.9523   26.866   4.1811  179.878   14.478  185.819   14.824 -5.941086 20.72078 
1 1 1    9   23   37 o   64.652   21.139   3.1625   2.4087   7.3903   3.3717  -1.2442   3.4423   95.099   23.338   49.888   22.240 45.21058 32.23818 
1 1 1    9   23   38 o  398.741   7.6349  122.074   4.6598  119.084   6.4630  125.311   6.7246  393.209   10.738  403.321   10.893 -10.11188 15.29618 
1 1 1    9   23   39 o  295.416   8.6247   67.079   3.8999   67.750   5.1094   66.143   6.0362  296.438   11.261  292.434   13.486 4.003662 17.56882 
1 1 1    9   23   40 o  197.239   10.939   30.083   3.2897   30.639   4.3908   29.372   4.9668  198.277   14.570  193.497   16.941 4.779800 22.34433 
1 1 1    9   23   41 o  119.918   17.553   11.449   3.1264   10.629   4.3974   12.287   4.4459  113.269   25.924  122.319   24.599 -9.050339 35.73732 
1 1 1    9   23   42 o  291.859   9.3646   65.589   4.1834   60.461   5.8203   71.069   6.0172  279.277   13.616  302.965   12.976 -23.68796 18.80840 
1 1 1    9   23   43 o  150.721   31.625   19.245   7.0631   21.610   10.403   17.223   9.6201  155.177   42.534  139.390   41.785 15.78654 59.62533 
1 1 1    9   23   44 o  296.625   9.2065   67.786   4.1799   69.013   5.8561   66.511   5.9682  298.372   12.823  292.765   13.318 5.606964 18.48788 
1 1 1    9   23   45 o  180.926   13.681   25.580   3.7606   28.392   5.5984   23.268   5.0763  188.671   19.676  170.567   19.813 18.10408 27.92274 
1 1 1    9   23   46 o  180.979   14.693   25.703   4.0349   20.829   5.4954   31.404   5.9433  159.822   23.137  198.257   19.852 -38.43509 30.48684 
1 1 1    9   23   47 o  394.944   10.501  120.630   6.3482  128.291   7.6591  103.817   11.346  406.502   12.310  360.536   20.647 45.96619 24.03782 
1 1 1    9   23   48 o  488.585   19.062  189.553   14.255  189.553   14.255   0.0000   0.0000  488.585   19.062  ?   ?  0.000000 19.06191 
1 1 1    9   23   49 o  189.762   14.833   28.403   4.2741   23.784   5.8332   33.758   6.2804  170.008   23.008  204.421   20.342 -34.41306 30.71088 
1 1 1    9   23   50 o  247.763   18.961   49.339   7.1359   50.368   10.439   48.437   9.7771  243.250   28.582  239.670   27.130 3.579163 39.40709 
1 1 1    9   23   51 o   94.208   25.926   7.6567   3.8561   6.2012   5.3502   9.2300   5.5628   87.644   31.412  102.026   32.004 -14.38211 44.84385 
1 1 1    9   23   52 o   59.862   25.196   0.9959   3.9289  -2.9288   5.7985   4.3270   5.3420   59.740   27.500   79.238   30.763 -19.49800 41.26265 
1 1 1    9   23   53 f  243.370   15.882   47.416   5.8839   55.401   7.4480   34.159   9.5967  260.906   18.776  192.233   33.852 68.67316 38.71047 
1 1 1    9   23   54 o   64.623   25.873   2.4171   3.8838   2.4606   5.3432   2.3683   5.6549   71.040   29.606   71.969   30.256 -0.9290009 42.33134 
1 1 1    9   23   55 o   85.410   27.635   6.5396   4.1215   8.8718   6.1550   4.6438   5.5493   96.710   33.781   78.872   31.137 17.83765 45.94176 
1 1 1    9   24    0 o  1299.54   18.554  1295.04   36.889  1295.04   36.889  1295.04   36.889  1299.54   18.554  1299.54   18.554 0.000000 0.000000 
1 1 1    9   24    1 o  194.918   16.161   29.337   4.7782   28.705   6.6676   30.004   6.8510  191.880   23.172  196.218   23.264 -4.337875 32.83503 
1 1 1    9   24    2 o  1545.38   14.929  1831.01   35.313  1736.44   46.824  1955.73   53.773  1503.78   20.343  1595.45   22.019 -91.67517 29.97830 
1 1 1    9   24    3 o  752.807   14.291  434.439   16.467   0.0000   0.0000  434.439   16.467  ?   ?   752.807   14.291 0.000000 14.29106 
1 1 1    9   24    4 o  405.111   15.052  125.833   9.3330   0.0000   0.0000  125.833   9.3330  ?   ?   405.111   15.052 0.000000 15.05150 
1 1 1    9   24    5 o  829.990   10.916  527.734   13.867  493.261   19.475  563.190   19.750  801.983   15.865  857.036   15.056 -55.05267 21.87193 
1 1 1    9   24    6 o  613.287   10.271  288.107   9.6415  273.595   13.578  302.865   13.693  597.353   14.851  628.542   14.233 -31.18915 20.56953 
1 1 1    9   24    7 o  541.466   8.3818  224.514   6.9467  225.469   8.5653  222.678   11.874  542.532   10.315  538.931   14.395 3.601624 17.70872 
1 1 1    9   24    8 o  138.147   19.438   14.940   3.9965   18.918   4.9668   7.6328   6.7308  155.465   21.443  103.568   35.366 51.89661 41.35934 
1 1 1    9   24    9 o  653.341   8.4006  326.885   8.4008  324.009   10.327  332.511   14.443  650.351   10.375  658.540   14.329 -8.188843 17.69042 
1 1 1    9   24   10 o  944.338   9.2503  683.029   13.371  671.161   16.217  708.222   23.628  935.914   11.320  960.829   16.066 -24.91528 19.65372 
1 1 1    9   24   11 o  976.026   9.3770  729.672   14.009  723.923   17.113  741.351   24.390  971.966   11.503  982.983   16.210 -11.01666 19.87692 
1 1 1    9   24   12 o  602.010   8.5904  277.566   7.9157  269.276   9.6358  294.771   13.881  592.837   10.619  619.954   14.629 -27.11755 18.07650 
1 1 1    9   24   13 o  537.913   8.9385  221.628   7.3595  219.721   9.1496  225.125   12.386  535.468   11.163  541.736   14.938 -6.267883 18.64845 
1 1 1    9   24   14 o  274.895   21.324   58.465   8.9021   0.0000   0.0000   58.465   8.9021  ?   ?   274.895   21.324 0.000000 21.32396 
1 1 1    9   24   15 f  646.234   15.200  320.465   15.035   0.0000   0.0000  320.465   15.035  ?   ?   646.234   15.200 0.000000 15.20014 
1 1 1    9   24   16 o   91.286   31.539   5.8470   5.3580   9.5716   7.1657   1.1237   8.0693  112.550   36.441   86.715   36.281 25.83515 51.42186 
1 1 1    9   24   17 o  228.817   12.428   40.269   4.3363   44.859   6.1045   35.593   6.1609  241.101   16.644  214.323   18.977 26.77885 25.24132 
1 1 1    9   24   18 o  389.349   8.8508  116.144   5.2746  120.722   7.4027  111.422   7.5175  396.753   12.190  381.118   12.887 15.63467 17.73871 
1 1 1    9   24   19 o  249.074   11.605   47.575   4.4241   52.073   6.1892   42.875   6.3263  259.905   15.631  235.482   17.681 24.42316 23.59935 
1 1 1    9   24   20 o  349.278   9.4331   93.499   5.0431   98.010   6.9835   88.583   7.2904  357.391   12.766  339.677   14.022 17.71368 18.96301 
1 1 1    9   24   21 o  613.412   7.9794  288.286   7.4919  288.164   10.400  288.417   10.802  612.969   11.084  613.187   11.509 -0.2178955 15.97890 
1 1 1    9   24   22 o  270.247   12.612   56.059   5.2170   50.218   6.4102   67.519   8.9783  254.986   16.513  295.266   19.984 -40.27985 25.92342 
1 1 1    9   24   23 o  472.827   9.6161  171.415   6.9594  174.035   8.7050  166.773   11.585  476.189   11.943  465.583   16.257 10.60507 20.17269 
1 1 1    9   24   24 o  218.323   13.544   36.762   4.5036   40.837   6.3400   32.612   6.3986  229.475   18.200  204.462   20.733 25.01309 27.58740 
1 1 1    9   24   25 o  280.357   11.356   60.334   4.8730   63.817   6.7722   56.593   7.0173  287.565   15.442  270.499   17.036 17.06653 22.99316 
1 1 1    9   24   26 o  146.393   20.729   16.895   4.5150   21.527   6.0953   11.263   6.7207  164.668   24.966  118.405   34.787 46.26306 42.81851 
1 1 1    9   24   27 o  200.299   16.022   31.108   4.8709   31.223   6.8569   30.990   6.9205  199.345   22.888  198.518   23.214 0.8266907 32.59935 
1 1 1    9   24   28 o  241.563   16.442   45.206   6.0431   42.430   6.9514   53.797   12.228  233.378   19.643  259.782   31.387 -26.40376 37.02708 
1 1 1    9   24   29 o  133.921   28.107   14.557   5.5778   14.572   6.4397   14.513   11.161  133.339   31.967  136.055   45.547 -2.715546 55.64535 
1 1 1    9   24   30 o  426.353   10.866  139.658   7.0908  128.656   11.180  147.062   9.1714  407.858   17.909  437.005   13.711 -29.14731 22.55501 
1 1 1    9   24   31 o  398.968   14.152  122.685   8.6423   0.0000   0.0000  122.685   8.6423  ?   ?   398.968   14.152 0.000000 14.15211 
1 1 1    9   24   32 o  139.587   14.639   15.194   3.0812   15.748   3.4392   12.945   6.9351  141.856   16.126  125.237   34.884 16.61964 38.43139 
1 1 1    9   24   33 o  638.174   7.3246  312.376   7.1547  313.473   8.7165  310.112   12.526  638.954   8.9126  634.384   12.900 4.569397 15.67970 
1 1 1    9   24   34 o  127.765   16.012   12.826   3.0626   12.303   3.3832   15.200   7.2078  124.603   18.283  134.851   34.714 -10.24826 39.23435 
1 1 1    9   24   35 o  236.142   10.144   42.888   3.6664   44.047   4.1558   38.817   7.7876  239.163   11.352  221.193   23.355 17.97000 25.96774 
1 1 1    9   24   36 o  274.694   8.2593   57.953   3.4726   56.245   4.8759   59.711   4.9470  270.120   11.793  278.349   11.611 -8.228455 16.54992 
1 1 1    9   24   37 o  107.432   17.305   9.1942   2.7490   14.156   3.8440   4.0003   3.9329  133.316   19.407   75.623   26.950 57.69263 33.21046 
1 1 1    9   24   38 o   98.856   18.041   7.8459   2.6293   3.6492   3.5445   12.981   3.9206   72.108   25.596  127.095   20.879 -54.98770 33.03189 
1 1 1    9   24   39 o  274.985   8.3661   58.120   3.5213   55.051   4.8523   61.536   5.1181  267.044   11.871  282.341   11.843 -15.29727 16.76852 
1 1 1    9   24   40 o  187.255   11.212   27.150   3.1988   25.117   4.3415   29.564   4.7312  178.989   16.016  194.290   16.053 -15.30095 22.67645 
1 1 1    9   24   41 o  108.492   19.660   9.5119   3.1446   4.3340   4.1789   16.272   4.7747   77.883   27.777  141.705   22.786 -63.82115 35.92727 
1 1 1    9   24   42 o  269.170   22.493   57.850   9.1823   59.950   10.729   52.103   17.754  272.140   26.076  236.833   50.516 35.30728 56.84921 
1 1 1    9   24   43 o  108.161   19.917   9.4952   3.1759   10.336   4.4129   8.5916   4.5741  111.168   26.338  101.248   28.376 9.919350 38.71593 
1 1 1    9   24   44 o   80.495   24.197   5.2747   3.2226   5.6751   4.4198   4.8202   4.7087   85.080   28.661   81.642   29.445 3.437859 41.09092 
1 1 1    9   24   45 o  118.687   21.846   11.541   3.8224   13.873   5.3439   9.0982   5.4698  128.129   28.028  103.702   31.603 24.42696 42.24128 
1 1 1    9   24   46 o  138.784   16.536   15.315   3.4436   14.305   4.7346   16.449   5.0177  131.268   24.464  141.143   24.091 -9.874603 34.33472 
1 1 1    9   24   47 o  126.900   19.206   13.038   3.6138   13.208   5.2511   12.884   4.9811  124.261   28.249  123.122   27.160 1.138283 39.18743 
1 1 1    9   24   48 o  178.184   14.131   24.983   3.8223   28.929   5.5553   21.435   5.2673  189.622   19.414  161.908   21.809 27.71335 29.19830 
1 1 1    9   24   49 o  178.995   14.625   25.317   3.9720   26.076   5.7429   24.620   5.4996  178.562   21.441  173.602   21.133 4.959534 30.10487 
1 1 1    9   24   50 f  158.467   17.416   20.199   4.1547   20.887   5.8149   19.481   5.9383  157.368   24.976  150.924   26.682 6.443726 36.54736 
1 1 1    9   24   51 o  140.435   19.713   16.191   4.1207   24.200   6.4521   10.673   5.3551  168.510   25.839  108.963   30.762 59.54689 40.17403 
1 1 1    9   24   52 o  159.542   17.693   20.681   4.2479   17.326   6.1322   23.776   5.8900  138.852   29.749  167.625   23.611 -28.77246 37.97960 
1 1 1    9   24   53 o  172.566   16.103   24.043   4.2042   24.239   5.8527   23.834   6.0431  168.708   23.285  166.445   24.449 2.262924 33.76324 
1 1 1    9   24   54 o   71.214   26.636   3.8775   3.9112   5.7300   5.7027   2.2322   5.3744   83.611   31.961   69.997   29.465 13.61445 43.47082 
1 1 1    9   25    0 o  594.400   13.684  271.054   12.435  271.054   12.435  271.054   12.435  594.400   13.684  594.400   13.684 0.000000 0.000000 
1 1 1    9   25    1 o  658.090   9.8889  331.739   9.9610  332.982   14.199  330.535   13.978  659.021   14.076  656.609   13.908 2.411865 19.78799 
1 1 1    9   25    2 o  206.556   15.168   32.896   4.7620   35.905   6.4007   29.167   7.1266  215.337   19.635  193.141   24.670 22.19574 31.53046 
1 1 1    9   25    3 o  260.298   12.538   51.929   4.9954   58.455   7.0489   45.345   7.0802  275.504   16.796  242.243   19.254 33.26141 25.55033 
1 1 1    9   25    4 o  432.412   10.393  143.242   6.8786  134.586   9.2278  154.068   10.319  418.949   14.390  448.207   15.041 -29.25812 20.81634 
1 1 1    9   25    5 o  839.020   10.948  539.357   14.060  529.402   20.056  548.978   19.716  830.735   15.773  846.022   15.225 -15.28778 21.92248 
1 1 1    9   25    6 o  412.380   11.635  130.317   7.3442  130.727   10.878  129.974   9.9560  412.708   17.220  411.610   15.803 1.097656 23.37180 
1 1 1    9   25    7 o  617.431   10.276  292.058   9.7113  274.913   13.216  312.182   14.318  598.732   14.421  638.006   14.662 -39.27356 20.56519 
1 1 1    9   25    8 o  747.342   10.456  427.917   11.961  431.239   16.988  424.651   16.843  749.821   14.801  744.073   14.789 5.748169 20.92349 
1 1 1    9   25    9 o  902.571   11.029  624.244   15.236  638.482   21.988  611.094   21.131  912.205   15.748  892.467   15.469 19.73846 22.07466 
1 1 1    9   25   10 o  391.334   11.210  117.361   6.7146  124.892   9.5574  110.021   9.4356  403.446   15.477  378.614   16.282 24.83142 22.46402 
1 1 1    9   25   11 o  508.992   10.942  198.540   8.5244  192.373   12.252  204.326   11.868  500.642   15.989  516.048   15.025 -15.40546 21.94049 
1 1 1    9   25   12 o  599.742   11.094  275.676   10.184  245.925   14.200  307.194   14.615  565.972   16.391  632.710   15.092 -66.73804 22.28077 
1 1 1    9   25   13 o  491.224   11.247  184.960   8.4568  199.902   12.735  173.173   11.311  510.242   16.306  474.976   15.558 35.26596 22.53742 
1 1 1    9   25   14 o  192.350   16.493   28.623   4.8088   24.139   5.8256   38.211   8.5191  175.675   22.158  221.055   25.655 -45.38023 33.89945 
1 1 1    9   25   15 o  513.946   9.1410  202.384   7.1909  197.368   8.6680  213.455   12.878  507.395   11.161  527.195   15.959 -19.80023 19.47464 
1 1 1    9   25   16 o  412.924   9.9006  130.678   6.2575  128.314   7.5206  135.997   11.281  409.034   12.012  420.603   17.523 -11.56924 21.24480 
1 1 1    9   25   17 o  368.157   9.0553  103.862   5.1028   98.657   7.0878  109.464   7.3523  358.577   12.914  377.721   12.717 -19.14413 18.12433 
1 1 1    9   25   18 o  308.789   10.182   73.098   4.8122   74.163   6.5767   71.870   7.0600  310.807   13.824  305.873   15.080 4.933533 20.45764 
1 1 1    9   25   19 o  394.022   8.8214  118.980   5.3202  109.586   7.1946  130.315   7.9029  377.893   12.439  412.077   12.530 -34.18411 17.65527 
1 1 1    9   25   20 o  596.017   7.9744  272.192   7.2749  279.514   10.218  264.666   10.360  603.648   11.059  587.339   11.524 16.30933 15.97183 
1 1 1    9   25   21 o  391.432   10.203  117.505   6.1129  112.101   7.3271  129.880   11.088  382.124   12.527  410.680   17.639 -28.55582 21.63478 
1 1 1    9   25   22 o  522.137   8.3065  208.953   6.6385  212.456   9.1783  205.110   9.6134  526.153   11.397  516.879   12.151 9.273315 16.65941 
1 1 1    9   25   23 o  459.387   8.6918  161.789   6.1116  168.477   8.6120  155.002   8.6747  468.419   12.012  449.219   12.616 19.19977 17.41966 
1 1 1    9   25   24 o  370.385   9.8067  105.237   5.5596  114.435   7.9289   96.341   7.7977  385.836   13.426  353.905   14.395 31.93100 19.68418 
1 1 1    9   25   25 o  484.379   8.8383  179.926   6.5528  179.905   9.2089  179.947   9.3263  483.870   12.434  483.902   12.592 -0.3244019E-01 17.69611 
1 1 1    9   25   26 o  391.344   11.327  117.625   6.7847  121.384   8.1145  108.892   12.368  397.274   13.344  374.167   21.689 23.10730 25.46553 
1 1 1    9   25   27 o  363.530   12.078  101.577   6.7206  105.848   7.9932   91.274   12.415  370.807   14.083  341.670   23.889 29.13675 27.73112 
1 1 1    9   25   28 o  142.786   22.187   16.203   4.6917   15.603   6.7248   16.771   6.5487  137.860   32.414  143.312   30.773 -5.452148 44.69540 
1 1 1    9   25   29 f  398.773   10.088  122.121   6.1575  123.911   8.6437  120.278   8.7737  401.028   14.082  395.023   14.511 6.004761 20.22022 
1 1 1    9   25   30 o  295.841   14.032   67.463   6.3539   67.321   11.565   67.524   7.6045  291.887   26.162  295.032   16.910 -3.144958 31.15162 
1 1 1    9   25   31 o  329.258   12.989   83.517   6.5462   85.297   10.679   82.446   8.2854  330.293   21.236  326.038   16.658 4.254395 26.99035 
1 1 1    9   25   32 o  161.818   23.583   20.907   5.6693   27.792   9.7468   17.386   6.9697  182.816   36.113  144.936   32.249 37.87964 48.41626 
1 1 1    9   25   33 o  396.069   12.434  120.897   7.5377  125.362   12.696  118.467   9.3674  400.315   20.791  391.275   15.641 9.039886 26.01776 
1 1 1    9   25   34 o  329.102   9.2200   83.235   4.6444   84.500   5.5081   80.125   8.6389  331.326   10.861  320.655   17.670 10.67142 20.74101 
1 1 1    9   25   35 o  136.922   15.725   14.717   3.2358   14.842   3.5737   14.148   7.6236  137.126   17.420  129.493   36.754 7.632263 40.67351 
1 1 1    9   25   36 o  380.443   8.7578  111.241   5.0998  114.030   5.7195  100.422   11.265  384.997   9.7059  357.465   20.676 27.53174 22.84082 
1 1 1    9   25   37 o  122.056   13.883   11.673   2.5476   10.920   3.4566   12.567   3.7693  116.544   20.103  125.147   20.379 -8.603554 28.62571 
1 1 1    9   25   38 o  154.367   12.186   18.515   2.8558   17.344   3.9313   19.824   4.1554  148.125   17.689  158.570   17.407 -10.44498 24.81769 
1 1 1    9   25   39 o  150.748   12.879   17.703   2.9431   18.043   4.1830   17.369   4.1416  150.824   18.508  147.885   18.716 2.939621 26.32160 
1 1 1    9   25   40 o  307.651   10.716   73.009   5.0460   63.961   10.382   75.808   5.7739  282.516   24.243  313.168   12.046 -30.65170 27.07097 
1 1 1    9   25   41 o  177.731   24.887   25.679   6.5846   10.414   9.9319   37.650   8.7953  115.883   42.615  214.569   27.406 -98.68620 50.66699 
1 1 1    9   25   42 o  314.967   9.1606   76.415   4.4163   73.088   5.7594   81.163   6.8802  307.255   12.246  323.247   13.906 -15.99225 18.52963 
1 1 1    9   25   43 o  297.214   9.7027   68.125   4.4140   65.367   5.8019   71.916   6.8011  290.235   13.060  303.899   14.621 -13.66418 19.60480 
1 1 1    9   25   44 o  225.407   12.473   39.523   4.2868   40.036   5.8775   38.940   6.2659  225.257   17.176  221.545   18.651 3.712067 25.35557 
1 1 1    9   25   45 o   79.698   24.899   5.1548   3.3709   9.1188   4.8704   1.5100   4.6702  103.480   29.379   67.229   27.819 36.25059 40.46058 
1 1 1    9   25   46 o  202.342   12.691   31.960   3.9105   40.511   5.4286   22.736   5.6381  226.759   15.738  166.821   22.668 59.93796 27.59527 
1 1 1    9   25   47 o  252.450   11.190   49.446   4.3238   44.304   5.7479   56.148   6.5621  236.821   15.950  266.614   16.157 -29.79353 22.70315 
1 1 1    9   25   48 o  191.958   13.717   28.978   4.0036   22.025   5.3501   37.827   6.0356  163.774   21.891  217.276   18.319 -53.50240 28.54457 
1 1 1    9   25   49 o  211.507   13.001   35.114   4.1884   35.603   5.7313   34.553   6.1361  210.638   17.948  206.555   19.645 4.083023 26.60910 
1 1 1    9   25   50 o  160.518   22.922   21.506   5.4717   0.0000   0.0000   21.506   5.4717  ?   ?   160.518   22.922 0.000000 22.92152 
1 1 1    9   25   51 o   71.581   26.420   3.8059   3.8229   7.0586   5.4425   0.6380   5.3710   90.599   31.759   66.222   28.698 24.37649 42.80415 
1 1 1    9   25   52 o   52.241   23.553  -1.2153   3.9813  -1.6339   5.5388  -0.7678   5.7268   60.524   27.485   63.639   28.505 -3.114761 39.59790 
1 1 1    9   25   53 o  161.957   20.180   21.922   4.8941   28.886   6.0347   8.5402   8.3653  184.989   21.726   97.381   38.297 87.60824 44.03058 
1 1 1    9   25   54 o   88.646   32.669   7.0466   5.8412  -2.2190   8.7562   14.476   7.8409   72.301   33.463  117.673   38.121 -45.37156 50.72447 
1 1 1    9   26    0 o  1080.28   16.858  895.136   27.859  895.136   27.859  895.136   27.859  1080.28   16.858  1080.28   16.858 0.000000 0.000000 
1 1 1    9   26    1 o  685.963   10.043  360.503   10.545  359.993   14.802  361.029   15.025  685.117   14.115  686.082   14.308 -0.9643555 20.09871 
1 1 1    9   26    2 o  226.575   14.512   39.538   5.0064   39.557   7.1348   39.519   7.0267  225.870   20.874  225.807   20.555 0.6297302E-01 29.29552 
1 1 1    9   26    3 f  415.566   10.275  132.318   6.5356  131.668   9.1784  132.986   9.3084  414.311   14.473  416.371   14.606 -2.059204 20.56235 
1 1 1    9   26    4 o  532.684   9.9977  217.399   8.1515  225.784   11.669  209.408   11.392  542.569   14.051  522.507   14.244 20.06232 20.00818 
1 1 1    9   26    5 o  347.946   12.515   92.816   6.6651   88.497   9.9906   96.281   8.9473  338.796   19.346  354.150   16.506 -15.35422 25.43030 
1 1 1    9   26    6 o  1038.69   12.077  827.051   19.201  834.808   27.957  820.126   26.416  1042.58   17.519  1033.54   16.698 9.043213 24.20205 
1 1 1    9   26    7 o  362.195   12.210  100.574   6.7691  109.551   10.237   93.598   9.0235  377.650   17.709  349.131   16.886 28.51944 24.46916 
1 1 1    9   26    8 o  370.938   9.9568  105.429   5.6531   98.324   6.9896  118.868   9.6127  358.083   12.753  393.501   15.960 -35.41788 20.42903 
1 1 1    9   26    9 o  786.079   10.982  473.615   13.213  471.050   19.154  475.944   18.251  783.290   15.976  787.476   15.142 -4.185547 22.01151 
1 1 1    9   26   10 o  562.353   10.850  242.393   9.3390  251.383   14.110  235.384   12.458  572.162   16.112  553.810   14.697 18.35144 21.80787 
1 1 1    9   26   11 f  648.159   8.7590  321.850   8.6897  317.406   10.627  330.817   15.096  643.497   10.789  656.467   15.024 -12.96997 18.49661 
1 1 1    9   26   12 o  120.059   24.429   11.522   4.3364   13.688   5.2352   6.7867   7.7399  130.704   27.059  103.107   37.664 27.59754 46.37693 
1 1 1    9   26   13 o  246.592   12.740   46.772   4.7920   48.819   5.8390   42.550   8.3867  251.679   15.229  233.639   23.783 18.03940 28.24137 
1 1 1    9   26   14 f  514.551   9.0576  202.884   7.1336  202.570   8.6079  203.573   12.747  514.003   10.941  514.707   16.180 -0.7041626 19.53185 
1 1 1    9   26   15 o  334.625   10.872   85.860   5.5682   82.127   6.6429   94.681   10.211  327.115   13.268  350.174   19.123 -23.05914 23.27447 
1 1 1    9   26   16 o  816.771   9.1984  511.296   11.500  508.150   13.966  517.920   20.264  813.968   11.210  820.808   16.130 -6.840393 19.64237 
1 1 1    9   26   17 o  867.332   9.4027  576.645   12.483  574.648   15.253  580.695   21.722  865.481   11.514  868.965   16.331 -3.484009 19.98197 
1 1 1    9   26   18 o  558.541   7.9707  239.046   6.8143  230.732   9.3873  248.306   9.9075  548.419   11.183  568.897   11.378 -20.47791 15.95357 
1 1 1    9   26   19 o  225.567   13.576   39.226   4.6654   38.068   5.6246   41.778   8.3528  221.783   16.691  231.099   23.962 -9.315414 29.20240 
1 1 1    9   26   20 o  141.608   21.683   15.849   4.5502   6.9982   5.3888   37.835   8.4932   96.399   31.623  219.330   25.792 -122.9302 40.80747 
1 1 1    9   26   21 o  251.803   11.929   48.683   4.5975   50.489   6.2938   46.617   6.7322  255.580   16.172  245.236   18.062 10.34343 24.24389 
1 1 1    9   26   22 o  426.246   8.9496  139.318   5.8389  136.528   7.9342  142.615   8.6237  421.590   12.295  430.782   13.079 -9.191803 17.95089 
1 1 1    9   26   23 o  212.112   16.361   34.872   5.2708   32.930   6.0744   40.790   10.604  205.521   19.545  225.983   31.513 -20.46161 37.08214 
1 1 1    9   26   24 o  535.000   9.9807  219.650   8.1730  216.973   9.6316  226.537   15.447  531.435   11.841  541.495   18.638 -10.05939 22.08088 
1 1 1    9   26   25 o  309.230   11.129   73.446   5.2676   71.895   7.2723   75.158   7.6404  305.023   15.629  311.803   16.064 -6.779388 22.41214 
1 1 1    9   26   26 o  681.380   8.3633  356.090   8.7224  358.665   12.379  353.551   12.292  683.097   11.840  678.209   11.841 4.888062 16.74484 
1 1 1    9   26   27 o  685.566   8.4701  360.553   8.8881  357.132   12.431  364.131   12.713  681.516   11.917  688.120   12.070 -6.604187 16.96171 
1 1 1    9   26   28 o  363.595   12.495  101.733   6.9540   99.575   12.442  102.714   8.3861  356.722   22.908  364.899   15.015 -8.177155 27.39015 
1 1 1    9   26   29 o  469.087   11.322  169.217   8.1293  166.397   14.713  170.456   9.7531  462.530   20.783  470.312   13.548 -7.781708 24.80897 
1 1 1    9   26   30 o  221.138   15.123   37.943   5.0881   37.512   7.0691   38.407   7.3292  218.383   21.424  220.842   21.974 -2.457993 30.68974 
1 1 1    9   26   31 o  196.909   17.668   30.307   5.2685   35.856   7.4310   24.698   7.4708  212.813   23.188  174.412   29.003 38.40065 37.13330 
1 1 1    9   26   32 o   67.190   28.150   0.8357   4.8674   2.9680   7.1761  -0.9811   6.6242   86.020   34.912   72.015   31.528 14.00506 47.04063 
1 1 1    9   26   33 o  405.170   12.102  126.557   7.5052  126.398   12.346  126.651   9.4523  402.368   20.046  404.449   15.269 -2.080933 25.19893 
1 1 1    9   26   34 o  129.230   30.116   13.892   5.8468   7.2507   10.164   17.177   7.1478  108.846   42.385  143.026   33.277 -34.17996 53.88692 
1 1 1    9   26   35 o  348.311   9.0276   93.270   4.8129   94.301   5.3782   89.128   10.784  350.042   10.038  336.521   21.043 13.52097 23.31439 
1 1 1    9   26   36 o  150.067   14.759   17.616   3.3463   18.120   3.7061   15.393   7.7850  151.889   16.191  134.295   36.787 17.59343 40.19280 
1 1 1    9   26   37 o  242.085   10.744   45.173   3.9813   45.616   4.5227   43.649   8.3912  242.719   12.213  233.670   23.793 9.049500 26.74452 
1 1 1    9   26   38 o  189.689   10.556   27.822   3.0527   21.683   4.1122   35.357   4.5562  166.111   16.387  213.129   14.045 -47.01802 21.58254 
1 1 1    9   26   39 o  306.340   10.497   72.366   4.9219   73.910   10.660   71.947   5.5487  304.468   23.046  305.130   11.881 -0.6624146 25.92791 
1 1 1    9   26   40 o  248.976   17.863   48.774   6.7621   58.473   10.282   41.381   8.9767  269.214   25.246  225.525   26.511 43.68872 36.60851 
1 1 1    9   26   41 o  331.495   8.2857   84.545   4.2041   82.184   5.8285   87.107   6.0699  325.985   11.681  335.565   11.818 -9.580750 16.61657 
1 1 1    9   26   42 o  149.727   19.535   17.957   4.3702   17.957   4.3702   0.0000   0.0000  149.727   19.535  ?   ?  0.000000 19.53450 
1 1 1    9   26   43 o  102.832   21.172   8.6842   3.2214   12.665   4.7177   5.2068   4.4093  123.114   25.858   82.524   28.605 40.58987 38.56042 
1 1 1    9   26   44 o  121.642   19.030   11.953   3.4270   11.783   4.4779   12.194   5.3244  118.572   25.435  119.339   29.352 -0.7664261 38.83942 
1 1 1    9   26   45 o   45.366   20.851  -2.1782   3.3158  -8.5153   4.3720   6.4023   5.0874   40.875   20.091   89.489   30.743 -48.61419 36.72553 
1 1 1    9   26   46 o  133.991   17.645   14.423   3.5308   13.359   4.9258   15.547   5.0638  125.404   26.493  136.103   25.236 -10.69916 36.58876 
1 1 1    9   26   47 o  230.146   11.739   41.308   4.1216   39.789   5.4999   43.255   6.2249  224.008   16.149  232.862   17.595 -8.853928 23.88221 
1 1 1    9   26   48 o   81.173   26.632   5.4313   3.8219   12.933   5.5726  -1.2313   5.2516  120.886   30.203   61.116   27.342 59.76947 40.74084 
1 1 1    9   26   49 o  216.387   19.291   37.947   6.3225   0.0000   0.0000   37.947   6.3225  ?   ?   216.387   19.291 0.000000 19.29146 
1 1 1    9   26   50 o  182.898   37.702   31.897   10.204   31.897   10.204   0.0000   0.0000  182.898   37.702  ?   ?  0.000000 37.70192 
1 1 1    9   26   51 o  371.913   15.296  110.207   8.7076   0.0000   0.0000  110.207   8.7076  ?   ?   371.913   15.296 0.000000 15.29632 
1 1 1    9   26   52 o   70.667   28.230   3.1737   4.6123  -5.8951   9.2800   6.1489   5.3153   69.245   32.804   85.004   31.188 -15.75856 45.26341 
1 1 1    9   26   53 o  128.184   30.660   15.470   5.9347   22.936   9.1624   10.074   7.7895  147.640   39.689  101.332   37.651 46.30815 54.70664 
1 1 1    9   27    0 o  621.631   13.995  296.559   13.301  296.559   13.301  296.559   13.301  621.631   13.995  621.631   13.995 0.000000 0.000000 
1 1 1    9   27    1 o  293.501   12.124   66.052   5.4467   71.933   7.6869   60.121   7.7189  305.602   16.494  279.102   18.168 26.49957 24.53820 
1 1 1    9   27    2 o  1069.28   11.824  876.624   19.352  863.231   26.857  891.089   27.911  1060.16   16.550  1077.04   16.930 -16.88232 23.67601 
1 1 1    9   27    3 o  1087.84   11.974  907.379   19.938  886.948   27.490  930.053   28.959  1074.57   16.713  1100.25   17.196 -25.68420 23.98005 
1 1 1    9   27    4 o  829.187   10.668  526.990   13.539  544.272   19.486  510.861   18.825  842.032   15.119  815.785   15.076 26.24713 21.35137 
1 1 1    9   27    5 o  170.195   20.732   22.622   5.2892   15.520   8.1443   27.802   6.9556  138.759   37.468  188.242   24.740 -49.48349 44.89935 
1 1 1    9   27    6 o  980.745   11.855  737.557   17.796  717.163   25.121  758.103   25.215  966.104   16.988  993.390   16.583 -27.28601 23.74024 
1 1 1    9   27    7 o  698.023   10.863  373.512   11.606  358.582   16.527  388.040   16.303  683.293   15.802  710.933   14.982 -27.63989 21.77550 
1 1 1    9   27    8 o  566.083   11.112  245.685   9.6284  235.666   13.679  255.525   13.555  553.870   16.135  576.837   15.353 -22.96704 22.27205 
1 1 1    9   27    9 o  861.343   9.1371  568.506   12.046  570.890   14.863  563.942   20.564  862.868   11.254  856.838   15.680 6.030823 19.30070 
1 1 1    9   27   10 o  200.305   14.972   30.983   4.5570   29.303   5.5041   34.644   8.1253  194.260   18.744  210.152   25.802 -15.89217 31.89165 
1 1 1    9   27   11 o  985.360   9.6101  744.174   14.494  727.860   17.434  780.691   26.083  974.152   11.692  1007.68   16.911 -33.52704 20.55924 
1 1 1    9   27   12 o  189.706   15.780   27.846   4.5405   28.200   5.4657   27.058   8.1561  190.451   19.003  184.400   29.923 6.050873 35.44709 
1 1 1    9   27   13 o  226.919   13.749   39.682   4.7529   39.691   5.7635   39.660   8.4027  226.571   16.738  225.122   24.797 1.449051 29.91691 
1 1 1    9   27   14 o  670.604   8.9449  344.672   9.1814  351.929   11.347  330.911   15.625  677.381   10.944  656.113   15.559 21.26837 19.02251 
1 1 1    9   27   15 o   54.608   24.432  -1.8048   4.1943  -1.5660   5.0269  -2.3520   7.6093   61.366   27.142   75.261   33.335 -13.89500 42.98760 
1 1 1    9   27   16 o  340.587   10.803   88.984   5.6318   94.775   6.8202   76.573   9.9850  351.339   12.682  314.267   20.876 37.07217 24.42677 
1 1 1    9   27   17 f  202.592   18.641   31.903   5.7155   31.903   5.7155   0.0000   0.0000  202.592   18.641  ?   ?  0.000000 18.64071 
1 1 1    9   27   18 o  388.474   12.280  115.882   7.3017  115.882   7.3017   0.0000   0.0000  388.474   12.280  ?   ?  0.000000 12.27988 
1 1 1    9   27   19 o  229.849   12.515   40.700   4.3865   34.897   5.8633   48.076   6.6106  211.945   18.252  249.151   17.444 -37.20551 25.24737 
1 1 1    9   27   20 o   65.559   27.370   0.7247   4.5780   1.6092   5.3921  -1.5595   8.6648   73.625   30.116   82.346   36.055 -8.721458 46.97757 
1 1 1    9   27   21 o  408.370   10.810  128.015   6.7570  129.021   8.1665  125.833   12.031  409.691   13.023  403.504   19.480 6.186462 23.43250 
1 1 1    9   27   22 o  338.741   11.937   88.159   6.1892   89.600   7.4234   84.874   11.210  341.221   14.213  330.048   22.320 11.17261 26.46152 
1 1 1    9   27   23 o  467.459   8.8893  167.619   6.3604  159.583   8.7959  176.425   9.2082  455.589   12.614  479.036   12.558 -23.44675 17.79928 
1 1 1    9   27   24 o  545.331   8.6698  228.119   7.2367  220.862   9.8462  236.645   10.672  536.021   12.001  554.724   12.569 -18.70294 17.37820 
1 1 1    9   27   25 o  360.860   10.177   99.996   5.6214  105.432   7.7777   94.050   8.1339  370.027   13.732  349.242   15.216 20.78558 20.49649 
1 1 1    9   27   26 o  224.500   14.246   38.996   4.8700   40.817   6.7470   37.015   7.0364  228.651   19.464  217.194   21.446 11.45700 28.96125 
1 1 1    9   27   27 o  498.677   10.672  191.117   8.1461  193.785   14.465  189.878   9.8581  499.917   18.903  496.563   12.970 3.353973 22.92530 
1 1 1    9   27   28 o   93.518   29.281   6.8923   4.6589   0.9976   6.5240   13.027   6.6553   77.238   32.486  125.503   33.863 -48.26514 46.92611 
1 1 1    9   27   29 o  567.157   12.725  247.852   11.047  247.852   11.047   0.0000   0.0000  567.157   12.725  ?   ?  0.000000 12.72539 
1 1 1    9   27   30 o  388.561   10.607  116.130   6.3082  107.781   8.5965  125.871   9.2854  373.385   15.042  403.508   15.034 -30.12296 21.26688 
1 1 1    9   27   31 o  270.818   15.476   56.956   6.3886   60.771   10.539   54.740   8.0325  276.567   25.172  264.195   20.012 12.37253 32.15799 
1 1 1    9   27   32 o   60.673   26.820  -1.2512   4.9014  -4.4587   6.9001   2.0154   6.9635   65.493   30.093   81.921   33.940 -16.42764 45.35963 
1 1 1    9   27   33 o  288.250   13.098   64.176   5.7790   68.276   8.2737   60.269   8.0754  295.471   18.385  277.283   19.144 18.18729 26.54285 
1 1 1    9   27   34 o  332.483   15.434   85.734   7.8546   80.544   11.441   90.361   10.802  318.660   23.625  338.869   20.929 -20.20831 31.56234 
1 1 1    9   27   35 o  438.340   12.404  148.391   8.3225  145.880   13.703  149.859   10.476  431.117   20.765  439.358   15.578 -8.240906 25.95911 
1 1 1    9   27   36 o  217.155   11.747   36.503   3.8898   37.573   4.4122   32.768   8.2420  220.009   13.162  200.629   27.567 19.37973 30.54861 
1 1 1    9   27   37 o  216.742   11.884   36.391   3.9273   39.174   4.4585   26.755   8.2968  224.633   13.023  179.118   31.408 45.51512 34.00046 
1 1 1    9   27   38 o  111.890   32.453   10.546   5.8828   7.9731   8.4013   13.022   8.2400  105.067   39.089  123.541   38.981 -18.47417 55.20405 
1 1 1    9   27   39 o  109.924   22.474   9.9067   3.6537   8.3730   4.0552   16.522   8.4223  100.278   26.150  137.337   38.510 -37.05811 46.54914 
1 1 1    9   27   40 o  114.824   17.694   10.555   3.0100   17.288   4.0550   2.2934   4.4919  147.343   18.380   69.733   27.859 77.61033 33.37539 
1 1 1    9   27   41 o  189.176   12.642   27.863   3.6395   26.574   4.8219   29.571   5.5484  183.337   17.391  192.888   19.041 -9.551743 25.78801 
1 1 1    9   27   42 o  164.872   13.715   21.279   3.4297   25.626   5.1506   17.815   4.5971  179.289   19.061  148.559   20.786 30.73079 28.20269 
1 1 1    9   27   43 o   41.002   19.088  -2.4831   2.9136  -5.2861   3.9766   0.7658   4.2813   43.427   20.820   62.262   26.259 -18.83522 33.51139 
1 1 1    9   27   44 o   64.451   23.791   2.7813   3.1000   2.3829   4.3132   3.2070   4.4584   68.588   27.332   72.803   28.149 -4.214203 39.23486 
1 1 1    9   27   45 o   93.208   23.695   7.3137   3.3878   8.4958   4.6722   6.0031   4.9196   99.522   28.938   86.898   30.210 12.62419 41.83346 
1 1 1    9   27   46 o  314.085   24.597   81.325   11.730   81.325   11.730   0.0000   0.0000  314.085   24.597  ?   ?  0.000000 24.59687 
1 1 1    9   27   47 o   94.721   24.854   7.6725   3.6486   10.019   5.1125   5.2371   5.2087  106.615   30.042   83.365   30.825 23.25052 43.04318 
1 1 1    9   27   48 o  172.791   18.723   24.196   4.8726   28.740   5.9165   14.615   8.5903  187.182   21.014  123.392   39.893 63.78962 45.08949 
1 1 1    9   27   49 o  167.829   15.922   22.582   4.0410   17.781   5.7022   27.426   5.7277  142.799   27.079  182.254   20.911 -39.45485 34.21300 
1 1 1    9   27   50 o  109.377   24.615   10.438   4.0214   12.653   5.3538   7.5708   6.0917  117.766   29.705   92.875   33.492 24.89009 44.76704 
1 1 1    9   27   51 o   50.191   22.888  -1.6598   3.8926  -6.2345   5.1147   4.6375   6.0010   48.489   23.342   80.658   32.208 -32.16833 39.77682 
1 1 1    9   27   52 o   84.717   34.914   5.0917   7.3151  -4.6580   8.7193   28.263   13.442   68.479   32.245  150.009   49.981 -81.52969 59.47957 
1 1 1    9   28    0 o  390.452   15.660  117.457   9.3247  117.457   9.3247  117.457   9.3247  390.452   15.660  390.452   15.660 0.000000 0.000000 
1 1 1    9   28    1 o  744.993   10.512  425.491   11.987  427.004   16.993  423.992   16.911  745.674   14.888  743.043   14.869 2.631104 21.04189 
1 1 1    9   28    2 o  622.367   10.198  296.919   9.7147  292.230   13.583  301.830   13.900  616.938   14.384  626.975   14.484 -10.03729 20.41295 
1 1 1    9   28    3 o  467.629   10.319  167.638   7.3857  153.880   9.9696  184.373   10.996  447.659   14.550  489.998   14.661 -42.33936 20.65521 
1 1 1    9   28    4 o  273.009   13.440   57.206   5.6162   61.326   8.1209   53.430   7.7753  281.644   18.948  262.721   19.474 18.92319 27.17131 
1 1 1    9   28    5 f  567.307   10.865  246.777   9.4346  238.678   13.732  254.019   12.985  557.284   16.098  575.108   14.751 -17.82349 21.83431 
1 1 1    9   28    6 o  263.700   14.897   53.582   5.9881   52.940   8.7970   54.135   8.1741  261.025   22.230  264.292   20.363 -3.267029 30.14687 
1 1 1    9   28    7 o  384.735   12.174  113.566   7.1693  111.339   10.411  115.574   9.8875  380.396   17.880  387.700   16.662 -7.304291 24.44002 
1 1 1    9   28    8 o  904.874   11.542  628.082   15.986  629.541   22.998  626.718   22.235  904.812   16.606  902.912   16.089 1.899780 23.12170 
1 1 1    9   28    9 o  418.139   9.4719  134.021   6.0622  133.882   7.4110  134.303   10.539  417.756   11.590  417.904   16.476 -0.1485596 20.14382 
1 1 1    9   28   10 o  507.442   9.0293  197.361   7.0131  192.528   8.5445  207.337   12.277  500.995   11.142  519.364   15.443 -18.36829 19.04352 
1 1 1    9   28   11 o  143.684   19.919   16.215   4.2628   14.509   5.1694   19.840   7.5355  134.617   26.030  156.676   32.488 -22.05867 41.62992 
1 1 1    9   28   12 f  464.804   9.2021  165.616   6.5468  165.649   8.0429  165.550   11.270  464.654   11.309  463.951   15.871 0.7032166 19.48749 
1 1 1    9   28   13 o  265.867   12.097   54.258   4.9229   56.050   6.0158   50.625   8.5655  269.644   14.630  254.985   22.167 14.65952 26.56008 
1 1 1    9   28   14 o  125.202   23.843   12.534   4.4024   14.868   5.3080   7.3890   7.8802  136.135   26.427  105.220   38.070 30.91486 46.34304 
1 1 1    9   28   15 o  569.802   11.097  249.158   9.6782  249.158   9.6782   0.0000   0.0000  569.802   11.097  ?   ?  0.000000 11.09689 
1 1 1    9   28   16 o  144.973   25.397   16.782   5.4301   16.782   5.4301   0.0000   0.0000  144.973   25.397  ?   ?  0.000000 25.39664 
1 1 1    9   28   17 o  512.099   9.5477  201.144   7.4838  200.983   9.0072  201.502   13.449  511.640   11.502  511.294   17.185 0.3456421 20.67839 
1 1 1    9   28   18 o  367.850   10.710  103.858   6.0304   97.266   7.1102  120.751   11.382  355.734   13.058  395.449   18.805 -39.71509 22.89421 
1 1 1    9   28   19 o  144.548   21.723   16.536   4.6576   14.942   5.5209   20.470   8.6745  136.046   27.459  157.769   36.626 -21.72266 45.77605 
1 1 1    9   28   20 o  155.176   18.142   18.843   4.2278   15.916   5.7575   22.268   6.2282  140.381   27.779  167.370   25.084 -26.98917 37.42831 
1 1 1    9   28   21 o  283.950   10.958   61.922   4.7624   61.537   6.6021   62.341   6.8764  282.181   15.343  283.925   15.887 -1.744598 22.08640 
1 1 1    9   28   22 o  154.481   18.420   18.708   4.2697   23.506   5.9520   13.621   6.1283  172.374   23.144  128.971   31.350 43.40222 38.96705 
1 1 1    9   28   23 o  468.812   8.8914  168.638   6.3803  160.068   8.7765  178.243   9.2917  456.160   12.570  481.353   12.611 -25.19336 17.80584 
1 1 1    9   28   24 o  200.955   14.950   31.311   4.5654   34.524   6.3583   27.892   6.5592  210.036   20.020  187.800   23.320 22.23529 30.73518 
1 1 1    9   28   25 o  237.530   16.222   43.791   5.8624   40.856   10.653   45.065   7.0211  224.963   31.827  240.303   19.250 -15.33968 37.19587 
1 1 1    9   28   26 o  255.740   15.270   50.681   5.9501   57.166   11.006   48.004   7.0728  268.234   27.183  248.080   18.765 20.15410 33.03099 
1 1 1    9   28   27 o  130.384   24.228   13.723   4.6573   10.429   6.2475   17.844   6.9872  113.104   33.621  147.008   31.963 -33.90382 46.38992 
1 1 1    9   28   28 o  159.177   22.209   20.164   5.2637   14.616   8.5665   23.529   6.6717  132.390   39.373  170.957   26.343 -38.56769 47.37280 
1 1 1    9   28   29 o  223.236   16.829   38.854   5.7080   37.213   9.3482   39.830   7.2077  214.536   29.229  224.846   21.193 -10.30992 36.10368 
1 1 1    9   28   30 o  109.934   28.494   9.9745   4.8340   16.530   6.9131   3.7029   6.7620  140.659   32.726   86.482   34.298 54.17639 47.40566 
1 1 1    9   28   31 o  272.785   13.518   57.492   5.6440   56.732   7.9978   58.246   7.9660  268.922   19.564  272.619   19.213 -3.697479 27.42093 
1 1 1    9   28   32 f  129.327   28.026   13.816   5.3877   14.929   7.0963   12.301   8.2782  132.960   34.553  122.008   39.132 10.95197 52.20388 
1 1 1    9   28   33 o  194.507   20.202   29.922   5.9268   38.284   7.8888   19.087   8.9803  218.939   23.930  148.872   38.958 70.06679 45.72112 
1 1 1    9   28   34 o  514.430   10.339  203.833   8.1410  224.836   11.911  185.422   11.152  538.647   14.447  488.967   14.901 49.68024 20.75487 
1 1 1    9   28   35 o  149.689   25.757   18.302   5.6885   22.117   8.6018   15.337   7.5836  160.888   35.847  133.800   36.166 27.08751 50.92183 
1 1 1    9   28   36 o  181.700   23.806   26.604   6.4616   24.461   10.519   27.903   8.1884  166.532   41.437  183.499   30.205 -16.96747 51.27690 
1 1 1    9   28   37 o  158.356   29.222   20.864   6.8219   23.557   11.064   19.212   8.6650  162.045   43.636  148.417   37.984 13.62726 57.85205 
1 1 1    9   28   38 f  219.950   12.323   37.551   4.1321   39.146   4.6929   32.049   8.7164  224.208   13.741  196.480   29.929 27.72832 32.93255 
1 1 1    9   28   39 o  278.558   20.591   61.630   8.7171   61.037   10.169   63.274   16.927  275.213   24.393  267.238   42.829 7.974884 49.28853 
1 1 1    9   28   40 o  211.377   10.667   34.597   3.4399   32.286   4.6407   37.415   5.1248  203.002   15.042  218.486   15.424 -15.48384 21.54440 
1 1 1    9   28   41 o  248.481   10.392   47.695   3.9525   52.730   5.8344   43.425   5.3733  259.657   14.741  235.473   14.986 24.18353 21.02107 
1 1 1    9   28   42 o  142.153   14.967   15.949   3.2076   12.833   4.3877   19.527   4.7010  124.412   23.910  155.661   20.208 -31.24896 31.30552 
1 1 1    9   28   43 o  107.470   20.022   9.4570   3.1724   14.633   4.5632   4.6152   4.4135  133.065   23.251   79.121   28.512 53.94434 36.79004 
1 1 1    9   28   44 o  206.608   11.671   33.256   3.6758   32.354   5.2618   34.115   5.1371  201.711   17.207  207.554   16.302 -5.842941 23.70283 
1 1 1    9   28   45 o  131.571   17.871   13.970   3.5058   15.720   5.0170   12.300   4.9010  136.662   24.902  119.488   27.384 17.17448 37.01294 
1 1 1    9   28   46 o   85.177   26.562   6.1108   3.8382   11.110   5.4763   1.2839   5.3809  111.871   30.941   69.199   29.325 42.67202 42.62992 
1 1 1    9   28   47 f  186.209   19.741   28.224   5.5408   28.224   5.5408   0.0000   0.0000  186.209   19.741  ?   ?  0.000000 19.74121 
1 1 1    9   28   48 o  126.887   20.911   13.428   3.9197   10.402   5.3793   16.855   5.7234  107.013   31.032  138.401   27.979 -31.38828 41.78290 
1 1 1    9   28   49 o   78.888   32.477   3.6069   6.3214   12.228   9.4154  -3.4681   8.5296  111.497   41.401   70.925   32.897 40.57228 52.87969 
1 1 1    9   28   50 o  200.743   13.464   32.020   4.1130   38.847   5.8688   25.430   5.7658  218.352   17.713  173.385   22.239 44.96759 28.43052 
1 1 1    9   28   51 o   72.307   30.610   2.3870   5.8530 -10.4017   8.9959   11.775   7.7075   61.984   30.105  108.015   37.798 -46.03096 48.32221 
1 1 1    9   29    0 o  688.604   14.851  364.134   15.636  364.134   15.636  364.134   15.636  688.604   14.851  688.604   14.851 0.000000 0.000000 
1 1 1    9   29    1 o  748.521   10.612  429.683   12.159  423.427   17.065  436.133   17.327  742.281   15.020  753.334   15.027 -11.05286 21.24663 
1 1 1    9   29    2 o  385.259   11.526  113.871   6.7966  115.010   9.6515  112.751   9.5727  386.706   16.306  382.886   16.334 3.819550 23.07998 
1 1 1    9   29    3 f  403.445   11.038  124.852   6.8159  115.292   9.2196  136.374   10.122  387.259   15.554  421.162   15.701 -33.90289 22.10118 
1 1 1    9   29    4 o  470.428   10.800  169.739   7.7768  161.973   10.567  178.914   11.487  459.068   15.039  482.406   15.556 -23.33835 21.63701 
1 1 1    9   29    5 f  435.505   11.619  145.528   7.7450  152.750   11.789  140.044   10.273  445.484   17.290  426.764   15.727 18.72003 23.37225 
1 1 1    9   29    6 o  384.090   12.424  113.243   7.3040  108.986   10.541  117.174   10.130  376.142   18.309  390.196   16.962 -14.05331 24.95798 
1 1 1    9   29    7 o  506.528   11.160  196.843   8.6523  185.126   12.311  208.278   12.163  490.520   16.397  520.474   15.267 -29.95383 22.40452 
1 1 1    9   29    8 o  520.490   11.275  207.867   8.9829  216.467   13.208  200.467   12.253  530.408   16.269  510.527   15.680 19.88116 22.59543 
1 1 1    9   29    9 o  282.836   14.713   61.663   6.3473   64.959   9.5055   59.011   8.5270  289.145   21.634  275.760   20.346 13.38464 29.69842 
1 1 1    9   29   10 o  295.505   11.699   67.026   5.2916   67.054   6.5121   66.973   9.0790  295.343   14.405  293.840   20.311 1.502533 24.90077 
1 1 1    9   29   11 o  284.650   11.796   62.201   5.1394   63.379   6.3580   59.980   8.7298  286.741   14.534  277.895   20.671 8.846130 25.26939 
1 1 1    9   29   12 o  452.975   11.617  157.516   8.0548  157.516   8.0548   0.0000   0.0000  452.975   11.617  ?   ?  0.000000 11.61741 
1 1 1    9   29   13 o  324.121   13.489   80.745   6.6920   80.745   6.6920   0.0000   0.0000  324.121   13.489  ?   ?  0.000000 13.48907 
1 1 1    9   29   14 o  546.329   9.2544  228.905   7.7388  232.125   9.5081  222.584   13.320  549.878   11.297  537.579   16.188 12.29840 19.74007 
1 1 1    9   29   15 o  679.385   9.1866  353.996   9.5530  351.475   11.694  359.052   16.562  676.593   11.292  682.784   15.848 -6.190613 19.45934 
1 1 1    9   29   16 o  663.739   9.2031  337.910   9.3498  340.687   11.473  332.417   16.133  666.095   11.253  656.835   16.047 9.260010 19.59926 
1 1 1    9   29   17 o  609.822   9.3884  285.296   8.7633  283.166   10.641  289.783   15.447  607.185   11.450  613.068   16.461 -5.882629 20.05199 
1 1 1    9   29   18 o  388.965   10.573  116.158   6.2946  113.892   7.5522  121.315   11.392  384.863   12.820  396.143   18.788 -11.28006 22.74531 
1 1 1    9   29   19 o  480.303   9.7604  177.055   7.1755  189.153   8.9503  155.291   12.005  496.117   11.786  448.405   17.491 47.71198 21.09174 
1 1 1    9   29   20 o  139.936   20.062   15.472   4.1741   19.185   5.6910   11.149   6.1408  155.012   24.823  117.034   32.906 37.97871 41.21899 
1 1 1    9   29   21 o  276.507   11.574   58.772   4.8984   64.099   6.9014   53.364   6.9537  287.811   15.726  262.188   17.427 25.62366 23.47300 
1 1 1    9   29   22 o  590.838   8.5269  267.837   7.7113  261.020   10.623  275.429   11.211  582.573   11.914  598.355   12.241 -15.78253 17.08170 
1 1 1    9   29   23 o  397.259   9.6427  121.189   5.8633  109.596   7.9678  134.882   8.6593  377.109   13.804  418.415   13.521 -41.30624 19.32251 
1 1 1    9   29   24 o  342.152   12.657   90.150   6.6286   97.222   11.918   86.983   7.9760  352.409   22.208  335.565   15.529 16.84378 27.09907 
1 1 1    9   29   25 o  423.508   9.7276  137.798   6.3058  135.037   8.9427  140.528   8.8929  418.389   13.964  426.895   13.610 -8.505920 19.49950 
1 1 1    9   29   26 o  469.500   10.801  169.551   7.7622  172.985   12.845  167.576   9.7422  472.208   17.772  466.057   13.657 6.151550 22.41303 
1 1 1    9   29   27 f  140.023   26.417   15.950   5.4543   9.9575   8.3780   20.358   7.1856  113.923   39.434  157.215   30.962 -43.29210 50.13670 
1 1 1    9   29   28 f  259.356   13.282   52.054   5.2548   49.106   7.4077   55.040   7.4554  250.287   19.490  265.369   18.470 -15.08226 26.85136 
1 1 1    9   29   29 o  283.080   12.814   61.843   5.5522   53.545   7.6472   71.092   8.0740  261.375   19.250  301.930   17.546 -40.55566 26.04720 
1 1 1    9   29   30 o  282.910   12.843   61.792   5.5614   57.935   7.8713   65.635   7.8587  271.905   19.033  289.902   17.796 -17.99765 26.05705 
1 1 1    9   29   31 o  223.717   17.549   39.183   5.9612   42.974   7.7511   33.693   9.3268  232.909   22.003  202.519   31.081 30.39027 38.08094 
1 1 1    9   29   32 o  275.749   14.538   59.068   6.1142   62.029   8.5069   55.905   8.7937  280.798   19.922  265.788   21.808 15.01028 29.53769 
1 1 1    9   29   33 o  119.888   29.064   11.997   5.2780   9.8855   7.2574   14.367   7.6898  110.589   36.719  129.746   36.944 -19.15641 52.08795 
1 1 1    9   29   34 o  109.878   31.568   10.094   5.5900   8.9711   7.7614   11.304   8.0580  107.616   37.911  117.054   38.683 -9.438271 54.16350 
1 1 1    9   29   35 o  305.461   14.016   72.349   6.5529   86.664   9.5375   59.548   9.0188  332.089   18.841  273.884   21.691 58.20535 28.73111 
1 1 1    9   29   36 o   87.414   32.271   5.2873   5.7043   11.117   8.3116   0.0961   7.8431  116.068   39.302   79.877   34.647 36.19030 52.39339 
1 1 1    9   29   37 o  313.933   21.371   78.302   10.208   91.104   13.044   58.069   16.398  336.151   25.543  255.992   43.400 80.15900 50.35835 
1 1 1    9   29   38 o  322.139   10.530   80.106   5.1920   83.643   6.0329   70.004   10.195  328.758   11.989  295.800   22.691 32.95792 25.66353 
1 1 1    9   29   39 o  106.843   23.576   9.4581   3.7521   11.143   4.1447   1.8060   8.8326  115.996   24.130   87.643   37.371 28.35257 44.48393 
1 1 1    9   29   40 o  162.532   16.811   20.921   4.1216   22.385   4.6039   15.008   9.2506  167.699   18.230  129.619   41.345 38.07979 45.18576 
1 1 1    9   29   41 o  302.112   8.9815   70.380   4.1532   71.533   5.6738   69.049   6.0961  303.611   12.209  297.884   13.370 5.727325 18.10586 
1 1 1    9   29   42 o  142.606   15.263   16.099   3.2797   15.889   4.3998   16.361   4.9202  139.553   21.271  140.654   23.696 -1.101578 31.84257 
1 1 1    9   29   43 o  134.002   16.618   14.355   3.3354   9.7752   4.6084   19.393   4.8334  106.567   27.918  154.265   21.017 -47.69798 34.94491 
1 1 1    9   29   44 f   57.431   23.403   1.3122   3.2409   8.8870   4.9181  -4.5017   4.3087  101.148   29.770   47.247   22.374 53.90076 37.24001 
1 1 1    9   29   45 o  264.781   15.921   55.563   6.4226   55.563   6.4226   0.0000   0.0000  264.781   15.921  ?   ?  0.000000 15.92118 
1 1 1    9   29   46 o  142.466   17.085   16.364   3.6514   19.555   5.3389   13.560   5.0050  152.661   23.610  124.984   26.955 27.67776 35.83301 
1 1 1    9   29   47 o  211.401   14.731   35.512   4.7367   32.281   9.5614   36.563   5.4528  186.983   34.685  213.333   16.836 -26.34987 38.55520 
1 1 1    9   29   48 f  110.880   41.620   12.019   9.5661   12.019   9.5661   0.0000   0.0000  110.880   41.620  ?   ?  0.000000 41.62032 
1 1 1    9   29   49 o   74.080   27.064   4.3364   3.9963   5.8637   5.5651   2.7103   5.7424   84.450   31.736   73.415   30.651 11.03520 44.12117 
1 1 1    9   30    0 f  151.909   34.333   20.310   6.9631   20.310   6.9631   20.310   6.9631  151.909   34.333  151.909   34.333 0.000000 0.000000 
1 1 1    9   30    1 o  852.722   11.110  557.973   14.501  565.731   20.690  550.484   20.330  857.472   15.764  845.856   15.703 11.61597 22.25079 
1 1 1    9   30    2 o  285.536   13.496   62.644   5.8986   52.874   8.3541   72.356   8.3296  260.756   21.112  305.909   17.867 -45.15305 27.65810 
1 1 1    9   30    3 o  687.138   10.640  362.245   11.191  365.170   15.844  359.334   15.809  689.061   15.023  683.514   15.110 5.547180 21.30744 
1 1 1    9   30    4 o  510.190   10.642  199.705   8.3102  203.290   11.930  196.326   11.582  514.089   15.161  505.237   14.977 8.852051 21.31154 
1 1 1    9   30    5 o  322.382   13.179   79.849   6.5030   77.410   9.4510   82.041   8.9617  316.084   19.632  325.738   18.045 -9.654175 26.66495 
1 1 1    9   30    6 o  429.414   11.777  141.567   7.7406  145.315   11.483  138.445   10.480  434.277   17.275  424.067   16.145 10.20975 23.64485 
1 1 1    9   30    7 o  475.637   11.562  173.673   8.4177  175.432   12.543  172.232   11.354  477.153   17.175  473.048   15.681 4.104980 23.25646 
1 1 1    9   30    8 o  452.519   11.733  157.224   8.1264  171.009   12.067  145.786   10.993  471.152   16.733  435.058   16.508 36.09375 23.50551 
1 1 1    9   30    9 o  280.211   21.872   61.138   9.3066   61.138   9.3066   0.0000   0.0000  280.211   21.872  ?   ?  0.000000 21.87203 
1 1 1    9   30   10 o  127.840   39.354   13.044   8.4558   13.044   8.4558   0.0000   0.0000  127.840   39.354  ?   ?  0.000000 39.35372 
1 1 1    9   30   11 o  487.894   9.5059  182.592   7.0989  187.111   8.8240  174.303   11.952  493.608   11.679  475.617   16.418 17.99033 20.14803 
1 1 1    9   30   12 o  379.532   10.279  110.542   5.9713  110.828   7.4301  110.021   10.034  379.738   12.783  377.680   17.358 2.057831 21.55709 
1 1 1    9   30   13 o  297.544   11.709   68.005   5.3325   66.370   6.4975   71.377   9.3329  293.664   14.455  303.079   20.235 -9.414825 24.86753 
1 1 1    9   30   14 o  229.000   14.185   40.511   4.9476   41.319   6.0283   38.842   8.6599  230.789   17.188  221.780   26.004 9.008881 31.17136 
1 1 1    9   30   15 o  242.898   13.787   45.544   5.1047   50.276   6.2977   36.479   8.7162  254.838   16.230  214.466   27.161 40.37128 31.64044 
1 1 1    9   30   16 o  677.547   9.2852  352.239   9.6295  358.574   11.951  340.511   16.260  683.160   11.429  664.494   15.987 18.66632 19.65171 
1 1 1    9   30   17 o  292.244   12.398   65.676   5.5458   64.498   6.7257   68.178   9.8025  288.862   15.266  295.516   21.826 -6.653839 26.63464 
1 1 1    9   30   18 o  643.073   9.5494  317.427   9.3995  311.304   11.425  330.253   16.535  636.362   11.730  654.015   16.518 -17.65240 20.25884 
1 1 1    9   30   19 o  249.294   14.197   48.039   5.3947   46.528   6.4846   51.434   9.7223  244.714   17.426  255.351   25.204 -10.63730 30.64136 
1 1 1    9   30   20 o  554.215   9.7757  235.866   8.2927  239.211   10.204  229.360   14.231  557.664   11.954  544.636   17.072 13.02826 20.84099 
1 1 1    9   30   21 o  182.229   16.182   25.858   4.4665   29.418   6.2935   22.245   6.3398  193.235   21.651  166.661   25.677 26.57336 33.58674 
1 1 1    9   30   22 o  390.035   11.599  117.039   6.9246  118.492   12.402  116.382   8.3467  389.639   20.871  388.465   14.038 1.174103 25.15297 
1 1 1    9   30   23 o  381.252   14.407  112.191   8.4074   0.0000   0.0000  112.191   8.4074  ?   ?   381.252   14.407 0.000000 14.40713 
1 1 1    9   30   24 o  261.801   14.185   53.064   5.6628   58.954   9.2608   49.546   7.1568  273.758   22.295  251.871   18.697 21.88693 29.09705 
1 1 1    9   30   25 o  295.013   12.002   67.048   5.4194   73.298   7.8884   61.462   7.4580  307.034   16.850  280.916   17.431 26.11807 24.24377 
1 1 1    9   30   26 o  430.389   9.7654  142.416   6.4331  139.773   9.0353  145.134   9.1616  425.383   13.877  433.485   13.808 -8.101929 19.57626 
1 1 1    9   30   27 o  485.346   9.4506  181.090   7.0207  179.560   9.7525  182.737   10.115  482.260   13.212  486.386   13.587 -4.125458 18.95130 
1 1 1    9   30   28 o  380.488   10.706  111.459   6.2347  104.249   8.5618  119.599   9.0971  366.853   15.248  392.973   15.124 -26.12000 21.47623 
1 1 1    9   30   29 o  148.459   23.021   17.722   5.0618   19.842   7.0005   15.399   7.3276  154.741   30.641  134.917   35.136 19.82335 46.61934 
1 1 1    9   30   30 o   80.951   30.673   4.0284   5.2234   2.3519   6.6058   6.8253   8.5325   81.028   33.260  102.550   39.120 -21.52181 51.34787 
1 1 1    9   30   31 o  261.567   14.482   53.169   5.7756   47.906   8.1348   58.518   8.2013  245.847   21.846  272.701   19.783 -26.85442 29.47195 
1 1 1    9   30   32 o  255.910   14.955   50.983   5.8323   56.064   8.3826   46.214   8.1201  266.388   20.722  241.125   22.252 25.26350 30.40643 
1 1 1    9   30   33 o  208.199   18.813   34.193   5.9305   33.686   8.2305   34.739   8.5528  203.475   27.101  206.375   27.782 -2.899918 38.81073 
1 1 1    9   30   34 o  267.617   15.324   55.862   6.2510   58.312   8.8576   53.430   8.8230  271.008   21.531  258.922   22.486 12.08609 31.13186 
1 1 1    9   30   35 o  363.473   15.789  102.914   8.7843   98.340   10.137  116.704   17.600  353.550   18.800  376.916   30.775 -23.36633 36.06317 
1 1 1    9   30   36 o  108.880   36.423   9.7501   7.1378   12.924   8.2177  -0.0015   14.404  122.624   38.953  103.630   45.884 18.99459 60.18916 
1 1 1    9   30   37 o  127.203   31.404   13.827   6.0777   17.090   8.3515   10.154   8.8615  139.200   38.091  112.647   40.420 26.55326 55.54004 
1 1 1    9   30   38 o  198.253   14.211   30.734   4.2837   29.566   4.8358   34.993   9.2320  193.724   16.465  204.387   30.439 -10.66338 34.60646 
1 1 1    9   30   39 o  216.079   13.403   36.435   4.4108   34.856   4.9577   42.433   9.6613  210.646   15.485  226.029   28.563 -15.38213 32.49073 
1 1 1    9   30   40 o  299.587   11.268   69.521   5.1672   77.057   6.0955   50.274   9.7411  314.919   12.646  247.269   26.134 67.64999 29.03232 
1 1 1    9   30   41 o  127.259   20.137   13.183   3.7919   15.015   4.2492   6.0196   8.4029  135.591   21.166   96.303   38.220 39.28786 43.68959 
1 1 1    9   30   42 o   68.779   23.697   3.6027   3.0238   3.0837   4.0957   4.2246   4.4832   70.320   27.037   77.137   28.583 -6.816536 39.34460 
1 1 1    9   30   43 f  360.741   9.3908  100.645   5.1852   99.086   7.3594  102.181   7.3068  355.956   13.508  361.647   13.200 -5.691040 18.88641 
1 1 1    9   30   44 o  285.981   10.439   63.466   4.5697   66.616   6.3904   60.170   6.5370  291.218   14.336  275.754   15.551 15.46445 21.15118 
1 1 1    9   30   45 o   86.322   24.261   6.3705   3.3387   8.7426   4.8562   4.2442   4.5977   99.476   29.658   76.700   28.842 22.77570 41.36985 
1 1 1    9   30   46 o  123.429   19.642   12.612   3.5865   11.760   5.2233   13.371   4.9334  114.213   29.626  123.444   26.872 -9.231407 39.99801 
1 1 1    9   30   47 o  111.941   33.596   11.844   6.2163   6.0100   9.2385   16.671   8.4030   93.333   38.915  128.636   39.164 -35.30299 55.21040 
1 1 1    9   30   48 o   48.529   21.891  -1.1486   3.4449   3.5974   4.9210  -5.7098   4.8242   73.640   29.241   47.588   22.846 26.05278 37.10807 
1 1 1    9   31    0 o  518.729   15.241  207.055   12.077  207.055   12.077  207.055   12.077  518.729   15.241  518.729   15.241 0.000000 0.000000 
1 1 1    9   31    1 o  185.081   19.219   26.733   5.3653   33.411   7.4693   19.614   7.7118  206.112   24.133  155.124   33.462 50.98871 41.25683 
1 1 1    9   31    2 o  414.539   11.299  131.932   7.1691  132.515   9.9087  131.292   10.385  414.857   15.605  412.801   16.437 2.056030 22.66409 
1 1 1    9   31    3 o  401.971   11.441  124.067   7.0391  120.468   9.9203  127.715   9.9897  395.418   16.391  407.198   16.028 -11.77948 22.92486 
1 1 1    9   31    4 o  193.314   18.404   29.099   5.3798   29.099   5.3798   0.0000   0.0000  193.314   18.404  ?   ?  0.000000 18.40373 
1 1 1    9   31    5 o  792.073   11.437  481.751   13.866  481.751   13.866   0.0000   0.0000  792.073   11.437  ?   ?  0.000000 11.43747 
1 1 1    9   31    6 o  509.611   17.184  200.279   13.404  200.279   13.404   0.0000   0.0000  509.611   17.184  ?   ?  0.000000 17.18390 
1 1 1    9   31    7 o  455.722   17.850  160.279   12.451  160.279   12.451   0.0000   0.0000  455.722   17.850  ?   ?  0.000000 17.84992 
1 1 1    9   31    8 o  514.084   11.748  203.010   9.2441  200.561   13.662  205.079   12.554  509.822   17.508  515.903   15.898 -6.080322 23.64923 
1 1 1    9   31    9 o  233.993   17.581   42.491   6.2508   43.519   9.0006   41.533   8.6876  235.087   25.418  229.680   25.122 5.407928 35.73755 
1 1 1    9   31   10 o  218.486   17.838   37.098   5.9134   38.070   8.5952   36.225   8.1483  219.488   26.096  214.228   25.341 5.259995 36.37490 
1 1 1    9   31   11 o  745.553   9.2604  426.452   10.568  425.456   12.975  428.415   18.212  744.210   11.391  745.456   15.961 -1.245483 19.60891 
1 1 1    9   31   12 o  407.108   10.167  127.231   6.3356  123.890   7.7939  133.739   10.878  401.385   12.686  416.231   17.075 -14.84561 21.27166 
1 1 1    9   31   13 o  440.181   9.8490  148.727   6.6358  151.861   8.2685  143.056   11.123  444.451   12.154  430.474   16.881 13.97653 20.80121 
1 1 1    9   31   14 o  202.722   16.002   31.898   4.9249   32.310   6.0448   31.086   8.4936  203.315   19.670  196.998   29.039 6.317184 35.07416 
1 1 1    9   31   15 o  737.283   9.4595  417.230   10.675  422.259   13.197  407.710   18.157  741.160   11.633  726.732   16.323 14.42792 20.04424 
1 1 1    9   31   16 f  423.409   10.345  137.699   6.7043  139.876   8.2166  133.362   11.597  426.372   12.590  415.106   18.252 11.26678 22.17294 
1 1 1    9   31   17 o  338.547   11.466   88.122   5.9418   85.788   7.2352   92.958   10.413  333.627   14.168  345.603   19.767 -11.97589 24.32015 
1 1 1    9   31   18 o  227.488   15.255   40.119   5.2810   37.897   6.3307   45.204   9.5759  220.292   18.960  238.568   26.681 -18.27542 32.73148 
1 1 1    9   31   19 o  597.243   9.8279  274.000   8.9843  264.195   10.782  296.277   16.251  585.922   12.022  618.708   17.161 -32.78503 20.95270 
1 1 1    9   31   20 o  144.677   41.128   17.600   9.5384   0.0000   0.0000   17.600   9.5384  ?   ?   144.677   41.128 0.000000 41.12833 
1 1 1    9   31   21 o  198.397   34.023   32.338   9.9599   0.0000   0.0000   32.338   9.9599  ?   ?   198.397   34.023 0.000000 34.02303 
1 1 1    9   31   22 o  358.024   11.749   98.696   6.4385   92.968   10.204  102.486   8.2992  345.165   19.392  364.165   14.889 -19.00034 24.44897 
1 1 1    9   31   23 o  287.704   11.835   63.758   5.2119   57.079   7.0515   71.801   7.7378  270.754   17.103  303.903   16.699 -33.14871 23.90318 
1 1 1    9   31   24 o   84.809   28.685   5.4014   4.4275   9.2711   6.0380   0.9010   6.5116  107.047   33.305   76.520   32.334 30.52714 46.41895 
1 1 1    9   31   25 o  335.408   11.005   86.619   5.6496   81.827   7.7653   92.009   8.2350  325.007   15.610  344.635   15.611 -19.62805 22.07650 
1 1 1    9   31   26 o  174.989   18.926   24.131   4.9884   26.504   6.8686   21.482   7.2568  181.502   25.421  161.372   30.497 20.13013 39.70307 
1 1 1    9   31   27 o  182.822   18.472   26.298   5.0983   26.933   7.0934   25.618   7.3326  182.645   26.117  177.406   27.927 5.238281 38.23607 
1 1 1    9   31   28 o  180.000   20.816   25.711   5.6294   25.117   7.0061   26.795   9.4561  175.852   26.883  178.084   35.930 -2.231232 44.87406 
1 1 1    9   31   29 o  658.870   9.4088  333.946   9.4886  349.098   13.445  318.914   13.393  672.046   13.071  642.060   13.628 29.98584 18.88278 
1 1 1    9   31   30 o  399.358   11.032  122.962   6.7436  126.629   9.5000  119.238   9.5743  403.874   15.368  391.689   15.970 12.18582 22.16296 
1 1 1    9   31   31 o  237.793   15.844   44.151   5.7339   49.821   8.2593   38.875   7.9666  250.545   21.753  220.218   24.025 30.32739 32.40947 
1 1 1    9   31   32 o  519.896   10.261  208.305   8.1652  223.799   11.698  193.583   11.403  537.167   14.227  499.259   14.921 37.90781 20.61716 
1 1 1    9   31   33 o  158.170   29.295   20.824   6.8312   22.181   7.7240   15.953   14.637  162.091   32.267  138.584   51.588 23.50720 60.84781 
1 1 1    9   31   34 o  280.085   18.884   61.849   8.0483   52.369   9.1136   95.434   17.154  255.527   23.567  338.283   33.573 -82.75638 41.01922 
1 1 1    9   31   35 o  114.227   32.045   11.102   5.8304   6.8083   8.2355   15.417   8.2552  100.229   38.386  132.616   38.438 -32.38669 54.32255 
1 1 1    9   31   36 o  171.992   34.472   25.455   8.7588   0.0000   0.0000   25.455   8.7588  ?   ?   171.992   34.472 0.000000 34.47159 
1 1 1    9   31   37 o   70.940   31.996  -2.4826   7.3562   2.1647   13.998  -4.2557   8.6463  105.047   45.914   73.770   33.819 31.27641 57.02473 
1 1 1    9   31   38 o  230.945   19.550   42.499   6.8459   49.237   9.4930   35.198   9.8817  245.336   25.659  202.853   32.957 42.48268 41.76815 
1 1 1    9   31   39 o  267.383   18.131   56.701   7.3767   59.468   10.813   54.292   10.089  268.560   26.656  256.953   26.011 11.60706 37.24427 
1 1 1    9   31   40 o  290.040   11.833   65.331   5.2533   71.339   6.2368   50.658   9.7463  302.433   13.473  247.460   26.126 54.97284 29.39572 
1 1 1    9   31   42 o   83.586   27.402   5.7560   4.0463   3.6096   4.6022   13.064   8.4923   74.542   28.660  119.157   39.728 -44.61561 48.98710 
1 1 1    9   31   43 o   85.548   24.551   6.2113   3.3828   3.3339   4.4846   10.010   5.1526   72.609   28.187  106.421   30.220 -33.81210 41.32492 
1 1 1    9   31   44 f   53.522   22.687   0.5330   3.2216   4.1634   4.5144  -3.2345   4.5989   75.969   28.577   51.720   24.046 24.24805 37.34744 
1 1 1    9   31   45 o  136.804   18.369   15.314   3.7492   19.810   5.3789   11.067   5.2287  152.826   23.767  110.475   30.102 42.35044 38.35332 
1 1 1    9   31   46 o   65.818   24.796   3.0447   3.4013   1.1471   4.9911   4.6902   4.6476   65.533   28.021   77.850   29.052 -12.31643 40.36325 
1 1 1    9   31   47 f   81.812   28.547   5.7095   4.3949   8.6000   5.1885  -1.6306   8.2683   96.654   30.979   72.616   33.209 24.03886 45.41477 
1 1 1    9   32    3 o  369.860   18.206  105.692   10.307   0.0000   0.0000  105.692   10.307  ?   ?   369.860   18.206 0.000000 18.20604 
1 1 1    9   32    4 o  337.371   13.237   87.551   6.8352   70.126   9.8832  103.527   9.4634  299.914   21.675  366.283   16.880 -66.36908 27.47255 
1 1 1    9   32    5 o  583.803   11.426  261.839   10.210  266.066   15.415  258.536   13.628  587.091   17.155  579.214   15.372 7.877197 23.03396 
1 1 1    9   32    6 o  367.763   13.387  104.060   7.5359  104.751   11.419  103.527   10.030  367.150   20.401  366.055   17.902 1.094696 27.14125 
1 1 1    9   32    7 o  710.787   11.618  388.228   12.640  394.628   18.630  382.769   17.206  714.958   17.024  704.506   15.956 10.45239 23.33258 
1 1 1    9   32    8 o  439.242   12.174  148.327   8.1845  138.162   11.804  157.738   11.358  422.730   18.244  452.124   16.412 -29.39346 24.53952 
1 1 1    9   32    9 f  305.451   14.490   71.875   6.7747   74.069   10.156   70.116   9.0932  308.106   21.674  300.187   19.903 7.919373 29.42642 
1 1 1    9   32   10 o  414.870   13.154  132.454   8.3527  137.033   12.095  128.280   11.549  420.776   18.779  407.176   18.531 13.60016 26.38277 
1 1 1    9   32   11 o  199.426   19.859   31.124   5.9812   38.898   8.8766   24.658   8.0949  221.372   26.739  174.238   31.513 47.13457 41.32820 
1 1 1    9   32   12 o  234.421   14.446   42.510   5.1580   42.561   6.4374   42.418   8.6210  233.850   18.126  231.828   24.675 2.021591 30.61693 
1 1 1    9   32   13 o  159.230   19.861   19.961   4.7353   24.935   5.9478   11.350   7.8256  177.638   22.371  119.350   38.023 58.28870 44.11604 
1 1 1    9   32   14 o  195.898   16.905   29.885   5.0193   25.965   6.0571   38.475   8.9669  181.292   22.298  219.765   27.241 -38.47330 35.20346 
1 1 1    9   32   15 o  227.805   15.092   40.224   5.2327   43.868   6.4149   32.978   9.0457  237.379   17.785  202.208   30.148 35.17033 35.00252 
1 1 1    9   32   16 o   74.435   30.364   1.8625   5.4628  -4.6446   7.4854   9.2770   7.9903   68.900   31.542  111.198   38.509 -42.29800 49.77800 
1 1 1    9   32   17 o  153.452   26.906   19.037   6.0891   12.527   8.2239   26.936   9.0593  124.133   38.909  180.891   33.967 -56.75783 51.64973 
1 1 1    9   32   18 o  265.568   25.621   55.914   10.285   0.0000   0.0000   55.914   10.285  ?   ?   265.568   25.621 0.000000 25.62056 
1 1 1    9   32   19 o  259.729   15.087   52.308   5.9719   45.191   7.1840   68.225   10.744  240.216   19.712  293.985   24.087 -53.76886 31.12518 
1 1 1    9   32   20 o  354.717   12.023   96.924   6.5280   95.846   7.7846   99.480   11.983  352.232   14.439  355.985   22.101 -3.753571 26.39968 
1 1 1    9   32   21 o  279.263   14.279   60.410   6.0830   65.082   7.3689   50.418   10.778  289.255   16.715  250.449   28.629 38.80551 33.15133 
1 1 1    9   32   22 o  197.409   15.892   30.378   4.7611   34.424   6.8522   26.602   6.6202  208.639   21.778  182.370   24.323 26.26855 32.64762 
1 1 1    9   32   23 o  266.703   12.990   54.898   5.3029   56.843   7.5576   53.011   7.4427  269.652   18.421  260.246   18.811 9.405884 26.32838 
1 1 1    9   32   24 o  220.797   15.269   37.933   5.1285   37.532   7.2317   38.338   7.2741  217.721   22.002  220.108   21.881 -2.386505 31.03046 
1 1 1    9   32   25 o  236.974   14.874   43.652   5.3679   40.722   7.3839   46.937   7.8173  226.928   21.515  243.889   21.150 -16.96162 30.17021 
1 1 1    9   32   26 o  105.538   31.199   9.1697   5.3911   17.173   6.8857  -3.5068   8.6659  143.142   32.207   76.640   34.632 66.50240 47.29344 
1 1 1    9   32   27 o  170.157   22.167   23.133   5.6362   16.700   6.8307   36.856   9.9763  140.963   32.345  211.431   31.813 -70.46782 45.36770 
1 1 1    9   32   28 o  198.682   17.473   30.988   5.2597   33.811   7.4212   28.139   7.4556  205.389   24.062  186.057   26.966 19.33250 36.14075 
1 1 1    9   32   29 f  159.411   22.525   20.418   5.3431   20.769   7.4808   20.053   7.6340  157.267   32.162  154.017   33.349 3.249954 46.33067 
1 1 1    9   32   30 o  282.764   13.582   61.927   5.8784   68.278   8.4039   55.843   8.2258  294.784   18.722  265.835   20.371 28.94901 27.66783 
1 1 1    9   32   31 o  301.252   16.793   70.997   7.7124   62.588   8.9458   95.339   15.221  281.090   20.943  342.000   29.361 -60.91049 36.06484 
1 1 1    9   32   32 o  202.381   23.313   32.929   7.0896   33.734   8.2357   30.625   13.932  203.187   27.161  181.719   48.980 21.46864 56.00633 
1 1 1    9   32   33 o  537.807   10.730  223.248   8.8326  217.481   12.298  229.394   12.694  528.564   15.200  542.800   15.279 -14.23578 21.55218 
1 1 1    9   32   34 o  218.698   18.819   37.860   6.2382   30.286   8.7422   45.718   8.9044  189.993   31.141  237.695   24.841 -47.70186 39.83531 
1 1 1    9   32   35 o  199.775   25.908   32.664   7.7356   30.719   14.377   33.456   9.1772  178.995   50.359  199.526   31.060 -20.53154 59.16714 
1 1 1    9   32   36 f  165.996   31.924   23.544   7.8165   16.094   15.057   26.293   9.1453  136.203   51.965  173.584   35.615 -37.38063 62.99825 
1 1 1    9   32   37 o  158.578   28.162   21.147   6.5851   32.882   9.4445   10.045   9.1863  195.893   32.648  111.476   40.986 84.41802 52.39937 
1 1 1    9   32   38 o  151.204   28.827   19.436   6.4282   13.535   9.0411   25.468   9.1414  122.881   40.993  169.115   36.394 -46.23434 54.81694 
1 1 1    9   32   39 o  142.601   32.713   17.921   6.9885   10.249   11.952   21.906   8.6146  114.857   45.583  155.585   36.758 -40.72807 58.55730 
1 1 1    9   32   40 o   88.816   27.527   6.6388   4.1291   3.6518   4.7369   16.090   8.4259   75.424   29.056  131.608   39.028 -56.18394 48.65604 
1 1 1    9   32   41 o  266.496   12.218   55.347   4.9837   63.209   5.9789   37.449   9.0212  284.116   13.749  209.385   28.920 74.73126 32.02192 
1 1 1    9   32   42 o   82.436   37.458  -1.7995   10.308   0.0000   0.0000  -1.7995   10.308  ?   ?    82.436   37.458 0.000000 37.45848 
1 1 1    9   32   43 o  151.430   19.920   18.836   4.5050   17.384   5.3360   22.439   8.4060  142.475   25.400  154.535   36.177 -12.06030 44.20314 
1 1 1    9   32   44 o   52.619   22.510   0.3671   3.2234  -2.1630   4.5520   2.9118   4.5652   53.709   24.591   70.271   28.081 -16.56200 37.32624 
1 1 1    9   32   45 f  130.872   17.873   14.049   3.4866   12.849   4.9126   15.267   4.9492  120.009   27.353  132.372   25.350 -12.36284 37.29353 
1 1 1    9   32   46 o  264.309   14.069   55.580   5.6711   69.304   7.3339   35.169   8.9439  293.250   16.405  196.576   30.731 96.67430 34.83593 
1 1 1    9   33    0 o  306.529   19.412   73.203   9.0238   73.203   9.0238   73.203   9.0238  306.529   19.412  306.529   19.412 0.000000 0.000000 
1 1 1    9   33    1 o  227.295   16.362   40.084   5.6543   42.305   7.8245   37.656   8.1803  232.227   22.286  218.289   24.930 13.93726 33.43950 
1 1 1    9   33    2 o  226.172   16.422   39.696   5.6461   44.639   7.6434   33.759   8.3765  238.883   21.122  205.887   27.250 32.99573 34.47758 
1 1 1    9   33    3 o  538.498   11.066  222.819   9.1212  222.772   12.895  222.866   12.904  537.357   15.678  537.469   15.685 -0.1115112 22.17706 
1 1 1    9   33    4 o  529.353   9.4777  215.091   7.6792  224.061   9.5795  198.961   12.845  539.881   11.592  507.579   16.534 32.30154 20.19296 
1 1 1    9   33    5 o  486.257   9.5559  181.509   7.1123  182.396   8.8154  179.855   12.038  487.049   11.825  482.633   16.295 4.415283 20.13372 
1 1 1    9   33    6 o  535.854   11.886  220.807   9.7490  219.855   14.259  221.643   13.359  533.222   17.471  535.745   16.291 -2.523010 23.88807 
1 1 1    9   33    7 o  176.571   22.719   24.661   5.9976   19.171   8.9229   29.185   8.1004  151.609   38.407  190.675   28.640 -39.06567 47.91012 
1 1 1    9   33    8 o  474.559   12.305  173.270   8.9378  172.703   13.300  173.738   12.069  472.238   18.401  474.163   16.629 -1.924408 24.80173 
1 1 1    9   33    9 o  224.968   18.646   39.474   6.3627   41.769   9.5011   37.609   8.5675  228.973   27.671  217.550   26.260 11.42366 38.14802 
1 1 1    9   33   10 o  245.450   24.507   47.557   9.0840   0.0000   0.0000   47.557   9.0840  ?   ?   245.450   24.507 0.000000 24.50687 
1 1 1    9   33   11 f  312.618   20.809   76.328   9.9003   0.0000   0.0000   76.328   9.9003  ?   ?   312.618   20.809 0.000000 20.80915 
1 1 1    9   33   12 o  248.072   24.598   48.630   9.2167   0.0000   0.0000   48.630   9.2167  ?   ?   248.072   24.598 0.000000 24.59756 
1 1 1    9   33   13 o  224.374   18.375   39.292   6.2553   40.752   8.6397   37.684   9.0685  226.598   25.344  216.956   27.959 9.642105 37.73624 
1 1 1    9   33   14 o  302.177   15.457   70.742   7.1254   75.641   9.9127   65.505   10.249  310.942   20.950  288.463   23.416 22.47845 31.41954 
1 1 1    9   33   15 o  306.514   15.866   72.854   7.4180   73.890   10.622   71.867   10.364  306.588   22.798  302.424   22.552 4.163177 32.06745 
1 1 1    9   33   16 o  293.772   16.871   67.081   7.5544   57.731   10.644   76.573   10.724  269.513   26.129  312.087   22.602 -42.57373 34.54876 
1 1 1    9   33   17 o  216.798   16.167   36.589   5.3264   34.755   6.4538   40.507   9.4326  210.233   20.309  224.560   28.055 -14.32712 34.63427 
1 1 1    9   33   18 o  321.095   12.785   79.507   6.2837   79.947   7.6404   78.587   11.046  321.405   15.531  315.793   23.011 5.611969 27.76158 
1 1 1    9   33   19 o  208.842   17.892   34.127   5.6641   38.636   6.8654   24.517   10.023  221.585   20.474  169.756   39.343 51.82884 44.35131 
1 1 1    9   33   20 o  123.140   28.829   12.532   5.3378   15.278   6.4552   6.5947   9.4917  135.449   31.698  105.343   40.976 30.10555 51.80510 
1 1 1    9   33   21 o  428.603   11.394  141.510   7.4750  143.921   9.0100  136.186   13.388  431.631   13.638  416.702   21.059 14.92905 25.08950 
1 1 1    9   33   22 o  307.670   13.924   73.178   6.5572   79.001   8.0107   61.354   11.415  318.631   16.482  276.623   27.318 42.00760 31.90457 
1 1 1    9   33   23 o  450.928   9.7739  156.421   6.7460  162.487   9.6389  150.597   9.4447  458.440   13.736  441.266   13.984 17.17349 19.60177 
1 1 1    9   33   24 o  103.995   31.023   8.8761   5.3123   13.809   6.8481   1.4230   8.4179  127.926   34.280   86.567   36.682 41.35833 50.20623 
1 1 1    9   33   25 o  139.399   26.941   15.960   5.5404   23.130   7.1051   4.8347   8.8496  167.883   28.680   97.425   39.038 70.45800 48.44098 
1 1 1    9   33   26 o   93.124   29.850   6.9130   4.8174   4.1747   6.7587   9.7406   6.8682   87.551   34.426  109.507   35.691 -21.95576 49.58801 
1 1 1    9   33   27 o  255.121   14.301   50.596   5.5620   55.795   7.8342   45.313   7.8978  266.275   19.354  238.910   21.839 27.36549 29.18088 
1 1 1    9   33   28 f   62.648   28.641  -3.4879   6.1436  -1.8249   7.1180  -8.3453   12.165   71.946   32.035   83.739   38.991 -11.79242 50.46281 
1 1 1    9   33   29 o  185.750   24.362   27.865   6.7595   30.480   7.8843   20.611   13.131  193.107   27.447  151.301   49.352 41.80669 56.47050 
1 1 1    9   33   30 o  482.393   10.690  179.514   7.8929  191.633   11.065  166.961   11.262  496.733   14.554  463.006   15.891 33.72726 21.54844 
1 1 1    9   33   31 o  188.588   20.486   28.346   5.8183   33.107   8.1974   23.514   8.2597  201.051   27.347  166.126   33.637 34.92462 43.35115 
1 1 1    9   33   32 o  355.699   12.781   98.029   6.9588  105.015   9.8064   90.943   9.8764  366.203   17.495  339.571   19.079 26.63202 25.88621 
1 1 1    9   33   33 o  271.949   15.589   57.879   6.4621   71.006   9.2200   45.205   9.0596  299.099   20.259  235.813   25.506 63.28610 32.57294 
1 1 1    9   33   34 f  203.969   24.944   33.926   7.6252   63.481   14.582   22.802   8.9459  271.969   35.906  160.801   37.101 111.1682 51.63127 
1 1 1    9   33   35 o  404.748   12.659  127.187   7.8425  131.960   10.901  122.067   11.291  409.694   17.384  393.179   18.762 16.51541 25.57740 
1 1 1    9   33   36 o  227.549   19.289   41.308   6.6549   41.432   9.4369   41.185   9.3861  222.866   28.302  222.239   28.230 0.6276855 39.97410 
1 1 1    9   33   37 o  163.049   29.668   22.709   7.1313   35.171   12.146   16.152   8.8098  194.793   41.974  132.554   40.044 62.23889 58.01130 
1 1 1    9   33   38 o  129.286   35.138   15.046   7.1353   14.400   12.806   15.338   8.5926  126.340   47.990  128.865   39.671 -2.524345 62.26417 
1 1 1    9   33   39 o  131.671   32.405   15.409   6.4867   24.169   9.7550   8.4649   8.6851  160.619   39.866  103.504   39.472 57.11516 56.10088 
1 1 1    9   33   40 o   63.247   29.483  -4.6975   6.9879   2.0792   9.7458 -11.8680   10.025   88.624   38.531   67.165   32.419 21.45967 50.35534 
1 1 1    9   33   41 f   88.573   27.929   6.7214   4.2304   5.5778   4.5997   12.997   10.776   83.069   29.192  117.615   44.168 -34.54631 52.94362 
1 1 1    9   33   42 o  118.315   23.459   11.931   4.0983   14.086   4.7950   6.0870   7.8945  127.777   25.411   91.961   36.864 35.81590 44.77361 
1 1 1    9   33   43 o   96.305   27.195   8.2267   4.1848   6.2859   4.9118   13.366   7.9929   86.095   30.171  116.769   38.524 -30.67316 48.93270 
1 1 1    9   33   44 o  120.341   24.390   12.578   4.3387   16.376   5.1779   3.6271   7.9494  136.941   25.646   83.703   35.566 53.23798 43.84787 
1 1 1    9   34    0 o  171.949   36.448   25.882   8.4362   25.882   8.4362   25.882   8.4362  171.949   36.448  171.949   36.448 0.000000 0.000000 
1 1 1    9   34    1 o  248.598   15.773   47.922   5.9707   46.813   8.4208   49.044   8.4669  243.962   22.816  249.880   22.374 -5.918579 31.95560 
1 1 1    9   34    2 o  306.725   14.416   72.561   6.7683   78.126   9.5415   66.926   9.6023  316.601   19.789  292.416   21.607 24.18457 29.29940 
1 1 1    9   34    3 o  141.648   25.796   16.194   5.3868   17.374   7.4857   14.927   7.7577  144.751   34.310  134.069   36.722 10.68141 50.25611 
1 1 1    9   34    4 o  288.272   13.902   64.065   6.1341   65.881   8.4972   62.088   8.8643  290.765   19.201  281.826   20.694 8.938782 28.22935 
1 1 1    9   34    5 o  190.916   20.161   28.628   5.8024   31.378   7.9408   25.477   8.4995  198.110   26.881  176.373   32.688 21.73729 42.32129 
1 1 1    9   34    6 o  500.156   17.016  193.596   13.027   0.0000   0.0000  193.596   13.027  ?   ?   500.156   17.016 0.000000 17.01637 
1 1 1    9   34    7 o  133.395   37.889   14.795   8.0987   0.0000   0.0000   14.795   8.0987  ?   ?   133.395   37.889 0.000000 37.88921 
1 1 1    9   34    8 o  271.298   16.987   57.195   7.0184   63.302   10.567   52.375   9.3880  283.189   24.625  257.579   24.092 25.60947 34.44961 
1 1 1    9   34    9 o   65.559   29.000  -1.5347   5.7402  -1.7477   8.4901  -1.3553   7.7906   80.189   35.380   77.562   34.068 2.626572 49.11581 
1 1 1    9   34   10 o  246.197   18.335   47.288   6.8597   40.187   9.5400   54.888   9.8707  223.777   28.499  263.377   24.776 -39.60011 37.76323 
1 1 1    9   34   11 o  366.344   14.264  103.604   7.9983   99.951   11.515  107.010   11.118  357.399   21.144  370.380   19.682 -12.98102 28.88655 
1 1 1    9   34   12 o  429.686   13.392  142.408   8.8081  141.174   13.080  143.433   11.915  425.760   20.071  429.845   18.109 -4.084930 27.03301 
1 1 1    9   34   13 o  608.614   12.134  285.351   11.303  270.866   15.981  299.853   15.990  590.796   17.673  622.022   16.795 -31.22601 24.37990 
1 1 1    9   34   14 o  276.208   14.055   59.064   5.9223   63.186   7.3841   51.632   9.9156  284.962   17.007  254.701   25.790 30.26193 30.89245 
1 1 1    9   34   15 o  296.291   13.517   67.761   6.1301   64.229   7.4122   75.406   10.905  287.295   16.931  309.208   23.210 -21.91333 28.72893 
1 1 1    9   34   16 o  139.876   24.663   15.824   5.0873   10.673   6.0166   28.743   9.5283  113.731   32.772  185.936   34.758 -72.20524 47.77122 
1 1 1    9   34   17 o  313.608   13.127   75.903   6.3010   75.135   7.6210   77.561   11.202  310.974   16.066  313.323   23.530 -2.349060 28.49125 
1 1 1    9   34   18 o  138.095   26.340   15.555   5.3644   14.534   6.5117   17.713   9.4633  131.873   32.475  143.991   40.978 -12.11818 52.28577 
1 1 1    9   34   19 o  539.843   10.658  224.341   8.8064  218.046   10.677  237.737   15.575  531.416   13.127  552.543   18.415 -21.12762 22.61493 
1 1 1    9   34   20 o  412.722   11.943  131.354   7.5447  129.353   9.0526  135.903   13.652  408.848   14.466  415.784   21.526 -6.936371 25.93472 
1 1 1    9   34   21 o   84.802   31.894   4.5550   5.6227   8.0205   6.7067  -3.6432   10.315  102.308   35.289   84.092   37.912 18.21664 51.79429 
1 1 1    9   34   22 o  317.857   16.749   78.748   8.1200   78.748   8.1200   0.0000   0.0000  317.857   16.749  ?   ?  0.000000 16.74908 
1 1 1    9   34   23 o  340.194   15.873   89.869   8.2650   89.869   8.2650   0.0000   0.0000  340.194   15.873  ?   ?  0.000000 15.87255 
1 1 1    9   34   24 o  330.207   11.956   84.164   6.0430   83.311   8.3835   85.087   8.7184  326.761   16.819  330.044   17.319 -3.283783 24.14157 
1 1 1    9   34   26 o  340.201   14.256   89.737   7.4234   87.488   8.6900   95.810   14.279  334.582   17.025  344.713   27.286 -10.13135 32.16179 
1 1 1    9   34   27 o  379.909   13.806  111.868   8.0281  115.184   9.5710  103.998   14.745  384.561   16.260  359.083   27.027 25.47739 31.54076 
1 1 1    9   34   28 o  254.985   15.333   50.743   5.9563   52.018   8.4433   49.479   8.4039  255.703   21.780  249.128   22.274 6.575134 31.15289 
1 1 1    9   34   29 o  287.058   14.217   63.982   6.2465   58.850   8.7545   69.304   8.9153  272.195   21.180  296.174   19.780 -23.97861 28.97960 
1 1 1    9   34   30 o  224.127   17.281   39.519   5.8825   35.796   8.1328   43.603   8.5190  209.742   25.882  232.521   24.295 -22.77910 35.49800 
1 1 1    9   34   31 o  248.947   16.643   48.667   6.3051   45.894   8.7586   51.651   9.0837  238.305   24.354  253.272   23.707 -14.96744 33.98803 
1 1 1    9   34   32 o  273.369   18.992   59.162   7.8975   63.472   14.844   57.461   9.3272  271.617   36.639  267.328   23.020 4.289886 43.26987 
1 1 1    9   34   33 o  244.144   20.709   47.638   7.6657   45.486   14.019   48.556   9.1558  224.438   42.361  244.282   24.832 -19.84401 49.10327 
1 1 1    9   34   34 o  160.129   25.947   21.287   6.1420   21.769   8.5815   20.780   8.7947  156.521   36.492  152.101   37.911 4.420181 52.62036 
1 1 1    9   34   35 o  353.378   15.385   97.847   8.3218   88.874   13.368  103.525   10.633  328.214   26.845  360.607   19.336 -32.39304 33.08320 
1 1 1    9   34   36 o  244.735   20.727   48.241   7.6915   33.439   12.790   56.625   9.6266  186.555   45.255  262.984   24.186 -76.42879 51.31292 
1 1 1    9   34   37 o  190.362   23.347   29.792   6.6602   45.647   9.7655   16.004   9.1068  232.922   27.949  130.781   40.937 102.1410 49.56818 
1 1 1    9   34   38 o  243.801   18.962   47.709   7.0202   42.228   10.394   52.307   9.5198  220.473   31.713  251.087   25.107 -30.61465 40.44847 
1 1 1    9   34   39 o   68.238   31.031  -2.3347   7.0909   5.6156   9.3236 -13.2421   10.921   95.465   39.389   69.065   33.457 26.39998 51.67979 
1 1 1    9   34   40 o  200.569   21.214   33.076   6.4137   26.792   9.3695   38.618   8.7983  168.706   37.277  211.914   27.795 -43.20836 46.49907 
1 1 1    9   34   41 o   81.949   32.125   4.7146   5.8690   6.8028   8.8562   3.0795   7.8369   95.802   38.818   83.016   35.295 12.78618 52.46469 
1 1 1    9   34   42 o  159.234   19.017   20.821   4.5432   27.000   5.5450   8.2006   7.9241  180.683   20.408   97.681   37.594 83.00238 42.77626 
1 1 1    9   34   43 o   79.156   27.201   5.2737   3.9830   5.3430   4.6257   5.0751   7.8325   80.646   29.170   87.248   36.059 -6.601852 46.37982 
1 1 1    9   35    0 o  111.052   44.799   13.496   7.4302   13.496   7.4302   13.496   7.4302  111.052   44.799  111.052   44.799 0.000000 0.000000 
1 1 1    9   35    1 o  139.399   27.706   15.852   5.7034   13.468   7.7535   18.663   8.4192  127.442   37.342  149.054   37.060 -21.61265 52.61055 
1 1 1    9   35    2 o  206.007   19.266   33.267   6.0043   31.792   8.2735   34.908   8.7273  198.781   27.965  208.413   28.072 -9.632385 39.62465 
1 1 1    9   35    3 o  186.536   17.357   27.197   4.8988   32.097   6.1390   18.607   8.1281  202.098   20.113  149.020   36.031 53.07892 41.26486 
1 1 1    9   35    4 o  419.849   10.305  135.523   6.6225  136.905   8.2305  132.986   11.153  421.471   12.758  414.092   17.597 7.379333 21.73510 
1 1 1    9   35    5 o   88.417   29.324   5.9611   4.6291   5.8328   5.7876   6.1891   7.7122   91.223   32.673   98.859   37.316 -7.636101 49.59822 
1 1 1    9   35    6 f  129.482   24.616   13.578   4.7004   16.142   5.8698   8.9965   7.8474  140.466   28.280  109.391   38.148 31.07467 47.48666 
1 1 1    9   35    7 o  296.718   16.057   68.347   7.2656   75.923   11.183   62.813   9.5573  310.255   23.729  282.555   22.279 27.70071 32.54925 
1 1 1    9   35    8 o  254.637   17.754   50.562   6.8765   59.500   10.056   42.710   9.4247  274.246   24.204  230.992   27.176 43.25441 36.39167 
1 1 1    9   35    9 o  229.964   19.231   41.427   6.7069   40.178   10.085   42.418   8.9807  222.697   30.379  230.612   25.890 -7.915283 39.91474 
1 1 1    9   35   10 o  212.188   21.012   35.482   6.7345   38.428   9.8854   32.931   9.1996  217.603   30.519  201.032   30.886 16.57147 43.42039 
1 1 1    9   35   11 o  311.543   16.297   75.405   7.7443   82.483   11.664   69.825   10.356  323.239   23.742  297.589   22.913 25.65027 32.99472 
1 1 1    9   35   12 o  239.430   19.469   44.942   7.0731   53.401   10.416   37.703   9.6357  258.565   26.702  215.587   30.015 42.97876 40.17321 
1 1 1    9   35   13 o  121.980   33.548   12.396   6.4590   26.155   9.5000   0.5684   8.8081  176.509   36.373   86.601   37.132 89.90755 51.97868 
1 1 1    9   35   14 o  548.740   10.315  231.656   8.6636  233.783   10.684  227.572   14.805  550.519   12.679  541.060   17.877 9.459839 21.91696 
1 1 1    9   35   15 o  205.109   17.947   32.957   5.5777   32.838   6.7833   33.204   9.8008  203.532   22.131  200.618   33.069 2.914154 39.79143 
1 1 1    9   35   16 o  257.329   15.363   51.474   6.0236   54.253   7.3766   45.910   10.436  263.336   18.417  238.163   29.242 25.17386 34.55794 
1 1 1    9   35   17 o  215.164   18.003   36.277   5.8745   33.135   7.0925   43.143   10.484  204.013   23.121  230.114   30.518 -26.10141 38.28781 
1 1 1    9   35   18 o  266.485   15.351   55.217   6.2349   58.163   7.7871   49.957   10.407  272.474   18.786  248.994   27.780 23.48000 33.53630 
1 1 1    9   35   19 o   87.342   31.858   5.2478   5.5347   3.7811   6.6015   8.7180   10.154   85.788   33.930  112.870   42.767 -27.08221 54.59166 
1 1 1    9   35   20 o  249.442   20.069   49.008   7.5976   49.008   7.5976   0.0000   0.0000  249.442   20.069  ?   ?  0.000000 20.06916 
1 1 1    9   35   21 o  122.874   34.744   12.746   6.8258   12.746   6.8258   0.0000   0.0000  122.874   34.744  ?   ?  0.000000 34.74408 
1 1 1    9   35   22 o  197.851   20.813   31.054   6.2085   26.416   7.4200   41.882   11.337  179.792   27.864  224.154   34.120 -44.36179 44.05225 
1 1 1    9   35   23 o  278.616   16.094   60.566   6.8341   65.261   8.1372   49.326   12.590  288.365   18.534  242.884   34.867 45.48003 39.48659 
1 1 1    9   35   24 o  141.038   28.841   16.551   6.0160   20.787   7.2503   7.1876   10.779  157.571   31.165  109.203   43.305 48.36807 53.35326 
1 1 1    9   35   25 o  214.468   17.673   36.165   5.7499   28.502   7.9197   44.706   8.3613  186.103   28.728  236.363   23.419 -50.26004 37.06414 
1 1 1    9   35   26 o  224.829   16.671   39.633   5.6962   46.115   8.0915   33.264   8.0201  240.469   22.236  202.130   26.566 38.33806 34.64357 
1 1 1    9   35   27 o  192.191   19.399   29.300   5.6285   37.504   8.1364   21.771   7.7944  215.275   25.168  160.117   32.903 55.15779 41.42531 
1 1 1    9   35   28 o   66.416   28.578   0.1369   5.2509  -5.5810   7.4321   5.8360   7.4198   65.595   30.520   94.720   36.397 -29.12487 47.50025 
1 1 1    9   35   29 o  263.216   15.199   54.153   6.0976   57.714   8.5936   50.543   8.6532  269.252   21.018  251.029   22.769 18.22275 30.98685 
1 1 1    9   35   30 o  226.436   17.496   40.448   6.0170   46.370   8.6139   34.806   8.4083  239.615   23.801  205.536   27.410 34.07881 36.30201 
1 1 1    9   35   31 o  249.885   20.541   49.838   7.7870   51.425   13.954   49.120   9.3840  241.784   39.035  245.487   25.339 -3.703125 46.53792 
1 1 1    9   35   32 o  201.658   20.992   32.692   6.3846   39.054   9.1372   26.621   8.9251  216.654   28.223  174.818   34.579 41.83685 44.63521 
1 1 1    9   35   33 o  259.190   19.019   53.501   7.4926   62.625   12.304   48.124   9.4460  273.040   29.932  241.759   25.932 31.28145 39.60247 
1 1 1    9   35   34 o   83.880   33.703   3.9018   6.6155  -8.3415   10.596   11.724   8.4690   74.991   35.382  115.529   39.667 -40.53713 53.15417 
1 1 1    9   35   35 o  136.818   30.745   16.321   6.2816   18.669   8.7367   13.809   9.0379  142.030   38.998  122.878   40.985 19.15169 56.57438 
1 1 1    9   35   36 f  205.000   21.080   34.128   6.5203   40.788   9.4791   28.147   8.9831  219.014   28.989  177.966   34.221 41.04819 44.84855 
1 1 1    9   35   37 o  285.652   18.180   65.290   7.9076   64.058   10.216   67.133   12.490  278.327   24.222  280.001   29.591 -1.674011 38.24010 
1 1 1    9   35   38 o  117.995   35.506   12.909   6.9364   10.739   9.0618   15.981   10.779  109.560   40.629  126.835   44.678 -17.27500 60.38960 
1 1 1    9   35   39 o  117.932   32.297   12.748   6.0012   22.812   8.8896   4.3212   8.1346  154.206   37.926   87.610   36.521 66.59568 52.65142 
1 1 1    9   35   40 o   94.938   33.005   7.9619   5.8721   15.709   8.7800   1.6921   7.8985  125.194   40.316   79.488   34.623 45.70595 53.14283 
1 1 1    9   35   41 o  185.561   22.283   28.896   6.2024   32.088   8.9411   25.935   8.6113  187.197   32.377  165.505   35.082 21.69255 47.73885 
1 1 1    9   36    0 o  179.150   33.986   27.585   8.3432   27.585   8.3432   27.585   8.3432  179.150   33.986  179.150   33.986 0.000000 0.000000 
1 1 1    9   36    1 o  534.312   11.828  219.913   9.6731  214.961   13.632  224.937   13.729  526.482   16.916  538.671   16.651 -12.18866 23.73593 
1 1 1    9   36    2 o   55.681   25.930  -4.6468   5.3836  -5.4559   7.5924  -3.8286   7.6348   67.655   31.259   71.063   32.270 -3.408325 44.92766 
1 1 1    9   36    3 o  268.336   13.990   55.758   5.7261   62.018   7.2658   45.496   9.3023  282.303   16.893  238.845   25.858 43.45871 30.88690 
1 1 1    9   36    4 o  221.301   15.991   38.121   5.3802   38.646   6.8135   37.251   8.7688  221.702   20.304  215.384   27.205 6.318283 33.94684 
1 1 1    9   36    5 f  238.907   14.820   44.299   5.3925   44.623   6.8546   43.773   8.7350  238.748   18.912  234.617   24.695 4.130249 31.10466 
1 1 1    9   36    6 o  410.623   10.892  129.770   6.8456  132.274   8.6412  125.551   11.218  413.905   13.640  401.859   18.237 12.04559 22.77365 
1 1 1    9   36    7 o  324.183   15.667   81.380   7.7741   81.589   11.337   81.194   10.680  321.610   23.187  321.362   21.843 0.2487793 31.85480 
1 1 1    9   36    8 o  413.305   13.749  131.933   8.6976  137.880   12.890  126.962   11.785  420.371   20.032  403.748   19.070 16.62332 27.65812 
1 1 1    9   36    9 o  323.790   15.864   81.232   7.8620   66.954   11.061   95.810   11.177  290.302   25.142  349.454   20.993 -59.15219 32.75393 
1 1 1    9   36   10 o  124.956   33.167   13.052   6.4491   17.487   9.4309   9.1575   8.8385  143.114   40.970  111.690   40.333 31.42397 57.49110 
1 1 1    9   36   11 o  407.443   14.568  128.426   9.0854  128.280   13.095  128.562   12.616  404.263   21.237  405.094   20.412 -0.8302307 29.45614 
1 1 1    9   36   12 o  367.474   15.330  104.604   8.6227  104.751   12.432  104.469   11.970  364.627   22.383  364.513   21.550 0.1144714 31.07088 
1 1 1    9   36   13 o  204.065   23.463   33.181   7.1951   32.479   10.442   33.816   9.9281  196.895   35.975  202.219   33.230 -5.323959 48.97377 
1 1 1    9   36   14 o  239.891   20.679   45.358   7.5188   38.795   10.651   51.877   10.615  216.824   33.147  253.849   27.773 -37.02509 43.24410 
1 1 1    9   36   15 o  276.759   14.810   59.485   6.2508   67.217   7.5944   43.246   11.006  293.589   16.972  229.444   32.228 64.14522 36.42396 
1 1 1    9   36   16 o  184.054   20.499   26.837   5.6768   24.805   6.7033   31.990   10.674  175.151   25.775  194.423   37.225 -19.27141 45.27761 
1 1 1    9   36   17 o  348.843   15.615   94.433   8.3377   94.433   8.3377   0.0000   0.0000  348.843   15.615  ?   ?  0.000000 15.61522 
1 1 1    9   36   18 o  209.660   22.574   35.005   7.1302   35.005   7.1302   0.0000   0.0000  209.660   22.574  ?   ?  0.000000 22.57437 
1 1 1    9   36   19 o  304.752   14.512   71.979   6.7691   70.623   8.0904   75.142   12.359  300.474   17.669  305.852   26.668 -5.377930 31.98992 
1 1 1    9   36   20 o  211.915   19.008   35.399   6.1001   37.154   7.3294   31.444   11.003  215.913   22.509  191.163   38.929 24.74986 44.96758 
1 1 1    9   36   21 o  275.765   15.979   59.335   6.7155   50.473   7.8510   83.500   12.964  252.689   20.475  322.215   26.522 -69.52551 33.50570 
1 1 1    9   36   22 o  106.396   33.483   9.3277   6.0832   7.7325   7.2402   13.157   11.218  101.684   36.531  127.256   45.498 -25.57251 58.34857 
1 1 1    9   36   23 f  406.906   13.117  128.188   8.1697  132.004   9.9285  120.186   14.377  411.875   15.749  387.927   24.336 23.94849 28.98758 
1 1 1    9   36   24 o  184.342   24.159   27.461   6.6526   22.207   7.7564   42.079   12.939  162.137   32.387  220.223   39.851 -58.08606 51.35240 
1 1 1    9   36   25 o  248.546   19.059   48.772   7.1953   44.963   8.3307   59.961   14.277  236.807   23.285  266.079   35.977 -29.27180 42.85502 
1 1 1    9   36   26 o  235.977   16.578   43.697   5.9497   51.532   8.4531   36.004   8.3757  254.082   21.951  209.960   26.664 44.12280 34.53698 
1 1 1    9   36   27 o  121.225   30.212   12.493   5.5859   5.4148   7.8653   19.695   7.9343   94.474   37.141  150.680   35.061 -56.20618 51.07579 
1 1 1    9   36   28 o  251.500   16.004   49.616   6.1287   52.124   8.7034   47.149   8.6317  254.818   22.547  241.714   23.633 13.10429 32.66341 
1 1 1    9   36   29 o  180.533   25.402   26.761   6.8253   49.505   13.619   19.133   7.8873  237.302   38.838  147.666   35.363 89.63579 52.52577 
1 1 1    9   36   30 o  322.646   15.550   81.440   7.6793   84.102   12.936   79.992   9.5425  320.337   26.625  317.110   19.758 3.227600 33.15549 
1 1 1    9   36   31 o   73.761   31.540   0.9400   6.3237  -2.8856   9.7818   3.6867   8.2886   80.609   36.575   89.529   37.055 -8.919868 52.06531 
1 1 1    9   36   32 f  271.176   16.536   58.063   6.8307   62.560   9.8804   53.945   9.4538  277.284   23.501  256.814   24.341 20.47064 33.83443 
1 1 1    9   36   33 o  104.243   33.662   9.3758   6.1176   4.1846   8.4443   15.110   8.8748   90.748   37.468  128.000   40.462 -37.25249 55.14489 
1 1 1    9   36   34 o  193.331   22.259   30.551   6.4666   41.155   9.4759   21.309   8.8468  220.346   28.784  152.000   38.099 68.34604 47.75012 
1 1 1    9   36   35 o  108.682   33.890   10.528   6.2479   11.048   9.1315   10.070   8.5671  111.993   40.911  108.134   39.607 3.859283 56.94200 
1 1 1    9   36   36 o  237.815   35.131   50.992   12.403   0.0000   0.0000   50.992   12.403  ?   ?   237.815   35.131 0.000000 35.13121 
1 1 1    9   36   37 o   63.615   28.714  -1.5879   5.9376  -1.7642   8.5541  -1.4240   8.2483   75.286   34.177   74.723   33.775 0.5633698 48.04982 
1 1 1    9   36   38 o  199.315   21.357   32.853   6.4141   36.751   9.2180   29.196   8.9306  203.537   30.530  178.215   33.979 25.32204 45.68036 
1 1 1    9   36   39 o  127.571   30.522   14.837   5.8799   7.2053   8.2141   22.858   8.4207   95.139   37.779  154.486   36.238 -59.34692 52.34901 
1 1 1    9   37    0 o  217.583   29.767   38.945   9.3873   38.945   9.3873   38.945   9.3873  217.583   29.767  217.583   29.767 0.000000 0.000000 
1 1 1    9   37    1 f  231.868   19.146   42.179   6.7343   34.070   9.0380   52.300   10.097  204.620   29.727  255.820   26.155 -51.20047 39.59509 
1 1 1    9   37    2 o  132.896   29.165   14.601   5.7697   16.414   8.1609   12.790   8.1582  139.111   37.483  124.174   38.726 14.93716 53.89494 
1 1 1    9   37    3 o  384.773   11.280  114.040   6.6431  108.789   8.0922  124.892   11.634  375.133   14.093  400.305   18.987 -25.17206 23.64569 
1 1 1    9   37    4 o  332.901   12.730   85.518   6.4865   79.817   7.9101   97.222   11.334  320.411   16.181  351.823   21.145 -31.41174 26.62574 
1 1 1    9   37    5 o  784.009   10.035  472.856   12.042  470.840   14.870  476.697   20.523  781.256   12.435  783.334   17.117 -2.078369 21.15730 
1 1 1    9   37    6 o  319.506   13.002   78.811   6.3585   79.228   7.7257   77.937   11.195  319.691   15.788  313.865   23.473 5.826019 28.28872 
1 1 1    9   37    7 f  443.907   13.582  152.263   9.2283  157.079   13.506  148.044   12.639  448.527   19.672  435.749   18.950 12.77875 27.31495 
1 1 1    9   37    8 o  502.936   13.539  195.458   10.422  172.797   14.283  221.266   15.242  470.298   19.841  532.799   18.690 -62.50018 27.25791 
1 1 1    9   37    9 o  306.688   17.080   73.323   7.9859   76.827   11.416   69.966   11.175  311.162   24.159  296.559   24.848 14.60370 34.65680 
1 1 1    9   37   10 o  364.689   15.614  103.134   8.7160  101.363   12.820  104.657   11.886  357.880   23.534  364.711   21.385 -6.831238 31.79913 
1 1 1    9   37   11 o  151.758   30.559   19.109   6.8528   30.305   10.010   9.2318   9.4015  189.864   35.755  112.750   41.462 77.11413 54.74971 
1 1 1    9   37   12 o  144.782   32.165   17.561   6.9428   20.480   9.9107   14.748   9.7290  153.649   41.267  132.236   42.424 21.41275 59.18394 
1 1 1    9   37   13 o  344.462   16.215   92.168   8.5493   94.586   12.343   89.937   11.853  345.448   23.483  336.993   23.119 8.454620 32.95354 
1 1 1    9   37   14 o  325.487   24.201   84.243   11.971   84.243   11.971   0.0000   0.0000  325.487   24.201  ?   ?  0.000000 24.20068 
1 1 1    9   37   15 o  103.620   40.449   6.5269   9.2743   6.5269   9.2743   0.0000   0.0000  103.620   40.449  ?   ?  0.000000 40.44855 
1 1 1    9   37   16 o  284.353   18.330   63.387   7.9355   63.387   7.9355   0.0000   0.0000  284.353   18.330  ?   ?  0.000000 18.33019 
1 1 1    9   37   17 o  348.667   13.500   94.092   7.2046   90.046   8.6794  103.057   12.920  340.090   16.673  360.107   23.570 -20.01694 28.87092 
1 1 1    9   37   18 o  286.046   15.142   63.702   6.6061   66.326   7.9108   57.655   12.008  290.943   17.850  265.549   30.074 25.39355 34.97237 
1 1 1    9   37   19 o  422.983   12.649  138.351   8.1891  132.824   9.9807  149.738   14.325  413.264   15.778  435.839   21.474 -22.57404 26.64731 
1 1 1    9   37   20 o  368.428   13.927  105.229   7.8537  108.430   9.4475   98.069   14.130  373.009   16.547  348.906   26.659 24.10275 31.37741 
1 1 1    9   37   21 o  379.951   13.662  111.899   7.9456  118.789   9.6122   97.033   14.118  390.523   16.081  346.737   26.810 43.78632 31.26328 
1 1 1    9   37   22 o   74.090   31.441   0.9174   6.1991   4.0319   7.3439  -6.8018   11.562   88.753   35.563   83.129   38.466 5.624069 52.38695 
1 1 1    9   37   23 o  119.704   33.779   12.251   6.4586   15.781   7.6562   3.5416   12.027  134.798   36.299  103.222   43.798 31.57616 56.88485 
1 1 1    9   37   24 o  217.732   20.934   37.802   6.8908   30.184   8.0513   58.662   13.323  191.118   28.385  264.052   33.735 -72.93434 44.08820 
1 1 1    9   37   25 o  171.815   26.122   24.259   6.6533   21.593   7.8351   31.152   12.598  158.671   33.321  184.266   45.045 -25.59532 56.03030 
1 1 1    9   37   26 o  358.480   15.082  100.218   8.2755  102.001   10.013   96.375   14.701  359.682   18.247  342.664   28.281 17.01718 33.65689 
1 1 1    9   37   27 o   88.044   34.543   4.7042   6.7905  -7.0935   13.569   8.6463   7.8434   88.990   41.350  104.814   37.972 -15.82421 56.13990 
1 1 1    9   37   28 o  215.313   25.836   38.100   8.3446   0.0000   0.0000   38.100   8.3446  ?   ?   215.313   25.836 0.000000 25.83620 
1 1 1    9   37   29 o  359.051   14.766  100.778   8.1150  114.633   13.483   92.909   10.162  376.298   23.528  341.590   19.516 34.70853 30.56833 
1 1 1    9   37   30 o  108.009   32.332   10.122   5.7625   19.214   8.2550   1.4799   8.0478  145.915   36.929   82.547   35.446 63.36782 51.18815 
1 1 1    9   37   31 o  137.940   29.598   16.414   6.0620   17.299   8.4630   15.482   8.6872  137.202   38.649  129.667   39.884 7.534210 55.53825 
1 1 1    9   37   32 o   86.476   32.942   5.2718   6.0451   3.8235   8.6238   6.6709   8.4763   90.022   37.572   97.712   38.511 -7.690018 53.80262 
1 1 1    9   37   33 f  146.619   28.675   18.563   6.2046   24.270   8.8735   13.104   8.6790  162.922   36.490  119.159   40.162 43.76286 54.26358 
1 1 1    9   37   34 o  282.443   18.544   64.068   7.9725   66.183   9.8922   60.149   13.467  283.567   22.989  259.073   34.844 24.49454 41.74486 
1 1 1    9   37   35 o  138.086   32.950   17.383   6.8671   14.823   8.5450   22.051   11.539  123.872   39.761  145.357   46.157 -21.48528 60.92142 
1 1 1    9   37   36 o   79.863   31.845   4.1009   5.8588   8.4542   8.5683   0.2780   8.0292  100.554   38.982   77.150   34.204 23.40479 51.86069 
1 1 1    9   37   37 o   94.781   33.099   7.9212   5.9089   0.3650   8.5268   14.902   8.1958   78.716   35.054  122.896   38.887 -44.17909 52.35453 
1 1 1    9   37   38 o   99.860   35.448   9.1056   6.7979   11.763   8.3857   4.0122   11.610  110.162   39.342   94.213   41.480 15.94901 57.17004 
1 1 1    9   38    0 o  412.164   19.936  132.327   12.510  132.327   12.510  132.327   12.510  412.164   19.936  412.164   19.936 0.000000 0.000000 
1 1 1    9   38    1 o  157.796   26.662   20.277   6.2101   20.724   8.8303   19.840   8.7353  155.783   37.487  152.339   37.673 3.443619 53.14642 
1 1 1    9   38    2 f  191.459   23.847   29.332   6.8370   34.842   9.7191   23.934   9.6198  205.666   31.908  167.236   38.392 38.43086 49.92074 
1 1 1    9   38    3 o  294.609   13.458   67.091   6.0688   72.097   7.7250   59.020   9.8086  304.169   16.656  272.546   23.750 31.62350 29.00809 
1 1 1    9   38    4 o  210.405   17.470   34.679   5.5754   35.802   6.7559   32.282   9.8726  212.732   21.023  196.865   33.993 15.86647 39.96840 
1 1 1    9   38    5 o  190.929   19.580   28.773   5.6411   32.639   7.1039   22.174   9.2813  202.229   23.381  160.845   38.257 41.38425 44.83592 
1 1 1    9   38    6 o  202.394   17.554   32.119   5.3841   33.328   6.7175   29.948   9.0034  204.914   21.750  190.222   32.063 14.69200 38.74403 
1 1 1    9   38    7 o  364.004   12.385  102.287   6.9003  102.137   8.4502  102.586   11.954  362.941   15.211  360.700   21.755 2.241669 26.54506 
1 1 1    9   38    8 o  346.461   16.113   93.236   8.5449   96.751   12.346   90.003   11.839  349.488   23.211  337.091   23.084 12.39633 32.73562 
1 1 1    9   38    9 o  474.836   14.094  174.552   10.243  194.914   15.451  158.585   13.682  498.747   20.240  450.067   19.861 48.67929 28.35713 
1 1 1    9   38   10 o  257.946   20.271   52.453   7.9389   51.030   11.454   53.768   11.014  249.866   30.587  257.661   28.398 -7.795868 41.73744 
1 1 1    9   38   11 o  482.418   20.467  182.585   15.113  182.585   15.113   0.0000   0.0000  482.418   20.467  ?   ?  0.000000 20.46720 
1 1 1    9   38   12 o  309.366   25.627   76.629   12.026   76.629   12.026   0.0000   0.0000  309.366   25.627  ?   ?  0.000000 25.62748 
1 1 1    9   38   13 o  223.862   24.342   40.170   8.2063   35.265   11.331   45.580   11.901  203.339   37.799  233.766   34.278 -30.42735 51.02674 
1 1 1    9   38   14 o  161.219   30.902   21.674   7.3480   16.141   10.804   26.437   10.023  136.906   44.771  175.035   38.462 -38.12860 59.02331 
1 1 1    9   38   15 o   79.623   33.782   1.1210   7.1538  -0.2262   10.049   2.5054   10.186   89.027   38.907   95.629   40.427 -6.601776 56.10824 
1 1 1    9   38   16 o   69.050   31.453  -3.6464   7.3246   6.2465   10.518 -12.9598   10.206  105.914   42.518   69.082   33.182 36.83202 53.93370 
1 1 1    9   38   17 o  427.458   12.370  141.272   8.0932  138.773   9.8565  146.444   14.179  422.552   15.240  430.817   21.502 -8.264984 26.35527 
1 1 1    9   38   18 o  134.446   30.873   15.256   6.2192   10.050   7.4279   27.463   11.374  110.947   37.156  175.676   42.714 -64.72821 56.61335 
1 1 1    9   38   19 o  195.253   22.501   30.571   6.6017   35.160   7.9354   20.254   11.897  208.318   25.414  149.777   46.775 58.54178 53.23336 
1 1 1    9   38   20 o  220.011   20.552   38.486   6.8408   50.959   8.2812   11.689   12.138  252.939   21.597  123.379   46.756 129.5602 51.50263 
1 1 1    9   38   21 o  467.224   12.438  169.020   8.8947  166.969   10.563  174.020   16.491  463.217   14.898  467.557   23.043 -4.340424 27.43933 
1 1 1    9   38   22 o  177.156   47.995   29.364   13.337   0.0000   0.0000   29.364   13.337  ?   ?   177.156   47.995 0.000000 47.99460 
1 1 1    9   38   23 o  279.595   17.640   61.573   7.5104   58.090   8.8832   70.305   14.064  269.582   21.712  289.673   32.267 -20.09097 38.89223 
1 1 1    9   38   24 o  138.009   37.464   16.894   8.1171   11.877   10.526   24.254   12.750  120.009   43.910  159.934   48.141 -39.92461 65.15888 
1 1 1    9   38   25 o  399.651   25.812  129.974   15.705   0.0000   0.0000  129.974   15.705  ?   ?   399.651   25.812 0.000000 25.81225 
1 1 1    9   38   26 o  188.382   31.183   30.211   8.6770   20.715   11.379   43.406   13.413  148.074   45.663  218.752   41.579 -70.67761 61.75694 
1 1 1    9   38   28 o   99.478   33.206   8.2980   5.9324   12.175   8.4130   4.4637   8.3665  117.354   39.542   91.642   37.503 25.71247 54.49806 
1 1 1    9   38   29 o  383.865   12.850  114.772   7.5501  122.547   10.948  107.720   10.426  393.228   18.189  367.997   18.571 25.23187 25.99426 
1 1 1    9   38   30 o   73.939   31.211   1.6250   6.0573 -13.1229   8.4307   17.361   8.7085   58.802   28.690  136.466   39.458 -77.66389 48.78538 
1 1 1    9   38   31 o  305.591   15.400   73.719   7.1803   76.154   10.202   71.328   10.108  305.896   21.935  295.532   22.514 10.36325 31.43302 
1 1 1    9   38   32 o  241.419   21.140   47.528   7.7328   46.172   9.6142   50.013   13.014  233.158   27.466  233.243   37.741 -0.8465576E-01 46.67789 
1 1 1    9   38   33 o  175.345   27.807   26.516   7.2141   28.502   8.9902   22.927   12.089  176.863   34.448  147.416   47.290 29.44653 58.50705 
1 1 1    9   38   34 f   88.858   32.760   6.4034   5.8748   5.2163   8.9644   7.2970   7.7779   92.215   38.381   95.713   37.131 -3.498581 53.40255 
1 1 1    9   38   35 o   58.024   26.935  -3.4400   5.7345   6.1607   8.5027 -11.4508   7.7668   93.123   37.923   56.370   27.511 36.75298 46.85086 
1 1 1    9   38   36 f   69.390   30.731  -0.0281   6.4651  -3.6079   8.2813   5.5585   10.345   69.908   32.421   95.020   40.478 -25.11180 51.86176 
1 1 1    9   39    0 o   90.371   48.769   9.7033   9.3843   9.7033   9.3843   9.7033   9.3843   90.371   48.769   90.371   48.769 0.000000 0.000000 
1 1 1    9   39    1 o  177.534   25.084   25.461   6.6264   27.783   9.2144   22.974   9.5361  181.749   34.382  163.140   38.762 18.60898 51.81345 
1 1 1    9   39    2 o  124.414   28.045   12.853   5.2129   13.882   6.5900   11.134   8.5209  128.119   33.299  117.317   39.794 10.80235 51.88771 
1 1 1    9   39    3 o  224.890   16.777   39.569   5.7335   38.010   7.1483   42.380   9.6005  218.822   21.625  228.513   28.036 -9.691071 35.40734 
1 1 1    9   39    4 o  336.122   13.228   87.380   6.8055   80.493   8.3423  101.080   11.767  321.072   17.036  357.815   21.586 -36.74310 27.49869 
1 1 1    9   39    5 o  186.648   20.749   27.667   5.8275   27.319   7.2157   28.319   9.8821  183.431   26.466  182.392   36.669 1.038345 45.22244 
1 1 1    9   39    6 o  318.650   16.280   79.165   7.9140   79.165   7.9140   0.0000   0.0000  318.650   16.280  ?   ?  0.000000 16.28028 
1 1 1    9   39    7 o  161.019   29.395   21.450   6.9777   21.450   6.9777   0.0000   0.0000  161.019   29.395  ?   ?  0.000000 29.39493 
1 1 1    9   39    8 f  354.943   23.835  100.233   12.874  100.233   12.874   0.0000   0.0000  354.943   23.835  ?   ?  0.000000 23.83517 
1 1 1    9   39    9 o  499.294   21.439  196.326   16.385  196.326   16.385   0.0000   0.0000  499.294   21.439  ?   ?  0.000000 21.43939 
1 1 1    9   39   10 o  333.756   17.032   87.045   8.6720   75.048   12.560   97.975   11.988  304.985   27.190  351.559   22.396 -46.57404 35.22579 
1 1 1    9   39   11 o  296.295   18.852   68.992   8.5055   82.351   12.700   58.126   11.454  320.087   26.149  267.413   28.419 52.67389 38.61880 
1 1 1    9   39   12 o  217.527   24.124   38.001   7.8969   23.021   11.096   53.373   11.241  160.633   43.886  255.603   29.259 -94.96997 52.74499 
1 1 1    9   39   13 o  257.746   20.923   52.640   8.1831   60.865   12.129   45.769   11.086  272.874   29.511  235.163   31.599 37.71066 43.23649 
1 1 1    9   39   14 o  106.400   37.202   8.8833   7.4657   2.9938   11.024   13.873   10.147   99.313   42.024  128.065   43.424 -28.75116 60.42931 
1 1 1    9   39   15 o  100.625   36.697   7.4634   7.3431   5.9604   10.660   8.8205   10.130  105.142   42.593  111.678   42.619 -6.536026 60.25414 
1 1 1    9   39   16 o   77.656   34.026  -0.5782   7.7303   6.3980   11.233  -6.8545   10.654  107.655   43.684   79.154   36.733 28.50027 57.07491 
1 1 1    9   39   17 o  254.566   23.354   51.969   8.9984   59.801   13.735   46.079   11.911  266.453   34.486  233.585   34.339 32.86855 48.66628 
1 1 1    9   39   18 o  167.434   26.344   23.037   6.5283   21.934   7.9060   25.402   11.574  160.212   33.325  166.941   44.490 -6.728394 55.58692 
1 1 1    9   39   19 o  297.323   16.671   69.337   7.5562   73.989   9.2018   59.707   13.240  305.678   19.773  266.495   33.178 39.18378 38.62293 
1 1 1    9   39   20 o  369.618   14.487  106.353   8.1961  103.465   9.7489  113.315   15.137  363.138   17.539  373.283   26.669 -10.14493 31.91931 
1 1 1    9   39   21 o  402.727   16.499  126.998   10.170  113.127   13.171  147.480   16.005  375.487   23.028  427.555   24.559 -52.06808 33.66710 
1 1 1    9   39   22 o  303.517   31.102   77.128   14.245   0.0000   0.0000   77.128   14.245  ?   ?   303.517   31.102 0.000000 31.10194 
1 1 1    9   39   23 o   81.894   36.138  -0.4560   8.8611   9.5622   13.051  -9.0229   12.069  116.982   47.220   80.592   37.945 36.39002 60.57684 
1 1 1    9   39   24 o   92.501   35.099   6.0434   6.8458  -2.6545   8.3174   24.310   12.054   74.770   33.845  159.207   46.533 -84.43732 57.53994 
1 1 1    9   39   25 o  112.071   36.130   10.942   7.0499   9.0119   8.4111   15.501   12.926  106.171   39.189  130.913   48.530 -24.74236 62.37681 
1 1 1    9   39   26 f   86.684   34.618   4.4031   6.9331   3.8491   8.3069   5.6752   12.587   89.667   37.103  106.067   44.894 -16.40071 58.24176 
1 1 1    9   39   27 o  274.947   19.300   60.467   8.0708   72.856   9.8815   35.642   13.988  300.283   21.644  189.833   48.087 110.4496 52.73373 
1 1 1    9   39   29 o  115.982   33.086   12.084   6.1618   17.436   8.9556   7.2723   8.4912  135.309   40.261   98.788   38.664 36.52050 55.81995 
1 1 1    9   39   30 o  303.953   15.729   73.212   7.2929   76.809   10.453   69.801   10.180  306.000   22.474  291.161   23.031 14.83948 32.17939 
1 1 1    9   39   31 o  157.382   31.041   22.026   7.2118   24.285   9.1428   18.306   11.733  160.149   37.890  133.201   46.635 26.94766 60.08669 
1 1 1    9   39   32 o  284.909   15.904   64.649   6.9077   80.983   10.497   52.171   9.1742  313.524   22.013  249.404   24.343 64.11960 32.81965 
1 1 1    9   39   33 o  149.558   27.790   19.600   6.1274   26.563   9.5388   14.708   7.9951  165.811   38.349  122.822   38.342 42.98881 54.22876 
1 1 1    9   40    2 o  188.231   40.072   30.814   11.191   30.814   11.191   0.0000   0.0000  188.231   40.072  ?   ?  0.000000 40.07222 
1 1 1    9   40    3 o   83.714   37.378  -2.2240   9.7634  -2.2240   9.7634   0.0000   0.0000   83.714   37.378  ?   ?  0.000000 37.37807 
1 1 1    9   40    4 o  331.152   13.917   84.990   7.0540   89.784   8.7268   75.952   11.981  339.395   16.799  307.523   25.690 31.87241 30.69464 
1 1 1    9   40    5 o  163.755   23.936   21.687   5.8224   16.073   7.1175   33.044   10.123  137.219   34.049  197.837   34.695 -60.61713 48.61157 
1 1 1    9   40    6 o   76.791   31.115   2.4899   5.6901   2.4099   7.0369   2.6409   9.6715   82.698   34.178   93.896   39.527 -11.19775 52.25416 
1 1 1    9   40    7 o  116.944   31.361   11.546   5.7290   9.0063   6.9027   17.167   10.270  105.980   35.817  139.820   43.426 -33.83929 56.29071 
1 1 1    9   40    8 o  321.132   18.305   80.969   8.9603   67.283   13.123   92.921   12.264  286.315   30.411  341.291   23.622 -54.97592 38.50751 
1 1 1    9   40    9 o  440.942   15.439  151.255   10.420  163.950   15.830  141.550   13.841  454.202   22.843  422.889   21.454 31.31271 31.33801 
1 1 1    9   40   10 o  345.169   17.529   93.375   9.2309   85.589   13.589  100.045   12.578  324.850   27.591  354.157   23.335 -29.30753 36.13504 
1 1 1    9   40   11 o  207.377   26.540   35.036   8.2309   26.183   12.079   42.710   11.246  169.638   45.556  225.437   33.620 -55.79919 56.61861 
1 1 1    9   40   12 o  145.729   36.693   18.483   8.1794   14.127   11.836   22.465   11.316  129.960   46.705  157.400   44.816 -27.44026 64.72932 
1 1 1    9   40   13 o  407.393   16.702  129.657   10.415  142.115   15.848  120.186   13.818  420.834   24.712  387.848   23.385 32.98633 34.02308 
1 1 1    9   40   14 o  243.032   24.100   47.602   8.8469   51.858   13.684   44.545   11.596  245.468   37.620  229.497   34.045 15.97089 50.73732 
1 1 1    9   40   15 o  234.043   25.047   44.405   8.8336   42.832   12.939   45.778   12.089  221.022   39.707  231.704   35.194 -10.68184 53.05915 
1 1 1    9   40   16 o  217.690   38.439   41.373   12.340   0.0000   0.0000   41.373   12.340  ?   ?   217.690   38.439 0.000000 38.43865 
1 1 1    9   40   17 o  182.530   44.644   30.691   12.370   0.0000   0.0000   30.691   12.370  ?   ?   182.530   44.644 0.000000 44.64409 
1 1 1    9   40   18 f   57.104   28.807 -34.8323   11.830   0.0000   0.0000 -34.8323   11.830  ?   ?    57.104   28.807 0.000000 28.80656 
1 1 1    9   40   19 o  194.321   24.390   30.831   7.0945   31.968   8.5516   28.319   12.706  195.205   29.545  172.745   46.865 22.45927 55.40095 
1 1 1    9   40   20 o  299.160   21.863   71.861   9.9416   66.399   13.878   77.617   14.248  279.323   33.105  303.973   31.060 -24.64987 45.39457 
1 1 1    9   40   21 o  140.242   39.224   17.866   8.7493   22.635   12.079   12.602   12.690  153.636   46.993  123.545   47.568 30.09126 66.86562 
1 1 1    9   40   22 o  265.001   19.353   55.997   7.7955   61.390   9.3113   43.359   14.255  275.783   22.248  215.253   44.726 60.52988 49.95345 
1 1 1    9   40   23 f  171.963   29.008   25.070   7.3635   34.273   8.8883   4.9317   13.148  201.125   29.772  106.075   45.421 95.05038 54.30865 
1 1 1    9   40   24 o  297.224   18.189   70.239   8.2349   77.058   10.152   57.119   14.081  309.037   21.598  253.311   37.446 55.72520 43.22781 
1 1 1    9   40   25 o  151.528   32.965   20.304   7.4282   22.788   9.2034   15.661   12.582  157.122   38.557  129.245   47.885 27.87656 61.47868 
1 1 1    9   40   26 o  170.960   29.826   25.253   7.5210   29.364   9.2461   17.214   12.930  181.271   34.586  132.551   48.642 48.72006 59.68418 
1 1 1    9   40   27 o  383.150   15.072  115.623   8.8389  122.306   11.109  104.092   14.592  391.226   18.551  351.582   27.331 39.64389 33.03196 
1 1 1    9   40   28 o   94.109   35.562   6.9930   7.0092   5.3758   8.9100   9.6186   11.353   93.514   38.535  109.342   44.074 -15.82792 58.54474 
1 1 1    9   40   29 o  366.149   20.105  108.792   11.224  108.792   11.224   0.0000   0.0000  366.149   20.105  ?   ?  0.000000 20.10477 
1 1 1    9   40   30 o   77.591   31.660   3.3368   5.9412   0.1791   8.7533   6.0340   8.0900   79.751   35.516   92.421   37.222 -12.67073 51.44773 
1 1 1    9   40   31 o   79.095   33.079   3.0315   6.7041   3.4662   8.4754   2.3049   10.958   86.013   36.640   90.459   40.038 -4.445831 54.27289 
1 1 1    9   41    0 o  188.380   43.270   32.479   10.864   32.479   10.864   32.479   10.864  188.380   43.270  188.380   43.270 0.000000 0.000000 
1 1 1    9   41    1 o  225.966   22.282   40.823   7.6063   26.767   10.775   54.785   10.739  173.706   41.157  259.371   27.468 -85.66437 49.48158 
1 1 1    9   41    2 o  280.427   15.835   61.460   6.7690   64.000   8.6238   57.382   10.925  284.483   19.931  265.608   27.258 18.87488 33.76751 
1 1 1    9   41    3 f   60.264   27.424  -2.8371   5.5508 -12.7315   6.9335   14.823   9.2632   52.206   25.588  130.497   41.347 -78.29059 48.62378 
1 1 1    9   41    4 o  123.114   30.624   12.850   5.7470   20.021   7.2912   1.0852   9.3387  153.658   32.039   88.461   38.088 65.19627 49.77119 
1 1 1    9   41    5 o  264.172   16.378   54.663   6.5899   49.849   8.0760   64.253   11.400  250.250   21.286  281.316   26.799 -31.06607 34.22383 
1 1 1    9   41    6 o  258.618   16.933   52.490   6.6658   52.414   8.1773   52.639   11.508  256.741   20.992  252.263   30.418 4.477554 36.95829 
1 1 1    9   41    7 o  283.661   16.124   62.979   6.9717   66.357   8.5571   56.310   12.024  289.770   19.405  260.712   30.720 29.05774 36.33591 
1 1 1    9   41    8 o  253.971   17.132   50.687   6.6207   57.484   8.1894   37.863   11.249  269.285   20.012  209.904   36.327 59.38191 41.47460 
1 1 1    9   41    9 o  336.508   24.986   91.302   12.778   0.0000   0.0000   91.302   12.778  ?   ?   336.508   24.986 0.000000 24.98611 
1 1 1    9   41   10 o  187.576   38.596   30.898   10.712   0.0000   0.0000   30.898   10.712  ?   ?   187.576   38.596 0.000000 38.59647 
1 1 1    9   41   11 o  184.717   40.647   30.446   11.180   0.0000   0.0000   30.446   11.180  ?   ?   184.717   40.647 0.000000 40.64706 
1 1 1    9   41   12 o  223.900   35.837   43.133   11.867   0.0000   0.0000   43.133   11.867  ?   ?   223.900   35.837 0.000000 35.83684 
1 1 1    9   41   13 o   93.764   40.589   1.5557   10.721   0.0000   0.0000   1.5557   10.721  ?   ?    93.764   40.589 0.000000 40.58892 
1 1 1    9   41   14 o  363.507   18.085  104.013   10.062   80.554   13.956  129.409   14.521  311.642   29.614  400.840   23.774 -89.19724 37.97622 
1 1 1    9   41   15 f  105.833   38.305   8.9006   7.9791   9.7881   11.225   7.9942   11.344  114.565   44.561  110.082   44.168 4.483238 62.74154 
1 1 1    9   41   16 o   79.789   34.831   0.1436   8.0335  -4.6249   11.191   5.2140   11.540   83.627   38.388  103.659   43.379 -20.03117 57.92560 
1 1 1    9   41   17 o   72.610   33.196  -3.6632   8.2536  -6.1806   11.272  -0.7539   12.118   81.396   37.777   93.276   41.645 -11.87936 56.22641 
1 1 1    9   41   18 o  183.063   33.324   29.006   8.9934   40.347   12.890   18.249   12.554  210.486   41.485  139.252   48.267 71.23306 63.64466 
1 1 1    9   41   19 o  100.863   38.850   7.3523   8.4678   10.814   11.593   3.3929   12.398  116.868   45.333  101.407   43.773 15.46156 63.01728 
1 1 1    9   41   21 o  140.201   33.536   17.421   7.1000   11.671   8.4586   31.134   13.063  115.103   39.635  178.118   47.167 -63.01462 61.60924 
1 1 1    9   41   22 o   65.543   30.091  -3.4162   6.8802  -7.8481   8.1859   7.2488   12.698   64.514   30.634  108.603   45.482 -44.08933 54.83646 
1 1 1    9   41   23 o  104.972   36.126   9.5550   7.0266   14.420   8.6255  -0.0434   12.115  124.404   39.949   92.370   41.412 32.03415 57.54025 
1 1 1    9   41   24 o  356.618   16.033  100.490   8.7517  104.434   10.885   93.278   14.719  360.107   19.824  330.659   29.389 29.44781 35.45007 
1 1 1    9   41   25 o  125.057   37.030   14.619   7.5896   13.137   9.3947   17.402   12.878  118.327   41.707  131.279   48.483 -12.95238 63.95421 
1 1 1    9   41   26 o  260.755   25.508   57.119   10.050   57.119   10.050   0.0000   0.0000  260.755   25.508  ?   ?  0.000000 25.50766 
1 1 1    9   41   27 o  190.294   33.788   32.813   9.4809   32.813   9.4809   0.0000   0.0000  190.294   33.788  ?   ?  0.000000 33.78782 
1 1 1    9   41   28 o  285.554   18.343   65.803   7.9747   65.417   10.206   66.408   12.779  279.599   24.082  274.359   30.973 5.240234 39.23348 
1 1 1    9   42    0 o  140.902   54.825   22.503   11.271   22.503   11.271   22.503   11.271  140.902   54.825  140.902   54.825 0.000000 0.000000 
1 1 1    9   42    1 o  189.023   27.248   29.490   7.6558   16.931   10.886   41.778   10.769  137.063   44.946  222.374   32.606 -85.31052 55.52792 
1 1 1    9   42    2 o   61.884   28.965  -5.7262   6.8562 -19.5102   9.8808   7.0738   9.5216   60.041   29.644  103.919   40.861 -43.87778 50.48147 
1 1 1    9   42    3 o  144.564   33.513   18.077   7.2710   13.892   10.132   22.522   10.441  126.410   43.387  157.255   42.407 -30.84537 60.66914 
1 1 1    9   42    4 o  370.546   16.146  107.378   9.1578  119.245   12.956   95.528   12.947  386.418   21.995  343.814   24.767 42.60419 33.12420 
1 1 1    9   42    5 o  213.973   19.845   36.482   6.4256   31.487   8.0315   45.364   10.710  195.069   27.675  232.770   30.820 -37.70132 41.42181 
1 1 1    9   42    6 o  189.988   22.806   29.203   6.4995   29.470   8.0306   28.696   11.066  187.963   28.833  178.159   41.373 9.803757 50.42918 
1 1 1    9   42    7 o  405.208   12.831  127.454   7.9583  133.943   9.9679  116.045   13.217  413.931   15.733  380.319   22.810 33.61212 27.70934 
1 1 1    9   42    8 o  301.487   15.387   71.183   7.0769   69.020   8.7360   75.312   12.070  294.859   19.466  303.729   26.220 -8.870148 32.65625 
1 1 1    9   42    9 o  119.429   38.351   12.445   7.9491   7.3382   11.845   16.630   10.722  109.695   44.726  135.206   44.619 -25.51129 63.17672 
1 1 1    9   42   10 o  172.936   31.195   25.460   7.9536   14.052   11.185   37.129   11.312  126.859   45.423  205.589   37.323 -78.73043 58.78965 
1 1 1    9   42   11 o  331.123   18.681   86.841   9.4296   84.516   13.194   89.269   13.481  320.756   27.129  329.857   26.936 -9.101013 38.23033 
1 1 1    9   42   12 o  344.162   18.411   93.755   9.6633   94.869   13.464   92.572   13.877  340.677   26.018  335.477   27.260 5.200012 37.68344 
1 1 1    9   42   13 o  249.590   22.977   50.419   8.6794   62.531   12.284   38.343   12.266  273.301   29.849  206.201   40.307 67.09990 50.15585 
1 1 1    9   42   14 o  142.757   37.048   18.289   8.1656   21.308   11.562   15.284   11.534  149.582   46.012  130.005   46.171 19.57700 65.18338 
1 1 1    9   42   15 o  258.677   21.867   53.969   8.5768   47.321   12.198   60.469   12.062  232.975   35.312  268.207   29.892 -35.23251 46.26514 
1 1 1    9   42   16 o  114.760   38.736   11.531   8.0736   6.6766   10.937   17.346   11.969  104.554   42.843  135.632   47.122 -31.07848 63.68659 
1 1 1    9   42   17 o  225.163   27.058   42.266   9.1387   52.620   12.678   31.068   13.185  245.457   34.713  177.764   47.537 67.69260 58.86163 
1 1 1    9   42   18 o  246.987   24.725   50.246   9.2216   40.733   12.545   61.429   13.602  210.350   40.431  265.143   34.322 -54.79231 53.03459 
1 1 1    9   42   19 o   89.721   37.637   3.6587   8.7193   3.2498   12.061   4.1063   12.620   98.570   42.860  101.681   44.027 -3.111877 61.44359 
1 1 1    9   42   20 f   77.041   34.584  -1.3019   8.4786 -13.2986   11.900   11.068   12.083   73.259   35.351  115.550   45.841 -42.29030 57.88834 
1 1 1    9   42   21 o  151.456   32.425   20.437   7.2899   18.608   8.7125   24.705   13.312  140.169   39.120  153.265   49.673 -13.09555 63.22752 
1 1 1    9   42   22 o  129.942   35.273   15.578   7.1955   11.895   8.7092   23.501   12.772  113.877   40.155  149.527   48.667 -35.64994 63.09433 
1 1 1    9   42   23 o  214.810   23.584   38.357   7.6268   41.317   9.4014   32.658   13.044  219.012   28.739  177.652   47.176 41.36050 55.24032 
1 1 1    9   42   24 o   54.610   26.946 -14.9549   8.1228 -14.9549   8.1228   0.0000   0.0000   54.610   26.946  ?   ?  0.000000 26.94644 
1 1 1    9   42   25 o  124.102   39.373   14.962   8.3977   14.962   8.3977   0.0000   0.0000  124.102   39.373  ?   ?  0.000000 39.37288 
1 1 1    9   43    0 o  234.959   33.820   46.776   11.431   46.776   11.431   46.776   11.431  234.959   33.820  234.959   33.820 0.000000 0.000000 
1 1 1    9   43    1 o  252.144   17.308   50.221   6.6395   49.505   8.3141   51.481   11.031  247.911   22.143  248.139   29.631 -0.2280121 36.99058 
1 1 1    9   43    2 o  354.062   14.030   97.695   7.6032   93.183   9.4894  105.786   12.707  343.301   18.123  362.338   23.031 -19.03754 29.30645 
1 1 1    9   43    3 o  128.957   30.703   14.329   5.9733   17.850   7.7050   9.0238   9.4564  142.011   35.534  108.700   41.251 33.31179 54.44505 
1 1 1    9   43    4 o  129.076   30.955   14.381   6.0369   25.472   7.6282  -4.2051   9.8753  173.488   29.800   78.912   36.163 94.57593 46.85985 
1 1 1    9   43    5 o  152.886   26.948   19.558   6.0756   23.304   7.7828   13.713   9.7216  164.544   32.054  124.345   42.503 40.19931 53.23532 
1 1 1    9   43    6 f   83.883   32.497   4.4532   5.9514   3.8179   7.3538   5.6592   10.132   86.771   35.294  100.628   41.235 -13.85735 54.27723 
1 1 1    9   43    7 o  272.329   16.389   58.420   6.7995   56.516   8.3547   62.154   11.702  265.605   20.714  273.449   28.371 -7.843689 35.12792 
1 1 1    9   43    8 o  193.515   22.528   30.419   6.5480   34.867   7.9511   21.044   11.543  205.550   25.843  148.568   46.020 56.98186 52.78022 
1 1 1    9   43    9 o  140.257   36.008   17.591   7.7698   16.546   11.066   18.607   10.912  133.552   45.349  140.523   44.912 -6.971390 63.82551 
1 1 1    9   43   10 o  121.561   37.301   13.207   7.6035   12.903   10.799   13.506   10.708  121.660   44.482  123.445   44.417 -1.785172 62.86126 
1 1 1    9   43   11 o  242.964   23.123   48.039   8.4956   48.677   11.715   47.331   12.338  237.527   33.125  231.989   35.906 5.538315 48.85180 
1 1 1    9   43   12 o  187.596   29.675   29.968   8.2374   35.322   11.332   23.971   11.995  197.277   38.912  156.479   46.602 40.79791 60.71138 
1 1 1    9   43   13 o  222.661   25.973   41.180   8.6855   36.442   11.435   47.641   13.353  200.205   38.716  228.783   39.564 -28.57861 55.35529 
1 1 1    9   43   14 o   82.705   35.262   2.0561   7.8624   6.1100   10.338  -3.5049   12.108  100.669   41.499   87.160   39.980 13.50865 57.62483 
1 1 1    9   43   15 o   62.419   29.815  -8.5248   7.9916 -18.7102   10.538   5.2639   12.261   62.579   30.843  102.995   43.976 -40.41615 53.71360 
1 1 1    9   43   16 o   93.597   38.004   5.4478   8.5082   15.557   12.051  -4.6004   12.014  127.607   46.939   84.630   39.179 42.97669 61.14135 
1 1 1    9   43   17 o  359.029   19.437  103.594   10.641  100.798   14.745  106.633   15.374  345.310   28.141  354.716   28.558 -9.406128 40.09334 
1 1 1    9   43   18 o  175.988   35.095   28.081   9.1220   27.896   12.377   28.301   13.496  165.148   46.817  163.616   49.593 1.532257 68.20042 
1 1 1    9   43   19 o  283.198   22.813   65.997   9.8050   54.851   13.329   79.142   14.475  245.259   36.628  300.621   31.947 -55.36189 48.60231 
1 1 1    9   43   20 o  196.886   30.418   33.932   8.8712   19.708   12.129   50.296   13.009  137.550   47.456  233.027   37.765 -95.47688 60.64874 
1 1 1    9   43   21 o  266.971   33.658   63.858   13.448   63.858   13.448   0.0000   0.0000  266.971   33.658  ?   ?  0.000000 33.65838 
1 1 1    9   43   22 o  225.354   27.091   43.449   9.1573   43.449   9.1573   0.0000   0.0000  225.354   27.091  ?   ?  0.000000 27.09097 
1 1 1    9   44    0 o   49.775   34.970  -9.5622   10.264  -9.5622   10.264  -9.5622   10.264   49.775   34.970   49.775   34.970 0.000000 0.000000 
1 1 1    9   44    1 o  245.982   18.046   48.165   6.7470   50.847   8.5114   43.632   11.068  250.174   22.467  224.178   33.264 25.99571 40.14003 
1 1 1    9   44    2 o  202.404   21.240   33.189   6.4821   36.721   8.0912   26.861   10.831  210.447   25.650  168.913   42.055 41.53456 49.25938 
1 1 1    9   44    3 o  145.780   29.284   18.269   6.3074   17.528   8.1751   19.360   9.9145  138.439   37.605  142.991   42.319 -4.552017 56.61328 
1 1 1    9   44    4 o  102.118   33.626   8.9304   6.0909   4.9610   7.4633   16.847   10.540   89.860   35.906  133.327   44.250 -43.46613 56.98494 
1 1 1    9   44    5 o  107.888   33.920   10.198   6.2446   3.4206   7.7454   22.785   10.555   86.123   35.747  154.315   43.056 -68.19205 55.96108 
1 1 1    9   44    6 o  214.795   20.126   37.194   6.5398   42.653   8.1695   27.454   10.912  227.943   23.765  170.271   42.105 57.67221 48.34909 
1 1 1    9   44    7 o   57.867   27.251  -5.5181   6.2316  -6.9516   7.5427  -2.4357   11.060   62.619   29.639   85.248   38.762 -22.62898 48.79446 
1 1 1    9   44    8 o  341.498   14.585   91.459   7.6238   94.039   9.2808   86.107   13.369  343.930   17.690  320.756   27.495 23.17413 32.69443 
1 1 1    9   44    9 o  169.223   25.967   24.067   6.5111   32.653   8.0867   8.2408   10.979  196.462   27.658  107.002   43.268 89.46023 51.35213 
1 1 1    9   44   10 o  203.221   27.565   34.939   8.3530   47.463   12.242   24.028   11.426  230.274   35.902  155.631   45.255 74.64273 57.76661 
1 1 1    9   44   11 o  127.445   38.122   15.129   8.0135   16.244   11.155   13.939   11.520  129.497   45.463  122.602   45.741 6.895233 64.49142 
1 1 1    9   44   12 o  156.913   36.129   22.569   8.4979   28.988   12.209   16.536   11.836  170.034   45.859  129.941   46.704 40.09230 65.45442 
1 1 1    9   44   13 o  119.583   38.898   13.331   8.1595   11.793   11.292   15.011   11.803  115.742   44.785  125.082   46.373 -9.340714 64.46786 
1 1 1    9   44   14 o   70.605   32.251  -2.7401   7.7681 -14.1927   10.873   9.2017   11.102   67.860   32.991  108.310   43.611 -40.45014 54.68365 
1 1 1    9   44   15 o   98.677   38.032   7.6975   8.1186   13.976   11.247   0.8658   11.732  121.157   45.197   91.604   40.932 29.55309 60.97679 
1 1 1    9   44   16 o  109.661   39.073   10.909   8.2669   0.4790   11.043   24.207   12.469   88.642   39.653  151.351   47.972 -62.70910 62.23861 
1 1 1    9   44   18 o  256.844   34.146   59.444   13.091   59.444   13.091   0.0000   0.0000  256.844   34.146  ?   ?  0.000000 34.14585 
1 1 1    9   45    0 o  286.452   20.737   65.443   8.9827   65.443   8.9827   65.443   8.9827  286.452   20.737  286.452   20.737 0.000000 0.000000 
1 1 1    9   45    1 o  328.238   15.228   84.870   7.6507   88.909   9.5755   77.740   12.723  332.977   18.865  303.454   27.697 29.52322 33.51169 
1 1 1    9   45    2 o  193.062   23.240   30.812   6.7296   35.537   8.4302   22.513   11.173  204.524   27.637  149.988   45.048 54.53534 52.84974 
1 1 1    9   45    3 o  131.877   31.673   15.503   6.3130   15.526   7.8547   15.463   10.610  128.968   37.527  126.611   44.345 2.356430 58.09236 
1 1 1    9   45    4 o  318.833   15.322   80.136   7.4773   82.077   9.4390   76.864   12.252  319.376   19.401  302.515   26.735 16.86118 33.03253 
1 1 1    9   45    5 o  212.892   20.892   36.922   6.7201   35.093   8.4671   40.037   11.046  202.796   28.027  210.653   35.523 -7.857208 45.24824 
1 1 1    9   45    6 o  287.588   16.535   65.739   7.2478   72.627   8.8390   51.604   12.662  300.309   19.332  239.297   35.659 61.01213 40.56205 
1 1 1    9   45    7 o  143.722   30.408   18.215   6.4806   15.525   7.8341   24.047   11.534  128.635   37.491  153.851   45.670 -25.21587 59.08766 
1 1 1    9   45    8 o  335.991   15.231   89.062   7.8328   90.155   9.5676   86.841   13.640  335.041   18.732  319.551   28.175 15.49005 33.83379 
1 1 1    9   45    9 o  167.633   27.513   24.115   6.8143   29.523   8.3641   13.440   11.751  183.378   30.897  119.891   45.868 63.48721 55.30387 
1 1 1    9   45   10 o  140.766   36.393   18.515   7.8989   8.9711   11.216   27.905   11.125  107.420   43.629  167.874   43.082 -60.45348 61.31555 
1 1 1    9   45   11 o  310.547   20.021   78.160   9.4659   89.429   14.221   69.194   12.684  322.600   29.113  282.904   29.738 39.69687 41.61629 
1 1 1    9   45   12 o  238.204   24.229   47.347   8.7111   49.364   12.462   45.420   12.182  232.214   36.244  221.654   37.225 10.56029 51.95570 
1 1 1   10    0    2 o  653.307   10.754  327.053   10.747  327.053   10.747  327.053   10.747  653.307   10.754  653.307   10.754 0.000000 0.000000 
1 1 1   10    0    3 o  371.231   9.0720  105.692   5.1479  105.692   5.1479  105.692   5.1479  371.231   9.0720  371.231   9.0720 0.000000 0.000000 
1 1 1   10    0    4 o   74.890   15.406   4.8018   1.5600   4.8018   1.5600   4.8018   1.5600   74.890   15.406   74.890   15.406 0.000000 0.000000 
1 1 1   10    0    5 o   72.454   16.160   4.5712   1.5656   4.5712   1.5656   4.5712   1.5656   72.454   16.160   72.454   16.160 0.000000 0.000000 
1 1 1   10    0    6 o  307.549   6.3640   72.494   2.9929   72.494   2.9929   72.494   2.9929  307.549   6.3640  307.549   6.3640 0.000000 0.000000 
1 1 1   10    0    7 o  987.376   8.0723  746.483   12.198  746.483   12.198  746.483   12.198  987.376   8.0723  987.376   8.0723 0.000000 0.000000 
1 1 1   10    0    8 o  521.568   5.7236  208.298   4.5681  208.298   4.5681  208.298   4.5681  521.568   5.7236  521.568   5.7236 0.000000 0.000000 
1 1 1   10    0    9 o  246.475   4.8796   46.553   1.8393   46.553   1.8393   46.553   1.8393  246.475   4.8796  246.475   4.8796 0.000000 0.000000 
1 1 1   10    0   10 o   93.909   8.9185   6.9327   1.2554   6.9327   1.2554   6.9327   1.2554   93.909   8.9185   93.909   8.9185 0.000000 0.000000 
1 1 1   10    0   11 o  813.647   7.2514  506.909   9.0293  506.909   9.0293  506.909   9.0293  813.647   7.2514  813.647   7.2514 0.000000 0.000000 
1 1 1   10    0   12 f  1053.10   8.7173  849.241   14.049  849.241   14.049  849.241   14.049  1053.10   8.7173  1053.10   8.7173 0.000000 0.000000 
1 1 1   10    0   13 o  318.895   7.7872   77.990   3.7959   77.990   3.7959   77.990   3.7959  318.895   7.7872  318.895   7.7872 0.000000 0.000000 
1 1 1   10    0   14 o  147.423   7.9641   16.783   1.7851   16.783   1.7851   16.783   1.7851  147.423   7.9641  147.423   7.9641 0.000000 0.000000 
1 1 1   10    0   15 o   83.114   16.429   5.8710   1.8580   5.8710   1.8580   5.8710   1.8580   83.114   16.429   83.114   16.429 0.000000 0.000000 
1 1 1   10    0   16 o  1882.94   13.960  2716.07   40.229  2716.07   40.229  2716.07   40.229  1882.94   13.960  1882.94   13.960 0.000000 0.000000 
1 1 1   10    0   17 o  252.251   7.2969   48.829   2.8120   48.829   2.8120   48.829   2.8120  252.251   7.2969  252.251   7.2969 0.000000 0.000000 
1 1 1   10    0   18 o  182.466   9.1419   25.679   2.5386   25.679   2.5386   25.679   2.5386  182.466   9.1419  182.466   9.1419 0.000000 0.000000 
1 1 1   10    0   19 o  582.438   6.9599  259.772   6.2028  259.772   6.2028  259.772   6.2028  582.438   6.9599  582.438   6.9599 0.000000 0.000000 
1 1 1   10    0   20 f  401.903   6.1360  123.718   3.7727  123.718   3.7727  123.718   3.7727  401.903   6.1360  401.903   6.1360 0.000000 0.000000 
1 1 1   10    0   21 o  217.536   8.0065   36.370   2.6577   36.370   2.6577   36.370   2.6577  217.536   8.0065  217.536   8.0065 0.000000 0.000000 
1 1 1   10    0   22 o  102.543   16.415   8.6464   2.3784   8.6464   2.3784   8.6464   2.3784  102.543   16.415  102.543   16.415 0.000000 0.000000 
1 1 1   10    0   23 f  164.567   10.905   21.005   2.7191   21.005   2.7191   21.005   2.7191  164.567   10.905  164.567   10.905 0.000000 0.000000 
1 1 1   10    0   24 o  504.027   7.5914  194.585   5.8536  194.585   5.8536  194.585   5.8536  504.027   7.5914  504.027   7.5914 0.000000 0.000000 
1 1 1   10    0   25 o  875.019   7.3690  586.182   9.8679  586.182   9.8679  586.182   9.8679  875.019   7.3690  875.019   7.3690 0.000000 0.000000 
1 1 1   10    0   26 o  638.262   8.0504  311.981   7.8619  311.981   7.8619  311.981   7.8619  638.262   8.0504  638.262   8.0504 0.000000 0.000000 
1 1 1   10    0   27 o  768.831   8.4414  452.642   9.9311  452.642   9.9311  452.642   9.9311  768.831   8.4414  768.831   8.4414 0.000000 0.000000 
1 1 1   10    0   28 o  825.573   7.5350  521.846   9.5198  521.846   9.5198  521.846   9.5198  825.573   7.5350  825.573   7.5350 0.000000 0.000000 
1 1 1   10    0   29 o  734.607   7.4020  413.207   8.3210  413.207   8.3210  413.207   8.3210  734.607   7.4020  734.607   7.4020 0.000000 0.000000 
1 1 1   10    0   30 o  559.363   7.7760  239.652   6.6547  239.652   6.6547  239.652   6.6547  559.363   7.7760  559.363   7.7760 0.000000 0.000000 
1 1 1   10    0   31 o  198.129   20.884   31.084   6.1724   31.084   6.1724   31.084   6.1724  198.129   20.884  198.129   20.884 0.000000 0.000000 
1 1 1   10    0   32 o  1804.28   14.012  2494.05   38.691  2494.05   38.691  2494.05   38.691  1804.28   14.012  1804.28   14.012 0.000000 0.000000 
1 1 1   10    0   33 o  369.197   10.202  104.608   5.7553  104.608   5.7553  104.608   5.7553  369.197   10.202  369.197   10.202 0.000000 0.000000 
1 1 1   10    0   34 o  509.827   8.7613  199.180   6.8324  199.180   6.8324  199.180   6.8324  509.827   8.7613  509.827   8.7613 0.000000 0.000000 
1 1 1   10    0   35 o  620.035   8.3251  294.500   7.8977  294.500   7.8977  294.500   7.8977  620.035   8.3251  620.035   8.3251 0.000000 0.000000 
1 1 1   10    0   36 o   56.649   34.677   2.0783   5.7450   2.0783   5.7450   2.0783   5.7450   56.649   34.677   56.649   34.677 0.000000 0.000000 
1 1 1   10    0   37 o  278.183   12.423   59.649   5.2657   59.649   5.2657   59.649   5.2657  278.183   12.423  278.183   12.423 0.000000 0.000000 
1 1 1   10    0   38 o  279.173   13.909   60.192   5.9099   60.192   5.9099   60.192   5.9099  279.173   13.909  279.173   13.909 0.000000 0.000000 
1 1 1   10    0   39 o  328.484   11.024   82.960   5.5285   82.960   5.5285   82.960   5.5285  328.484   11.024  328.484   11.024 0.000000 0.000000 
1 1 1   10    0   40 f  135.298   26.090   15.564   4.8237   15.564   4.8237   15.564   4.8237  135.298   26.090  135.298   26.090 0.000000 0.000000 
1 1 1   10    0   41 o  464.451   9.1801  165.467   6.5204  165.467   6.5204  165.467   6.5204  464.451   9.1801  464.451   9.1801 0.000000 0.000000 
1 1 1   10    0   42 o  258.474   15.154   51.828   5.9481   51.828   5.9481   51.828   5.9481  258.474   15.154  258.474   15.154 0.000000 0.000000 
1 1 1   10    0   43 o  145.032   23.542   17.443   4.8131   17.443   4.8131   17.443   4.8131  145.032   23.542  145.032   23.542 0.000000 0.000000 
1 1 1   10    0   44 o   54.285   33.098   2.0996   5.1867   2.0996   5.1867   2.0996   5.1867   54.285   33.098   54.285   33.098 0.000000 0.000000 
1 1 1   10    0   45 o   50.071   30.718   1.6599   4.5305   1.6599   4.5305   1.6599   4.5305   50.071   30.718   50.071   30.718 0.000000 0.000000 
1 1 1   10    0   46 o  362.090   10.724  100.868   5.9315  100.868   5.9315  100.868   5.9315  362.090   10.724  362.090   10.724 0.000000 0.000000 
1 1 1   10    0   47 o   41.560   27.752  -1.4999   4.8379  -1.4999   4.8379  -1.4999   4.8379   41.560   27.752   41.560   27.752 0.000000 0.000000 
1 1 1   10    0   48 o  158.522   29.370   21.482   6.4070   21.482   6.4070   21.482   6.4070  158.522   29.370  158.522   29.370 0.000000 0.000000 
1 1 1   10    0   49 o  281.510   13.226   61.383   5.6704   61.383   5.6704   61.383   5.6704  281.510   13.226  281.510   13.226 0.000000 0.000000 
1 1 1   10    0   50 o   39.462   27.089  -3.4039   5.2880  -3.4039   5.2880  -3.4039   5.2880   39.462   27.089   39.462   27.089 0.000000 0.000000 
1 1 1   10    0   51 o  238.555   15.376   44.464   5.5610   44.464   5.5610   44.464   5.5610  238.555   15.376  238.555   15.376 0.000000 0.000000 
1 1 1   10    0   52 o  215.139   16.810   36.450   5.4578   36.450   5.4578   36.450   5.4578  215.139   16.810  215.139   16.810 0.000000 0.000000 
1 1 1   10    0   53 f  121.201   33.330   13.902   5.3468   13.902   5.3468   13.902   5.3468  121.201   33.330  121.201   33.330 0.000000 0.000000 
1 1 1   10    0   54 o  203.576   20.484   33.253   6.2345   33.253   6.2345   33.253   6.2345  203.576   20.484  203.576   20.484 0.000000 0.000000 
1 1 1   10    0   55 o   42.823   29.259  -3.2375   6.0107  -3.2375   6.0107  -3.2375   6.0107   42.823   29.259   42.823   29.259 0.000000 0.000000 
1 1 1   10    0   56 o  236.740   17.182   44.223   6.1507   44.223   6.1507   44.223   6.1507  236.740   17.182  236.740   17.182 0.000000 0.000000 
1 1 1   10    0   57 o  118.169   37.083   14.079   5.8883   14.079   5.8883   14.079   5.8883  118.169   37.083  118.169   37.083 0.000000 0.000000 
1 1 1   10    0   58 o  153.008   34.692   21.512   7.0843   21.512   7.0843   21.512   7.0843  153.008   34.692  153.008   34.692 0.000000 0.000000 
1 1 1   10    0   59 o  136.744   30.510   17.014   5.5783   17.014   5.5783   17.014   5.5783  136.744   30.510  136.744   30.510 0.000000 0.000000 
1 1 1   10    0   60 o   53.510   33.277   2.1580   5.4934   2.1580   5.4934   2.1580   5.4934   53.510   33.277   53.510   33.277 0.000000 0.000000 
1 1 1   10    0   61 o  303.807   15.561   72.706   7.1929   72.706   7.1929   72.706   7.1929  303.807   15.561  303.807   15.561 0.000000 0.000000 
1 1 1   10    0   62 o  170.081   21.255   24.108   5.2995   24.108   5.2995   24.108   5.2995  170.081   21.255  170.081   21.255 0.000000 0.000000 
1 1 1   10    0   63 o   44.927   29.263   0.4076   4.8749   0.4076   4.8749   0.4076   4.8749   44.927   29.263   44.927   29.263 0.000000 0.000000 
1 1 1   10    0   64 o   36.132   25.510  -5.5909   5.6779  -5.5909   5.6779  -5.5909   5.6779   36.132   25.510   36.132   25.510 0.000000 0.000000 
1 1 1   10    1    0 o  663.586   10.615  337.405   10.776  337.405   10.776  337.405   10.776  663.586   10.615  663.586   10.615 0.000000 0.000000 
1 1 1   10    1    1 o  675.762   7.6268  349.638   7.8887  374.581   11.834  329.688   10.583  699.281   11.056  656.067   10.539 43.21332 15.27454 
1 1 1   10    1    2 o  635.805   10.554  309.641   10.271  309.641   10.271   0.0000   0.0000  635.805   10.554  ?   ?  0.000000 10.55367 
1 1 1   10    1    3 o   50.917   18.095   1.7044   1.7719   1.7044   1.7719   0.0000   0.0000   50.917   18.095  ?   ?  0.000000 18.09507 
1 1 1   10    1    4 o  1127.36   8.8852  973.286   15.332  959.041   26.333  980.591   18.858  1118.37   15.383  1131.40   10.889 -13.03052 18.84749 
1 1 1   10    1    5 f  833.992   6.2128  532.480   7.9308  537.402   15.838  530.832   9.1624  837.442   12.356  832.656   7.1891 4.785706 14.29492 
1 1 1   10    1    6 o  541.916   7.0225  224.848   5.8249   0.0000   0.0000  224.848   5.8249  ?   ?   541.916   7.0225 0.000000 7.022451 
1 1 1   10    1    7 o  467.340   4.6853  167.183   3.3515  176.653   4.7772  158.004   4.7032  480.350   6.4974  454.280   6.7640 26.06973 9.379135 
1 1 1   10    1    8 o   41.574   10.945   1.3721   0.7060   0.7882   0.9155   2.2286   1.1089   35.626   12.963   52.923   13.612 -17.29673 18.79700 
1 1 1   10    1    9 o  332.497   3.3685   84.618   1.7143   83.684   2.3925   85.604   2.4577  330.640   4.7274  334.410   4.8016 -3.770233 6.738178 
1 1 1   10    1   10 o  632.609   4.1614  306.326   4.0295  303.833   6.0863  308.271   5.3766  629.960   6.3120  634.573   5.5355 -4.612732 8.395408 
1 1 1   10    1   11 o  269.022   4.6519   55.400   1.9155   55.436   2.4210   55.340   3.1322  269.092   5.8780  268.827   7.6120 0.2652893 9.617380 
1 1 1   10    1   12 o  591.577   3.8833  267.872   3.5162  267.108   4.9557  268.647   4.9899  590.689   5.4812  592.388   5.5032 -1.699158 7.767155 
1 1 1   10    1   13 o  784.467   4.7685  471.070   5.7257  483.374   9.0013  462.708   7.4204  794.523   7.4017  777.413   6.2360 17.10999 9.678469 
1 1 1   10    1   14 o  384.057   3.7629  112.898   2.2120  110.656   3.1052  115.209   3.1518  380.197   5.3360  387.941   5.3079 -7.744598 7.526402 
1 1 1   10    1   15 o  173.404   5.5446   23.018   1.4716   23.826   1.9987   22.063   2.1749  176.400   7.4024  169.735   8.3714 6.664383 11.17482 
1 1 1   10    1   16 o  731.781   4.7040  409.905   5.2689  410.607   7.0123  408.994   7.9848  732.355   6.2556  730.879   7.1375 1.475708 9.490860 
1 1 1   10    1   17 o  869.664   5.1652  578.939   6.8756  573.993   9.0646  585.639   10.551  865.874   6.8395  874.563   7.8817 -8.688354 10.43553 
1 1 1   10    1   18 o  510.500   5.1094  199.485   3.9924  194.962   6.2195  202.656   5.2068  504.610   8.0525  514.508   6.6116 -9.898468 10.41901 
1 1 1   10    1   19 o  618.146   4.9583  292.476   4.6913  286.291   6.5590  298.955   6.7127  611.526   7.0073  624.904   7.0180 -13.37860 9.917425 
1 1 1   10    1   20 o  752.607   4.9434  433.551   5.6946  438.319   8.7855  430.097   7.4784  756.659   7.5857  749.563   6.5182 7.096375 10.00148 
1 1 1   10    1   21 o  358.990   4.8679   98.642   2.6748   95.566   4.0865  100.949   3.5381  353.314   7.5566  363.146   6.3652 -9.831390 9.880174 
1 1 1   10    1   22 o  329.523   4.8043   83.113   2.4232   84.301   3.4932   82.010   3.3643  331.849   6.8773  327.312   6.7152 4.536926 9.612030 
1 1 1   10    1   23 o  755.913   5.1390  437.365   5.9459  435.574   9.1365  438.681   7.8313  754.291   7.9135  757.011   6.7587 -2.719910 10.40690 
1 1 1   10    1   24 o  461.828   5.4135  163.256   3.8267  156.079   5.4319  170.328   5.3919  451.523   7.8597  471.691   7.4682 -20.16818 10.84198 
1 1 1   10    1   25 f  543.025   5.0687  225.705   4.2130  222.568   5.5931  229.820   6.4052  539.208   6.7768  547.902   7.6377 -8.694641 10.21074 
1 1 1   10    1   26 o  981.537   5.9365  737.468   8.9188  740.854   13.702  734.979   11.748  983.649   9.1006  979.804   7.8337 3.845398 12.00784 
1 1 1   10    1   27 o  333.577   5.9697   85.178   3.0480   86.586   4.3899   83.868   4.2353  336.283   8.5286  330.966   8.3605 5.317200 11.94301 
1 1 1   10    1   28 o  1051.54   5.8736  846.439   9.4538  851.547   13.502  841.526   13.241  1054.59   8.3647  1048.37   8.2516 6.217285 11.74975 
1 1 1   10    1   29 o  628.635   5.2211  302.497   5.0238  301.444   7.1930  303.500   7.0196  627.475   7.4893  629.617   7.2840 -2.142273 10.44731 
1 1 1   10    1   30 o  661.715   5.7216  335.190   5.7951  326.001   7.6442  347.608   8.8864  652.517   7.6537  673.754   8.6170 -21.23700 11.52525 
1 1 1   10    1   31 o  452.642   6.8210  156.862   4.7258  160.609   8.1937  154.994   5.7849  457.845   11.692  449.894   8.4008 7.951080 14.39714 
1 1 1   10    1   32 o  782.944   6.0370  469.291   7.2348  468.482   9.5662  470.372   11.058  782.173   7.9904  783.675   9.2188 -1.502441 12.19975 
1 1 1   10    1   33 o  370.384   7.0132  105.039   3.9759  108.710   5.6169  101.353   5.6288  376.716   9.7412  363.733   10.110 12.98257 14.03946 
1 1 1   10    1   34 o  846.520   5.8136  548.619   7.5327  543.200   10.547  554.261   10.762  842.180   8.1818  850.706   8.2652 -8.525513 11.62988 
1 1 1   10    1   35 o  234.746   10.105   42.224   3.6308   47.059   5.1481   37.439   5.1216  247.322   13.652  220.348   15.280 26.97356 20.49017 
1 1 1   10    1   36 o  502.353   7.4032  193.277   5.6924  189.793   8.0976  196.681   8.0038  497.608   10.632  506.579   10.322 -8.971161 14.81831 
1 1 1   10    1   37 o   79.304   25.021   4.7935   3.3951   3.2153   4.8865   6.2662   4.7205   77.443   29.590   91.261   29.580 -13.81808 41.83912 
1 1 1   10    1   38 o  430.053   7.5731  141.688   4.9850  146.115   7.0004  137.132   7.1004  436.514   10.477  422.843   10.971 13.67151 15.17014 
1 1 1   10    1   39 o  251.969   9.7205   48.684   3.7489   44.355   5.2594   53.154   5.3451  239.803   14.396  262.724   13.336 -22.92108 19.62327 
1 1 1   10    1   40 o  711.699   5.9272  387.964   6.4567  391.085   9.1940  384.927   9.0696  714.257   8.4097  708.618   8.3620 5.639282 11.85943 
1 1 1   10    1   41 o  357.348   7.4056   97.872   4.0506   92.531   5.6903  103.359   5.7674  347.184   10.708  366.981   10.267 -19.79715 14.83514 
1 1 1   10    1   42 o  377.259   7.6381  109.114   4.4105  110.223   5.8668  107.673   6.6886  378.921   10.115  374.322   11.674 4.599548 15.44680 
1 1 1   10    1   43 f  504.541   7.1325  195.150   5.5082  191.325   9.1590  197.318   6.8943  498.799   11.996  507.098   8.8823 -8.299103 14.92684 
1 1 1   10    1   44 o  117.952   20.291   11.103   3.5312   12.500   4.6711   9.2393   5.3943  124.170   25.433  106.794   31.105 17.37596 40.17914 
1 1 1   10    1   45 o  193.759   11.522   28.991   3.4018   24.122   4.7572   34.085   4.8664  175.486   17.964  209.486   15.282 -34.00031 23.58535 
1 1 1   10    1   46 o  147.286   15.136   16.948   3.3638   22.861   4.8225   11.346   4.6942  170.469   18.795  117.625   26.686 52.84396 32.64024 
1 1 1   10    1   47 o  134.980   18.243   14.425   3.6724   16.906   5.9886   12.930   4.6493  143.449   28.280  125.925   25.003 17.52383 37.74792 
1 1 1   10    1   48 o  606.637   6.8222  282.393   6.3346  278.681   8.3442  287.444   9.7321  602.026   9.0552  610.960   10.407 -8.934204 13.79500 
1 1 1   10    1   49 o   78.929   24.911   4.9238   3.3650   7.5918   4.8063   2.3587   4.7127   96.514   29.663   71.526   28.548 24.98741 41.16926 
1 1 1   10    1   50 o  451.499   7.8454  156.665   5.4217  156.895   7.7211  156.442   7.6150  450.856   11.188  450.251   11.050 0.6050110 15.72499 
1 1 1   10    1   51 o  197.943   12.861   30.473   3.8754   24.931   5.4735   36.044   5.4877  176.666   20.630  214.167   16.877 -37.50157 26.65411 
1 1 1   10    1   52 f   63.115   25.192   1.8240   3.6700   2.3008   5.0403   1.2860   5.3541   72.518   29.319   70.553   29.539 1.965103 41.61905 
1 1 1   10    1   53 o  251.769   10.657   48.980   4.1069   46.356   5.7791   51.658   5.8375  243.135   15.612  256.981   14.905 -13.84563 21.58407 
1 1 1   10    1   54 o  208.774   14.027   34.104   4.4564   33.801   6.1943   34.429   6.4162  205.581   19.936  207.249   20.495 -1.667419 28.59151 
1 1 1   10    1   55 o  284.999   11.728   63.006   5.1161   60.654   7.0505   65.623   7.4353  277.272   16.691  288.323   16.922 -11.05130 23.76844 
1 1 1   10    1   56 o  210.075   13.031   34.508   4.1694   36.352   5.8614   32.620   5.9321  213.573   18.101  201.610   19.465 11.96239 26.58042 
1 1 1   10    1   57 o  238.420   12.382   44.396   4.5029   42.616   6.4055   46.135   6.3314  230.870   18.276  240.792   17.294 -9.922699 25.16117 
1 1 1   10    1   58 o  127.341   26.307   13.916   4.9578   11.348   7.0494   16.429   6.9740  111.732   36.140  134.391   33.905 -22.65930 49.55503 
1 1 1   10    1   59 o   91.617   26.344   7.2856   3.8917  -0.2135   5.4508   15.083   5.5581   64.543   28.419  130.800   28.562 -66.25670 40.29211 
1 1 1   10    1   60 o  131.265   19.937   14.275   3.8797   13.878   5.4855   14.672   5.4878  124.305   29.308  128.289   28.669 -3.983582 40.99874 
1 1 1   10    1   61 o  281.430   12.552   62.330   5.4071   68.104   8.8856   58.935   6.8139  287.266   20.340  270.508   16.536 16.75858 26.21376 
1 1 1   10    1   62 o   53.500   23.217   0.2361   3.5249   4.5274   5.0024  -3.9960   4.9677   76.945   29.798   51.431   24.254 25.51408 38.42108 
1 1 1   10    1   63 o   68.318   24.861   3.7548   3.3675   2.6254   4.7823   4.8657   4.7428   68.075   28.159   76.926   29.209 -8.851089 40.57143 
1 1 1   10    1   64 o  100.455   26.120   9.3814   4.0538   8.6453   5.6478   10.164   5.8219   93.460   32.376  100.179   32.870 -6.719360 46.13695 
1 1 1   10    2    0 o  677.689   10.713  351.899   11.107  351.899   11.107  351.899   11.107  677.689   10.713  677.689   10.713 0.000000 0.000000 
1 1 1   10    2    1 o  854.582   7.1637  559.140   9.3705  556.225   16.196  560.606   11.488  852.012   12.419  855.617   8.7723 -3.605103 15.20508 
1 1 1   10    2    2 o  591.846   7.1895  268.184   6.5129  259.007   8.9942  278.301   9.4436  581.516   10.105  602.780   10.236 -21.26373 14.38311 
1 1 1   10    2    3 o  511.681   6.8658  200.448   5.3773  190.208   7.3791  212.043   7.8521  498.348   9.6738  526.172   9.7497 -27.82388 13.73462 
1 1 1   10    2    4 o  345.272   6.5058   91.267   3.4382   81.175   4.7016  102.869   5.0409  325.561   9.4350  366.503   8.9859 -40.94211 13.02939 
1 1 1   10    2    5 o  426.900   9.2098  139.574   6.0179  139.574   6.0179   0.0000   0.0000  426.900   9.2098  ?   ?  0.000000 9.209776 
1 1 1   10    2    6 o  520.398   5.8265  207.320   4.6410  210.443   7.8594  205.648   5.7507  524.158   9.7962  518.253   7.2496 5.905640 12.18697 
1 1 1   10    2    7 f  246.672   4.2410   46.575   1.6012   50.310   2.6862   44.516   1.9943  256.339   6.8464  241.146   5.4030 15.19286 8.721543 
1 1 1   10    2    8 o  175.072   4.2276   23.461   1.1329   22.188   1.5648   24.863   1.6422  170.242   6.0052  180.213   5.9536 -9.971054 8.456255 
1 1 1   10    2    9 o  477.292   4.3890  174.376   3.2064  173.665   4.1169  175.473   5.1120  476.288   5.6471  478.723   6.9765 -2.435150 8.975611 
1 1 1   10    2   10 o  757.560   5.3609  439.336   6.2162  435.979   7.9590  444.587   9.9540  754.591   6.8910  761.909   8.5355 -7.317444 10.96993 
1 1 1   10    2   11 o  406.236   3.7471  126.316   2.3299  124.390   3.0870  128.865   3.5517  403.105   5.0032  410.279   5.6557 -7.173737 7.551037 
1 1 1   10    2   12 o  390.471   3.5871  116.701   2.1439  116.353   3.0399  117.045   3.0240  389.864   5.0942  391.023   5.0525 -1.159668 7.174853 
1 1 1   10    2   13 o  853.382   4.9626  557.481   6.4821  550.494   8.5237  567.065   9.9825  847.942   6.5674  860.550   7.5786 -12.60840 10.02827 
1 1 1   10    2   14 o  756.342   5.0851  437.906   5.8869  438.737   8.4478  437.120   8.2081  756.963   7.2912  755.577   7.0973 1.386658 10.17512 
1 1 1   10    2   15 o  536.587   4.2001  220.387   3.4496  220.350   4.6177  220.434   5.1891  536.509   5.6231  536.591   6.3180 -0.8221436E-01 8.457956 
1 1 1   10    2   16 o  940.673   5.0317  677.343   7.2448  680.095   10.303  674.650   10.190  942.481   7.1418  938.704   7.0919 3.777771 10.06478 
1 1 1   10    2   17 o  861.156   5.5350  567.682   7.2958  558.697   10.244  576.930   10.393  854.215   7.8348  868.042   7.8225 -13.82739 11.07137 
1 1 1   10    2   18 o  1097.73   5.9919  922.444   10.068  921.012   15.344  923.527   13.341  1096.70   9.1407  1098.27   7.9362 -1.575439 12.10519 
1 1 1   10    2   19 o  581.212   4.2528  258.559   3.7833  253.615   5.3417  263.535   5.3593  575.594   6.0630  586.746   5.9674 -11.15137 8.507077 
1 1 1   10    2   20 o  697.919   4.8560  372.830   5.1874  364.845   6.8152  383.826   7.9981  690.369   6.4495  708.072   7.3797 -17.70294 9.800867 
1 1 1   10    2   21 o  1003.85   5.7463  771.362   8.8293  766.147   13.414  775.348   11.728  1000.33   8.7609  1006.37   7.6137 -6.041382 11.60697 
1 1 1   10    2   22 o  1126.32   6.2126  971.077   10.710  977.543   16.468  966.336   14.100  1129.91   9.5220  1123.48   8.1993 6.424927 12.56575 
1 1 1   10    2   23 o  365.436   5.1575  102.217   2.8848  102.570   4.6598  101.998   3.6734  366.026   8.3174  365.027   6.5747 0.9979858 10.60213 
1 1 1   10    2   24 o  960.009   5.7466  705.453   8.4442  707.444   11.248  702.881   12.782  961.297   7.6445  958.146   8.7159 3.150818 11.59333 
1 1 1   10    2   25 o  288.119   6.1192   63.544   2.6986   64.207   3.6687   62.763   3.9835  289.592   8.2766  286.306   9.0900 3.286285 12.29350 
1 1 1   10    2   26 o  360.170   5.7425   99.298   3.1657  100.022   4.9181   98.785   4.1367  361.432   8.8900  359.214   7.5237 2.218201 11.64636 
1 1 1   10    2   27 o  543.048   5.0386  225.729   4.1881  222.037   6.0111  229.211   5.8384  538.543   7.2923  547.181   6.9709 -8.638245 10.08822 
1 1 1   10    2   28 o  118.249   14.421   10.875   2.5561   9.8714   3.6977   11.794   3.5373  111.399   22.462  122.473   19.525 -11.07362 29.76148 
1 1 1   10    2   29 o  918.984   5.5703  646.476   7.8353  641.966   11.082  650.985   11.080  915.668   7.9068  922.081   7.8505 -6.412842 11.14215 
1 1 1   10    2   30 o  816.549   5.8510  510.409   7.3127  509.232   9.7350  511.934   11.078  815.522   7.7988  817.627   8.8521 -2.105103 11.79749 
1 1 1   10    2   31 o  184.594   12.027   26.220   3.3795   31.598   5.9005   23.595   4.1227  201.964   19.323  174.719   15.580 27.24590 24.82147 
1 1 1   10    2   32 o  308.886   8.2613   73.064   3.9059   78.750   5.3859   66.757   5.6727  320.604   10.975  295.135   12.557 25.46954 16.67778 
1 1 1   10    2   33 o  365.722   7.1408  102.413   3.9973   99.299   5.7662  105.295   5.5463  360.015   10.464  370.750   9.7736 -10.73505 14.31842 
1 1 1   10    2   34 f  456.098   6.4951  159.277   4.5343  165.025   6.6027  154.147   6.2378  464.145   9.2939  448.596   9.0846 15.54865 12.99642 
1 1 1   10    2   35 o  181.967   12.860   25.518   3.5587   27.339   5.1720   23.880   4.9043  187.755   18.227  175.312   18.559 12.44261 26.01222 
1 1 1   10    2   36 o  279.432   10.639   59.850   4.5504   54.804   6.9191   63.697   6.0406  266.530   17.050  288.125   13.697 -21.59473 21.87001 
1 1 1   10    2   37 o  731.652   6.1268  409.927   6.8613  412.853   9.3116  406.451   10.149  734.078   8.2873  728.282   9.1044 5.795715 12.31137 
1 1 1   10    2   38 o  229.113   10.414   40.253   3.6519   40.592   5.2731   39.940   5.0624  229.335   15.107  227.541   14.613 1.794479 21.01762 
1 1 1   10    2   39 o  247.296   10.040   46.901   3.8003   42.817   5.8800   49.832   4.9803  235.305   16.429  254.415   12.830 -19.10962 20.84538 
1 1 1   10    2   40 o  470.645   6.3608  169.685   4.5822  178.022   6.7161  162.425   6.2676  481.826   9.1066  460.255   8.8968 21.57071 12.73119 
1 1 1   10    2   41 o  521.109   6.2012  208.040   4.9462  203.961   7.1799  211.724   6.8237  515.669   9.0966  525.466   8.4842 -9.797180 12.43901 
1 1 1   10    2   42 o  146.823   16.074   16.820   3.5532   20.421   4.9639   13.037   5.0884  161.059   20.608  126.816   27.040 34.24344 33.99810 
1 1 1   10    2   43 o  311.261   8.9638   74.346   4.2706   80.373   7.4302   71.373   5.2187  322.844   15.036  304.745   11.188 18.09937 18.74190 
1 1 1   10    2   44 o  125.180   19.261   12.429   3.5723   12.049   4.7404   12.929   5.4343  121.699   26.222  125.638   28.865 -3.939178 38.99725 
1 1 1   10    2   45 o  196.695   11.388   29.867   3.4137   31.002   4.9210   28.815   4.7397  199.532   16.254  192.317   16.253 7.215363 22.98625 
1 1 1   10    2   46 o  121.219   18.279   11.662   3.2861   13.880   4.6446   9.4400   4.6499  131.009   24.048  107.167   28.028 23.84206 36.93117 
1 1 1   10    2   47 o  301.166   9.3706   69.731   4.3196   71.134   7.1083   68.909   5.4391  302.641   15.396  298.976   11.886 3.665833 19.44987 
1 1 1   10    2   48 o  342.415   8.6735   90.121   4.5458   90.513   6.0323   89.605   6.9153  342.598   11.504  340.449   13.271 2.149323 17.56250 
1 1 1   10    2   49 o  218.605   11.520   36.982   3.8409   47.220   5.3942   26.454   5.4703  246.374   14.367  182.632   19.891 63.74196 24.53633 
1 1 1   10    2   50 o  160.739   15.680   20.286   3.8087   23.210   5.7306   17.973   5.0975  169.875   22.600  148.995   23.100 20.87982 32.31649 
1 1 1   10    2   51 o  243.063   10.868   45.608   4.0433   42.875   5.7917   48.206   5.6472  233.884   16.280  248.522   14.915 -14.63828 22.07913 
1 1 1   10    2   52 o  146.635   17.050   17.043   3.7552   18.046   5.4220   16.118   5.2060  148.296   24.760  139.785   25.261 8.510712 35.37240 
1 1 1   10    2   53 o  311.871   9.3550   74.992   4.4657   73.496   6.2881   76.515   6.3431  307.561   13.357  313.870   13.203 -6.308838 18.78143 
1 1 1   10    2   54 f  218.113   14.848   37.308   4.9273   34.760   7.4203   39.318   6.5900  206.594   23.907  221.995   19.595 -15.40129 30.91181 
1 1 1   10    2   55 o   63.105   26.345   1.0963   4.2419  -0.3700   5.5349   3.1835   6.6036   65.878   28.831   81.763   33.373 -15.88519 44.10154 
1 1 1   10    2   56 o   86.984   27.149   6.2917   4.0087   11.774   5.6953   0.9093   5.6433  116.012   31.335   69.989   29.858 46.02310 43.28257 
1 1 1   10    2   57 o  147.400   18.961   17.573   4.1788   15.708   5.7665   19.636   6.0640  134.751   28.830  152.042   27.049 -17.29099 39.53213 
1 1 1   10    2   58 o  360.965   10.530  101.163   5.8180   90.895   8.3393  110.900   8.1209  338.950   16.074  375.802   14.118 -36.85132 21.39371 
1 1 1   10    2   59 o  248.943   11.964   48.427   4.5589   50.684   7.1854   46.906   5.8981  250.256   18.898  242.592   15.974 7.663696 24.74429 
1 1 1   10    2   60 o  234.656   12.243   43.264   4.3819   34.274   5.8450   54.800   6.6213  205.147   18.824  261.380   16.637 -56.23299 25.12228 
1 1 1   10    2   61 o  218.826   12.832   37.855   4.2792   45.817   6.5326   31.870   5.6634  237.159   18.133  196.992   19.019 40.16710 26.27832 
1 1 1   10    2   62 o   90.099   24.442   7.2316   3.4564   4.3269   4.9142   10.075   4.8623   75.850   29.489  103.814   29.313 -27.96420 41.57993 
1 1 1   10    2   63 o   66.038   24.740   3.3308   3.3769   4.0588   4.7306   2.5746   4.8219   73.438   28.825   68.022   28.217 5.415672 40.33730 
1 1 1   10    3    0 o  928.240   9.2837  659.843   13.187  659.843   13.187  659.843   13.187  928.240   9.2837  928.240   9.2837 0.000000 0.000000 
1 1 1   10    3    1 o  493.308   6.5788  186.306   4.9675  185.973   7.0648  186.632   6.9859  492.779   9.3666  493.655   9.2455 -0.8765259 13.16100 
1 1 1   10    3    2 o  640.987   7.4819  314.583   7.3406  305.030   10.146  325.076   10.634  631.039   10.504  651.437   10.664 -20.39728 14.96897 
1 1 1   10    3    3 f  1019.00   10.104  795.349   15.759  771.280   21.545  823.043   23.110  1003.07   14.033  1036.12   14.572 -33.04749 20.23025 
1 1 1   10    3    4 o  386.488   6.6219  114.360   3.9173  106.916   5.4141  122.539   5.6749  373.624   9.4672  399.999   9.2689 -26.37415 13.24915 
1 1 1   10    3    5 o  502.708   5.7804  193.464   4.4478  184.141   5.2758  216.372   8.2700  490.411   7.0284  531.475   10.166 -41.06387 12.35904 
1 1 1   10    3    6 o  957.355   9.7491  702.038   14.286  712.551   20.410  691.940   20.003  964.076   13.831  950.039   13.755 14.03680 19.50697 
1 1 1   10    3    7 f  490.759   5.0872  184.365   3.8214  174.885   5.1879  195.610   5.6500  477.920   7.0920  505.439   7.3032 -27.51819 10.18004 
1 1 1   10    3    8 o  694.449   5.1118  369.171   5.4336  363.795   8.5494  372.815   7.0377  689.245   8.1039  697.810   6.5891 -8.565552 10.44458 
1 1 1   10    3    9 o  492.912   3.7724  185.968   2.8461  182.279   4.2761  188.903   3.8135  487.954   5.7253  496.759   5.0155 -8.805237 7.611452 
1 1 1   10    3   10 o  258.414   4.4171   51.116   1.7471   55.653   2.3566   45.579   2.6035  269.620   5.7103  243.981   6.9716 25.63976 9.011646 
1 1 1   10    3   11 o  483.585   4.4781  179.008   3.3146  179.622   4.3724  178.177   5.0825  484.380   5.8975  482.397   6.8834 1.982849 9.064258 
1 1 1   10    3   12 f  253.320   4.7363   49.122   1.8364   50.455   2.5269   47.630   2.6736  256.711   6.4309  249.410   7.0033 7.300156 9.508095 
1 1 1   10    3   13 o  662.180   4.3731  335.638   4.4324  340.455   5.9791  329.762   6.6041  666.866   5.8577  656.282   6.5743 10.58423 8.805333 
1 1 1   10    3   14 o  441.166   4.0499  148.973   2.7348  150.736   4.2998  147.776   3.5440  443.720   6.3310  439.367   5.2698 4.352478 8.237200 
1 1 1   10    3   15 o  307.411   3.9710   72.333   1.8685   72.248   2.7106   72.410   2.5792  307.207   5.7645  307.555   5.4789 -0.3471985 7.952891 
1 1 1   10    3   16 o  720.989   4.6829  397.901   5.1679  398.092   7.9364  397.759   6.8094  721.077   7.1907  720.815   6.1718 0.2621460 9.476142 
1 1 1   10    3   17 o  274.907   4.6553   57.847   1.9588   59.494   2.7234   56.082   2.8196  278.773   6.3825  270.656   6.8061 8.116638 9.330519 
1 1 1   10    3   18 o  1276.36   6.6642  1247.15   13.019  1242.71   19.810  1250.53   17.274  1273.83   10.160  1277.94   8.8311 -4.108032 13.46172 
1 1 1   10    3   19 o  287.064   4.5385   63.074   1.9942   62.220   2.8752   63.866   2.7681  285.093   6.5890  288.843   6.2612 -3.750366 9.089394 
1 1 1   10    3   20 o  426.710   4.5668  139.366   2.9827  138.416   3.9443  140.636   4.5584  425.233   6.0601  428.615   6.9483 -3.382782 9.219695 
1 1 1   10    3   21 o  237.295   5.3627   43.101   1.9478   42.347   2.8211   43.787   2.6926  235.191   7.8366  239.160   7.3555 -3.969833 10.74782 
1 1 1   10    3   22 o  575.756   4.7016  253.727   4.1434  250.169   6.3077  256.428   5.4953  571.659   7.2089  578.786   6.2030 -7.127563 9.510226 
1 1 1   10    3   23 o  157.593   9.2110   19.080   2.2122   13.904   4.1374   21.153   2.6178  133.018   21.020  165.881   10.362 -32.86305 23.43497 
1 1 1   10    3   24 o  328.038   8.6664   82.388   4.3515   82.388   4.3515   0.0000   0.0000  328.038   8.6664  ?   ?  0.000000 8.666444 
1 1 1   10    3   25 o  717.430   4.8942  393.965   5.3745  393.602   7.6989  394.310   7.5060  717.048   7.0147  717.698   6.8328 -0.6502686 9.792542 
1 1 1   10    3   26 o  646.966   4.9232  320.380   4.8753  325.537   7.1349  315.863   6.6773  652.100   7.1483  642.347   6.7914 9.753113 9.860091 
1 1 1   10    3   27 o  601.679   5.3228  277.108   4.9020  279.518   7.7238  275.482   6.3432  604.211   8.3517  599.875   6.9084 4.335876 10.83869 
1 1 1   10    3   28 o  581.978   5.1150  259.257   4.5564  264.125   6.6473  254.942   6.2578  587.360   7.3939  577.067   7.0847 10.29254 10.24026 
1 1 1   10    3   29 o  886.105   5.5011  601.043   7.4612  609.558   10.820  593.322   10.303  892.253   7.9223  880.304   7.6463 11.94946 11.01038 
1 1 1   10    3   30 o  727.640   6.1601  405.323   6.8608  408.216   9.8792  402.628   9.5352  730.117   8.8401  725.114   8.5912 5.002625 12.32708 
1 1 1   10    3   31 o  312.717   7.6511   74.878   3.6622   77.117   5.7666   73.365   4.7411  317.246   11.876  309.487   10.008 7.759399 15.53054 
1 1 1   10    3   32 o  525.254   6.2606  211.219   5.0333  211.534   6.7559  210.827   7.5459  525.570   8.3981  524.649   9.3966 0.9210205 12.60258 
1 1 1   10    3   33 o  660.165   5.6760  333.643   5.7354  332.898   8.2357  334.345   7.9919  659.315   8.1609  660.760   7.9020 -1.445068 11.35964 
1 1 1   10    3   34 o  663.515   5.7438  337.053   5.8334  334.398   8.3409  339.594   8.1613  660.772   8.2469  665.899   8.0072 -5.127258 11.49466 
1 1 1   10    3   35 o  1012.67   6.5867  785.250   10.210  781.094   15.817  788.218   13.367  1009.61   10.236  1014.39   8.6091 -4.783691 13.37474 
1 1 1   10    3   36 o  409.527   7.4886  128.453   4.6941  123.726   6.3136  134.296   7.0193  401.782   10.266  418.551   10.957 -16.76880 15.01489 
1 1 1   10    3   37 f  524.885   6.4751  210.990   5.2021  205.630   7.0250  217.497   7.7407  518.023   8.8599  532.710   9.4933 -14.68762 12.98541 
1 1 1   10    3   38 o  566.145   6.0464  245.465   5.2396  240.705   7.5270  249.939   7.2980  560.420   8.7748  571.106   8.3487 -10.68658 12.11193 
1 1 1   10    3   39 o  114.527   20.331   10.422   3.4335   12.765   5.3706   8.8021   4.4651  125.635   28.573  104.531   27.527 21.10389 39.67583 
1 1 1   10    3   40 o  168.490   13.213   21.950   3.3804   19.902   4.8097   23.949   4.7520  159.251   20.185  175.325   17.961 -16.07358 27.01896 
1 1 1   10    3   41 o  541.890   6.1106  224.959   5.0683  229.719   7.3587  220.663   6.9909  547.296   8.7843  536.434   8.5142 10.86206 12.23338 
1 1 1   10    3   42 o  366.076   8.3122  102.778   4.6575   98.914   6.6387  106.523   6.5360  358.707   12.091  372.331   11.469 -13.62411 16.66518 
1 1 1   10    3   43 o   92.369   23.114   6.9048   3.2600   7.2341   5.0019   6.6615   4.2984   96.163   30.374   91.804   28.024 4.358994 41.32661 
1 1 1   10    3   44 o   78.095   25.263   4.6587   3.4444   4.4330   4.5628   4.9578   5.2518   80.770   29.002   85.809   31.074 -5.039490 42.50554 
1 1 1   10    3   45 o  384.723   7.1359  113.519   4.2021  114.389   6.0340  112.699   5.8554  385.760   10.219  382.937   9.9899 2.822845 14.29094 
1 1 1   10    3   46 o  189.047   11.935   27.642   3.4359   28.236   4.9213   27.076   4.7991  190.042   17.102  186.084   17.038 3.957794 24.14062 
1 1 1   10    3   47 o  138.930   20.197   15.379   4.1691   17.393   6.4139   13.906   5.4861  145.011   29.890  129.754   28.411 15.25746 41.23839 
1 1 1   10    3   48 o  229.155   10.763   40.459   3.7750   45.528   5.3633   35.483   5.3143  241.995   14.547  213.053   16.423 28.94250 21.93915 
1 1 1   10    3   49 o  207.623   12.125   33.412   3.8365   36.189   5.3474   30.467   5.5074  215.019   16.371  196.557   18.524 18.46194 24.72146 
1 1 1   10    3   50 o  452.522   7.3587  157.302   5.0969  158.287   7.9055  156.601   6.6678  452.761   11.408  450.908   9.6611 1.852722 14.94887 
1 1 1   10    3   51 o  354.790   8.0634   96.800   4.3788   99.331   6.4227   94.601   5.9856  358.446   11.706  349.965   11.174 8.480927 16.18334 
1 1 1   10    3   52 o  353.237   8.3172   96.019   4.4969  108.068   6.6630   85.939   6.0942  373.763   11.647  333.212   11.949 40.55099 16.68591 
1 1 1   10    3   53 o  128.273   21.089   13.372   3.9967   15.741   5.3984   10.499   5.9454  137.306   26.647  110.740   32.771 26.56586 42.23745 
1 1 1   10    3   54 o  170.310   16.467   22.950   4.2390   21.177   6.8743   24.038   5.3845  158.078   29.496  172.715   20.785 -14.63651 36.08394 
1 1 1   10    3   55 o  263.399   10.896   53.724   4.3931   48.865   6.0652   59.086   6.3715  249.060   15.995  274.313   15.235 -25.25299 22.08919 
1 1 1   10    3   56 o   79.137   27.004   4.9257   3.9242   9.5783   5.4193  -0.2030   5.6899  105.120   31.328   66.955   29.269 38.16497 42.87334 
1 1 1   10    3   57 o  276.332   10.735   59.235   4.5403   60.689   6.5081   57.856   6.3373  277.352   15.391  270.805   15.352 6.547455 21.73848 
1 1 1   10    3   58 o  170.486   18.677   23.501   4.7939   21.296   6.9843   25.464   6.5920  155.693   30.399  173.724   25.554 -18.03091 39.71246 
1 1 1   10    3   59 o  212.455   12.452   35.449   4.0315   28.344   5.7016   42.552   5.7012  185.923   20.369  230.832   16.240 -44.90906 26.05016 
1 1 1   10    3   60 o  276.034   10.884   59.429   4.5987   51.701   6.1100   69.529   6.9844  254.422   15.768  295.371   15.503 -40.94920 22.11238 
1 1 1   10    3   61 o   46.132   21.628  -3.1461   3.8503  -6.5276   5.8352  -0.5384   5.1242   52.439   25.162   60.983   27.165 -8.544727 37.02779 
1 1 1   10    3   62 o   42.870   20.224  -3.1454   3.4594  -5.3250   4.9279  -1.0277   4.8576   48.602   23.268   57.591   25.986 -8.989349 34.88074 
1 1 1   10    3   63 f  104.775   22.265   9.6478   3.4606   9.9961   4.7783   9.2636   5.0184  102.475   29.102   98.070   30.339 4.405281 42.04031 
1 1 1   10    4    0 o  538.550   6.7561  222.116   5.5672  222.116   5.5672  222.116   5.5672  538.550   6.7561  538.550   6.7561 0.000000 0.000000 
1 1 1   10    4    1 o  669.267   7.5894  342.965   7.7746  337.782   10.905  348.323   11.087  664.029   10.729  674.310   10.742 -10.28070 15.18253 
1 1 1   10    4    2 o  540.074   5.5763  223.286   4.6096  222.598   5.5903  224.749   8.1478  539.206   6.7734  541.688   9.8270 -2.481750 11.93525 
1 1 1   10    4    3 o  770.652   8.4191  454.805   9.9310  437.451   13.571  474.815   14.572  755.586   11.734  787.164   12.094 -31.57782 16.85115 
1 1 1   10    4    4 o  998.892   10.049  764.312   15.364  741.821   21.094  789.726   22.423  983.665   14.010  1014.87   14.435 -31.20953 20.11563 
1 1 1   10    4    5 o  609.086   6.2502  284.022   5.8270  278.815   7.0507  295.241   10.349  603.424   7.6338  620.776   10.892 -17.35138 13.30078 
1 1 1   10    4    6 o  326.554   6.8561   81.647   3.4269   85.598   4.8064   77.561   4.8874  334.300   9.3932  318.200   10.035 16.10010 13.74514 
1 1 1   10    4    7 o  466.219   5.8911  166.403   4.2039  161.785   5.0419  176.938   7.6149  459.668   7.1660  480.586   10.352 -20.91818 12.59030 
1 1 1   10    4    8 o  544.185   5.2867  226.699   4.4036  226.354   6.2414  227.041   6.2138  543.696   7.4999  544.523   7.4554 -0.8265991 10.57507 
1 1 1   10    4    9 o  677.629   4.5957  351.491   4.7667  354.435   6.8241  348.687   6.6611  680.387   6.5527  674.852   6.4486 5.534790 9.193630 
1 1 1   10    4   10 o  318.590   3.9796   77.691   1.9406   76.411   2.7948   78.883   2.6967  315.926   5.7796  321.002   5.4885 -5.075989 7.970402 
1 1 1   10    4   11 o  809.589   5.5924  501.766   6.9300  507.214   9.1139  494.299   10.670  813.884   7.3160  803.369   8.6773 10.51434 11.34988 
1 1 1   10    4   12 o  454.141   4.1789  157.868   2.9048  161.523   4.2259  154.594   3.9996  459.327   6.0107  449.372   5.8149 9.955719 8.363092 
1 1 1   10    4   13 o  787.451   5.1189  474.672   6.1698  481.471   8.8968  468.373   8.5637  792.968   7.3300  782.118   7.1535 10.85059 10.24216 
1 1 1   10    4   14 o  372.439   4.9001  106.180   2.7934  101.156   4.5383  109.245   3.5444  363.452   8.1578  377.753   6.1300 -14.30063 10.20426 
1 1 1   10    4   15 o  675.801   4.8793  349.595   5.0471  333.498   8.4941  358.379   6.2749  659.930   8.4091  684.205   5.9918 -24.27490 10.32544 
1 1 1   10    4   16 o  360.450   4.2156   99.446   2.3258   99.711   3.1370   99.124   3.4658  360.908   5.6788  359.834   6.2926 1.074493 8.476178 
1 1 1   10    4   17 o  595.242   4.1406  271.194   3.7725  275.457   5.4201  267.188   5.2539  599.865   5.9032  590.794   5.8100 9.070435 8.282763 
1 1 1   10    4   18 o  449.156   4.2679  154.414   2.9342  158.547   4.5666  151.508   3.8292  455.091   6.5557  444.890   5.6233 10.20126 8.637051 
1 1 1   10    4   19 o  396.101   4.4869  120.090   2.7203  119.299   4.2562  120.636   3.5371  394.760   7.0440  396.984   5.8211 -2.224487 9.137972 
1 1 1   10    4   20 o  1170.07   6.3447  1048.00   11.363  1037.31   14.850  1063.09   17.650  1163.99   8.3351  1178.28   9.7863 -14.28821 12.85477 
1 1 1   10    4   21 o  483.641   4.2616  179.031   3.1547  183.084   4.5841  175.384   4.3482  489.060   6.1239  478.667   5.9348 10.39246 8.527787 
1 1 1   10    4   22 o  867.187   5.3637  575.614   7.1194  568.420   10.858  581.040   9.4295  861.661   8.2325  871.216   7.0712 -9.554382 10.85244 
1 1 1   10    4   23 o  588.991   5.2628  265.534   4.7445  263.807   6.8217  267.153   6.6033  587.025   7.5921  590.743   7.3028 -3.718018 10.53430 
1 1 1   10    4   24 f  948.716   6.1435  688.972   8.9212  689.456   12.717  688.503   12.518  948.948   8.7554  948.298   8.6244 0.6503906 12.28976 
1 1 1   10    4   25 o  731.612   5.2142  409.704   5.8390  406.019   8.9164  412.470   7.7261  728.239   7.9992  734.036   6.8766 -5.797180 10.54863 
1 1 1   10    4   26 o  618.577   5.6169  292.894   5.3182  298.721   9.5627  290.285   6.3990  624.570   10.003  615.789   6.7891 8.780579 12.08935 
1 1 1   10    4   27 f  874.881   5.7183  585.908   7.6574  586.723   11.943  585.340   9.9784  875.356   8.9137  874.391   7.4556 0.9648438 11.62070 
1 1 1   10    4   28 o  675.111   5.0985  348.874   5.2686  350.691   7.5946  347.189   7.3150  676.802   7.3312  673.422   7.0967 3.379578 10.20340 
1 1 1   10    4   29 o  889.953   6.3133  606.320   8.5999  605.664   12.232  606.961   12.093  889.336   8.9860  890.295   8.8745 -0.9587402 12.62951 
1 1 1   10    4   30 o  205.495   10.835   32.438   3.3959   30.828   4.8947   33.932   4.7155  199.849   16.139  209.864   14.774 -10.01520 21.88003 
1 1 1   10    4   31 o  565.341   5.8101  244.673   5.0276  250.878   8.0100  240.639   6.4582  572.343   9.1434  560.606   7.5263 11.73657 11.84261 
1 1 1   10    4   32 o  720.635   6.0141  397.572   6.6337  407.551   9.0097  385.757   9.8032  729.526   8.0687  709.698   9.0246 19.82739 12.10562 
1 1 1   10    4   33 o  226.981   9.7848   39.467   3.3995   42.867   5.0506   36.651   4.5966  236.020   14.044  218.192   13.835 17.82721 19.71402 
1 1 1   10    4   34 o  191.228   11.389   28.126   3.3186   28.827   5.0417   27.590   4.4082  192.999   17.249  189.001   15.371 3.997726 23.10390 
1 1 1   10    4   35 o  813.493   6.2519  506.711   7.7846  508.859   12.497  505.348   9.9509  814.904   10.019  812.272   8.0037 2.632019 12.82377 
1 1 1   10    4   36 o  141.031   18.027   15.538   3.8023   11.179   5.0393   21.301   5.7938  117.859   28.293  164.526   23.690 -46.66728 36.90113 
1 1 1   10    4   37 o  613.090   6.2014  287.849   5.8195  291.564   8.0740  283.832   8.3953  616.857   8.5514  608.583   9.0125 8.274475 12.42383 
1 1 1   10    4   38 o  337.887   7.6215   87.471   3.9417   91.239   5.8648   84.366   5.3233  344.875   11.110  331.674   10.486 13.20154 15.27702 
1 1 1   10    4   39 o  386.658   7.4727  114.556   4.4226  114.197   7.0676  114.788   5.6698  385.686   11.972  386.899   9.5742 -1.212219 15.32959 
1 1 1   10    4   40 o  175.249   12.325   23.708   3.2851   19.140   4.8626   27.543   4.4558  155.968   20.894  188.514   15.582 -32.54533 26.06424 
1 1 1   10    4   41 o  567.574   5.9798  246.783   5.1949  250.337   7.6312  243.714   7.0918  571.326   8.7265  563.785   8.2182 7.540710 11.98711 
1 1 1   10    4   42 o  201.541   12.936   31.374   3.9695   35.289   5.9597   28.253   5.3217  212.831   18.478  190.258   18.508 22.57332 26.15329 
1 1 1   10    4   43 o  215.040   10.445   35.523   3.4380   41.262   5.0619   30.609   4.6842  230.934   14.392  198.571   15.535 32.36349 21.17727 
1 1 1   10    4   44 o  502.800   6.8001  193.822   5.2334  196.206   7.0045  190.810   7.8737  505.537   9.0523  498.302   10.323 7.234833 13.73003 
1 1 1   10    4   45 o  413.019   6.8792  130.815   4.3489  125.339   6.2372  135.997   6.0669  403.812   10.091  420.747   9.4205 -16.93542 13.80492 
1 1 1   10    4   46 o  155.903   13.928   18.918   3.2887   17.472   4.7889   20.209   4.5242  147.960   21.799  160.112   18.820 -12.15230 28.79872 
1 1 1   10    4   47 o  267.721   11.014   55.206   4.5132   42.818   6.9607   64.192   5.9283  233.376   19.670  288.239   13.437 -54.86272 23.82118 
1 1 1   10    4   48 o  339.786   7.7655   88.674   4.0387   88.589   5.7548   88.757   5.6694  338.998   11.091  339.358   10.915 -0.3600464 15.56076 
1 1 1   10    4   49 o   47.909   21.612  -1.5882   3.3581  -5.0528   4.6662   2.1337   4.8365   49.461   23.381   71.263   28.752 -21.80229 37.05859 
1 1 1   10    4   50 o  180.674   13.739   25.448   3.7709   21.615   5.6914   28.448   5.0345  163.527   23.406  190.042   17.504 -26.51526 29.22764 
1 1 1   10    4   51 o  110.839   21.657   10.036   3.5424   13.604   5.1250   6.7728   4.9018  127.718   27.058   91.969   30.160 35.74923 40.51862 
1 1 1   10    4   52 o  263.087   10.110   53.406   4.0712   53.147   5.8381   53.650   5.6803  260.885   14.680  262.289   14.202 -1.403656 20.42505 
1 1 1   10    4   53 o  146.004   18.298   17.022   3.9995   18.122   5.3374   15.613   6.0397  148.496   24.325  135.397   29.938 13.09923 38.57474 
1 1 1   10    4   54 o  145.299   19.047   16.956   4.1340   12.339   6.4225   20.222   5.4019  118.873   33.733  157.254   23.134 -38.38107 40.90359 
1 1 1   10    4   55 o  107.898   24.168   9.7609   3.8922   12.595   5.3546   6.5855   5.6674  120.999   29.238   91.532   32.380 29.46687 43.62687 
1 1 1   10    4   56 o  380.303   9.1324  111.690   5.3160  107.950   6.8921  117.184   8.3526  372.627   12.084  387.149   14.095 -14.52222 18.56598 
1 1 1   10    4   57 o  128.010   20.834   13.472   3.9417   16.226   5.5675   10.704   5.5813  137.654   27.388  110.106   31.517 27.54864 41.75377 
1 1 1   10    4   58 o  131.629   24.189   14.640   4.6940   14.397   6.8054   14.861   6.4829  125.282   34.427  128.081   32.896 -2.799004 47.61680 
1 1 1   10    4   59 o  138.564   18.362   15.655   3.7984   15.451   5.2713   15.875   5.4782  133.347   26.757  134.783   27.486 -1.435913 38.35879 
1 1 1   10    4   60 o  214.217   12.828   36.178   4.1867   30.436   5.5008   44.085   6.4548  193.158   18.846  233.184   18.230 -40.02673 26.21989 
1 1 1   10    4   61 o  119.822   22.996   12.361   4.0642   12.838   6.2772   12.017   5.3328  115.720   33.511  113.955   30.119 1.764313 45.05719 
1 1 1   10    4   62 o  115.607   21.225   11.465   3.6174   11.102   5.1244   11.825   5.1071  108.443   29.905  112.310   29.374 -3.866959 41.91834 
1 1 1   10    4   63 o   43.843   20.435  -2.3363   3.3549  -3.2516   4.6240  -1.3190   4.8750   50.390   23.649   56.386   25.675 -5.995796 34.90721 
1 1 1   10    5    0 o  530.948   6.7297  215.894   5.4672  215.894   5.4672  215.894   5.4672  530.948   6.7297  530.948   6.7297 0.000000 0.000000 
1 1 1   10    5    1 o  880.271   6.3408  593.239   8.5434  578.990   11.804  608.914   12.381  869.485   8.8696  891.656   9.0715 -22.17145 12.68711 
1 1 1   10    5    2 o  491.963   6.8054  185.305   5.1245  180.044   7.0913  191.055   7.4138  484.831   9.5558  499.431   9.6984 -14.60010 13.61510 
1 1 1   10    5    3 o  576.807   5.8334  254.704   5.1501  245.399   6.0612  278.865   9.7673  566.135   6.9947  603.332   10.577 -37.19720 12.68034 
1 1 1   10    5    4 o  478.701   7.0834  175.456   5.1901  176.373   7.4354  174.585   7.2480  479.835   10.124  477.405   9.9188 2.429657 14.17297 
1 1 1   10    5    5 o  441.343   7.0522  149.139   4.7640  158.773   6.9118  140.421   6.5753  455.271   9.9187  428.147   10.033 27.12463 14.10851 
1 1 1   10    5    6 o  896.844   9.4501  616.084   12.973  646.200   19.176  590.671   17.615  918.082   13.646  877.810   13.110 40.27216 18.92342 
1 1 1   10    5    7 o  148.803   8.3000   17.010   1.8829   14.541   2.2800   22.305   3.3391  137.327   10.938  170.095   12.922 -32.76819 16.92935 
1 1 1   10    5    8 o  1014.81   7.3034  788.563   11.344  784.357   15.976  792.842   16.112  1011.83   10.315  1017.29   10.347 -5.454529 14.61080 
1 1 1   10    5    9 f  553.395   4.7521  234.426   4.0252  232.558   5.1081  237.488   6.5380  551.146   6.0551  556.897   7.6701 -5.750916 9.772117 
1 1 1   10    5   10 o  323.808   4.5661   80.261   2.2631   82.453   2.8926   76.802   3.6338  328.180   5.7584  316.700   7.4961 11.47964 9.452564 
1 1 1   10    5   11 o  464.272   4.5194  164.995   3.2116  174.326   4.3506  153.820   4.7608  477.185   5.9565  448.215   6.9395 28.97049 9.145278 
1 1 1   10    5   12 o  279.005   3.9943   59.584   1.7058   61.452   2.7014   58.345   2.1998  283.315   6.2294  276.075   5.2059 7.239960 8.118297 
1 1 1   10    5   13 o  757.398   5.0652  439.125   5.8720  448.557   10.346  434.643   7.1320  765.309   8.8323  753.480   6.1840 11.82916 10.78197 
1 1 1   10    5   14 o  502.066   5.4549  192.962   4.1919  190.302   9.2619  193.647   4.7010  498.343   12.142  502.940   6.1067 -4.597107 13.59144 
1 1 1   10    5   15 f  218.444   5.4967   36.528   1.8379   35.117   2.5662   38.014   2.6334  214.156   7.8287  222.818   7.7214 -8.662369 10.99583 
1 1 1   10    5   16 o  114.748   8.3578   10.136   1.4578   10.679   2.2610   9.7491   1.9072  117.360   12.794  112.252   11.252 5.107964 17.03793 
1 1 1   10    5   17 o  957.284   5.4700  701.471   8.0149  694.713   12.154  706.672   10.661  952.532   8.3364  960.752   7.2499 -8.219421 11.04799 
1 1 1   10    5   18 o  1103.85   6.0181  932.743   10.168  936.333   15.584  930.082   13.418  1105.81   9.2072  1102.18   7.9534 3.622803 12.16674 
1 1 1   10    5   19 o  451.882   4.1345  156.291   2.8597  156.839   4.1135  155.779   3.9784  452.649   5.9371  451.120   5.7616 1.528809 8.273188 
1 1 1   10    5   20 o  523.861   4.5756  210.050   3.6689  213.490   4.8810  205.582   5.5629  528.110   6.0383  518.220   7.0132 9.890747 9.254510 
1 1 1   10    5   21 o  244.841   5.6496   45.886   2.1173   47.674   2.8358   43.635   3.1826  249.549   7.4242  238.730   8.7098 10.81889 11.44464 
1 1 1   10    5   22 o  594.565   5.1849  270.583   4.7186  271.663   6.7696  269.562   6.5806  595.707   7.4244  593.402   7.2451 2.304321 10.37367 
1 1 1   10    5   23 o  325.843   5.0979   81.267   2.5426   82.528   3.7084   80.149   3.4927  328.336   7.3791  323.572   7.0522 4.764099 10.20708 
1 1 1   10    5   24 o  268.759   6.0437   55.291   2.4862   55.056   3.4688   55.538   3.5651  268.163   8.4511  269.331   8.6480 -1.167755 12.09173 
1 1 1   10    5   25 o  969.276   5.4784  719.135   8.1278  710.242   11.448  728.173   11.541  963.179   7.7654  975.263   7.7314 -12.08441 10.95791 
1 1 1   10    5   26 o  857.931   5.5680  563.414   7.3118  554.585   11.095  570.193   9.7217  851.073   8.5167  863.015   7.3596 -11.94226 11.25603 
1 1 1   10    5   27 o  854.427   6.0804  558.851   7.9520  564.479   14.067  556.208   9.6399  858.498   10.706  852.355   7.3889 6.143372 13.00786 
1 1 1   10    5   28 o  641.458   5.3985  314.967   5.3004  321.095   8.2904  310.731   6.8933  647.575   8.3640  637.083   7.0691 10.49207 10.95122 
1 1 1   10    5   29 f  802.726   6.1645  493.286   7.5742  489.871   10.739  496.667   10.685  799.825   8.7718  805.360   8.6676 -5.535095 12.33172 
1 1 1   10    5   30 o  381.249   6.3783  111.275   3.7221  109.652   5.8687  112.368   4.8142  378.362   10.134  383.074   8.2105 -4.712341 13.04236 
1 1 1   10    5   31 o  680.493   5.4728  354.487   5.7004  353.571   8.3613  355.282   7.7919  679.511   8.0391  681.179   7.4733 -1.668213 10.97620 
1 1 1   10    5   32 o  805.512   6.0897  496.747   7.5082  498.981   10.009  493.870   11.355  807.213   8.1005  802.994   9.2384 4.219238 12.28684 
1 1 1   10    5   33 o  433.797   6.3728  144.077   4.2314  150.977   6.3617  138.602   5.6667  443.957   9.3618  425.398   8.7030 18.55884 12.78225 
1 1 1   10    5   34 f  533.061   6.0016  217.557   4.8968  222.314   7.2411  213.548   6.6473  538.731   8.7814  528.032   8.2246 10.69904 12.03150 
1 1 1   10    5   35 o  110.116   22.198   9.6706   3.6122   17.440   6.5495   6.2742   4.3303  147.499   30.031   90.429   28.216 57.06989 41.20684 
1 1 1   10    5   36 o   49.469   22.285  -1.8194   3.5562  -3.8471   4.7076   0.8760   5.4275   53.211   24.595   71.636   29.845 -18.42435 38.67334 
1 1 1   10    5   37 o  460.106   6.3223  162.126   4.4525  161.883   6.4868  162.342   6.1226  459.585   9.2214  460.273   8.6906 -0.6880493 12.67122 
1 1 1   10    5   38 o  291.070   8.2092   64.924   3.6574   70.349   5.5435   60.743   4.8669  302.764   11.962  281.375   11.300 21.38849 16.45581 
1 1 1   10    5   39 f  251.890   9.7494   48.661   3.7589   60.549   6.3004   42.091   4.6838  280.217   14.741  233.701   13.147 46.51660 19.75231 
1 1 1   10    5   40 o  437.003   6.4963  146.308   4.3453  144.738   6.4444  147.618   5.8842  434.368   9.6930  438.763   8.7616 -4.395294 13.06599 
1 1 1   10    5   41 o  300.829   7.8549   69.381   3.6168   68.949   5.2851   69.761   4.9603  299.589   11.525  301.423   10.751 -1.833862 15.76154 
1 1 1   10    5   42 o  102.627   24.221   8.5318   3.7435   11.177   5.4999   6.2488   5.1099  116.992   30.427   91.606   30.817 25.38592 43.30710 
1 1 1   10    5   43 o  444.402   6.5257  151.371   4.4389  145.330   6.3929  156.994   6.1682  435.066   9.6000  452.289   8.9099 -17.22339 13.09757 
1 1 1   10    5   44 o  142.589   16.554   15.931   3.5457   20.144   4.6872   10.296   5.4215  159.906   19.558  112.102   30.696 47.80379 36.39706 
1 1 1   10    5   45 o  457.676   6.5955  160.612   4.6203  158.259   6.6909  162.757   6.3879  453.825   9.6321  460.335   9.0660 -6.509277 13.22767 
1 1 1   10    5   46 o  180.382   12.297   25.198   3.3748   20.621   4.7898   29.711   4.7558  161.482   19.793  195.178   16.062 -33.69562 25.49013 
1 1 1   10    5   47 o  251.651   12.329   48.863   4.7489   41.709   6.9102   55.265   6.5371  230.234   19.802  266.402   16.107 -36.16737 25.52550 
1 1 1   10    5   48 o  164.058   14.219   20.999   3.5351   26.936   5.0422   15.258   4.9578  184.983   18.037  136.869   24.568 48.11391 30.47857 
1 1 1   10    5   49 f   56.801   23.363   0.9480   3.2674   5.0495   4.6888  -2.9238   4.5557   83.261   29.452   53.472   24.526 29.78847 38.32706 
1 1 1   10    5   50 o  272.394   9.5949   57.150   4.0004   62.070   5.9027   52.971   5.4405  282.957   13.629  261.047   13.663 21.91000 19.29859 
1 1 1   10    5   51 o  216.751   12.133   36.465   4.0090   38.599   6.1313   34.871   5.2986  221.105   18.281  210.675   16.565 10.43028 24.66974 
1 1 1   10    5   52 o  240.594   10.760   44.717   3.9624   44.047   5.6730   45.356   5.5367  237.047   15.725  240.777   15.100 -3.730209 21.80068 
1 1 1   10    5   53 o  179.116   15.984   25.285   4.3362   29.405   6.0431   20.912   6.2254  191.370   20.975  158.731   26.562 32.63922 33.84478 
1 1 1   10    5   54 o  233.038   11.526   42.082   4.1113   38.476   5.9726   45.329   5.6679  220.274   17.869  240.202   15.499 -19.92844 23.65376 
1 1 1   10    5   55 o  215.427   12.527   36.197   4.1128   40.619   5.9479   32.145   5.6931  226.379   17.297  200.625   18.757 25.75328 25.51467 
1 1 1   10    5   56 o   83.416   28.079   5.6007   4.2422  -0.2393   5.3646   15.348   6.9307   64.986   28.413  131.020   34.195 -66.03438 44.45955 
1 1 1   10    5   57 o  167.467   16.019   22.311   4.0561   22.529   5.6987   22.088   5.7743  164.987   23.208  163.013   23.848 1.974747 33.27621 
1 1 1   10    5   58 o  164.036   19.019   21.839   4.6867   18.129   6.8096   25.179   6.4602  142.148   32.062  172.816   25.161 -30.66806 40.75584 
1 1 1   10    5   59 o  100.944   24.563   8.8076   3.7591   10.238   5.2115   7.2566   5.4273  106.605   30.434   91.877   31.742 14.72763 43.97498 
1 1 1   10    5   60 o  179.613   14.189   25.652   3.8691   23.864   5.3062   27.681   5.6538  169.592   20.883  183.013   20.538 -13.42137 29.28960 
1 1 1   10    5   61 o   70.767   26.018   3.8581   3.7018   10.321   5.3120  -2.2437   5.1615  105.088   30.942   56.740   26.055 48.34859 40.45041 
1 1 1   10    5   62 o   91.889   24.630   7.5666   3.5347   7.3138   4.9243   7.8353   5.0768   89.127   30.251   91.662   30.718 -2.534225 43.11273 
1 1 1   10    5   63 o   85.242   25.975   6.6462   3.6951   7.1856   4.6973   5.7704   5.9850   87.586   29.547   82.547   32.416 5.039024 43.86082 
1 1 1   10    6    0 o  427.790   6.3335  140.174   4.1451  140.174   4.1451  140.174   4.1451  427.790   6.3335  427.790   6.3335 0.000000 0.000000 
1 1 1   10    6    1 o  856.471   6.2444  561.593   8.1860  550.255   11.335  573.954   11.835  847.635   8.7366  865.682   8.9317 -18.04736 12.49412 
1 1 1   10    6    2 o  451.183   4.5690  155.822   3.1553  147.374   4.3097  165.582   4.6323  438.741   6.4176  465.051   6.5077 -26.31067 9.139785 
1 1 1   10    6    3 o  646.008   7.7255  319.564   7.6390  314.441   10.611  325.076   11.007  640.637   10.821  651.366   11.040 -10.72919 15.45850 
1 1 1   10    6    4 o  1230.76   11.790  1160.79   22.210  1152.92   31.155  1168.92   31.670  1225.79   16.605  1234.23   16.764 -8.445190 23.59619 
1 1 1   10    6    5 o  542.358   7.5228  225.241   6.2451  223.243   8.7773  227.290   8.8874  539.802   10.623  544.670   10.660 -4.868774 15.04982 
1 1 1   10    6    6 o  875.969   7.6608  587.578   10.272  580.422   12.416  603.094   18.283  870.500   9.3186  886.930   13.467 -16.43097 16.37707 
1 1 1   10    6    7 o  1155.43   9.2753  1022.57   16.404  1026.16   20.145  1015.51   28.258  1157.20   11.374  1150.45   16.047 6.752197 19.66915 
1 1 1   10    6    8 o  669.146   6.7871  342.829   6.9515  339.292   8.4210  350.393   12.316  665.613   8.2656  676.171   11.900 -10.55804 14.48912 
1 1 1   10    6    9 o  228.882   4.8875   40.102   1.7123   38.292   2.1095   43.597   2.9315  223.642   6.1625  238.602   8.0269 -14.96033 10.11963 
1 1 1   10    6   10 o  559.872   4.8894  239.948   4.1900  239.125   5.3520  241.250   6.7345  558.870   6.2566  561.288   7.8388 -2.417236 10.02953 
1 1 1   10    6   11 f  1108.00   8.9728  940.268   15.217  923.742   18.258  977.864   27.539  1098.03   10.863  1129.01   15.936 -30.98315 19.28643 
1 1 1   10    6   12 o  447.511   5.3159  153.305   3.6413  155.108   5.0387  151.336   5.2680  450.082   7.3141  444.563   7.7419 5.519287 10.65043 
1 1 1   10    6   13 o  551.653   4.1706  232.936   3.5216  234.673   5.4203  231.667   4.6325  553.651   6.3961  550.118   5.5016 3.532227 8.436723 
1 1 1   10    6   14 o  525.405   4.9467  211.307   3.9781  224.285   6.7701  204.463   4.9164  541.206   8.1726  516.796   6.2152 24.40930 10.26748 
1 1 1   10    6   15 o  957.572   5.8614  701.932   8.5910  716.175   12.381  688.706   11.931  967.109   8.3638  948.389   8.2189 18.71924 11.72615 
1 1 1   10    6   16 o  555.860   5.0716  236.510   4.3150  231.114   5.5915  244.453   6.7847  549.448   6.6487  565.047   7.8447 -15.59937 10.28322 
1 1 1   10    6   17 o  271.740   4.9094   56.522   2.0420   52.164   3.0501   60.061   2.7489  261.027   7.6341  280.104   6.4117 -19.07748 9.969403 
1 1 1   10    6   18 o  1497.35   8.9236  1716.70   20.452  1705.28   32.026  1724.57   26.577  1491.84   14.025  1500.54   11.572 -8.699097 18.18258 
1 1 1   10    6   19 o  937.086   5.4687  672.159   7.8439  675.899   12.079  669.431   10.315  939.581   8.3989  935.124   7.2064 4.457153 11.06678 
1 1 1   10    6   20 o  528.103   5.5431  213.476   4.4806  223.306   5.8406  199.417   6.9849  540.097   7.0651  510.350   8.9417 29.74780 11.39604 
1 1 1   10    6   21 o  921.112   5.9571  649.451   8.3988  649.661   11.898  649.243   11.858  921.174   8.4383  920.879   8.4125 0.2952881 11.91531 
1 1 1   10    6   22 o  436.842   4.4880  146.061   3.0009  147.663   4.3333  144.585   4.1598  439.206   6.4459  434.607   6.2533 4.599548 8.980703 
1 1 1   10    6   23 o  340.302   5.1410   88.640   2.6778   84.741   3.6549   93.159   3.9345  332.710   7.1770  348.843   7.3687 -16.13223 10.28621 
1 1 1   10    6   24 o  1394.21   7.2955  1488.08   15.569  1476.96   20.507  1503.20   23.921  1388.84   9.6467  1400.99   11.155 -12.15686 14.74751 
1 1 1   10    6   25 o  243.754   6.4056   45.483   2.3899   47.402   3.4860   43.781   3.2828  248.812   9.1535  239.121   8.9694 9.691620 12.81549 
1 1 1   10    6   26 f  873.461   5.2894  583.988   7.0716  568.731   9.8629  600.128   10.144  861.899   7.4762  885.370   7.4857 -23.47107 10.57969 
1 1 1   10    6   27 o  665.042   5.3755  338.551   5.4719  334.502   8.5678  341.340   7.1111  660.958   8.4689  667.732   6.9577 -6.774292 10.96047 
1 1 1   10    6   28 o  437.731   5.9347  146.678   3.9763  148.168   6.5872  145.824   4.9874  439.853   9.7842  436.422   7.4662 3.430023 12.30748 
1 1 1   10    6   29 o  207.816   10.280   33.079   3.2698   35.599   4.6624   30.640   4.5870  215.036   14.246  199.339   15.147 15.69659 20.79365 
1 1 1   10    6   30 o  464.341   5.8998  165.059   4.1932  166.140   6.6074  164.330   5.4258  465.760   9.2683  463.269   7.6517 2.491028 12.01872 
1 1 1   10    6   31 o  345.141   7.1183   91.207   3.7605   97.546   5.3497   85.016   5.2872  356.861   9.7939  333.136   10.369 23.72516 14.26305 
1 1 1   10    6   32 o  775.600   6.0666  460.543   7.2020  465.398   9.6869  454.541   10.769  779.569   8.1182  770.357   9.1332 9.212402 12.21972 
1 1 1   10    6   33 o  577.323   5.6768  255.167   5.0164  254.447   7.3222  255.804   6.8863  576.396   8.2995  577.956   7.7843 -1.559814 11.37884 
1 1 1   10    6   34 f  581.149   6.2772  258.593   5.5838  257.780   9.2249  259.063   7.0147  580.001   10.391  581.600   7.8798 -1.598938 13.04101 
1 1 1   10    6   35 o  623.317   6.7337  297.523   6.4244  314.695   10.163  286.094   8.2913  640.786   10.362  611.091   8.8643 29.69495 13.63591 
1 1 1   10    6   36 o   81.086   24.740   5.0943   3.3506  -3.3797   4.7294   13.633   4.7475   54.492   24.992  130.773   24.621 -76.28125 35.08300 
1 1 1   10    6   37 o  393.317   6.8301  118.491   4.1119  121.702   6.1322  115.868   5.5426  398.419   10.056  388.802   9.3135 9.617432 13.70607 
1 1 1   10    6   38 o  296.223   7.9748   67.241   3.6159   65.939   5.3816   68.313   4.8820  293.104   11.996  298.422   10.688 -5.317780 16.06634 
1 1 1   10    6   39 o  273.706   9.0771   57.442   3.8028   64.332   6.3788   53.643   4.7365  289.243   14.408  264.335   11.707 24.90817 18.56451 
1 1 1   10    6   40 o  118.118   17.605   10.994   3.0857   15.150   4.5074   7.3274   4.2331  138.180   22.053   95.767   27.458 42.41246 35.21737 
1 1 1   10    6   41 o  526.767   6.9173  212.658   5.5773  217.957   7.8954  207.381   7.8796  532.933   9.6790  519.809   9.9036 13.12408 13.84786 
1 1 1   10    6   42 o  317.119   7.9983   77.123   3.8823   76.210   5.9938   77.783   5.0957  314.774   12.440  318.240   10.461 -3.465576 16.25417 
1 1 1   10    6   43 o  245.177   8.9655   46.138   3.3645   47.113   4.9705   45.313   4.5709  246.994   13.195  242.349   12.363 4.645325 18.08226 
1 1 1   10    6   44 o  162.496   14.242   20.525   3.5064   19.776   4.5610   21.606   5.4830  158.479   19.194  164.987   22.282 -6.508133 29.40911 
1 1 1   10    6   45 f   88.386   22.466   6.3447   3.0458   10.981   4.4920   2.3993   4.1438  115.887   25.968   69.166   27.027 46.72103 37.48029 
1 1 1   10    6   46 f  369.353   8.1601  104.751   4.6133  112.808   8.0203  100.767   5.6396  382.148   13.712  361.930   10.180 20.21747 17.07761 
1 1 1   10    6   47 o  444.861   8.0584  151.998   5.4871  162.007   8.6484  145.255   7.0989  458.180   12.332  434.296   10.679 23.88351 16.31318 
1 1 1   10    6   48 o  237.079   10.280   43.293   3.7306   43.366   5.3193   43.223   5.2334  236.021   14.799  235.690   14.578 0.3307648 20.77363 
1 1 1   10    6   49 o  307.348   8.3594   72.628   3.9326   74.762   5.8070   70.821   5.3447  311.022   12.198  302.871   11.529 8.151031 16.78426 
1 1 1   10    6   50 o  115.389   20.472   10.777   3.4833   10.627   5.2220   10.897   4.6755  112.330   29.859  114.235   27.141 -1.904572 40.35083 
1 1 1   10    6   51 o  157.899   16.128   19.649   3.8432   18.192   6.2095   20.553   4.8929  147.538   28.529  160.183   20.421 -12.64493 35.08414 
1 1 1   10    6   52 o  142.146   16.959   16.035   3.6170   13.342   5.2325   18.500   5.0054  125.878   27.891  150.993   22.332 -25.11441 35.72990 
1 1 1   10    6   53 o  235.131   13.051   43.075   4.6786   54.428   6.9982   33.899   6.2913  262.606   17.511  205.890   20.224 56.71622 26.75173 
1 1 1   10    6   54 o   93.962   24.698   7.4043   3.5988   6.5934   5.1445   8.1814   5.0361   90.719   30.920   98.488   30.380 -7.768745 43.34669 
1 1 1   10    6   55 o  152.599   16.774   18.533   3.8534   19.512   5.5180   17.602   5.3835  153.576   24.282  145.352   25.105 8.224167 34.92675 
1 1 1   10    6   56 o  186.269   16.247   27.524   4.5857   25.722   5.9675   30.122   7.1661  177.214   22.508  190.457   25.201 -13.24315 33.78889 
1 1 1   10    6   57 o   77.732   27.157   4.7198   3.9778   2.3165   5.5989   7.1693   5.6524   73.744   30.483   93.025   32.379 -19.28165 44.47053 
1 1 1   10    6   58 o  145.881   21.580   17.623   4.6731   20.488   6.9937   15.313   6.2812  151.802   31.144  130.405   31.763 21.39673 44.48392 
1 1 1   10    6   59 o   55.249   24.292  -0.3531   3.9700  -0.4352   5.3343  -0.2512   5.9440   63.144   27.943   66.793   29.530 -3.648983 40.65466 
1 1 1   10    6   60 o   54.797   23.836   0.0486   3.7334   0.9735   5.1328  -0.9904   5.4402   65.821   28.287   61.846   27.737 3.975578 39.61699 
1 1 1   10    6   61 o   78.210   26.382   5.2309   3.7449   2.3965   5.1044   8.5349   5.5112   69.676   28.978   95.907   32.006 -26.23109 43.17520 
1 1 1   10    6   62 o   88.218   26.254   7.0646   3.8079   9.1078   5.6663   5.3820   5.1421   97.243   32.453   80.386   30.439 16.85690 44.49446 
1 1 1   10    6   63 o   45.846   21.412  -2.5673   3.7133  -7.4344   4.6590   5.9094   6.1485   43.029   21.065   83.188   32.795 -40.15834 38.97792 
1 1 1   10    7    0 o  610.493   7.2799  285.428   6.8004  285.428   6.8004  285.428   6.8004  610.493   7.2799  610.493   7.2799 0.000000 0.000000 
1 1 1   10    7    1 o  484.884   4.6935  179.973   3.4834  182.193   4.9387  177.775   4.9140  487.814   6.6144  481.863   6.6626 5.951019 9.388275 
1 1 1   10    7    2 o  290.519   5.1519   64.610   2.2909   62.546   2.6893   70.069   4.3740  285.826   6.1471  302.453   9.4482 -16.62659 11.27190 
1 1 1   10    7    3 o  888.754   7.4903  604.838   10.189  596.861   12.229  622.953   18.428  882.764   9.0505  901.432   13.356 -18.66815 16.13389 
1 1 1   10    7    4 o  851.378   8.9125  555.165   11.614  543.143   15.703  569.683   17.256  841.825   12.187  862.052   13.078 -20.22772 17.87636 
1 1 1   10    7    5 o  285.174   11.109   62.314   4.8492   0.0000   0.0000   62.314   4.8492  ?   ?   285.174   11.109 0.000000 11.10949 
1 1 1   10    7    6 o  532.341   7.6725  217.005   6.2517  218.349   8.7741  215.620   8.9100  533.839   10.738  530.479   10.973 3.360229 15.35310 
1 1 1   10    7    7 o  361.212   7.6967   99.911   4.2554  100.233   5.9540   99.575   6.0841  361.695   10.755  360.494   11.026 1.200958 15.40258 
1 1 1   10    7    8 o  513.332   7.8715  201.788   6.1848  201.973   8.6633  201.596   8.8324  513.420   11.024  512.929   11.250 0.4911499 15.75093 
1 1 1   10    7    9 o  808.959   6.3485  501.025   7.8608  495.054   10.799  507.757   11.465  803.983   8.7750  814.203   9.1998 -10.21997 12.71366 
1 1 1   10    7   10 o  857.756   6.5448  563.302   8.5927  559.943   9.8482  574.013   17.587  855.140   7.5240  865.334   13.278 -10.19348 15.26169 
1 1 1   10    7   11 o  352.217   5.1153   94.964   2.7577   96.189   3.1896   91.339   5.4885  354.466   5.8787  345.303   10.384 9.163696 11.93296 
1 1 1   10    7   12 o  240.226   9.2611   44.198   3.4053   44.198   3.4053   0.0000   0.0000  240.226   9.2611  ?   ?  0.000000 9.261132 
1 1 1   10    7   13 o  692.307   6.1797  366.921   6.5484  371.820   9.3556  362.215   9.1689  696.804   8.7719  687.747   8.7101 9.056396 12.36166 
1 1 1   10    7   14 o  929.279   7.1461  661.150   10.164  674.664   14.650  648.607   14.114  938.540   10.198  920.250   10.020 18.28992 14.29710 
1 1 1   10    7   15 o  241.916   5.2266   44.798   1.9353   47.733   2.7048   41.719   2.7703  249.696   7.0770  233.428   7.7536 16.26765 10.49773 
1 1 1   10    7   16 o  910.360   5.3012  634.375   7.3868  645.993   11.474  626.151   9.6536  918.543   8.1608  904.379   6.9738 14.16376 10.73463 
1 1 1   10    7   17 o  646.943   5.2833  320.366   5.2317  315.646   8.1961  323.611   6.7963  642.079   8.3397  650.175   6.8293 -8.096069 10.77915 
1 1 1   10    7   18 o  707.784   5.5062  383.457   5.9652  383.663   9.4704  383.322   7.6802  707.880   8.7405  707.619   7.0909 0.2612915 11.25513 
1 1 1   10    7   19 o  231.067   6.3354   40.870   2.2407   38.561   2.9912   43.823   3.3823  224.422   8.7078  239.238   9.2367 -14.81628 12.69418 
1 1 1   10    7   20 f  608.975   5.6713  283.865   5.2863  281.151   6.6807  288.412   8.6454  606.025   7.2021  613.747   9.2030 -7.722290 11.68610 
1 1 1   10    7   21 o  397.128   4.7399  120.712   2.8811  119.177   4.5365  121.750   3.7300  394.559   7.5118  398.816   6.1103 -4.257172 9.683110 
1 1 1   10    7   22 o  782.467   5.1651  468.634   6.1860  482.676   9.8121  459.371   7.9693  794.022   8.0735  774.658   6.7211 19.36420 10.50499 
1 1 1   10    7   23 o  894.325   5.9405  612.230   8.1318  622.255   11.853  603.314   11.177  901.522   8.5895  887.710   8.2262 13.81244 11.89326 
1 1 1   10    7   24 o  542.690   4.6412  225.422   3.8552  226.544   5.5854  224.401   5.3279  544.002   6.7079  541.428   6.4291 2.573547 9.291307 
1 1 1   10    7   25 o  624.740   5.1658  298.750   4.9398  289.296   7.6420  305.537   6.4742  614.700   8.1222  631.760   6.6952 -17.05994 10.52595 
1 1 1   10    7   26 o  353.017   5.8088   95.395   3.1387   97.543   5.1372   94.116   3.9648  356.905   9.4038  350.617   7.3878 6.288055 11.95871 
1 1 1   10    7   27 o  445.620   7.1075  152.027   4.8479   0.0000   0.0000  152.027   4.8479  ?   ?   445.620   7.1075 0.000000 7.107548 
1 1 1   10    7   28 o  1544.90   8.0101  1827.45   18.941  1844.41   25.401  1806.21   28.427  1551.76   10.694  1535.42   12.096 16.33545 16.14562 
1 1 1   10    7   29 o  662.594   5.1997  336.069   5.2735  342.083   7.7417  330.863   7.2031  668.417   7.5669  657.379   7.1587 11.03766 10.41657 
1 1 1   10    7   30 o  905.968   5.9546  628.342   8.2573  632.272   12.724  625.483   10.853  908.610   9.1493  903.804   7.8451 4.806091 12.05220 
1 1 1   10    7   31 o  192.034   10.428   28.334   3.0537   34.607   4.7586   23.942   3.9818  211.924   14.762  176.066   14.915 35.85870 20.98531 
1 1 1   10    7   32 o  133.391   17.101   13.879   3.4112   17.850   4.7023   9.4684   4.9561  150.976   20.910  108.904   29.154 42.07235 35.87730 
1 1 1   10    7   33 o  368.992   6.7227  104.253   3.7969  104.748   5.6966  103.858   5.0932  369.753   10.065  368.218   9.0369 1.535339 13.52699 
1 1 1   10    7   34 o  444.482   7.4144  151.301   5.0443  137.742   7.7035  161.479   6.6741  423.874   11.874  459.089   9.4978 -35.21490 15.20494 
1 1 1   10    7   35 o  208.823   11.236   33.529   3.5781   35.437   4.8685   31.286   5.2765  214.334   14.933  201.031   17.317 13.30238 22.86641 
1 1 1   10    7   36 o  562.028   5.8810  241.878   5.0592  242.858   7.4416  241.036   6.8987  562.983   8.6357  560.913   8.0353 2.069824 11.79586 
1 1 1   10    7   37 o  722.961   5.7412  400.253   6.3532  407.191   9.2803  394.132   8.7157  728.958   8.3174  717.214   7.9393 11.74414 11.49839 
1 1 1   10    7   38 o  306.824   7.7896   72.139   3.6583   75.252   5.3886   69.478   4.9824  313.158   11.242  300.933   10.817 12.22507 15.60076 
1 1 1   10    7   39 o  195.960   11.467   29.580   3.4244   33.522   5.4979   27.081   4.3771  207.821   17.445  186.956   15.434 20.86552 23.29253 
1 1 1   10    7   40 o   81.776   23.476   5.3143   3.0927   3.5749   4.6178   6.7291   4.1646   77.353   28.940   92.203   27.460 -14.84971 39.89474 
1 1 1   10    7   41 o  404.551   7.5170  125.465   4.6546  126.600   6.4985  124.270   6.6701  406.054   10.456  402.251   10.833 3.802490 15.05617 
1 1 1   10    7   42 o  365.879   7.2583  102.631   4.0648   98.479   6.2439  105.684   5.3550  357.944   11.396  371.059   9.4286 -13.11511 14.79110 
1 1 1   10    7   43 o  288.093   8.0727   63.673   3.5598   65.848   5.2124   61.771   4.8732  292.593   11.639  283.440   11.233 9.152954 16.17507 
1 1 1   10    7   44 o  531.273   6.7068  216.411   5.4539  216.435   7.1955  216.379   8.3610  530.938   8.8541  530.569   10.295 0.3693848 13.57908 
1 1 1   10    7   45 o  201.564   10.788   31.347   3.3163   32.251   4.8717   30.566   4.5271  203.540   15.760  198.273   15.029 5.266312 21.77714 
1 1 1   10    7   46 o  466.812   7.3255  167.228   5.2342  156.006   8.7650  173.448   6.5255  449.639   12.736  475.090   8.9736 -25.45078 15.57949 
1 1 1   10    7   47 o   80.145   24.878   5.0896   3.3712   10.161   4.5329  -1.1879   5.0432  110.847   26.973   61.668   27.235 49.17914 38.33121 
1 1 1   10    7   48 o  235.903   9.7307   42.842   3.5135   44.328   5.1317   41.531   4.8207  238.786   14.103  231.212   13.683 7.574463 19.64960 
1 1 1   10    7   49 o  249.827   9.6084   48.062   3.6742   48.419   5.3794   47.749   5.0302  249.475   14.146  247.971   13.302 1.503433 19.41746 
1 1 1   10    7   50 f   85.532   24.534   5.9918   3.3789   7.8045   5.1182   4.5913   4.4986   97.627   30.711   80.191   28.797 17.43544 42.09993 
1 1 1   10    7   51 o  346.930   8.6162   92.642   4.5754   93.962   7.2433   91.766   5.9019  347.914   13.602  344.612   11.189 3.302582 17.61250 
1 1 1   10    7   52 o  118.135   20.382   11.330   3.5523   14.415   5.2092   8.6487   4.8568  131.288   26.828  101.371   29.512 29.91773 39.88410 
1 1 1   10    7   53 o  121.677   22.719   12.187   4.0756   13.226   5.7277   11.121   5.8004  124.126   30.391  113.593   31.996 10.53342 44.12888 
1 1 1   10    7   54 o  270.369   9.8419   56.466   4.0729   55.906   5.8725   56.985   5.6536  267.250   14.409  270.104   13.720 -2.853882 19.89644 
1 1 1   10    7   55 o   68.897   25.598   3.1949   3.6004   1.1242   5.0560   5.3250   5.1281   67.698   28.543   84.473   30.688 -16.77487 41.91024 
1 1 1   10    7   56 o   75.919   27.607   4.2140   4.1514   4.7846   5.3177   3.3237   6.6429   82.301   31.004   81.692   33.422 0.6087799 45.58858 
1 1 1   10    7   57 o  100.101   27.699   8.6888   4.3875   14.949   7.6121   5.5742   5.3691  126.968   36.942   85.315   31.339 41.65356 48.44403 
1 1 1   10    7   58 o   69.606   26.628   3.2057   3.9602   2.5830   5.1919   4.0719   6.1239   72.310   29.562   81.116   32.485 -8.805794 43.92223 
1 1 1   10    7   59 o   99.149   25.346   8.5676   3.8613   10.205   5.1625   6.4889   5.8173  106.296   30.271   88.888   32.625 17.40802 44.50598 
1 1 1   10    7   60 o  163.474   15.416   21.450   3.8118   13.259   5.1347   31.506   5.6893  121.629   28.140  196.017   19.209 -74.38820 34.07117 
1 1 1   10    7   61 o  175.566   14.608   24.735   3.8900   21.414   5.4148   28.276   5.5920  158.009   23.069  184.090   20.176 -26.08151 30.64707 
1 1 1   10    7   62 o   64.531   24.907   2.9224   3.4859  -1.9677   4.7321   8.7248   5.1547   54.225   24.917   95.658   30.900 -41.43320 39.69513 
1 1 1   10    7   63 o  149.521   18.303   18.725   4.1013   16.439   5.4774   21.643   6.1877  132.838   27.830  153.384   27.359 -20.54604 39.02616 
1 1 1   10    8    0 o   63.718   16.214   3.6528   1.3671   3.6528   1.3671   3.6528   1.3671   63.718   16.214   63.718   16.214 0.000000 0.000000 
1 1 1   10    8    1 o  750.610   5.8031  431.331   6.6672  429.445   9.3750  433.262   9.4835  748.844   8.1792  752.162   8.2374 -3.317505 11.60835 
1 1 1   10    8    2 o  106.063   8.1534   8.6658   1.3135   9.2391   1.5074   6.8573   2.6772  109.454   9.0796   92.759   19.477 16.69463 21.48901 
1 1 1   10    8    3 o  182.586   7.2196   25.527   2.0177   25.421   2.5070   25.722   3.3995  182.181   8.9904  182.789   12.221 -0.6079102 15.17153 
1 1 1   10    8    4 o  235.519   6.7372   42.470   2.4287   40.818   3.0006   45.609   4.1359  230.863   8.4915  243.975   11.075 -13.11185 13.95579 
1 1 1   10    8    5 o  383.178   7.2462  112.424   4.2499  107.480   5.7663  118.304   6.2880  374.570   10.058  392.962   10.454 -18.39200 14.50684 
1 1 1   10    8    6 f  660.363   6.7343  333.882   6.8068  329.984   8.2192  342.394   12.145  656.429   8.1803  668.421   11.870 -11.99249 14.41611 
1 1 1   10    8    7 o  381.256   6.2639  111.284   3.6554  109.597   4.3731  115.198   6.6593  378.322   7.5519  387.742   11.221 -9.420135 13.52525 
1 1 1   10    8    8 o  408.578   6.2701  127.806   3.9212  126.112   4.6860  131.762   7.1616  405.828   7.5439  414.682   11.283 -8.854401 13.57266 
1 1 1   10    8    9 o  613.762   6.7066  288.414   6.3005  287.959   7.6109  289.406   11.231  613.219   8.1087  614.544   11.940 -1.325195 14.43277 
1 1 1   10    8   10 o  485.250   7.7097  180.300   5.7263  180.300   5.7263   0.0000   0.0000  485.250   7.7097  ?   ?  0.000000 7.709739 
1 1 1   10    8   11 o  785.251   5.6901  472.036   6.8391  473.933   8.7406  469.042   10.983  786.760   7.2582  782.586   9.1687 4.174011 11.69386 
1 1 1   10    8   12 o  148.967   8.7412   17.052   1.9844   14.934   2.7675   19.294   2.8469  138.972   13.167  158.247   11.839 -19.27515 17.70723 
1 1 1   10    8   13 o  1295.76   8.9319  1285.72   17.715  1286.84   25.041  1284.59   25.064  1295.94   12.624  1294.80   12.647 1.134399 17.86909 
1 1 1   10    8   14 o  566.158   5.1735  245.355   4.4833  248.043   5.6832  240.928   7.2950  569.218   6.5229  560.937   8.4965 8.281494 10.71163 
1 1 1   10    8   15 o  945.132   6.4495  683.821   9.3301  688.525   12.026  676.709   14.788  948.293   8.2851  940.008   10.278 8.285278 13.20147 
1 1 1   10    8   16 o  401.897   4.7138  123.631   2.8997  123.374   4.0135  123.913   4.1940  401.453   6.5316  402.325   6.8106 -0.8717041 9.436421 
1 1 1   10    8   17 o  575.256   5.9123  253.308   5.2058  245.346   6.9553  263.449   7.8497  566.095   8.0270  586.588   8.7428 -20.49261 11.86886 
1 1 1   10    8   18 o  972.715   6.6711  724.297   9.9323  735.662   12.893  707.706   15.578  980.238   8.5929  961.332   10.587 18.90601 13.63542 
1 1 1   10    8   19 o  598.699   6.0977  274.373   5.5878  270.691   6.4169  285.924   11.366  594.648   7.0501  610.993   12.153 -16.34479 14.05002 
1 1 1   10    8   20 o  1032.61   6.2845  816.212   9.9329  827.787   14.349  805.563   13.764  1039.79   9.0159  1025.75   8.7665 14.04138 12.57527 
1 1 1   10    8   21 o  435.141   5.4925  144.934   3.6582  135.342   6.2698  149.885   4.5044  420.425   9.7430  442.495   6.6506 -22.06995 11.79649 
1 1 1   10    8   22 o  1428.70   7.4094  1562.61   16.203  1588.31   25.245  1544.60   21.130  1440.11   11.453  1420.29   9.7195 19.81750 15.02102 
1 1 1   10    8   23 o  548.620   5.1999  230.383   4.3666  234.497   6.5163  227.030   5.8827  553.447   7.6922  544.579   7.0574 8.867920 10.43925 
1 1 1   10    8   24 o  391.857   5.2150  117.534   3.1279  119.599   4.9848  116.193   4.0171  395.236   8.2398  389.594   6.7365 5.642395 10.64311 
1 1 1   10    8   25 o  705.347   5.2352  380.821   5.6520  373.216   8.6834  386.412   7.4451  698.183   8.1255  710.462   6.8463 -12.27911 10.62523 
1 1 1   10    8   26 o  866.812   6.6794  575.202   8.8621  581.071   21.070  573.940   9.7681  870.622   15.811  865.833   7.3707 4.789307 17.44458 
1 1 1   10    8   27 o  498.670   5.0415  190.346   3.8480  194.145   5.6296  187.015   5.2719  503.570   7.3038  494.246   6.9687 9.324158 10.09499 
1 1 1   10    8   28 o  334.547   6.4611   85.682   3.3085   84.832   4.4678   86.716   4.9231  332.837   8.7699  336.494   9.5586 -3.657104 12.97222 
1 1 1   10    8   29 o  780.148   5.3528  465.903   6.3919  464.988   9.1795  466.764   8.9058  779.284   7.6958  780.783   7.4520 -1.498962 10.71246 
1 1 1   10    8   30 o  822.783   5.7994  518.250   7.3036  525.445   11.307  513.098   9.5672  828.309   8.9185  818.595   7.6357 9.713745 11.74067 
1 1 1   10    8   31 o  278.206   7.4973   59.266   3.1926   60.831   4.7655   57.991   4.3002  281.768   11.050  275.135   10.211 6.633728 15.04536 
1 1 1   10    8   32 o  514.915   6.6026  203.005   5.2038  202.196   7.2429  203.868   7.4815  513.778   9.2102  515.885   9.4747 -2.107117 13.21351 
1 1 1   10    8   33 o  570.027   6.4644  248.794   5.6402  255.352   10.208  245.912   6.7670  577.188   11.555  566.654   7.8020 10.53406 13.94201 
1 1 1   10    8   34 o  706.871   7.0483  382.648   7.6259  361.301   12.245  396.175   9.7471  686.488   11.653  719.123   8.8553 -32.63464 14.63590 
1 1 1   10    8   35 o  430.423   6.6379  141.878   4.3732  144.547   6.2028  139.239   6.1665  434.316   9.3307  426.259   9.4514 8.056427 13.28121 
1 1 1   10    8   36 o  731.779   5.6818  410.051   6.3641  416.101   9.3304  404.787   8.7028  736.932   8.2718  726.888   7.8221 10.04340 11.38458 
1 1 1   10    8   37 o   65.198   22.819   2.9134   2.8092   4.3509   4.1127   1.6562   3.8463   79.159   27.616   64.679   25.799 14.48045 37.79157 
1 1 1   10    8   38 o  257.252   8.3563   50.725   3.2904   50.920   4.8759   50.562   4.4586  257.510   12.371  256.672   11.349 0.8382874 16.78774 
1 1 1   10    8   39 o  276.091   8.5172   58.442   3.5993   67.624   6.1763   53.720   4.4291  296.576   13.606  264.548   10.938 32.02783 17.45741 
1 1 1   10    8   40 o  700.944   6.5148  376.462   6.9897  385.452   10.009  367.904   9.7653  708.843   9.2250  692.521   9.2126 16.32135 13.03739 
1 1 1   10    8   41 o   33.427   16.485  -6.5666   3.0255  -4.2259   4.1389  -9.2526   4.4336   47.678   22.376   40.900   20.128 6.777847 30.09685 
1 1 1   10    8   42 o  276.125   8.4147   58.494   3.5564   56.125   5.4362   60.266   4.7024  270.003   13.154  280.038   10.971 -10.03510 17.12836 
1 1 1   10    8   43 o  204.111   10.116   32.009   3.1603   34.831   4.6822   29.647   4.2831  211.997   14.517  195.525   14.413 16.47127 20.45667 
1 1 1   10    8   44 o  290.000   8.7340   64.572   3.8769   59.922   5.0341   71.349   6.0777  278.995   11.788  304.234   13.052 -25.23920 17.58712 
1 1 1   10    8   45 f  185.413   11.374   26.568   3.2123   16.055   4.5198   37.299   4.5664  141.807   21.498  219.387   13.666 -77.57957 25.47383 
1 1 1   10    8   46 o  278.981   9.5693   59.850   4.0862   49.902   7.1065   64.764   4.9944  252.451   18.520  289.943   11.254 -37.49118 21.67162 
1 1 1   10    8   47 o   63.521   23.941   2.4117   3.1716  -0.9625   4.3131   6.3841   4.6798   57.339   25.262   90.186   29.464 -32.84672 38.81131 
1 1 1   10    8   48 o   78.981   23.410   5.0257   3.0321   5.2322   4.4500   4.8467   4.1426   83.492   28.749   80.569   27.738 2.922905 39.94846 
1 1 1   10    8   49 o  383.919   7.3961  113.223   4.3462  110.421   6.4795  115.515   5.8601  378.236   11.192  387.220   9.8873 -8.984528 14.93386 
1 1 1   10    8   50 o  115.966   19.966   10.866   3.4161   20.095   5.3986   4.7040   4.4116  157.523   23.075   80.404   28.555 77.11866 36.71263 
1 1 1   10    8   51 o  120.782   18.436   11.702   3.3003   13.477   4.8328   10.151   4.5178  127.429   25.665  109.976   27.030 17.45271 37.27394 
1 1 1   10    8   52 o  112.952   23.359   10.549   3.9052   16.481   5.4966   4.5026   5.5494  140.679   26.499   83.088   31.584 57.59076 41.22784 
1 1 1   10    8   53 o  182.582   13.629   26.081   3.7815   18.438   5.5412   32.744   5.1734  149.270   25.146  203.620   16.748 -54.34958 30.21308 
1 1 1   10    8   54 o  187.249   13.135   27.413   3.7408   34.397   5.4834   21.335   5.1161  208.293   17.357  162.291   21.095 46.00227 27.31762 
1 1 1   10    8   55 o  119.860   21.257   11.812   3.7570   12.162   5.2888   11.455   5.3381  118.617   29.302  114.883   30.023 3.733963 41.95226 
1 1 1   10    8   56 o  228.268   13.099   40.796   4.5577   41.280   5.8242   40.031   7.3204  227.985   16.809  221.757   21.851 6.228073 27.56800 
1 1 1   10    8   57 o  193.847   15.193   29.777   4.4717   22.186   7.3945   34.154   5.6147  158.380   31.610  206.323   17.958 -47.94336 36.35537 
1 1 1   10    8   58 o  179.909   15.636   25.818   4.2629   19.415   5.3755   36.667   6.9975  151.721   23.941  210.715   22.021 -58.99429 32.52883 
1 1 1   10    8   59 o  219.049   12.290   37.706   4.1041   21.904   5.7039   54.670   5.9097  160.812   23.900  262.415   14.773 -101.6031 28.09736 
1 1 1   10    8   60 o  124.332   20.003   12.913   3.6776   6.6662   4.9390   20.687   5.5096   87.505   30.278  155.467   23.920 -67.96265 38.58646 
1 1 1   10    8   61 o   95.378   25.596   8.1716   3.8146   13.436   5.6174   3.6663   5.1965  119.401   30.597   74.245   29.857 45.15620 42.75032 
1 1 1   10    8   62 o  185.775   12.997   27.553   3.6724   24.839   5.0482   30.605   5.3523  171.978   19.524  191.946   18.445 -19.96764 26.85850 
1 1 1   10    8   63 f   69.026   27.125   3.4890   4.1934   4.5412   5.9725   2.4659   5.8891   77.819   31.748   71.015   30.403 6.804443 43.95765 
1 1 1   10    9    1 o  263.643   4.6603   53.206   1.8806   52.738   2.6232   53.702   2.6976  262.454   6.5300  264.839   6.6546 -2.385376 9.323329 
1 1 1   10    9    2 o  368.686   6.5902  104.071   3.7190   98.351   4.9305  111.621   5.6644  358.346   8.9892  381.733   9.6945 -23.38690 13.22077 
1 1 1   10    9    3 o  614.524   6.2253  289.119   5.8555  290.971   7.1536  285.359   10.193  616.434   7.5817  610.283   10.912 6.151245 13.28768 
1 1 1   10    9    4 o  437.150   5.6685  146.296   3.7929  145.466   4.5017  148.327   7.0415  435.881   6.7475  440.013   10.455 -4.132141 12.44345 
1 1 1   10    9    5 o   59.719   19.650   2.6130   2.0801  -0.0313   2.6814   6.6088   3.2961   48.431   20.619   90.994   23.501 -42.56318 31.26423 
1 1 1   10    9    6 f  852.907   7.6632  557.031   10.004  548.867   12.080  574.860   17.850  846.523   9.3228  865.958   13.467 -19.43439 16.37922 
1 1 1   10    9    7 o  885.593   7.8423  600.550   10.630  605.091   13.102  591.801   18.185  888.810   9.6308  878.638   13.522 10.17194 16.60097 
1 1 1   10    9    8 o  677.415   6.9375  351.344   7.1933  346.433   8.6626  362.252   12.910  672.597   8.4144  687.543   12.268 -14.94543 14.87609 
1 1 1   10    9    9 o  649.044   8.3464  322.586   8.2917  322.586   8.2917   0.0000   0.0000  649.044   8.3464  ?   ?  0.000000 8.346390 
1 1 1   10    9   10 o  912.842   8.1162  638.066   11.340  651.012   14.036  613.730   19.244  921.931   9.9465  894.783   14.051 27.14868 17.21550 
1 1 1   10    9   11 o  745.374   7.3726  425.374   8.4113  424.968   10.173  426.251   14.956  744.946   8.9216  745.804   13.101 -0.8579712 15.85036 
1 1 1   10    9   12 o  700.352   6.2885  375.489   6.7412  385.601   9.6310  365.777   9.4388  709.619   8.8670  691.134   8.9225 18.48462 12.57913 
1 1 1   10    9   13 o  639.832   5.3293  313.369   5.2192  314.753   6.6093  311.076   8.5069  641.206   6.7343  637.382   8.7197 3.824219 11.01742 
1 1 1   10    9   14 o   96.969   10.302   7.2823   1.5056   6.6724   1.7760   8.8405   2.8387   92.432   12.905  105.882   18.170 -13.44918 22.28647 
1 1 1   10    9   15 o  531.985   5.2064  216.625   4.2394  218.243   5.3523  213.901   6.9449  533.942   6.5490  528.555   8.5843 5.386841 10.79725 
1 1 1   10    9   16 o  107.546   11.729   8.9640   1.8995   9.5438   2.0063   3.9519   5.8986  110.979   12.002   85.682   32.564 25.29607 34.70560 
1 1 1   10    9   17 o  1021.08   7.6263  798.174   11.919  786.927   16.287  811.144   17.490  1013.72   10.497  1029.16   11.103 -15.44360 15.27913 
1 1 1   10    9   18 o  620.651   5.0656  294.845   4.8122  303.725   6.8279  286.080   6.7834  629.888   7.0819  611.313   7.2496 18.57526 10.13458 
1 1 1   10    9   19 o  897.382   5.8795  616.414   8.0758  618.479   11.335  614.285   11.509  898.806   8.2390  895.747   8.3943 3.058594 11.76203 
1 1 1   10    9   20 o  869.066   5.8332  578.126   7.7594  586.656   10.997  569.670   10.950  875.378   8.2078  862.609   8.2931 12.76904 11.66806 
1 1 1   10    9   21 o  608.292   7.3723  283.263   6.8641  283.263   6.8641   0.0000   0.0000  608.292   7.3723  ?   ?  0.000000 7.372274 
1 1 1   10    9   22 o  644.034   5.2264  317.485   5.1520  326.909   7.6155  309.531   6.9960  653.467   7.6138  635.873   7.1880 17.59454 10.47081 
1 1 1   10    9   23 o  919.970   6.0254  647.857   8.4846  649.518   12.192  646.297   11.815  921.046   8.6481  918.770   8.4015 2.275757 12.05719 
1 1 1   10    9   24 o  1095.93   6.2478  919.411   10.480  929.697   16.285  912.138   13.693  1101.86   9.6557  1091.49   8.1961 10.36682 12.66525 
1 1 1   10    9   25 o  536.545   5.4768  220.362   4.4978  213.827   7.8982  223.499   5.4717  528.416   9.7652  540.325   6.6160 -11.90967 11.79539 
1 1 1   10    9   26 o  498.822   5.8303  190.473   4.4515  197.444   8.7618  188.048   5.1682  507.703   11.275  495.614   6.8128 12.08856 13.17340 
1 1 1   10    9   27 o  865.941   6.2373  574.040   8.2672  580.904   11.987  567.812   11.417  870.968   8.9915  861.116   8.6622 9.852173 12.48517 
1 1 1   10    9   28 o  226.116   8.4738   39.151   2.9328   31.592   4.9495   43.242   3.6407  202.327   16.116  237.607   10.011 -35.28029 18.97196 
1 1 1   10    9   29 o  677.382   7.1865  351.316   7.4511   0.0000   0.0000  351.316   7.4511  ?   ?   677.382   7.1865 0.000000 7.186540 
1 1 1   10    9   30 o  707.350   5.3377  383.020   5.7791  376.014   8.2106  389.898   8.1357  700.755   7.6549  713.585   7.4486 -12.83069 10.68077 
1 1 1   10    9   31 o  312.457   6.9152   74.753   3.3073   83.226   5.0660   68.460   4.3660  329.604   10.042  298.953   9.5414 30.65149 13.85180 
1 1 1   10    9   32 o  417.620   6.7920  133.542   4.3416  128.169   5.6859  141.055   6.7236  409.052   9.0814  429.071   10.238 -20.01871 13.68511 
1 1 1   10    9   33 o  123.486   18.187   11.965   3.3345   16.688   5.6058   9.3792   4.1483  144.881   26.245  108.134   25.481 36.74754 36.57971 
1 1 1   10    9   34 o  547.775   5.9127  229.749   4.9574  235.279   7.7975  225.996   6.4226  554.140   9.1932  543.191   7.7248 10.94916 12.00781 
1 1 1   10    9   35 o  233.848   9.3928   41.909   3.3620   37.631   4.9348   45.615   4.5928  220.887   14.679  243.533   12.361 -22.64635 19.19092 
1 1 1   10    9   36 o  198.952   10.523   30.437   3.1932   38.787   5.0089   24.720   4.1447  224.218   14.676  178.701   15.300 45.51717 21.20107 
1 1 1   10    9   37 o  691.685   5.6524  366.387   5.9842  363.197   8.6178  369.358   8.3162  688.422   8.1785  694.277   7.8257 -5.854431 11.31940 
1 1 1   10    9   38 o  107.949   18.738   9.2440   2.9838   13.332   4.7914   6.6541   3.8136  128.905   25.187   91.384   26.015 37.52148 36.21018 
1 1 1   10    9   39 o  257.231   8.9422   50.744   3.5208   52.278   6.1139   49.983   4.3065  260.109   15.425  255.157   11.027 4.951797 18.96140 
1 1 1   10    9   40 o  486.302   6.5770  181.217   4.8955  188.753   6.6335  172.204   7.2549  496.072   8.7363  473.662   10.007 22.40967 13.28371 
1 1 1   10    9   41 o  224.726   9.2998   38.758   3.1989   35.784   4.8695   41.015   4.2428  214.964   14.891  230.648   12.060 -15.68391 19.16222 
1 1 1   10    9   42 o  376.858   7.9228  108.936   4.5701  103.936   7.5921  111.777   5.7231  367.325   13.503  381.514   9.8006 -14.18924 16.68514 
1 1 1   10    9   43 o  362.084   6.9088  100.527   3.8290   97.734   5.5521  103.060   5.2876  356.625   10.171  366.319   9.4304 -9.693695 13.87035 
1 1 1   10    9   44 o  182.023   12.372   25.643   3.4264   20.642   4.4317   33.075   5.4028  162.090   18.176  205.838   17.309 -43.74828 25.09889 
1 1 1   10    9   45 o  128.309   17.287   13.003   3.3086   18.532   6.0229   10.613   3.9596  150.868   27.077  114.274   23.424 36.59390 35.80309 
1 1 1   10    9   46 o  223.524   10.670   38.473   3.6506   34.992   4.9197   42.738   5.4457  211.968   15.266  234.360   15.264 -22.39275 21.58804 
1 1 1   10    9   47 o  145.952   13.991   16.640   3.0872   15.046   4.5617   17.986   4.1934  136.485   22.628  150.688   18.574 -14.20262 29.27539 
1 1 1   10    9   48 o  135.549   15.230   14.444   3.1052   11.846   4.6404   16.551   4.1786  119.666   26.072  144.097   19.442 -24.43048 32.52283 
1 1 1   10    9   49 o  316.043   8.1527   76.794   3.9438   74.335   5.9047   78.774   5.2991  310.000   12.444  319.531   10.835 -9.531006 16.50005 
1 1 1   10    9   50 o   93.403   23.313   7.2101   3.3224   5.3957   5.4078   8.3102   4.2108   86.760   31.515   99.801   26.938 -13.04158 41.45922 
1 1 1   10    9   51 o   94.980   22.776   7.4632   3.2683   10.909   4.9370   4.7747   4.3607  113.625   28.451   80.380   28.406 33.24534 40.20404 
1 1 1   10    9   52 o  178.136   14.222   24.857   3.8454   23.920   5.1678   26.019   5.7560  172.849   19.896  179.786   21.333 -6.936569 29.17097 
1 1 1   10    9   53 o   75.697   25.285   4.4751   3.4398   2.2674   5.1480   6.2558   4.6233   72.482   29.512   88.145   29.310 -15.66328 41.59321 
1 1 1   10    9   54 f  135.907   18.097   14.825   3.6710   17.931   5.3135   11.988   5.0777  147.132   24.452  118.330   28.397 28.80209 37.47412 
1 1 1   10    9   55 o  166.004   17.627   22.016   4.4104   20.105   5.6700   24.943   7.0181  155.527   24.639  171.961   27.597 -16.43404 36.99591 
1 1 1   10    9   56 o  260.161   10.777   52.515   4.2914   56.543   6.1811   48.767   5.9628  267.792   15.142  248.327   15.769 19.46396 21.86212 
1 1 1   10    9   57 o  194.059   16.154   29.998   4.7547   29.043   7.3862   30.673   6.2132  184.798   26.902  193.502   21.332 -8.704407 34.33369 
1 1 1   10    9   58 o   57.519   24.371   0.7257   3.7152  -5.0373   5.0064   7.7892   5.5426   50.590   24.003   94.583   32.094 -43.99306 40.07724 
1 1 1   10    9   59 o  111.238   22.631   10.546   3.7222   9.4946   5.2041   11.647   5.3259  102.304   30.748  113.226   30.182 -10.92150 43.08590 
1 1 1   10    9   60 o  189.400   13.149   28.448   3.7883   27.528   5.2635   29.438   5.4566  182.838   19.089  189.107   19.114 -6.269470 27.01353 
1 1 1   10    9   61 f   99.551   25.724   8.9415   3.9479   14.937   5.9316   4.1735   5.2897  125.424   31.061   76.237   30.303 49.18688 43.39401 
1 1 1   10    9   62 o   84.538   25.523   6.4824   3.5799   8.3697   5.0462   4.5701   5.0794   93.565   30.597   76.404   29.904 17.16155 42.78362 
1 1 1   10   10    0 o  838.629   12.613  539.002   16.182  539.002   16.182  539.002   16.182  838.629   12.613  838.629   12.613 0.000000 0.000000 
1 1 1   10   10    1 o  1174.69   11.347  1057.30   20.402  1102.10   30.110  1019.28   27.741  1198.55   16.413  1152.75   15.722 45.79761 22.72844 
1 1 1   10   10    2 o  948.665   7.9370  689.151   11.525  693.628   14.160  680.364   19.836  951.605   9.7217  942.057   13.757 9.548767 16.84502 
1 1 1   10   10    3 o  458.471   5.7238  160.913   4.0166  159.692   4.8252  163.667   7.2485  456.698   6.9027  462.228   10.245 -5.530060 12.35365 
1 1 1   10   10    4 o  574.233   6.1544  252.443   5.4093  247.989   6.4369  263.148   9.9799  569.103   7.3895  586.059   11.125 -16.95587 13.35588 
1 1 1   10   10    5 o  1141.37   11.253  998.090   19.660  1002.33   27.833  993.864   27.774  1143.16   15.907  1138.32   15.941 4.845825 22.51939 
1 1 1   10   10    6 o  966.173   8.2932  714.834   12.264  714.892   15.014  714.716   21.260  966.071   10.154  965.525   14.386 0.5469360 17.60833 
1 1 1   10   10    7 o  625.463   6.7467  299.507   6.4589  291.211   7.7313  318.676   11.752  616.684   8.1906  644.909   11.906 -28.22479 14.45088 
1 1 1   10   10    9 o  508.259   6.5830  197.768   5.1213  201.703   6.2051  189.361   9.0699  513.253   7.8986  497.149   11.919 16.10382 14.29876 
1 1 1   10   10   10 f  1158.44   8.2039  1027.56   14.547  1026.06   20.491  1029.07   20.654  1157.32   11.568  1159.01   11.643 -1.687988 16.41224 
1 1 1   10   10   11 o  636.786   8.5134  310.489   8.2979  310.489   8.2979   0.0000   0.0000  636.786   8.5134  ?   ?  0.000000 8.513398 
1 1 1   10   10   12 o  522.793   6.8138  209.234   5.4524  208.616   6.4853  210.725   10.070  521.987   8.1171  524.460   12.544 -2.473755 14.94148 
1 1 1   10   10   13 o  801.080   7.7512  491.308   9.5042  495.095   11.553  483.379   16.717  804.091   9.3868  794.269   13.751 9.821228 16.64904 
1 1 1   10   10   14 o  908.185   8.2921  631.488   11.527  629.612   13.928  635.565   20.535  906.750   10.035  910.714   14.731 -3.963928 17.82452 
1 1 1   10   10   15 o  543.477   5.8835  226.093   4.8942  222.882   5.4335  239.901   11.269  539.592   6.5787  559.610   13.156 -20.01831 14.70895 
1 1 1   10   10   16 o  251.545   6.4756   48.436   2.4932   49.110   3.1770   47.356   4.0228  253.273   8.1953  248.676   10.569 4.596008 13.37383 
1 1 1   10   10   17 o  163.351   9.9651   20.508   2.4797   16.644   3.3452   25.220   3.6943  146.609   15.124  180.949   13.434 -34.34016 20.22919 
1 1 1   10   10   18 o  266.076   6.1503   54.192   2.5048   55.651   3.0878   51.384   4.2832  269.621   7.4822  259.039   10.803 10.58252 13.14075 
1 1 1   10   10   19 o  1353.79   8.4477  1403.14   17.505  1458.52   28.859  1370.90   22.018  1379.83   13.664  1337.99   10.751 41.84424 17.38659 
1 1 1   10   10   20 o  108.494   11.310   9.1124   1.8506   10.007   2.5507   8.1176   2.6892  113.287   15.085  101.399   17.986 11.88863 23.47388 
1 1 1   10   10   21 o  1122.74   6.7896  964.965   11.668  976.229   16.591  953.942   16.412  1129.14   9.5997  1116.17   9.6066 12.96338 13.58090 
1 1 1   10   10   22 f  529.885   5.6990  214.923   4.6222  209.777   5.9400  222.823   7.3592  523.468   7.4136  539.462   8.9125 -15.99414 11.59288 
1 1 1   10   10   23 o  813.463   7.0428  506.578   8.7691  506.271   12.406  506.884   12.397  813.094   9.9681  813.587   9.9550 -0.4925537 14.08776 
1 1 1   10   10   24 o  412.782   6.8129  130.440   4.3045  128.333   6.1174  132.507   6.0580  409.370   9.7629  415.980   9.5145 -6.609955 13.63236 
1 1 1   10   10   25 o  453.540   6.1665  157.465   4.2808  148.266   7.7084  161.567   5.1475  439.954   11.447  459.385   7.3206 -19.43158 13.58760 
1 1 1   10   10   26 o  383.185   7.1223  112.413   4.1773  100.643   7.6107  117.488   4.9974  362.390   13.721  391.712   8.3350 -29.32242 16.05403 
1 1 1   10   10   27 o  316.633   6.4446   76.752   3.1234   74.442   5.1432   78.102   3.9313  311.742   10.779  319.377   8.0420 -7.634460 13.44816 
1 1 1   10   10   28 o  557.144   5.4902  237.620   4.6820  251.346   7.7477  229.723   5.8763  572.897   8.8354  547.765   7.0087 25.13159 11.27773 
1 1 1   10   10   29 o  1050.56   6.8181  845.005   10.964  872.527   19.820  832.870   13.160  1067.06   12.135  1042.89   8.2444 24.16626 14.67081 
1 1 1   10   10   30 o  351.473   6.7401   94.582   3.6260   92.999   6.1082   95.444   4.5058  348.376   11.455  353.030   8.3386 -4.653320 14.16867 
1 1 1   10   10   31 o  280.027   9.4042   60.067   4.0308   56.368   5.9748   63.157   5.4607  270.713   14.472  287.041   12.429 -16.32877 19.07637 
1 1 1   10   10   32 o  499.592   7.7743  191.149   5.9449  190.768   7.9334  191.637   8.9779  498.958   10.388  500.008   11.731 -1.049591 15.66904 
1 1 1   10   10   33 o  554.948   6.1443  235.807   5.2191  233.324   8.6019  237.254   6.5657  551.784   10.185  556.570   7.7071 -4.786560 12.77228 
1 1 1   10   10   34 o  118.785   16.202   11.039   2.8689   15.704   4.1908   6.9234   3.9358  141.475   19.903   93.405   26.373 48.07022 33.04005 
1 1 1   10   10   35 o  472.317   5.9194  170.830   4.2794  181.277   6.4117  162.438   5.7467  486.385   8.6124  460.448   8.1539 25.93661 11.85999 
1 1 1   10   10   36 o  605.907   5.8457  281.149   5.4214  298.721   8.5501  269.333   7.0111  624.282   8.9478  592.894   7.7257 31.38727 11.82162 
1 1 1   10   10   37 o  469.476   6.0091  168.813   4.3181  174.966   6.7424  164.534   5.6224  477.702   9.2212  463.354   7.9275 14.34802 12.16046 
1 1 1   10   10   38 o  498.761   6.8832  190.601   5.2548  191.902   10.636  190.181   6.0438  499.573   13.910  498.117   7.9270 1.455750 16.01023 
1 1 1   10   10   39 o  419.271   6.2729  134.678   4.0256  142.000   5.9993  128.681   5.4295  430.261   9.1096  409.631   8.6596 20.62979 12.56873 
1 1 1   10   10   40 o  312.161   7.6299   74.708   3.6456   74.329   4.9451   75.159   5.3956  311.135   10.384  312.776   11.270 -1.641449 15.32457 
1 1 1   10   10   41 o  155.022   12.302   18.600   2.8951   21.834   4.4135   16.157   3.8358  167.163   17.509  143.463   17.854 23.69980 25.00677 
1 1 1   10   10   42 o  383.513   6.5186  112.742   3.8265  111.816   5.5284  113.593   5.3017  381.601   9.4650  384.682   9.0041 -3.081329 13.06371 
1 1 1   10   10   43 o   68.324   22.189   3.5381   2.6555   2.0329   3.7368   5.0738   3.7745   65.241   25.616   81.388   26.455 -16.14692 36.82431 
1 1 1   10   10   44 o  316.387   8.1421   76.841   3.9430   71.286   5.0544   85.477   6.3023  304.380   10.849  333.037   12.363 -28.65704 16.44845 
1 1 1   10   10   45 o  196.888   12.230   30.005   3.6674   35.100   6.4723   27.595   4.4509  211.055   20.285  188.109   15.599 22.94701 25.58939 
1 1 1   10   10   46 f  334.843   7.5583   86.082   3.8738   85.761   5.4622   86.407   5.4946  333.682   10.695  334.933   10.718 -1.250061 15.14095 
1 1 1   10   10   47 o   44.738   19.934  -0.9894   2.7615  -1.5363   3.9916  -0.4873   3.8243   53.162   23.806   55.292   24.087 -2.130001 33.86667 
1 1 1   10   10   48 o  163.885   12.768   20.898   3.1775   17.565   4.6575   23.801   4.3461  147.957   21.169  174.047   16.512 -26.08997 26.84712 
1 1 1   10   10   49 o  175.232   12.027   23.850   3.2063   26.062   4.6729   21.882   4.4074  181.941   16.976  166.412   17.569 15.52911 24.43036 
1 1 1   10   10   50 o   44.676   20.372  -1.8210   3.0831  -6.4577   4.6645   1.7765   4.1086   46.601   22.397   65.534   26.480 -18.93331 34.68117 
1 1 1   10   10   51 o  199.954   11.439   31.024   3.4864   39.061   5.3050   24.914   4.6256  223.182   15.628  177.502   17.243 45.67961 23.27137 
1 1 1   10   10   52 o  202.777   12.744   32.039   3.9353   27.573   5.2079   37.983   6.0081  186.182   18.521  218.960   18.089 -32.77785 25.88857 
1 1 1   10   10   53 o  254.906   9.9422   50.193   3.8791   48.097   5.6406   52.073   5.3432  247.665   14.950  258.273   13.564 -10.60791 20.18580 
1 1 1   10   10   54 o  123.214   20.280   12.378   3.6916   12.299   5.4314   12.445   5.0327  119.298   29.825  120.737   27.806 -1.439667 40.77641 
1 1 1   10   10   55 o   66.235   26.535   2.1630   4.0875   1.8680   5.2494   2.6174   6.5146   70.993   29.445   79.087   32.802 -8.093689 44.07883 
1 1 1   10   10   56 o   74.992   26.498   4.3003   3.7943   8.4989   5.5075   0.5074   5.2346   99.084   31.933   66.141   28.497 32.94338 42.79966 
1 1 1   10   10   57 o   62.091   25.670   1.4487   3.9715  -1.8387   5.1662   6.1983   6.2098   58.855   26.655   89.379   33.536 -30.52404 42.83882 
1 1 1   10   10   58 o   63.725   25.060   2.3689   3.5816   4.3803   5.0044   0.2567   5.1283   78.277   29.936   64.058   27.900 14.21920 40.92161 
1 1 1   10   10   59 o  186.769   13.702   27.662   3.8896   18.195   5.2987   38.724   5.7277  145.571   24.661  219.025   17.224 -73.45381 30.08080 
1 1 1   10   10   60 o  185.655   13.749   27.464   3.8793   30.579   5.3100   23.898   5.6811  193.194   18.171  167.558   22.739 25.63602 29.10703 
1 1 1   10   10   61 o  228.313   12.460   41.344   4.3377   38.847   6.6336   43.210   5.7334  215.111   20.391  230.549   16.353 -15.43721 26.13828 
1 1 1   10   10   62 o   57.551   24.656   0.9122   3.8780   8.1782   5.2650  -7.7053   5.7337   92.253   31.280   49.115   23.896 43.13777 39.36354 
1 1 1   10   11    0 o  158.880   8.7276   19.499   2.1078   19.499   2.1078   19.499   2.1078  158.880   8.7276  158.880   8.7276 0.000000 0.000000 
1 1 1   10   11    1 o  323.236   5.6627   79.983   2.8017   77.450   3.3679   85.674   5.0484  318.056   6.9181  334.447   9.8618 -16.39075 12.04636 
1 1 1   10   11    2 o  1053.77   8.5946  850.355   13.863  837.258   16.655  879.889   25.010  1045.47   10.408  1071.21   15.253 -25.73120 18.46604 
1 1 1   10   11    3 o  409.652   5.7432  128.466   3.6011  128.719   4.3358  127.904   6.4658  410.031   6.9085  408.629   10.338 1.401581 12.43358 
1 1 1   10   11    4 o  797.800   7.2175  487.319   8.8136  480.998   10.592  501.543   15.890  792.532   8.7317  808.989   12.833 -16.45709 15.52167 
1 1 1   10   11    5 o  636.578   8.0893  310.292   7.8819  310.018   10.990  310.582   11.310  636.138   11.287  636.699   11.605 -0.5606079 16.18912 
1 1 1   10   11    6 o  355.754   6.2940   96.888   3.4273   95.865   4.1440   99.104   6.0968  353.843   7.6514  359.682   11.074 -5.838837 13.46041 
1 1 1   10   11    7 o  904.992   9.7846  627.250   13.554  627.250   13.554   0.0000   0.0000  904.992   9.7846  ?   ?  0.000000 9.784589 
1 1 1   10   11    8 o  647.387   6.9371  320.862   6.8741  340.568   8.6574  287.242   11.308  666.914   8.4810  612.317   12.065 54.59717 14.74778 
1 1 1   10   11    9 o  779.353   7.4598  465.024   8.8987  458.586   10.705  479.426   16.010  773.870   9.0372  791.004   13.223 -17.13452 16.01649 
1 1 1   10   11   10 o  389.472   8.0837  116.139   4.8190  116.139   4.8190   0.0000   0.0000  389.472   8.0837  ?   ?  0.000000 8.083729 
1 1 1   10   11   11 o  862.888   7.9614  570.062   10.515  570.976   12.815  568.178   18.395  863.497   9.6962  861.105   13.956 2.391479 16.99404 
1 1 1   10   11   12 o  162.947   10.362   20.416   2.5708   20.439   2.9326   20.338   5.3432  162.923   11.841  161.276   22.237 1.647232 25.19271 
1 1 1   10   11   13 o  740.124   7.5336  419.362   8.5345  412.082   10.203  436.321   15.572  733.617   9.0867  754.672   13.481 -21.05499 16.25738 
1 1 1   10   11   14 o  172.040   10.903   22.757   2.8563   23.880   3.2609   19.058   5.9199  176.152   12.169  155.479   25.779 20.67284 28.50678 
1 1 1   10   11   15 o  422.202   14.008  136.562   9.0522   0.0000   0.0000  136.562   9.0522  ?   ?   422.202   14.008 0.000000 14.00761 
1 1 1   10   11   16 o  1262.43   8.8271  1220.20   17.057  1252.12   24.502  1190.18   23.759  1278.58   12.520  1246.56   12.452 32.01880 17.65804 
1 1 1   10   11   17 o  620.920   8.9786  295.183   8.5333  295.183   8.5333   0.0000   0.0000  620.920   8.9786  ?   ?  0.000000 8.978649 
1 1 1   10   11   18 o  401.897   5.5565  123.634   3.4181  123.349   4.1943  124.198   5.8979  401.416   6.8265  402.750   9.5673 -1.333221 11.75310 
1 1 1   10   11   19 o  650.798   5.7819  324.197   5.7595  319.195   7.1661  333.323   9.6797  645.726   7.2504  659.792   9.5848 -14.06665 12.01823 
1 1 1   10   11   20 o  377.436   5.9301  109.046   3.4259  106.336   4.2415  114.132   5.8107  372.697   7.4353  386.073   9.8331 -13.37610 12.32775 
1 1 1   10   11   21 o  1349.93   8.4180  1395.20   17.394  1381.14   22.153  1417.80   28.086  1342.93   10.777  1360.39   13.488 -17.45435 17.26519 
1 1 1   10   11   22 o  535.332   5.8944  219.370   4.8298  216.239   7.2975  221.811   6.4429  531.425   8.9715  538.260   7.8202 -6.834778 11.90135 
1 1 1   10   11   23 o  1642.76   9.0423  2066.38   22.736  2058.93   32.052  2073.93   32.257  1639.37   12.774  1645.32   12.809 -5.955933 18.08937 
1 1 1   10   11   24 o  422.974   5.9166  136.952   3.8305  139.382   5.4454  134.571   5.3894  426.661   8.3382  419.231   8.3988 7.429626 11.83499 
1 1 1   10   11   25 o  518.797   8.6045  206.093   6.8327  208.816   8.8890  202.161   10.682  522.120   11.123  513.622   13.588 8.498474 17.55960 
1 1 1   10   11   26 o  465.449   6.5363  165.853   4.6566  176.939   6.3609  153.051   6.8357  480.695   8.6453  447.028   9.9903 33.66742 13.21158 
1 1 1   10   11   27 o  965.121   7.1628  713.153   10.581  722.908   14.004  700.174   16.153  971.553   9.4171  956.026   11.039 15.52649 14.50980 
1 1 1   10   11   28 o  515.191   5.9267  203.193   4.6736  204.166   8.4163  202.759   5.6197  516.249   10.651  514.606   7.1346 1.643433 12.81979 
1 1 1   10   11   29 o  1035.75   6.7867  821.357   10.759  830.119   18.915  817.165   13.082  1040.80   11.873  1032.99   8.2738 7.807129 14.47151 
1 1 1   10   11   30 o  443.539   6.4299  150.620   4.3652  148.753   6.7883  151.937   5.7000  440.648   10.065  445.410   8.3607 -4.762146 13.08430 
1 1 1   10   11   31 o  265.389   10.441   53.967   4.2413   61.040   5.7737   45.675   6.2509  282.138   13.370  243.337   16.887 38.80110 21.53910 
1 1 1   10   11   32 o  302.189   7.5672   69.936   3.5001   85.808   6.2787   62.780   4.2160  334.537   12.262  286.248   9.6225 48.28824 15.58666 
1 1 1   10   11   33 o  371.774   6.7906  105.847   3.8642  119.358   6.7503   99.261   4.7128  394.575   11.177  359.955   8.5538 34.61984 14.07447 
1 1 1   10   11   34 o  362.987   7.3357  100.924   4.0757  106.255   6.8399   97.989   5.0751  372.184   12.007  357.580   9.2726 14.60486 15.17037 
1 1 1   10   11   35 o   95.625   20.944   7.3255   2.9806   16.912   5.5846   3.5071   3.5245  145.653   26.004   72.142   25.533 73.51138 36.44374 
1 1 1   10   11   36 o  446.114   6.6184  152.447   4.5192  159.118   7.5418  148.710   5.6450  455.430   10.819  440.494   8.3724 14.93628 13.68013 
1 1 1   10   11   37 o  962.147   6.8792  709.242   10.131  687.436   17.419  720.389   12.454  946.185   12.027  969.422   8.3932 -23.23633 14.66636 
1 1 1   10   11   38 o  175.773   11.730   23.834   3.1377   30.155   5.8276   21.253   3.7235  196.575   19.631  165.520   14.855 31.05502 24.61814 
1 1 1   10   11   39 o  154.384   13.216   18.465   3.0928   20.873   4.3483   15.999   4.4000  163.490   17.657  142.256   20.824 21.23473 27.30196 
1 1 1   10   11   40 o   52.086   21.228   0.8153   2.6669  -0.4737   4.0070   1.8402   3.5732   57.217   24.791   63.535   25.016 -6.318157 35.21935 
1 1 1   10   11   41 o  320.613   7.2114   78.813   3.5389   81.282   5.3891   76.941   4.6925  325.225   10.826  316.550   9.6848 8.675232 14.52564 
1 1 1   10   11   42 o  180.341   10.439   25.079   2.8692   21.820   4.2239   27.870   3.9095  167.133   16.736  189.681   13.555 -22.54752 21.53693 
1 1 1   10   11   43 o  442.836   6.9994  150.397   4.7443  147.965   7.9745  151.730   5.9025  438.372   11.885  444.543   8.6747 -6.170532 14.71386 
1 1 1   10   11   44 o  325.977   8.5574   81.607   4.2697   78.308   5.3008   87.701   7.2047  318.981   10.857  336.953   13.969 -17.97119 17.69227 
1 1 1   10   11   45 f  400.891   7.6104  123.372   4.6699  117.173   7.4607  127.365   5.9879  389.681   12.508  406.958   9.6130 -17.27667 15.77550 
1 1 1   10   11   46 o  123.600   15.367   12.027   2.8444   11.223   4.0882   12.782   3.9601  117.264   23.594  125.974   21.297 -8.710228 31.78414 
1 1 1   10   11   47 o   80.674   21.654   5.3051   2.7299   10.144   4.1441   1.5958   3.6284  110.889   25.012   62.140   24.963 48.74855 35.33717 
1 1 1   10   11   48 o  188.233   10.912   27.424   3.1303   27.090   4.6104   27.710   4.2637  185.782   16.381  188.307   14.915 -2.524719 22.15351 
1 1 1   10   11   49 o  123.096   15.918   11.995   2.9289   14.531   4.4215   10.013   3.9097  133.754   22.388  110.152   23.878 23.60162 32.73195 
1 1 1   10   11   50 o  166.213   13.746   21.594   3.4657   21.049   5.6572   21.922   4.3848  160.873   23.683  166.428   17.474 -5.555328 29.43187 
1 1 1   10   11   51 o   87.129   24.816   6.2774   3.4692   6.3620   4.7053   6.1767   5.1353   89.181   29.564   89.192   30.873 -0.1074982E-01 42.74572 
1 1 1   10   11   52 o  248.178   9.8488   47.550   3.7412   44.680   5.5065   50.011   5.0988  238.712   15.149  253.319   13.196 -14.60710 20.09043 
1 1 1   10   11   53 o  317.406   8.4465   77.634   4.1036   73.573   5.9037   81.431   5.7078  307.727   12.534  324.127   11.505 -16.40021 17.01374 
1 1 1   10   11   54 o  157.395   14.927   19.560   3.5530   15.074   5.0787   23.860   4.9725  133.945   25.706  172.362   19.173 -38.41747 32.06886 
1 1 1   10   11   55 f  198.559   14.035   30.994   4.2382   29.743   5.3747   33.052   6.8916  192.650   18.453  200.873   22.819 -8.223770 29.34660 
1 1 1   10   11   56 o  112.245   25.062   10.755   4.1968   18.286   7.1313   6.7650   5.1910  142.545   33.288   90.301   31.052 52.24417 45.52288 
1 1 1   10   11   57 o  232.778   14.016   42.766   4.9704   33.415   7.4174   50.387   6.6962  199.267   24.860  250.621   17.567 -51.35338 30.44031 
1 1 1   10   11   58 o  129.752   18.492   13.789   3.5686   11.104   4.9668   16.655   5.1309  111.421   28.884  139.390   24.965 -27.96931 38.17771 
1 1 1   10   11   59 o  156.996   15.390   19.797   3.6507   17.923   5.0946   21.775   5.2339  144.743   23.825  161.113   21.783 -16.37042 32.28144 
1 1 1   10   11   60 o   77.882   25.285   5.2488   3.4483   4.7403   4.7429   5.8189   5.0225   77.486   29.260   82.843   30.329 -5.356781 42.14200 
1 1 1   10   11   61 f   60.323   24.548   1.9500   3.5593   2.6257   5.2954   1.3931   4.8072   70.284   29.397   64.188   27.474 6.095871 40.23704 
1 1 1   10   11   62 o  110.996   25.007   11.180   4.1467   2.9832   5.8227   19.616   5.9069   72.567   30.615  145.895   27.459 -73.32800 41.12513 
1 1 1   10   12    0 o  606.734   7.7916  281.936   7.2333  281.936   7.2333  281.936   7.2333  606.734   7.7916  606.734   7.7916 0.000000 0.000000 
1 1 1   10   12    1 f  765.445   7.0591  448.570   8.2705  445.597   10.060  454.768   14.526  762.835   8.6161  770.421   12.319 -7.586670 15.03275 
1 1 1   10   12    2 o  359.385   5.8434   98.871   3.2143   97.406   3.8728  102.116   5.7627  356.690   7.0935  365.136   10.311 -8.446228 12.51537 
1 1 1   10   12    3 o  176.696   7.3979   23.904   2.0008   23.227   2.3457   25.712   3.8332  173.936   8.8398  182.648   13.813 -8.712234 16.39982 
1 1 1   10   12    4 o  1003.16   8.3804  770.550   12.868  777.466   15.847  757.162   22.048  1007.53   10.276  993.908   14.493 13.61639 17.76624 
1 1 1   10   12    5 o  715.922   11.946  392.651   13.090  392.651   13.090   0.0000   0.0000  715.922   11.946  ?   ?  0.000000 11.94594 
1 1 1   10   12    6 o  579.432   8.1041  257.063   7.1875  257.063   7.1875   0.0000   0.0000  579.432   8.1041  ?   ?  0.000000 8.104124 
1 1 1   10   12    7 o  433.642   6.4288  143.953   4.2671  143.889   5.1556  144.091   7.6032  433.518   7.7696  433.720   11.453 -0.2017822 13.83964 
1 1 1   10   12    8 o  686.771   7.0743  361.080   7.4365  360.205   9.0396  362.911   13.080  685.886   8.6104  688.280   12.416 -2.394348 15.10929 
1 1 1   10   12    9 o  1415.53   11.044  1534.62   23.928  1518.47   28.898  1569.85   42.678  1407.81   13.411  1430.54   19.491 -22.73743 23.65883 
1 1 1   10   12   10 o  737.143   7.4034  415.992   8.3532  420.206   10.222  407.522   14.493  740.809   9.0148  729.355   12.982 11.45477 15.80503 
1 1 1   10   12   11 o  221.771   7.1453   37.651   2.4255   38.704   3.3741   36.525   3.4890  224.823   9.8050  218.394   10.437 6.428589 14.32050 
1 1 1   10   12   12 o  132.839   10.738   13.602   2.1646   14.381   3.1274   12.885   2.9991  136.141   15.271  128.742   15.533 7.399429 21.78282 
1 1 1   10   12   13 o  685.394   6.3644  359.596   6.6768  363.387   9.4723  355.852   9.4128  688.925   8.9829  681.743   9.0205 7.181641 12.73032 
1 1 1   10   12   14 o  645.109   7.3233  318.586   7.2312  326.112   12.670  314.950   8.8064  652.503   12.686  641.373   8.9706 11.13062 15.53694 
1 1 1   10   12   15 o  502.481   8.9452  193.311   6.8799  185.126   9.0507  204.514   10.588  491.647   12.027  516.705   13.388 -25.05804 17.99698 
1 1 1   10   12   16 o  570.324   7.4672  249.004   6.5185  248.686   7.7343  249.784   12.111  569.927   8.8661  571.018   13.857 -1.091187 16.45084 
1 1 1   10   12   17 o  1123.56   7.3622  966.394   12.661  977.491   16.315  949.593   20.074  1129.89   9.4339  1113.51   11.778 16.38318 15.09061 
1 1 1   10   12   18 o  1211.03   7.7471  1122.76   14.360  1113.82   18.210  1137.47   23.353  1206.08   9.8644  1218.63   12.520 -12.54968 15.93921 
1 1 1   10   12   19 o  692.295   5.9550  366.865   6.3102  373.440   8.0476  356.370   10.167  698.431   7.5279  682.211   9.7369 16.22021 12.30757 
1 1 1   10   12   20 o  545.504   6.4731  227.792   5.4048  238.813   7.4179  215.321   7.8912  558.490   8.6775  530.281   9.7223 28.20923 13.03156 
1 1 1   10   12   21 o  875.501   8.3333  586.859   11.167  609.874   14.032  547.096   18.443  892.407   10.272  844.983   14.260 47.42444 17.57478 
1 1 1   10   12   22 o  372.266   5.7928  106.081   3.3007  103.663   4.5049  108.885   4.8501  367.963   7.9986  377.109   8.4026 -9.146301 11.60089 
1 1 1   10   12   23 o  491.243   5.5830  184.723   4.1979  182.884   5.7882  186.764   6.0973  488.744   7.7373  493.893   8.0656 -5.148895 11.17677 
1 1 1   10   12   24 o  812.647   7.6300  505.617   9.4907  503.351   13.387  507.906   13.457  810.658   10.789  814.317   10.796 -3.659119 15.26315 
1 1 1   10   12   25 o  1629.88   9.9005  2034.54   24.699  2003.23   37.998  2057.45   32.502  1616.46   15.358  1638.60   12.959 -22.14575 20.09467 
1 1 1   10   12   26 o  745.383   6.0919  425.331   6.9503  428.878   9.8117  421.758   9.8469  748.377   8.5655  742.134   8.6686 6.242798 12.18655 
1 1 1   10   12   27 o  200.876   10.827   31.002   3.3167   32.615   4.5138   29.108   4.8900  205.753   14.424  194.091   16.620 11.66287 22.00638 
1 1 1   10   12   28 o  297.961   8.7132   67.992   3.9738   71.603   5.8914   64.978   5.3826  305.658   12.593  291.189   12.077 14.46826 17.44769 
1 1 1   10   12   29 o  884.998   7.1374  599.709   9.6684  619.786   13.000  574.857   14.463  899.523   9.4418  866.180   10.909 33.34277 14.42761 
1 1 1   10   12   30 o  366.618   8.1706  102.938   4.5850  106.731   6.0595   97.858   7.0127  373.221   10.607  357.271   12.824 15.94992 16.64226 
1 1 1   10   12   31 o  318.234   8.2840   77.568   4.0351   78.651   5.8803   76.605   5.5472  320.304   11.994  316.134   11.464 4.169617 16.59163 
1 1 1   10   12   32 o  359.523   6.9656   98.986   3.8331   97.940   6.4098   99.568   4.7825  357.408   11.717  360.514   8.6669 -3.106445 14.57396 
1 1 1   10   12   33 o  311.132   8.3343   74.163   3.9690   62.793   5.8812   83.672   5.3786  286.052   13.432  330.369   10.636 -44.31744 17.13360 
1 1 1   10   12   34 o  876.491   6.5900  588.380   8.8410  619.769   13.731  566.153   11.555  899.134   9.9773  859.528   8.7827 39.60602 13.29220 
1 1 1   10   12   35 o  236.852   8.9602   43.000   3.2484   42.364   5.7668   43.296   3.9314  234.130   16.191  237.581   10.811 -3.449997 19.46887 
1 1 1   10   12   36 o  301.713   7.8372   69.761   3.6193   73.049   6.9014   68.513   4.2508  308.231   14.628  298.922   9.2905 9.308929 17.32905 
1 1 1   10   12   37 o  529.729   7.2140  215.031   5.8492  214.302   16.461  215.136   6.2576  526.484   20.427  529.810   7.7164 -3.326904 21.83578 
1 1 1   10   12   38 o  134.706   18.908   14.288   3.7911   23.038   9.2807   12.536   4.1535  167.289   37.206  125.292   22.484 41.99696 43.47242 
1 1 1   10   12   39 o  256.504   8.5446   50.465   3.3547   55.496   5.7965   47.931   4.1137  268.101   14.176  249.821   10.758 18.28017 17.79569 
1 1 1   10   12   40 o  336.287   7.7620   86.723   3.9953   70.581   7.2618   93.730   4.7846  302.034   15.763  349.493   8.9440 -47.45993 18.12338 
1 1 1   10   12   41 o  306.236   8.1325   71.947   3.8120   79.565   7.4465   69.242   4.4375  321.074   15.152  300.274   9.6550 20.79980 17.96685 
1 1 1   10   12   42 o  469.964   6.9596  169.367   5.0063  156.585   9.1409  174.844   5.9835  450.715   13.250  477.321   8.1899 -26.60562 15.57679 
1 1 1   10   12   43 o  414.212   6.9803  131.595   4.4256  131.659   5.7914  131.506   6.8611  413.988   9.1396  413.431   10.842 0.5572815 14.18044 
1 1 1   10   12   44 o   62.223   23.504   2.2620   3.0613   2.4536   5.1840   2.1594   3.7933   74.744   29.904   65.973   25.836 8.771225 39.51936 
1 1 1   10   12   45 o  283.358   7.9933   61.665   3.4668   60.362   4.9351   62.935   4.8712  279.818   11.523  285.788   11.136 -5.969940 16.02428 
1 1 1   10   12   46 o  137.256   13.490   14.713   2.7974   17.823   4.0855   11.967   3.8384  150.086   18.153  121.721   21.382 28.36468 28.04919 
1 1 1   10   12   47 o  171.618   11.358   22.827   2.9667   21.841   4.5042   23.582   3.9428  166.284   17.983  173.659   14.980 -7.374832 23.40512 
1 1 1   10   12   48 o  126.518   14.805   12.598   2.8128   13.937   4.1324   11.442   3.8396  131.376   21.278  118.577   21.964 12.79839 30.58047 
1 1 1   10   12   49 o  104.209   18.708   8.7669   2.8744   14.285   4.3361   4.4407   3.8393  132.630   22.140   77.134   26.695 55.49580 34.68103 
1 1 1   10   12   50 o   63.535   23.728   2.5525   3.1016   3.7799   5.0523   1.8102   3.9291   78.380   30.054   64.552   25.961 13.82861 39.71414 
1 1 1   10   12   51 o  307.412   8.9373   72.821   4.2053   73.111   5.5164   72.420   6.4977  307.266   11.729  305.084   13.915 2.181946 18.19877 
1 1 1   10   12   52 o  136.067   16.659   14.730   3.3972   15.266   5.1023   14.303   4.5531  135.330   25.569  131.715   23.443 3.614960 34.68945 
1 1 1   10   12   53 o   98.687   22.142   8.0949   3.2624   10.412   4.6537   5.8556   4.5746  110.493   27.598   85.789   29.157 24.70386 40.14722 
1 1 1   10   12   54 o  111.566   20.418   10.224   3.3582   9.1707   4.7663   11.262   4.7323  103.208   28.981  114.689   27.343 -11.48059 39.84389 
1 1 1   10   12   55 o  246.901   11.629   47.400   4.3948   44.559   5.4543   52.659   7.4204  237.683   15.070  256.249   19.055 -18.56589 24.29443 
1 1 1   10   12   56 f  218.988   14.520   37.868   4.8394   32.332   7.2973   42.215   6.4659  196.579   24.805  229.059   18.603 -32.48016 31.00552 
1 1 1   10   12   57 o  153.732   15.262   18.864   3.5438   17.137   4.8609   20.824   5.1774  142.833   23.016  158.303   21.959 -15.46947 31.81094 
1 1 1   10   12   58 o  213.681   11.547   35.784   3.7628   33.874   5.2311   37.830   5.4164  205.225   16.800  217.175   16.415 -11.95006 23.48869 
1 1 1   10   12   59 o  188.353   13.022   28.108   3.7312   28.615   5.1803   27.561   5.3789  187.005   18.334  182.716   19.536 4.288696 26.79116 
1 1 1   10   12   60 o  135.906   16.934   15.160   3.4462   12.266   4.6752   18.603   5.0996  116.390   26.797  146.503   23.539 -30.11317 35.66748 
1 1 1   10   12   61 o   55.437   23.870   0.6187   3.6685   7.8300   5.9542  -3.7938   4.6575   91.054   33.069   49.570   23.410 41.48454 40.51663 
1 1 1   10   13    0 o  100.220   22.424   8.7556   3.0038   8.7556   3.0038   8.7556   3.0038  100.220   22.424  100.220   22.424 0.000000 0.000000 
1 1 1   10   13    1 o  867.863   7.6416  576.646   10.151  575.302   12.400  579.377   17.675  866.769   9.3463  869.578   13.280 -2.809875 16.23893 
1 1 1   10   13    2 o  987.731   8.3055  746.986   12.557  756.496   15.543  729.116   21.306  993.883   10.217  975.415   14.271 18.46796 17.55104 
1 1 1   10   13    3 o  180.205   7.6364   24.862   2.1063   24.847   2.4639   24.903   4.0596  180.138   8.9362  179.643   14.898 0.4942169 17.37288 
1 1 1   10   13    4 o  1052.08   10.595  847.706   17.062  847.706   17.062   0.0000   0.0000  1052.08   10.595  ?   ?  0.000000 10.59512 
1 1 1   10   13    5 o  1136.44   11.409  989.209   19.846  1017.39   28.535  962.805   27.619  1152.05   16.182  1120.73   16.101 31.32300 22.82755 
1 1 1   10   13    6 o  672.094   8.4623  345.851   8.7053  345.123   12.110  346.629   12.522  671.250   11.787  672.694   12.162 -1.444519 16.93649 
1 1 1   10   13    7 o   83.503   20.129   5.5641   2.5426   5.7891   3.3123   5.2413   3.9672   85.713   24.191   83.893   27.109 1.819824 36.33344 
1 1 1   10   13    8 o  615.545   6.9315  290.054   6.5307  284.483   7.8587  302.488   11.741  609.565   8.4228  628.419   12.206 -18.85376 14.82993 
1 1 1   10   13    9 o  659.182   7.1143  332.638   7.1781  332.745   8.7393  332.417   12.584  659.242   8.6609  658.770   12.480 0.4724121 15.19087 
1 1 1   10   13   10 o  798.703   7.7294  488.372   9.4493  483.635   11.409  498.720   16.862  794.759   9.3786  806.844   13.654 -12.08453 16.56482 
1 1 1   10   13   11 o  777.786   9.3504  463.191   11.132  463.191   11.132   0.0000   0.0000  777.786   9.3504  ?   ?  0.000000 9.350421 
1 1 1   10   13   12 o  585.003   6.1259  261.962   5.4852  263.106   7.7216  260.798   7.7935  586.223   8.6055  583.643   8.7240 2.580078 12.25410 
1 1 1   10   13   13 o  491.398   7.0899  184.849   5.3326  177.032   9.1387  188.885   6.5665  480.768   12.419  496.703   8.6370 -15.93500 15.12698 
1 1 1   10   13   14 o  984.013   8.8042  741.331   13.261  754.057   23.281  735.220   16.133  992.028   15.332  979.855   10.757 12.17328 18.72950 
1 1 1   10   13   15 o  1025.61   7.8309  805.270   12.293  813.648   17.512  797.130   17.261  1030.77   11.100  1020.26   11.053 10.51367 15.66431 
1 1 1   10   13   16 f  965.659   7.5996  713.867   11.233  734.119   16.204  695.131   15.585  979.111   10.812  952.763   10.687 26.34802 15.20248 
1 1 1   10   13   17 o  895.057   8.5210  613.349   11.674  612.506   14.158  615.141   20.632  894.360   10.343  896.000   15.044 -1.639832 18.25595 
1 1 1   10   13   18 o  804.839   8.0276  495.920   9.8893  495.455   11.785  497.026   18.183  804.402   9.5714  805.398   14.750 -0.9954834 17.58318 
1 1 1   10   13   19 o  610.347   6.4969  285.166   6.0695  284.043   8.1954  286.530   9.0328  609.083   8.7907  611.716   9.6472 -2.632813 13.05163 
1 1 1   10   13   20 f  496.358   6.3143  188.597   4.7972  186.748   5.4931  194.538   9.8473  493.901   7.2662  503.929   12.767 -10.02878 14.68970 
1 1 1   10   13   21 o  606.472   6.0225  281.553   5.5906  290.526   7.1237  267.166   9.0204  616.020   7.5551  590.656   9.9775 25.36414 12.51524 
1 1 1   10   13   22 o  1620.52   9.7808  2011.05   24.260  2030.83   31.517  1982.29   38.005  1628.12   12.647  1608.12   15.440 19.99426 19.95873 
1 1 1   10   13   23 o  499.037   7.5736  190.669   5.7850  193.764   8.2106  187.618   8.1522  502.971   10.665  494.927   10.761 8.043823 15.15091 
1 1 1   10   13   24 o  643.716   6.6010  317.225   6.5039  321.893   10.622  314.426   8.2262  648.264   10.705  640.806   8.3870 7.458252 13.59932 
1 1 1   10   13   25 o  868.213   6.2781  577.068   8.3430  570.954   11.616  583.582   11.990  863.473   8.7893  872.958   8.9734 -9.485596 12.56080 
1 1 1   10   13   26 o  706.406   6.0257  382.015   6.5153  382.574   9.1742  381.446   9.2543  706.818   8.4799  705.770   8.5667 1.047241 12.05390 
1 1 1   10   13   27 o  1431.63   9.0543  1569.70   19.841  1544.28   30.560  1588.23   26.086  1419.25   14.068  1439.68   11.838 -20.42505 18.38573 
1 1 1   10   13   28 o  578.086   6.9023  255.872   6.1074  254.549   7.7989  257.971   9.8207  576.505   8.8381  580.245   11.058 -3.739380 14.15568 
1 1 1   10   13   29 o  1170.52   8.9608  1049.45   16.054  1072.26   19.066  993.864   29.762  1182.99   10.530  1137.85   17.089 45.13904 20.07243 
1 1 1   10   13   30 o  501.156   6.8723  192.319   5.2717  193.531   7.1780  190.899   7.7673  502.618   9.3303  499.143   10.167 3.475647 13.79910 
1 1 1   10   13   31 o  499.880   6.9612  191.356   5.3262  194.469   7.2978  187.808   7.7912  503.796   9.4638  495.042   10.282 8.753906 13.97465 
1 1 1   10   13   32 o  645.874   6.5516  319.453   6.4769  324.206   9.3719  315.108   8.9612  650.445   9.4134  641.278   9.1296 9.167236 13.11341 
1 1 1   10   13   33 o  258.607   10.177   51.270   4.0285   50.472   5.8171   52.005   5.5843  255.906   14.916  259.874   14.092 -3.967987 20.51960 
1 1 1   10   13   34 o  302.160   9.2619   69.985   4.2836   58.503   6.6375   78.181   5.6077  275.395   15.812  319.227   11.477 -43.83148 19.53840 
1 1 1   10   13   35 o   69.237   24.375   3.2671   3.2078   0.3437   4.8331   5.5688   4.2886   65.967   27.865   86.196   28.208 -20.22886 39.65023 
1 1 1   10   13   36 o  734.096   6.3557  412.816   7.1415  404.391   12.483  416.915   8.7071  725.837   11.236  737.567   7.7126 -11.73029 13.62831 
1 1 1   10   13   37 f   60.360   23.100   1.9400   2.9810   6.4469   8.8912   1.3693   3.1641  104.912   39.954   58.654   23.398 46.25843 46.30150 
1 1 1   10   13   38 o  198.941   11.209   30.495   3.3993   31.779   5.2566   29.573   4.4565  202.204   17.146  195.369   15.018 6.834259 22.79288 
1 1 1   10   13   39 o  482.300   6.3856  178.255   4.7140  173.266   7.7740  181.156   5.9283  474.946   10.694  486.033   7.9688 -11.08667 13.33636 
1 1 1   10   13   40 o  119.281   16.605   11.200   2.9494   11.174   5.9842   11.208   3.3898  116.860   32.353  118.772   19.309 -1.912285 37.67688 
1 1 1   10   13   41 o  194.014   10.384   29.010   3.0725   39.062   5.5214   24.502   3.6979  224.212   16.198  177.763   13.696 46.44885 21.21221 
1 1 1   10   13   42 o  129.272   15.225   13.089   2.9547   10.507   5.3965   14.195   3.5310  113.003   30.494  134.196   17.616 -21.19376 35.21628 
1 1 1   10   13   43 o  396.766   9.1737  120.961   5.5712  113.033   7.8704  128.923   7.8875  382.671   13.437  408.895   12.603 -26.22437 18.42212 
1 1 1   10   13   44 o  373.151   7.5624  106.883   4.3193   96.628   7.9040  111.249   5.1575  353.361   14.614  380.485   8.8558 -27.12421 17.08759 
1 1 1   10   13   45 o  347.313   8.0339   92.662   4.2709   95.307   7.1786   91.213   5.3136  351.083   13.358  344.217   10.085 6.866364 16.73798 
1 1 1   10   13   46 o  255.829   9.2069   50.355   3.6052   45.560   6.5980   52.396   4.3047  240.915   18.023  260.705   10.788 -19.78990 21.00511 
1 1 1   10   13   47 o   64.846   23.558   2.8133   3.0218   5.2080   6.1093   2.0377   3.4769   88.627   33.262   63.212   24.741 25.41524 41.45470 
1 1 1   10   13   48 o  245.895   8.6207   46.522   3.2446   47.423   4.8527   45.793   4.3634  247.136   12.873  243.417   11.711 3.719345 17.40309 
1 1 1   10   13   49 o  154.339   13.998   18.649   3.2710   17.791   5.5606   19.102   4.0448  146.974   25.651  155.320   17.308 -8.346191 30.94412 
1 1 1   10   13   50 o  185.876   12.424   26.892   3.5143   28.504   4.6936   24.835   5.3017  190.280   16.272  176.246   20.007 14.03357 25.78891 
1 1 1   10   13   51 o  238.431   9.8573   43.882   3.5974   44.021   5.3602   43.767   4.8526  237.096   14.845  236.893   13.438 0.2029266 20.02401 
1 1 1   10   13   52 o  204.147   11.204   32.368   3.4877   32.088   5.0450   32.624   4.8269  201.562   16.497  203.573   15.610 -2.011032 22.71168 
1 1 1   10   13   53 o  197.973   11.956   30.537   3.6059   31.290   5.1510   29.814   5.0495  198.595   17.112  193.785   17.203 4.810059 24.26455 
1 1 1   10   13   54 o  112.280   20.736   10.385   3.4324   11.610   4.9669   9.2661   4.7487  116.003   28.239  103.592   28.870 12.41023 40.38453 
1 1 1   10   13   55 o  218.680   23.254   39.377   7.6641   39.377   7.6641   0.0000   0.0000  218.680   23.254  ?   ?  0.000000 23.25386 
1 1 1   10   13   56 o  168.758   14.654   22.591   3.7476   21.204   5.1306   24.177   5.4871  160.323   21.445  171.367   21.385 -11.04346 30.28499 
1 1 1   10   13   57 o   77.560   24.920   5.0260   3.3558  -0.9026   4.6299   11.588   4.8709   57.819   25.784  114.425   28.032 -56.60595 38.08670 
1 1 1   10   13   58 o   83.160   24.580   5.9724   3.3464   8.6538   4.6498   3.0912   4.8199   98.169   28.962   71.902   28.811 26.26743 40.85130 
1 1 1   10   13   59 o   69.809   24.761   3.8886   3.3163   5.4042   4.5474   2.1671   4.8466   80.394   28.944   67.852   28.230 12.54189 40.43101 
1 1 1   10   13   60 o  115.835   20.845   11.477   3.5599   13.543   5.1429   9.5762   4.9327  121.118   28.258  100.735   29.859 20.38356 41.11034 
1 1 1   10   13   61 o  141.534   18.664   16.803   3.9446   14.191   5.4318   19.717   5.7379  122.281   29.386  147.542   26.376 -25.26109 39.48734 
1 1 1   10   14    0 o  669.263   11.654  343.241   11.931  343.241   11.931  343.241   11.931  669.263   11.654  669.263   11.654 0.000000 0.000000 
1 1 1   10   14    1 o  626.396   8.0854  300.402   7.7521  300.402   7.7521   0.0000   0.0000  626.396   8.0854  ?   ?  0.000000 8.085399 
1 1 1   10   14    2 o  1302.41   12.496  1299.34   24.911  1299.34   24.911   0.0000   0.0000  1302.41   12.496  ?   ?  0.000000 12.49596 
1 1 1   10   14    3 o  1468.30   11.266  1651.14   25.319  1702.32   32.046  1566.09   41.305  1490.59   14.046  1429.05   18.884 61.53711 23.53453 
1 1 1   10   14    4 o  938.661   8.1112  674.556   11.654  687.159   14.448  651.094   19.714  947.300   9.9646  921.857   13.972 25.44263 17.16099 
1 1 1   10   14    5 o  1157.35   11.523  1025.86   20.413  1025.86   28.699  1025.86   29.041  1156.94   16.207  1156.92   16.400 0.2026367E-01 23.05680 
1 1 1   10   14    6 o  1101.17   9.2100  928.430   15.523  921.789   18.922  942.100   27.149  1097.10   11.268  1108.73   15.998 -11.63135 19.56757 
1 1 1   10   14    7 o  820.598   9.4087  515.593   11.818  501.355   16.100  532.225   17.401  809.015   13.002  833.511   13.640 -24.49683 18.84356 
1 1 1   10   14    8 o  697.660   8.8163  372.653   9.4146  367.993   13.007  377.781   13.645  693.152   12.259  702.290   12.693 -9.137939 17.64691 
1 1 1   10   14    9 o  1067.56   9.1067  872.589   14.881  847.625   17.703  932.688   27.469  1052.08   10.994  1103.20   16.267 -51.12097 19.63392 
1 1 1   10   14   10 o  1214.21   9.9278  1128.86   18.451  1117.68   22.330  1152.92   32.755  1208.03   12.077  1226.44   17.449 -18.40173 21.22049 
1 1 1   10   14   11 o  951.179   8.5163  692.664   12.399  698.333   15.289  681.776   21.190  954.974   10.460  943.334   14.676 11.64056 18.02188 
1 1 1   10   14   12 o  241.102   8.7655   44.505   3.2348   39.698   5.2580   47.432   4.1032  227.113   15.213  248.880   10.771 -21.76665 18.64042 
1 1 1   10   14   13 o  540.563   7.3044  223.691   6.0437  232.184   10.528  219.516   7.3812  550.587   12.492  535.457   9.0060 15.13000 15.39993 
1 1 1   10   14   14 o  714.221   6.6447  390.484   7.2641  397.728   10.333  383.407   10.214  720.736   9.3669  707.638   9.4297 13.09741 13.29125 
1 1 1   10   14   15 o  660.055   9.3270  333.577   9.4230   0.0000   0.0000  333.577   9.4230  ?   ?   660.055   9.3270 0.000000 9.326987 
1 1 1   10   14   16 o  979.372   8.9094  734.378   13.356  752.645   23.643  725.817   16.186  991.043   15.586  973.546   10.862 17.49689 18.99740 
1 1 1   10   14   17 o  1595.83   12.416  1950.67   30.327  1975.49   53.310  1938.80   36.875  1604.54   21.706  1590.63   15.146 13.90442 26.46822 
1 1 1   10   14   18 o   92.680   23.790   6.8459   3.3919   2.8956   3.8847   19.520   6.9582   71.033   26.550  156.693   30.106 -85.65955 40.14093 
1 1 1   10   14   19 o  816.374   10.232  510.380   12.785  510.380   12.785   0.0000   0.0000  816.374   10.232  ?   ?  0.000000 10.23178 
1 1 1   10   14   20 o  557.143   6.6763  237.627   5.6934  243.046   6.3988  217.031   12.474  563.441   7.4196  532.130   15.315 31.31116 17.01776 
1 1 1   10   14   21 o  360.069   6.4911   99.251   3.5774   96.644   4.2880  105.221   6.4889  355.285   7.8850  370.630   11.438 -15.34537 13.89269 
1 1 1   10   14   22 o  544.276   7.3232  226.799   6.1009  224.785   8.5820  228.857   8.6746  541.752   10.350  546.635   10.368 -4.883911 14.64927 
1 1 1   10   14   23 o  529.472   7.5614  214.639   6.1279  214.996   8.5783  214.267   8.7570  529.805   10.578  528.895   10.817 0.9094849 15.12979 
1 1 1   10   14   24 o  468.645   6.7051  168.144   4.8097  171.292   5.9580  162.254   8.1496  472.970   8.2300  460.204   11.569 12.76636 14.19810 
1 1 1   10   14   25 o  302.580   7.2740   70.099   3.3689   69.737   4.6534   70.497   4.8835  301.737   10.076  303.366   10.517 -1.628845 14.56454 
1 1 1   10   14   26 o  544.788   7.5195  227.255   6.2703  240.001   8.4941  211.992   9.2949  559.754   9.9141  525.998   11.545 33.75623 15.21752 
1 1 1   10   14   27 o  552.399   7.3520  233.651   6.2162  243.775   8.6845  223.014   8.9016  564.114   10.058  539.520   10.779 24.59399 14.74298 
1 1 1   10   14   28 o  660.309   6.1861  333.815   6.2522  337.473   8.8488  330.168   8.8352  663.789   8.7093  656.561   8.7916 7.227783 12.37518 
1 1 1   10   14   29 o  390.411   6.8743  116.712   4.1079  117.434   5.8679  116.018   5.7527  391.510   9.7920  389.148   9.6580 2.362366 13.75354 
1 1 1   10   14   30 o  341.006   7.6233   89.060   3.9790   89.776   5.7163   88.386   5.5421  342.244   10.912  339.595   10.662 2.648621 15.25634 
1 1 1   10   14   31 o  317.592   8.2236   77.267   3.9976   79.420   5.5719   74.983   5.7387  321.848   11.310  312.694   11.990 9.153961 16.48302 
1 1 1   10   14   32 o  274.882   9.0674   57.903   3.8150   59.850   5.3525   55.894   5.4391  279.297   12.520  269.872   13.167 9.424988 18.16979 
1 1 1   10   14   33 o  345.416   8.1423   91.421   4.3049  100.758   6.1378   82.380   6.0394  362.444   11.064  327.660   12.042 34.78436 16.35284 
1 1 1   10   14   34 o  700.356   7.0948  375.768   7.6055  394.173   12.080  363.680   9.7894  716.789   11.010  688.749   9.2859 28.03973 14.40323 
1 1 1   10   14   35 o  290.102   9.3323   64.535   4.1439   63.305   6.2400   65.506   5.5425  286.952   14.207  292.055   12.399 -5.103210 18.85640 
1 1 1   10   14   36 o  659.589   6.7483  333.339   6.8130  331.185   9.8790  335.293   9.4083  657.032   9.8233  661.178   9.2966 -4.146423 13.52489 
1 1 1   10   14   37 f  279.020   14.693   60.105   6.2530   53.669   9.6842   64.707   8.1888  261.541   24.476  288.789   18.625 -27.24835 30.75605 
1 1 1   10   14   38 o  407.034   7.4772  127.013   4.6585  123.465   6.6683  130.395   6.5106  400.926   10.866  412.097   10.322 -11.17078 14.98717 
1 1 1   10   14   39 o  215.448   11.362   35.778   3.7336   37.799   5.9071   34.433   4.8181  220.390   17.659  210.784   15.032 9.605804 23.19103 
1 1 1   10   14   40 o  247.124   8.4547   46.863   3.1980   47.251   5.5271   46.668   3.9211  247.055   14.682  246.441   10.395 0.6141968 17.98946 
1 1 1   10   14   41 o  189.753   10.541   27.766   3.0494   21.407   5.4027   30.739   3.6940  164.237   22.048  199.444   12.159 -35.20673 25.17863 
1 1 1   10   14   42 o  108.849   21.952   9.5808   3.5312   6.1122   4.7313   13.943   5.3056   89.383   29.646  130.486   27.435 -41.10330 40.39300 
1 1 1   10   14   43 f  331.068   7.7032   84.132   3.9035   83.809   6.6753   84.300   4.8121  329.480   13.236  331.143   9.4940 -1.663818 16.28923 
1 1 1   10   14   44 o  412.860   7.3830  130.843   4.6656  112.554   7.4880  142.449   5.9650  381.767   12.814  430.456   9.0534 -48.68896 15.68990 
1 1 1   10   14   45 f  161.288   13.163   20.247   3.2213   9.2454   5.8096   25.131   3.8709  106.016   32.617  179.578   14.199 -73.56161 35.57364 
1 1 1   10   14   46 o   84.378   22.462   5.8231   2.9524   6.4573   6.0104   5.6214   3.3895   93.530   33.317   83.350   24.762 10.18018 41.51133 
1 1 1   10   14   47 o  426.212   7.4904  139.563   4.8865  141.798   9.3152  138.714   5.7396  427.464   14.237  424.595   8.8316 2.869019 16.75396 
1 1 1   10   14   48 o  206.985   11.497   33.207   3.6281   35.750   7.6075   32.458   4.1277  210.506   24.042  204.202   13.278 6.304398 27.46517 
1 1 1   10   14   49 o  243.695   11.130   45.896   4.1515   59.622   12.711   44.257   4.3924  267.285   31.686  238.811   12.055 28.47455 33.90178 
1 1 1   10   14   50 o  225.618   12.893   39.630   4.4340   45.252   7.6904   36.831   5.4268  237.755   21.360  216.296   16.517 21.45868 27.00109 
1 1 1   10   14   51 o  119.926   20.006   11.677   3.5430   5.6488   7.1055   13.672   4.0874   92.163   35.563  129.505   21.365 -37.34235 41.48765 
1 1 1   10   14   52 o  150.604   16.931   18.046   3.8353   8.9462   7.4362   21.344   4.4767  104.570   37.080  163.476   18.200 -58.90561 41.30542 
1 1 1   10   14   53 o   63.303   25.128   2.0279   3.6327   1.5139   6.9438   2.2216   4.2625   77.902   33.174   67.519   27.080 10.38327 42.82308 
1 1 1   10   14   54 o  226.268   12.034   39.946   4.1528   37.292   5.2070   44.584   6.8840  217.111   15.777  235.673   19.252 -18.56223 24.89051 
1 1 1   10   14   55 o  170.591   16.006   23.184   4.1304   26.666   6.6639   21.012   5.2633  178.270   25.118  159.521   22.154 18.74898 33.49226 
1 1 1   10   14   56 o  133.987   17.256   14.524   3.4567   10.805   4.7217   18.820   5.0743  110.811   27.866  150.026   22.816 -39.21468 36.01561 
1 1 1   10   14   57 o  145.608   16.156   17.061   3.5400   19.392   5.2020   15.051   4.8312  151.711   23.134  132.473   24.736 19.23859 33.86822 
1 1 1   10   14   58 o   66.806   24.813   3.2524   3.3824   2.6406   4.9560   3.7858   4.6278   70.459   28.852   73.749   28.633 -3.290642 40.64833 
1 1 1   10   14   59 o   69.526   24.506   3.9069   3.2435  -1.2287   4.5600   9.1657   4.6144   55.517   25.102   99.685   28.693 -44.16769 38.12331 
1 1 1   10   14   60 o  123.051   21.144   12.996   3.8389   16.814   6.4730   10.924   4.7678  131.437   32.385  108.071   28.438 23.36593 43.09888 
1 1 1   10   15    0 o  217.311   12.871   36.536   4.2469   36.536   4.2469   36.536   4.2469  217.311   12.871  217.311   12.871 0.000000 0.000000 
1 1 1   10   15    1 o  216.877   13.050   36.159   4.3120   0.0000   0.0000   36.159   4.3120  ?   ?   216.877   13.050 0.000000 13.05035 
1 1 1   10   15    2 o  814.632   9.2516  508.109   11.536  497.591   15.960  519.614   16.692  805.984   12.937  823.610   13.241 -17.62604 18.51232 
1 1 1   10   15    3 o  1171.43   11.630  1050.94   20.853  1064.45   29.875  1038.10   29.121  1178.51   16.562  1163.85   16.347 14.65820 23.27047 
1 1 1   10   15    4 o  1381.39   13.218  1461.71   27.949  1423.97   38.256  1504.91   40.930  1362.87   18.339  1400.97   19.087 -38.09729 26.46968 
1 1 1   10   15    5 o  852.403   9.5676  556.330   12.483  557.542   17.576  555.096   17.733  853.138   13.459  851.255   13.610 1.882996 19.14085 
1 1 1   10   15    6 o  1322.89   10.546  1340.08   21.353  1322.70   25.800  1377.86   38.047  1314.11   12.827  1340.62   18.541 -26.51208 22.54569 
1 1 1   10   15    7 f  826.229   7.8705  522.607   9.9534  524.863   12.240  518.202   17.103  827.945   9.6581  822.486   13.586 5.458923 16.66895 
1 1 1   10   15    8 o  999.019   15.168  764.692   23.193   0.0000   0.0000  764.692   23.193  ?   ?   999.019   15.168 0.000000 15.16751 
1 1 1   10   15    9 o  350.543   8.7567   94.078   4.6984   94.775   6.3263   93.222   7.0163  351.785   11.749  348.861   13.140 2.924011 17.62650 
1 1 1   10   15   10 o  2033.57   18.428  3170.21   57.360  3183.00   81.380  3157.59   80.861  2035.94   26.115  2027.81   26.052 8.126831 36.88741 
1 1 1   10   15   11 o  346.730   9.5366   92.049   5.0612   94.775   7.0641   89.175   7.2550  351.754   13.120  341.186   13.892 10.56796 19.10869 
1 1 1   10   15   12 o  1173.74   9.7855  1054.86   17.580  997.628   28.416  1090.36   22.377  1140.96   16.271  1193.16   12.253 -52.19543 20.36858 
1 1 1   10   15   13 o  1508.40   11.798  1742.55   27.240  1711.03   45.916  1759.67   33.837  1493.68   20.084  1515.50   14.587 -21.82642 24.82199 
1 1 1   10   15   14 o  671.501   7.6428  345.197   7.8555  346.441   13.484  344.558   9.6651  672.507   13.099  670.825   9.4130 1.682007 16.13040 
1 1 1   10   15   15 o  1037.13   7.9469  823.492   12.615  821.729   17.795  825.274   17.888  1035.84   11.223  1038.07   11.258 -2.230103 15.89665 
1 1 1   10   15   16 o  1264.95   9.0458  1225.14   17.514  1242.39   25.099  1208.77   24.451  1273.52   12.876  1256.18   12.717 17.33594 18.09721 
1 1 1   10   15   17 o  1178.40   8.6667  1063.20   15.632  1058.74   21.965  1067.78   22.251  1175.67   12.206  1180.66   12.313 -4.998779 17.33781 
1 1 1   10   15   18 o  388.624   8.1771  115.632   4.8641  112.687   6.0654  120.939   8.1420  383.596   10.330  397.304   13.389 -13.70792 16.91072 
1 1 1   10   15   19 o  832.627   7.4113  530.755   9.4453  553.071   13.764  510.893   12.985  849.794   10.582  816.759   10.387 33.03516 14.82785 
1 1 1   10   15   20 o  835.328   8.7004  534.289   11.124  546.135   13.659  510.955   19.170  844.435   10.568  816.445   15.340 27.99091 18.62791 
1 1 1   10   15   21 o  714.998   8.5712  391.449   9.3803  385.410   11.157  406.016   17.327  709.380   10.275  727.746   15.555 -18.36560 18.64216 
1 1 1   10   15   22 o  130.743   13.822   13.247   2.7240   14.544   3.1457   9.3557   5.4467  136.892   15.273  108.889   31.123 28.00356 34.66842 
1 1 1   10   15   23 o  159.289   11.979   19.550   2.8992   20.185   3.3656   17.724   5.7080  161.703   13.728  149.686   25.848 12.01744 29.26724 
1 1 1   10   15   24 o  599.256   6.6167  274.930   6.0691  277.844   7.6016  269.808   10.079  602.362   8.2447  593.451   11.096 8.910706 13.82390 
1 1 1   10   15   25 o  1061.58   8.4883  863.029   13.793  860.093   15.593  873.584   29.565  1059.68   9.6138  1066.85   18.105 -7.167969 20.49961 
1 1 1   10   15   26 o  653.345   7.3073  326.847   7.3075  317.371   9.7249  339.136   11.075  643.671   9.8708  665.310   10.876 -21.63959 14.68709 
1 1 1   10   15   27 o  639.609   6.0986  313.208   5.9705  309.566   8.2770  317.160   8.6207  635.764   8.5056  643.501   8.7523 -7.737183 12.20446 
1 1 1   10   15   28 o  528.660   6.2823  213.986   5.0835  218.121   7.1536  209.767   7.2252  533.633   8.7582  523.300   9.0205 10.33307 12.57278 
1 1 1   10   15   29 o  908.092   6.5864  631.442   9.1548  634.411   12.928  628.456   12.966  909.982   9.2814  905.694   9.3531 4.288147 13.17672 
1 1 1   10   15   30 o  773.915   6.4037  458.643   7.5856  459.535   10.685  457.738   10.771  774.450   9.0140  772.925   9.1041 1.524475 12.81163 
1 1 1   10   15   31 o  324.229   7.7804   80.530   3.8612   80.351   5.5319   80.701   5.3920  323.705   11.165  324.426   10.858 -0.7210388 15.57433 
1 1 1   10   15   32 o  512.857   7.1137  201.475   5.5842  200.049   7.5504  203.196   8.2968  510.848   9.6563  514.771   10.530 -3.922729 14.28716 
1 1 1   10   15   33 o  482.311   7.6696  178.237   5.6620  177.654   8.2032  178.768   7.8248  481.212   11.137  482.774   10.589 -1.562714 15.36771 
1 1 1   10   15   34 o  465.980   7.2567  166.371   5.1758  166.621   7.0640  166.082   7.6054  466.097   9.9015  465.260   10.680 0.8369446 14.56343 
1 1 1   10   15   35 o  194.481   11.474   29.140   3.4005   30.588   4.6962   27.544   4.9305  198.732   15.563  188.244   17.306 10.48802 23.27436 
1 1 1   10   15   36 o  558.605   9.6131  239.409   8.2193  250.629   12.320  230.408   11.034  570.722   14.103  547.403   13.169 23.31946 19.29548 
1 1 1   10   15   37 o  667.955   6.7682  341.923   6.9198  351.290   10.037  333.440   9.5527  676.556   9.6928  659.186   9.4678 17.37024 13.54951 
1 1 1   10   15   38 o  330.389   8.3204   83.729   4.2077   82.307   6.1285   84.997   5.7873  327.141   12.239  332.555   11.369 -5.414459 16.70510 
1 1 1   10   15   39 o  150.326   15.393   17.620   3.4919   18.251   5.4235   17.173   4.5636  151.054   24.280  147.262   20.827 3.791550 31.98879 
1 1 1   10   15   40 o  177.085   12.829   24.281   3.4538   29.105   5.1431   20.318   4.6612  193.058   17.598  160.641   19.346 32.41684 26.15277 
1 1 1   10   15   41 f  184.573   13.495   26.416   3.7861   21.820   5.2465   31.412   5.4693  165.986   21.129  200.401   18.023 -34.41472 27.77193 
1 1 1   10   15   42 o  312.538   8.8604   75.039   4.2386   78.517   6.3378   72.224   5.7013  319.010   12.980  306.109   12.168 12.90094 17.79144 
1 1 1   10   15   43 o  279.835   9.7403   60.231   4.1720   59.010   5.9975   61.376   5.8072  275.841   14.254  281.841   13.462 -5.999481 19.60576 
1 1 1   10   15   44 o   60.410   24.543   1.2986   3.5505  -3.5983   5.1063   5.8818   4.9402   55.860   25.748   88.293   30.297 -32.43363 39.75994 
1 1 1   10   15   45 o  125.556   15.558   12.425   2.9259   10.211   5.2495   13.423   3.5241  110.534   30.180  129.907   18.225 -19.37263 35.25572 
1 1 1   10   15   46 o  100.632   20.296   8.2284   3.0183   8.2050   5.4915   8.2385   3.6129  100.340   31.840   99.956   23.932 0.3841324 39.83078 
1 1 1   10   15   47 o  276.818   9.3709   59.013   3.9705   65.147   7.9799   56.994   4.5773  287.837   18.206  271.722   11.006 16.11545 21.27435 
1 1 1   10   15   48 o  175.932   12.890   24.112   3.4470   34.082   7.0781   21.012   3.9467  205.860   22.849  163.376   15.987 42.48477 27.88646 
1 1 1   10   15   49 o  216.116   15.454   36.615   5.0782   32.055   13.256   37.399   5.4976  185.536   46.709  218.035   16.598 -32.49913 49.57060 
1 1 1   10   15   50 o  171.641   14.204   23.093   3.6981   19.425   7.3060   24.357   4.2880  150.005   32.740  175.719   16.123 -25.71358 36.49417 
1 1 1   10   15   51 o  147.697   16.883   17.343   3.7481   17.732   7.2693   17.202   4.3744  142.264   33.870  145.978   20.112 -3.713394 39.39119 
1 1 1   10   15   52 o  107.263   22.506   9.5589   3.5771  -2.8886   6.6147   14.704   4.2526   65.628   29.893  134.110   21.439 -68.48147 36.78611 
1 1 1   10   15   53 o   43.819   20.672  -3.6791   3.6143 -18.6754   7.0800   1.6066   4.2033   46.379   23.246   64.609   26.527 -18.22984 35.27116 
1 1 1   10   15   54 o  103.356   28.653   9.2876   4.6904   9.7455   6.3748   8.7473   6.9257  105.283   34.388  101.513   35.807 3.770241 49.64558 
1 1 1   10   15   55 o  142.214   18.266   16.400   3.8842   7.0199   6.2995   22.154   4.9337   92.893   33.972  164.753   19.973 -71.85962 39.40850 
1 1 1   10   15   56 o  137.989   18.436   15.528   3.7965   13.920   6.7067   16.285   4.6053  122.290   34.391  139.473   22.326 -17.18303 41.00205 
1 1 1   10   15   57 o  112.535   22.749   10.806   3.7837   10.840   6.7024   10.790   4.5841  107.511   35.268  110.246   27.307 -2.734627 44.60386 
1 1 1   10   15   58 o  171.758   15.096   23.694   3.9285   17.283   6.5984   27.214   4.8895  135.527   32.272  182.587   17.719 -47.05954 36.81575 
1 1 1   10   15   59 o  102.060   24.932   9.3165   3.8615   7.5586   7.3659   9.9827   4.5345   92.243   36.036  104.053   27.899 -11.81071 45.57414 
1 1 1   10   15   60 o  102.538   27.820   9.8270   4.4773  -4.3100   7.9569   16.377   5.4162   65.062   30.686  133.561   27.412 -68.49881 41.14732 
1 1 1   10   16    0 o  183.297   14.861   26.230   4.1064   26.230   4.1064   26.230   4.1064  183.297   14.861  183.297   14.861 0.000000 0.000000 
1 1 1   10   16    1 o  802.226   9.2261  492.738   11.329  484.603   15.755  501.449   16.302  795.414   12.940  809.110   13.163 -13.69617 18.45887 
1 1 1   10   16    2 o  892.345   7.9810  609.596   10.901  612.950   13.389  603.000   18.773  894.726   9.7767  887.225   13.824 7.501282 16.93188 
1 1 1   10   16    3 o  299.892   6.8511   68.845   3.1448   67.372   3.7588   72.281   5.7416  296.651   8.2781  307.208   12.210 -10.55652 14.75202 
1 1 1   10   16    4 o  723.937   7.2170  401.193   7.9970  394.178   9.5977  417.122   14.463  717.538   8.7388  737.965   12.804 -20.42731 15.50181 
1 1 1   10   16    5 o  446.744   8.1772  152.792   5.5916  150.868   7.7209  154.915   8.1086  443.854   11.365  449.757   11.779 -5.903076 16.36753 
1 1 1   10   16    6 o  1447.29   13.796  1604.56   30.562  1597.15   42.888  1612.20   43.562  1443.28   19.414  1450.04   19.627 -6.758423 27.60692 
1 1 1   10   16    7 o  1251.69   12.356  1199.94   23.673  1197.15   33.278  1202.80   33.683  1249.77   17.396  1252.70   17.567 -2.925659 24.72320 
1 1 1   10   16    8 o  1346.73   13.068  1389.22   26.938  1375.03   37.578  1404.21   38.635  1339.29   18.331  1353.38   18.650 -14.09460 26.15090 
1 1 1   10   16    9 o  904.120   14.408  626.247   19.939   0.0000   0.0000  626.247   19.939  ?   ?   904.120   14.408 0.000000 14.40796 
1 1 1   10   16   10 o  809.752   13.726  502.296   17.013   0.0000   0.0000  502.296   17.013  ?   ?   809.752   13.726 0.000000 13.72611 
1 1 1   10   16   11 o  886.360   10.133  601.577   13.747  600.836   19.289  602.342   19.596  885.586   14.230  886.681   14.439 -1.095337 20.27262 
1 1 1   10   16   12 o  1345.74   13.243  1387.28   27.278  1390.09   38.498  1384.44   38.657  1346.48   18.680  1343.73   18.795 2.753174 26.49910 
1 1 1   10   16   13 o  768.596   6.9040  452.219   8.1221  445.805   11.283  459.117   11.701  763.031   9.6611  774.331   9.8724 -11.29993 13.81304 
1 1 1   10   16   14 o  516.085   9.1256  203.932   7.2087  203.932   7.2087   0.0000   0.0000  516.085   9.1256  ?   ?  0.000000 9.125636 
1 1 1   10   16   15 o  1193.85   8.7058  1091.27   15.909  1076.90   22.140  1106.61   22.874  1185.71   12.199  1201.94   12.433 -16.22449 17.41864 
1 1 1   10   16   16 o  815.432   7.2057  509.040   8.9936  519.623   12.855  498.892   12.587  823.735   10.195  807.136   10.189 16.59937 14.41362 
1 1 1   10   16   17 o  440.715   8.0340  148.707   5.4195  147.869   6.6279  150.397   9.4143  439.427   9.8542  443.033   13.883 -3.606354 17.02467 
1 1 1   10   16   18 o  1256.10   9.1254  1208.16   17.545  1213.65   24.805  1202.68   24.819  1258.60   12.876  1252.90   12.942 5.708008 18.25596 
1 1 1   10   16   19 o  924.695   7.7987  654.664   11.038  653.456   15.459  655.921   15.766  923.655   10.934  925.382   11.131 -1.727173 15.60311 
1 1 1   10   16   20 o  354.078   8.5475   95.998   4.6324   89.413   6.3110  103.691   6.8211  341.628   12.069  367.893   12.113 -26.26520 17.09955 
1 1 1   10   16   21 o  559.608   7.6026  239.771   6.5120  244.481   8.9941  234.582   9.4409  564.969   10.401  553.381   11.146 11.58856 15.24492 
1 1 1   10   16   22 o  539.935   7.2204  223.204   5.9672  221.700   6.5771  230.207   14.190  538.087   7.9856  547.830   16.922 -9.742249 18.71198 
1 1 1   10   16   23 o  853.050   7.6577  557.189   9.9987  552.003   11.203  577.495   22.168  849.015   8.6208  867.654   16.692 -18.63879 18.78671 
1 1 1   10   16   24 o  650.020   9.1932  323.609   9.1467  322.940   10.838  325.264   17.049  649.249   10.906  651.077   17.108 -1.828796 20.28910 
1 1 1   10   16   25 o  858.727   7.7939  564.677   10.244  549.746   13.540  584.667   15.666  847.102   10.443  873.475   11.718 -26.37323 15.69591 
1 1 1   10   16   26 o   77.325   23.877   4.5873   3.1099   6.2402   3.5939  -0.3396   6.2049   88.897   25.237   72.672   31.163 16.22578 40.09988 
1 1 1   10   16   27 o  503.186   6.2761  193.860   4.8338  194.159   6.6520  193.526   7.0361  503.474   8.6319  502.627   9.1457 0.8470459 12.57591 
1 1 1   10   16   28 o  177.957   10.995   24.365   2.9802   27.378   4.0823   20.927   4.3605  188.367   14.265  164.111   17.636 24.25607 22.68302 
1 1 1   10   16   29 o  359.085   7.1053   98.750   3.9053  100.176   5.4772   97.276   5.5697  361.549   9.8974  356.260   10.214 5.288940 14.22269 
1 1 1   10   16   30 o  328.140   7.6020   82.480   3.8182   79.466   5.3240   85.673   5.4789  321.940   10.804  334.282   10.708 -12.34222 15.21157 
1 1 1   10   16   31 o  254.627   9.0968   49.691   3.5454   48.883   4.8326   50.632   5.2173  252.388   12.510  256.471   13.336 -4.083221 18.28520 
1 1 1   10   16   32 o  411.035   7.3193  129.434   4.6049  133.011   6.7960  126.399   6.2613  416.432   10.662  405.997   10.076 10.43427 14.66966 
1 1 1   10   16   33 o  404.276   7.1529  125.221   4.4262  131.417   6.3203  119.257   6.2005  413.942   9.9754  394.300   10.274 19.64120 14.31990 
1 1 1   10   16   34 o  182.145   11.796   25.581   3.2711   32.231   4.9196   20.312   4.3795  203.994   15.881  161.300   18.048 42.69374 24.04025 
1 1 1   10   16   35 o  666.697   10.221  341.115   10.430  338.486   13.486  345.029   16.451  663.490   13.280  669.149   16.062 -5.659546 20.84120 
1 1 1   10   16   36 o   93.556   21.437   7.0544   3.0040   5.5090   4.1134   8.8207   4.3975   85.115   27.615  104.326   27.243 -19.21095 38.79129 
1 1 1   10   16   37 o  132.984   15.993   13.836   3.1900   21.241   4.4393   5.9307   4.5870  164.819   17.884   88.569   29.182 76.25007 34.22629 
1 1 1   10   16   38 o  311.059   8.8008   74.251   4.1902   73.312   6.3867   74.961   5.5522  308.517   13.525  312.227   11.618 -3.710236 17.82951 
1 1 1   10   16   39 o  289.427   8.9280   64.306   3.9551   64.408   5.6985   64.211   5.4939  289.178   12.874  288.800   12.428 0.3786926 17.89454 
1 1 1   10   16   40 o  123.653   18.690   12.128   3.4271   12.499   4.5741   11.654   5.1745  124.091   24.947  119.053   28.726 5.038506 38.04657 
1 1 1   10   16   41 o  224.472   10.567   38.763   3.6307   39.702   5.1889   37.862   5.0819  226.082   15.081  220.749   15.132 5.333313 21.36374 
1 1 1   10   16   42 o  278.373   9.3334   59.569   3.9768   50.929   5.5927   68.406   5.6560  256.242   14.317  297.802   12.408 -41.56003 18.94555 
1 1 1   10   16   43 o  376.540   8.4448  108.944   4.8671  119.021   6.8097   98.420   6.9590  392.945   11.322  356.984   12.736 35.96091 17.04087 
1 1 1   10   16   44 o  135.243   17.550   14.484   3.5473   18.143   5.3519   11.617   4.7374  149.631   24.193  118.466   26.758 31.16504 36.07352 
1 1 1   10   16   45 o  126.329   18.815   12.745   3.5272   9.2286   5.1718   15.802   4.8228  105.327   30.394  139.554   23.407 -34.22683 38.36227 
1 1 1   10   16   46 o  254.284   11.453   49.935   4.4577   51.565   6.9885   48.817   5.7881  256.147   17.938  250.131   15.190 6.015961 23.50561 
1 1 1   10   16   47 o   73.584   26.070   3.8906   3.6751   8.0773   5.6896   0.8934   4.8140   99.641   32.485   66.359   27.908 33.28173 42.82679 
1 1 1   10   16   48 o  139.417   34.406   16.841   7.2973   6.9055   12.067   22.569   9.1622  110.320   45.081  160.078   37.968 -49.75780 58.93957 
1 1 1   10   16   49 o  151.302   25.064   18.856   5.6014   24.141   7.0039   9.4754   9.3306  170.335   27.824  110.671   41.191 59.66378 49.70778 
1 1 1   10   16   50 o  135.586   21.809   14.990   4.3727   15.473   6.7726   14.644   5.7262  133.230   33.302  131.099   29.276 2.130936 44.34095 
1 1 1   10   16   51 o   66.108   24.857   2.7951   3.4151  -1.2066   6.8646   4.1112   3.9368   70.890   31.518   75.128   26.943 -4.238426 41.46462 
1 1 1   10   16   52 o  153.399   16.409   18.709   3.7930   14.702   7.1780   20.261   4.4677  128.107   35.420  158.830   18.738 -30.72343 40.07142 
1 1 1   10   16   53 o  245.597   11.313   46.842   4.2527   52.137   7.2175   44.026   5.2634  255.383   18.592  236.543   14.609 18.84004 23.64466 
1 1 1   10   16   54 o  208.400   14.561   34.288   4.6156   39.731   6.6572   29.249   6.4051  221.607   19.836  188.340   22.674 33.26740 30.12614 
1 1 1   10   16   55 o  186.148   14.320   27.431   4.0487   28.389   6.5817   26.848   5.1352  184.165   23.913  182.056   18.694 2.108322 30.35282 
1 1 1   10   16   56 o  229.681   11.842   41.343   4.1489   37.329   6.9709   43.544   5.1629  212.421   21.746  234.399   14.461 -21.97821 26.11556 
1 1 1   10   16   57 o  133.188   19.140   14.670   3.7897   12.410   6.5897   15.786   4.6324  113.891   34.683  136.092   23.062 -22.20169 41.65079 
1 1 1   10   16   58 o  129.876   20.102   14.181   3.8671   13.052   7.3879   14.608   4.5385  113.731   37.014  129.673   23.741 -15.94112 43.97342 
1 1 1   10   16   59 o  161.398   15.663   21.173   3.8206   17.408   6.2807   23.384   4.8137  135.299   30.993  167.370   19.134 -32.07124 36.42400 
1 1 1   10   17    0 o  612.890   11.853  287.901   11.110  287.901   11.110  287.901   11.110  612.890   11.853  612.890   11.853 0.000000 0.000000 
1 1 1   10   17    1 o  805.817   9.3271  497.164   11.504  508.696   16.517  486.297   16.033  814.932   13.241  796.793   13.146 18.13910 18.65872 
1 1 1   10   17    2 o  1159.24   11.632  1029.15   20.639  1028.69   29.101  1029.63   29.277  1158.60   16.410  1159.12   16.501 -0.5212402 23.27183 
1 1 1   10   17    3 o  774.891   7.5013  459.666   8.8971  455.348   10.764  468.979   15.807  771.191   9.1189  782.473   13.198 -11.28186 16.04190 
1 1 1   10   17    4 o  1271.26   10.175  1237.46   19.800  1245.15   24.386  1222.56   33.918  1275.04   12.495  1262.94   17.546 12.09521 21.54031 
1 1 1   10   17    5 o  1082.42   11.163  897.226   18.495  878.760   25.555  917.536   26.800  1070.91   15.590  1094.24   16.001 -23.33643 22.34038 
1 1 1   10   17    6 o  1480.39   11.558  1678.37   26.189  1690.56   32.428  1655.50   44.409  1485.50   14.262  1469.32   19.746 16.17603 24.35802 
1 1 1   10   17    7 o  378.765   9.0331  109.840   5.2369  114.633   7.7368  105.786   7.1146  386.853   13.066  371.639   12.507 15.21402 18.08730 
1 1 1   10   17    8 o  887.808   10.192  603.547   13.850  598.765   19.747  608.177   19.430  884.035   14.593  890.978   14.248 -6.943604 20.39528 
1 1 1   10   17    9 o  742.245   7.7078  421.764   8.7568  420.645   10.733  423.992   15.144  741.201   9.4607  743.972   13.299 -2.771362 16.32054 
1 1 1   10   17   10 o  992.427   8.8783  754.086   13.487  759.482   16.626  743.704   23.062  995.863   10.907  985.160   15.294 10.70349 18.78481 
1 1 1   10   17   11 o  298.630   8.4334   68.278   3.8549   68.370   4.6500   68.074   6.8929  298.806   10.167  297.668   15.179 1.138153 18.26937 
1 1 1   10   17   12 o  752.851   9.6866  433.999   11.162  430.392   15.556  437.827   16.026  749.525   13.560  755.955   13.850 -6.429382 19.38264 
1 1 1   10   17   13 o  857.651   8.3936  563.170   11.019  566.295   18.836  561.545   13.586  859.690   14.314  856.320   10.365 3.370056 17.67316 
1 1 1   10   17   14 o  841.432   7.2708  542.021   9.3642  529.652   12.987  555.417   13.515  831.647   10.202  851.625   10.368 -19.97870 14.54578 
1 1 1   10   17   15 o  897.442   10.566  616.816   14.514  616.816   14.514   0.0000   0.0000  897.442   10.566  ?   ?  0.000000 10.56572 
1 1 1   10   17   16 o  632.008   7.8747  305.816   7.6177  298.179   9.1625  322.912   13.709  624.007   9.5930  649.163   13.797 -25.15619 16.80441 
1 1 1   10   17   17 o  776.581   7.2529  461.709   8.6212  457.353   11.980  466.388   12.416  772.779   10.128  780.360   10.395 -7.581482 14.51322 
1 1 1   10   17   18 o  465.997   7.3877  166.254   5.2694  164.024   7.2224  168.792   7.7050  462.781   10.196  469.440   10.723 -6.658844 14.79692 
1 1 1   10   17   19 o  563.825   7.2680  243.387   6.2723  248.188   8.7484  238.309   8.9977  569.258   10.040  557.793   10.539 11.46509 14.55585 
1 1 1   10   17   20 o  1564.19   10.783  1874.17   25.818  1869.54   36.221  1878.95   36.809  1561.58   15.154  1565.46   15.362 -3.886353 21.57857 
1 1 1   10   17   21 o  498.334   9.2473  190.188   7.0536  188.769   8.2429  194.067   13.631  496.408   10.849  502.928   17.708 -6.519745 20.76659 
1 1 1   10   17   22 o  188.178   18.172   27.428   5.1691   29.752   5.9594   20.367   10.388  195.802   20.173  159.101   42.028 36.70050 46.61863 
1 1 1   10   17   23 o  388.431   10.745  115.590   6.3886  125.102   7.6160   93.005   11.735  404.032   12.315  347.133   22.202 56.89865 25.38931 
1 1 1   10   17   24 o  471.778   8.7345  170.465   6.3073  176.324   7.1363  149.550   13.483  479.775   9.7178  441.204   19.965 38.57178 22.20458 
1 1 1   10   17   25 o  354.338   7.8478   96.151   4.2564  102.547   5.0846   81.173   7.7808  365.895   9.0788  325.262   15.629 40.63248 18.07428 
1 1 1   10   17   26 o  465.331   7.0778  165.810   5.0412  165.689   6.0600  166.082   9.0837  465.102   8.5125  465.414   12.751 -0.3121643 15.33164 
1 1 1   10   17   27 o  742.429   7.0231  422.103   7.9810  418.815   9.8688  428.318   13.568  739.408   8.7199  747.446   11.860 -8.038086 14.72036 
1 1 1   10   17   28 o  261.616   8.1153   52.429   3.2496   51.576   4.5313   53.332   4.6629  259.363   11.414  263.735   11.551 -4.372101 16.23915 
1 1 1   10   17   29 o  839.803   6.5250  540.112   8.3875  533.701   11.554  547.256   12.196  834.548   9.0449  845.032   9.4289 -10.48462 13.06572 
1 1 1   10   17   30 o  599.429   7.2163  275.238   6.6210  279.098   9.3045  271.278   9.4235  603.359   10.075  594.817   10.351 8.542053 14.44437 
1 1 1   10   17   31 o  211.805   10.369   34.404   3.3615   40.305   5.0061   29.559   4.5364  228.585   14.381  195.499   15.281 33.08586 20.98439 
1 1 1   10   17   32 o  285.909   8.1739   62.649   3.5771   56.903   4.9808   68.770   5.1405  272.260   11.952  299.361   11.219 -27.10126 16.39244 
1 1 1   10   17   33 o  462.581   6.7650  163.941   4.7899  166.698   6.7040  161.065   6.8461  466.220   9.3944  458.238   9.7607 7.982635 13.54720 
1 1 1   10   17   34 o  201.221   18.010   31.494   5.4885   31.135   8.0782   31.802   7.4800  198.001   27.388  200.773   24.873 -2.771637 36.99694 
1 1 1   10   17   35 o   57.185   24.216   0.1994   3.6650  -5.6626   7.9469   1.7831   4.1305   69.905   32.185   66.792   26.703 3.112839 41.82016 
1 1 1   10   17   36 o  474.840   6.9480  172.818   5.0499  170.484   7.2376  175.033   7.0493  471.235   10.034  477.538   9.6442 -6.303162 13.91753 
1 1 1   10   17   37 o  453.712   7.9068  157.882   5.4910  156.200   7.9176  159.440   7.6217  450.755   11.476  455.501   10.932 -4.746002 15.84926 
1 1 1   10   17   38 o  212.956   11.077   34.961   3.5983   42.226   5.3206   28.837   4.8848  233.442   14.969  192.393   16.755 41.04837 22.46803 
1 1 1   10   17   39 o  381.572   8.6136  111.768   5.0307  111.229   6.3762  112.657   8.1880  380.293   10.954  382.132   13.999 -1.838409 17.77521 
1 1 1   10   17   40 o  138.798   15.200   15.070   3.1764   13.554   4.6800   16.365   4.3251  129.338   24.538  143.574   20.243 -14.23592 31.80998 
1 1 1   10   17   41 o  222.351   10.657   38.050   3.6271   38.038   5.3917   38.060   4.9021  220.973   16.051  221.385   14.548 -0.4120178 21.66236 
1 1 1   10   17   42 o  142.176   14.989   15.826   3.2128   16.990   4.6517   14.765   4.4427  145.730   21.500  135.466   22.195 10.26451 30.90095 
1 1 1   10   17   43 o  259.582   10.335   51.896   4.1065   48.255   5.8144   55.519   5.8005  248.921   15.335  267.374   14.225 -18.45335 20.91680 
1 1 1   10   17   44 o  200.383   12.205   31.130   3.7255   28.100   5.5449   33.622   5.0299  188.441   19.507  207.358   15.971 -18.91618 25.21070 
1 1 1   10   17   45 f  296.772   9.9490   67.852   4.5193   70.800   6.9384   65.680   5.9560  301.879   15.016  291.211   13.362 10.66800 20.10050 
1 1 1   10   17   46 o  211.681   12.363   34.782   3.9883   35.449   5.7790   34.175   5.5112  212.076   17.972  208.381   17.439 3.695663 25.04250 
1 1 1   10   17   47 o  224.641   12.715   39.219   4.3540   32.957   6.5320   44.226   5.8408  203.006   21.341  237.508   16.163 -34.50230 26.77094 
1 1 1   10   17   48 o  119.610   45.968   10.906   11.836   10.906   11.836   0.0000   0.0000  119.610   45.968  ?   ?  0.000000 45.96759 
1 1 1   10   17   49 o  143.048   19.794   16.469   4.2179   21.442   6.5630   12.969   5.5055  160.201   27.771  123.281   29.559 36.92014 40.55846 
1 1 1   10   17   50 o   54.814   24.315  -1.0021   4.0631  -8.2671   6.2522   4.3092   5.3458   53.831   25.886   81.215   30.969 -27.38390 40.36288 
1 1 1   10   17   51 o  117.256   26.044   11.621   4.5527   30.312   7.8054   1.9842   5.6048  190.342   27.596   73.436   30.439 116.9061 41.08603 
1 1 1   10   17   53 o  170.801   17.794   23.402   4.5836   18.556   6.8496   27.332   6.1682  144.880   31.763  182.298   22.590 -37.41782 38.97677 
1 1 1   10   17   54 o   54.677   24.706  -1.6189   4.4089  -3.5278   6.0935   0.4785   6.3873   60.438   27.952   71.416   31.120 -10.97894 41.83050 
1 1 1   10   17   55 o  129.004   23.728   14.117   4.5127   16.005   6.6332   12.491   6.1571  132.164   32.914  116.637   33.004 15.52672 46.61169 
1 1 1   10   17   56 o  190.681   16.418   29.225   4.7451   28.461   6.8374   29.934   6.5906  182.553   25.136  188.586   23.330 -6.032883 34.29454 
1 1 1   10   17   57 o   90.324   29.024   7.3233   4.5522   8.2747   6.7328   6.5220   6.1786   95.620   35.098   88.199   33.374 7.420395 48.43256 
1 1 1   10   17   58 o   80.289   26.187   5.6666   3.6973   2.3525   7.0273   6.9352   4.3477   76.074   32.896   87.489   28.391 -11.41472 43.45351 
1 1 1   10   17   59 o  118.316   25.925   12.691   4.5652   6.7786   8.2343   15.315   5.4854   89.889   37.044  128.144   28.682 -38.25424 46.84957 
1 1 1   10   18    0 o  434.083   11.544  144.562   7.6579  144.562   7.6579  144.562   7.6579  434.083   11.544  434.083   11.544 0.000000 0.000000 
1 1 1   10   18    1 o  727.584   9.0198  405.311   10.045  400.651   14.069  410.157   14.346  723.240   12.709  731.765   12.809 -8.524536 18.04398 
1 1 1   10   18    2 o  667.733   8.7358  341.363   8.9284  328.841   12.266  355.476   13.021  655.247   12.230  681.255   12.487 -26.00836 17.47876 
1 1 1   10   18    3 o  641.424   7.0737  314.952   6.9448  316.812   8.5096  311.241   12.018  643.275   8.6426  637.466   12.317 5.808350 15.04634 
1 1 1   10   18    4 o  1466.13   11.410  1646.20   25.606  1633.38   31.066  1673.38   45.222  1460.17   13.900  1477.14   20.001 -16.97144 24.35671 
1 1 1   10   18    5 o  1105.14   16.100  935.982   27.234   0.0000   0.0000  935.982   27.234  ?   ?   1105.14   16.100 0.000000 16.10016 
1 1 1   10   18    6 o  931.905   10.537  665.030   15.031  646.953   21.233  683.187   21.280  918.864   15.097  944.273   14.723 -25.40948 21.08785 
1 1 1   10   18    7 o  856.656   8.2096  561.839   10.765  558.822   13.210  567.801   18.572  854.273   10.103  860.883   14.095 -6.609985 17.34126 
1 1 1   10   18    8 o  625.714   7.4377  299.726   7.1234  302.327   8.8259  294.865   12.065  628.373   9.1764  620.437   12.705 7.935425 15.67198 
1 1 1   10   18    9 o  773.606   7.9569  458.178   9.4218  463.650   11.681  447.992   15.938  778.139   9.8078  764.694   13.617 13.44513 16.78115 
1 1 1   10   18   10 f  601.816   7.4971  277.273   6.9060  279.161   8.4952  273.595   11.859  603.812   9.1918  597.617   12.964 6.194458 15.89196 
1 1 1   10   18   11 o  426.924   7.6708  139.538   5.0126  136.191   6.0316  147.009   9.0124  421.738   9.3437  438.046   13.442 -16.30762 16.37013 
1 1 1   10   18   12 o  713.279   7.9088  389.515   8.6345  388.759   10.545  391.052   15.040  712.519   9.6694  714.408   13.754 -1.888977 16.81300 
1 1 1   10   18   13 o   89.323   24.006   6.3362   3.3525   8.4604   4.0569   1.7618   5.9533  102.927   25.801   77.935   31.735 24.99207 40.89934 
1 1 1   10   18   14 o  712.821   9.7246  389.105   10.610  386.063   14.648  392.463   15.390  709.828   13.482  715.651   14.050 -5.823059 19.47177 
1 1 1   10   18   15 o  1267.78   12.912  1231.44   25.055  1218.80   34.736  1245.15   36.174  1260.59   18.003  1274.06   18.549 -13.46960 25.84910 
1 1 1   10   18   16 o  1164.31   8.7010  1038.01   15.506  1031.21   21.707  1045.10   22.158  1160.19   12.224  1167.96   12.395 -7.769409 17.40834 
1 1 1   10   18   17 o  463.278   7.2897  164.320   5.1692  156.865   7.0377  173.054   7.6173  452.565   10.160  475.333   10.470 -22.76804 14.58880 
1 1 1   10   18   18 o  856.879   7.6286  562.173   10.005  558.299   13.869  566.377   14.448  853.745   10.614  859.874   10.977 -6.128174 15.26932 
1 1 1   10   18   19 o  709.252   8.6157  385.208   9.3533  374.881   11.018  411.851   17.697  699.592   10.289  732.863   15.776 -33.27118 18.83500 
1 1 1   10   18   20 o  172.599   17.892   23.103   4.6580   26.427   5.3617   12.875   9.4059  184.547   19.265  130.216   41.707 54.33089 45.94170 
1 1 1   10   18   21 o  766.923   7.7165  450.370   9.0583  443.156   12.444  458.500   13.211  760.574   10.690  773.595   11.157 -13.02075 15.45124 
1 1 1   10   18   22 o  675.470   7.7416  349.376   8.0040  338.081   11.025  361.963   11.639  664.285   10.843  687.333   11.063 -23.04742 15.49064 
1 1 1   10   18   23 o  622.721   9.0857  297.017   8.6600  283.853   14.652  304.084   10.736  608.271   15.737  629.958   11.134 -21.68689 19.27775 
1 1 1   10   18   24 o  320.798   10.558   78.853   5.1841   81.646   7.2124   75.868   7.4565  326.260   14.443  314.452   15.492 11.80850 21.18009 
1 1 1   10   18   25 f  106.289   21.489   9.0035   3.3758   10.627   3.5480  -6.5194   10.970  115.814   20.778   84.850   38.589 30.96378 43.82795 
1 1 1   10   18   26 o  157.987   14.686   19.319   3.5108   20.180   3.6849   10.852   11.557  161.448   15.086  127.686   46.119 33.76207 48.52389 
1 1 1   10   18   27 o  399.860   7.7027  122.468   4.7143  121.941   5.6127  123.730   8.6871  398.927   9.1920  401.514   14.135 -2.587067 16.86117 
1 1 1   10   18   28 o  663.435   8.9261  337.276   9.0642  337.276   9.0642   0.0000   0.0000  663.435   8.9261  ?   ?  0.000000 8.926106 
1 1 1   10   18   29 o  156.364   15.817   18.984   3.7336   15.550   4.1026   35.538   9.0081  140.748   19.573  212.179   28.454 -71.43153 34.53597 
1 1 1   10   18   30 o  546.639   6.7495  228.889   5.6473  230.080   7.3951  227.223   8.7470  547.888   8.8183  544.305   10.499 3.583374 13.71094 
1 1 1   10   18   31 o  375.659   6.9486  108.113   3.9954  107.078   5.5142  109.256   5.7972  373.679   9.6409  377.429   10.035 -3.750061 13.91566 
1 1 1   10   18   32 o  328.343   7.3823   82.614   3.7101   87.512   5.2411   77.694   5.2527  337.744   10.138  318.184   10.785 19.56033 14.80241 
1 1 1   10   18   33 o  528.982   7.4370  214.460   6.0216  203.392   7.2105  239.969   10.946  514.962   9.1479  558.771   12.799 -43.80933 15.73195 
1 1 1   10   18   34 o  500.245   7.9150  191.857   6.0604  188.623   10.840  193.327   7.3096  495.015   14.306  501.959   9.5138 -6.944366 17.18090 
1 1 1   10   18   35 o  877.832   6.8657  590.603   9.2250  578.274   12.910  603.467   13.187  867.987   9.7170  886.693   9.7164 -18.70599 13.74152 
1 1 1   10   18   36 o  286.396   8.3322   62.921   3.6525   57.519   5.0980   68.619   5.2357  273.462   12.180  298.772   11.449 -25.31067 16.71588 
1 1 1   10   18   37 o  173.456   13.385   23.314   3.5261   22.445   5.0007   24.173   4.9727  168.947   19.708  175.619   18.791 -6.672440 27.23043 
1 1 1   10   18   38 o  191.913   12.132   28.466   3.5455   31.759   4.8052   24.529   5.2528  202.125   15.654  176.592   19.773 25.53363 25.21899 
1 1 1   10   18   39 o  232.426   9.7891   41.519   3.4825   38.705   5.1040   43.970   4.7637  223.283   15.022  238.438   13.103 -15.15471 19.93336 
1 1 1   10   18   40 o   73.436   22.470   4.2476   2.7615   7.0547   3.8906   1.3976   3.9202   93.136   26.194   63.416   25.779 29.71988 36.75176 
1 1 1   10   18   41 o  214.240   11.278   35.460   3.6854   40.587   5.1270   29.980   5.3012  228.514   14.737  195.484   17.917 33.03036 23.19865 
1 1 1   10   18   42 o  224.046   10.702   38.671   3.6702   35.766   5.0731   41.861   5.3163  214.137   15.585  231.888   15.060 -17.75092 21.67229 
1 1 1   10   18   43 o  368.698   8.2612  104.473   4.6621  110.130   6.8221   99.516   6.3860  377.728   11.800  359.111   11.618 18.61691 16.55929 
1 1 1   10   18   44 o  172.695   14.251   23.278   3.7333   27.285   5.6967   20.262   4.9426  185.277   20.427  159.255   20.771 26.02196 29.13238 
1 1 1   10   18   45 o  177.990   13.901   24.716   3.7570   32.688   5.7246   18.684   4.9795  203.441   18.589  152.289   22.000 51.15167 28.80212 
1 1 1   10   18   46 o  169.926   14.670   22.611   3.7783   25.912   5.5227   19.707   5.1803  180.197   20.381  156.207   22.299 23.99036 30.21018 
1 1 1   10   18   47 o  296.130   17.960   69.063   8.1023   59.002   12.707   75.957   10.518  265.715   31.879  308.211   22.449 -42.49612 38.99023 
1 1 1   10   18   48 o  130.857   20.797   13.882   4.0261   12.194   6.0231   15.245   5.4131  118.959   32.263  134.896   27.156 -15.93684 42.17102 
1 1 1   10   18   49 o  160.858   17.981   20.611   4.3513   22.975   6.5963   18.790   5.7898  166.225   26.840  150.328   26.110 15.89670 37.44487 
1 1 1   10   18   50 o  293.040   11.024   66.494   4.9445   68.403   7.2760   64.856   6.7400  294.830   16.185  287.449   15.375 7.381622 22.32345 
1 1 1   10   18   51 o  287.876   11.976   64.385   5.2771   65.282   7.3515   63.431   7.5798  287.369   16.786  282.809   17.597 4.559509 24.31985 
1 1 1   10   18   52 o   93.546   27.120   7.4676   4.1092   6.1932   5.8956   8.6717   5.7304   89.632   32.852  100.345   32.596 -10.71307 46.27917 
1 1 1   10   18   53 o  101.559   27.563   8.9628   4.3943   17.014   6.5061   2.2092   5.9588  138.339   31.440   74.773   31.222 63.56551 44.30835 
1 1 1   10   18   54 o   59.931   26.114   0.0017   4.4968  -3.0735   6.3296   3.1355   6.3898   62.524   28.763   78.946   32.593 -16.42192 43.47018 
1 1 1   10   18   55 o   95.857   28.859   8.1342   4.5815   8.9389   6.8973   7.4988   6.1290  100.238   35.693   93.620   33.613 6.618248 49.02873 
1 1 1   10   18   56 o  143.702   20.870   17.270   4.4563   18.540   6.5506   16.177   6.0800  142.229   30.968  132.909   30.529 9.320374 43.48645 
1 1 1   10   18   57 o  147.408   20.982   18.332   4.6005   13.690   6.9880   21.883   6.1118  117.229   35.720  157.378   26.300 -40.14943 44.35754 
1 1 1   10   18   58 o   84.872   27.632   6.5124   4.1173   8.6596   5.7587   4.2669   5.8890   95.214   32.708   77.914   31.625 17.30029 45.49675 
1 1 1   10   19    0 o  165.378   19.023   21.769   4.6499   21.769   4.6499   21.769   4.6499  165.378   19.023  165.378   19.023 0.000000 0.000000 
1 1 1   10   19    1 o  826.161   9.6049  522.625   12.146  524.226   17.177  521.026   17.177  827.214   13.566  824.683   13.608 2.531128 19.21486 
1 1 1   10   19    2 o  259.702   9.8910   51.645   3.9317   49.194   5.5482   54.117   5.5725  252.981   14.388  265.421   13.764 -12.44022 19.91104 
1 1 1   10   19    3 o  790.086   9.4406  477.975   11.417  480.085   16.119  475.850   16.173  791.634   13.302  788.128   13.407 3.505737 18.88651 
1 1 1   10   19    4 o  230.687   9.0757   40.746   3.2046   41.185   3.9170   39.858   5.5730  231.900   11.035  227.477   16.110 4.423096 19.52722 
1 1 1   10   19    5 o  626.280   8.9070  300.313   8.5382  310.300   12.326  291.100   11.838  636.463   12.653  616.462   12.546 20.00012 17.81862 
1 1 1   10   19    6 o  645.312   7.5099  318.802   7.4178  317.401   9.1435  321.500   12.687  643.837   9.2782  647.836   12.795 -3.998291 15.80462 
1 1 1   10   19    7 o  879.580   8.4052  592.339   11.316  584.974   13.791  607.518   19.797  874.002   10.309  890.411   14.526 -16.40833 17.81238 
1 1 1   10   19    8 o  865.154   8.3712  573.071   11.085  564.273   13.461  591.612   19.541  858.398   10.245  878.667   14.530 -20.26965 17.77855 
1 1 1   10   19    9 o  776.414   8.0463  461.528   9.5622  458.605   11.679  467.474   16.655  773.874   9.8597  781.090   13.930 -7.215698 17.06664 
1 1 1   10   19   10 o  662.766   7.7384  336.297   7.8502  341.932   9.7210  325.735   13.310  668.232   9.5042  652.035   13.336 16.19708 16.37628 
1 1 1   10   19   11 o  734.948   8.0586  413.556   9.0654  417.436   11.206  406.204   15.423  738.309   9.9158  728.091   13.839 10.21814 17.02471 
1 1 1   10   19   12 o  544.674   7.8420  227.137   6.5378  239.542   8.1114  204.137   11.045  559.297   9.4751  516.133   13.981 43.16394 16.88930 
1 1 1   10   19   13 o  1115.93   11.888  953.955   20.306  953.955   20.306   0.0000   0.0000  1115.93   11.888  ?   ?  0.000000 11.88820 
1 1 1   10   19   14 o  889.387   7.5943  605.615   10.338  595.860   14.353  616.134   14.904  882.024   10.631  896.889   10.857 -14.86462 15.19505 
1 1 1   10   19   15 o  520.778   8.1171  207.660   6.4702  201.031   10.590  211.608   8.1734  512.183   13.508  525.635   10.159 -13.45203 16.90149 
1 1 1   10   19   16 o  992.983   11.337  755.342   17.231  734.104   23.340  780.785   25.547  978.502   15.584  1009.02   16.541 -30.51514 22.72595 
1 1 1   10   19   17 o  143.662   20.125   16.152   4.3039   20.078   5.0818   6.1909   8.0943  160.305   21.234  102.704   38.337 57.60063 43.82462 
1 1 1   10   19   18 o  907.789   9.1469  631.113   12.709  640.135   15.594  613.259   21.935  914.104   11.145  894.224   16.026 19.87958 19.52048 
1 1 1   10   19   19 o  628.216   7.5083  302.181   7.2198  292.474   9.8287  313.558   10.640  617.906   10.392  639.764   10.866 -21.85767 15.03521 
1 1 1   10   19   20 o  1041.03   8.4968  829.942   13.539  815.267   18.727  846.015   19.597  1031.47   11.861  1050.70   12.186 -19.23425 17.00534 
1 1 1   10   19   21 o  904.068   8.0491  625.908   11.138  616.466   15.484  636.035   16.035  896.955   11.278  911.058   11.499 -14.10364 16.10623 
1 1 1   10   19   22 o  366.744   10.727  103.057   6.0215  100.045   10.412  104.570   7.3812  360.406   18.940  369.323   13.057 -8.917511 23.00467 
1 1 1   10   19   23 o  372.131   9.3645  106.085   5.3340  104.547   7.2941  107.852   7.8201  369.264   12.905  375.015   13.624 -5.751099 18.76552 
1 1 1   10   19   24 o  142.404   20.720   15.922   4.3838   16.133   6.1312   15.701   6.2705  141.917   29.199  139.837   30.181 2.080048 41.99402 
1 1 1   10   19   25 o  717.715   8.1010  394.568   8.8994  401.183   12.570  387.919   12.602  723.403   11.352  711.320   11.574 12.08337 16.21206 
1 1 1   10   19   26 o  179.951   13.136   24.977   3.5931   26.931   3.7818   6.8507   11.519  186.876   13.308  115.963   45.131 70.91260 47.05188 
1 1 1   10   19   27 o  439.451   9.1317  147.995   6.1423  152.540   6.8076  128.092   14.245  446.091   9.9702  406.744   22.975 39.34702 25.04510 
1 1 1   10   19   28 o  721.686   7.8238  399.035   8.6424  398.033   9.6958  402.910   19.066  720.676   8.7897  723.666   17.213 -2.989624 19.32698 
1 1 1   10   19   29 o  583.113   7.6024  260.519   6.7854  258.841   7.7143  266.254   14.263  581.133   8.6726  588.381   15.837 -7.248352 18.05647 
1 1 1   10   19   30 o  803.021   7.2607  494.069   8.9243  498.295   11.261  486.933   14.634  806.181   9.1256  796.415   12.005 9.766663 15.07933 
1 1 1   10   19   31 o  767.404   7.2061  451.257   8.4644  434.059   10.262  487.862   14.971  752.394   8.9108  796.990   12.273 -44.59589 15.16636 
1 1 1   10   19   32 o  427.079   7.7518  139.809   5.0674  139.608   6.1215  140.248   9.0324  426.617   9.3745  427.023   13.819 -0.4051208 16.69887 
1 1 1   10   19   33 o  750.826   7.4090  432.109   8.5147  439.662   14.182  427.852   10.647  756.342   12.250  746.782   9.3149 9.560303 15.38931 
1 1 1   10   19   34 o  566.744   6.5885  246.147   5.7154  248.458   8.0643  243.814   8.1013  569.029   9.2590  563.665   9.3899 5.364258 13.18711 
1 1 1   10   19   35 o  361.112   7.3381   99.979   4.0560  107.371   5.7681   92.749   5.7044  373.926   10.078  347.454   10.726 26.47183 14.71795 
1 1 1   10   19   36 o  633.071   7.8977  307.422   7.6529  309.006   10.704  305.767   10.945  634.012   11.030  630.602   11.340 3.410706 15.81958 
1 1 1   10   19   37 o  503.813   7.3230  194.673   5.6471  188.677   7.2278  204.071   9.0479  495.626   9.5275  515.030   11.477 -19.40402 14.91657 
1 1 1   10   19   38 o  342.507   8.0356   90.033   4.2127   82.341   5.7211   99.143   6.2261  327.080   11.428  358.920   11.333 -31.84039 16.09444 
1 1 1   10   19   39 o  194.701   10.849   29.264   3.2202   31.717   4.7787   27.223   4.3583  201.830   15.590  186.944   15.367 14.88654 21.89047 
1 1 1   10   19   40 o  308.860   8.4583   73.279   3.9987   72.455   5.8891   73.984   5.4467  306.434   12.556  309.856   11.484 -3.422638 17.01574 
1 1 1   10   19   41 o  159.586   13.091   19.808   3.1694   26.803   4.5227   13.057   4.4429  185.113   16.123  126.713   23.781 58.39983 28.73134 
1 1 1   10   19   42 o  237.923   10.422   43.607   3.7956   39.745   5.2266   47.917   5.5209  225.824   15.209  248.213   14.596 -22.38918 21.08016 
1 1 1   10   19   43 o  134.852   16.302   14.348   3.2965   13.592   4.6417   15.117   4.6826  128.916   24.417  136.494   23.246 -7.578369 33.71346 
1 1 1   10   19   44 o   42.201   19.828  -3.2911   3.2658  -4.1238   4.7227  -2.5280   4.5210   51.794   24.176   54.181   24.692 -2.387081 34.55681 
1 1 1   10   19   45 o  175.527   14.028   24.062   3.7373   23.476   5.5364   24.553   5.0656  171.043   21.631  175.835   19.130 -4.792328 28.87637 
1 1 1   10   19   46 o  159.620   30.961   21.516   7.2913   45.120   11.786   6.8830   9.2801  230.618   34.446  103.173   40.409 127.4451 53.09843 
1 1 1   10   19   47 o  273.659   13.028   58.121   5.4569   47.396   11.898   60.978   6.1409  236.161   33.886  279.523   14.402 -43.36267 36.81904 
1 1 1   10   19   48 o   70.525   26.250   3.2843   3.7895   1.0010   5.7379   5.0506   5.0467   71.351   30.262   83.576   30.431 -12.22440 42.91703 
1 1 1   10   19   49 o  186.923   15.407   27.509   4.3688   21.479   6.4166   32.720   5.9648  160.307   27.118  202.347   19.500 -42.03940 33.40101 
1 1 1   10   19   50 o   44.902   21.336  -4.5463   3.9839  -3.3536   5.6113  -5.7586   5.6572   58.767   27.052   54.195   25.656 4.572449 37.28358 
1 1 1   10   19   51 o   96.470   26.510   7.9349   4.0352   0.4484   5.7488   15.205   5.6653   69.004   29.797  132.868   28.696 -63.86390 41.36801 
1 1 1   10   19   52 o  166.509   17.369   22.214   4.3616   22.151   6.2458   22.275   6.0933  161.949   26.082  162.870   25.261 -0.9207611 36.30952 
1 1 1   10   19   53 o  229.476   14.254   41.559   4.9818   40.474   6.6914   42.908   7.4622  223.373   19.776  228.843   21.558 -5.469635 29.25441 
1 1 1   10   19   54 o   49.075   22.986  -3.5676   4.3309   1.3716   6.2514  -8.1264   6.0058   72.845   31.259   51.583   24.945 21.26212 39.99252 
1 1 1   10   19   55 o  143.301   22.041   17.265   4.6795   23.289   6.8415   11.969   6.4148  162.321   28.580  112.673   34.199 49.64792 44.56949 
1 1 1   10   19   56 o  186.818   18.162   28.579   5.1278   48.328   8.8156   18.480   6.3041  237.276   24.632  142.084   29.932 95.19194 38.76431 
1 1 1   10   19   57 o   94.948   27.976   8.2870   4.3410   10.300   6.4608   6.6303   5.8612  102.529   34.652   87.081   32.600 15.44752 47.57605 
1 1 1   10   19   58 o  160.173   27.429   23.313   6.4829   13.656   10.159   29.948   8.4206  110.363   42.540  176.815   32.304 -66.45209 53.41579 
1 1 1   10   20    0 o  749.942   13.238  431.051   15.185  431.051   15.185  431.051   15.185  749.942   13.238  749.942   13.238 0.000000 0.000000 
1 1 1   10   20    1 o  592.623   8.7566  268.904   7.9430  265.124   11.056  272.936   11.419  588.312   12.278  596.907   12.498 -8.594360 17.51993 
1 1 1   10   20    2 o  283.008   10.079   61.334   4.3658   59.246   5.9537   63.764   6.4212  277.713   14.052  288.091   14.610 -10.37820 20.27063 
1 1 1   10   20    3 f  651.715   8.9757  325.213   8.9536  329.029   12.593  321.312   12.733  655.374   12.553  647.628   12.845 7.746155 17.96054 
1 1 1   10   20    4 o  1183.88   9.8377  1073.29   17.827  1065.02   21.627  1090.80   31.487  1179.15   11.983  1192.77   17.247 -13.62280 21.00072 
1 1 1   10   20    5 o  857.141   10.093  562.625   13.242  562.531   18.745  562.719   18.708  856.797   14.294  856.943   14.263 -0.1455688 20.19265 
1 1 1   10   20    6 o  857.488   8.3721  562.972   10.988  571.792   13.749  547.378   18.282  864.075   10.396  845.184   14.132 18.89117 17.54357 
1 1 1   10   20    7 f  483.384   7.5868  178.889   5.6133  177.098   6.8992  182.397   9.6550  480.911   9.3726  487.929   12.928 -7.017944 15.96793 
1 1 1   10   20    8 f  470.675   7.5922  169.608   5.4696  168.400   6.7342  171.950   9.3761  468.950   9.3819  473.746   12.930 -4.795685 15.97531 
1 1 1   10   20    9 o  429.943   7.8992  141.527   5.1984  134.861   6.2926  155.856   9.2250  419.647   9.7965  451.009   13.363 -31.36133 16.56953 
1 1 1   10   20   10 o  1005.30   9.1559  773.887   14.088  798.330   17.769  732.504   23.120  1020.90   11.371  977.539   15.452 43.35638 19.18495 
1 1 1   10   20   11 o  435.951   9.9707  145.551   6.6533  145.551   6.6533   0.0000   0.0000  435.951   9.9707  ?   ?  0.000000 9.970745 
1 1 1   10   20   12 o  1210.71   12.587  1123.08   23.325  1123.08   23.325   0.0000   0.0000  1210.71   12.587  ?   ?  0.000000 12.58665 
1 1 1   10   20   13 o  1605.46   12.587  1974.91   30.930  1948.47   37.322  2032.90   55.271  1594.24   15.295  1626.87   22.196 -32.62854 26.95522 
1 1 1   10   20   14 o  1074.07   9.6177  883.511   15.812  895.608   19.601  860.972   26.754  1081.20   11.844  1059.56   16.497 21.64343 20.30821 
1 1 1   10   20   15 o  345.265   8.4038   91.282   4.4412   93.733   6.2063   88.711   6.3581  349.781   11.592  340.262   12.208 9.518402 16.83489 
1 1 1   10   20   16 o  140.617   17.141   15.393   3.6129   16.546   5.0651   14.198   5.1549  144.856   23.662  133.555   26.152 11.30029 35.26804 
1 1 1   10   20   17 o  251.630   12.316   48.520   4.7436   55.651   7.6413   44.050   6.0507  268.614   18.702  239.054   16.640 29.55956 25.03297 
1 1 1   10   20   18 o  776.620   14.742  462.485   17.524  462.485   17.524   0.0000   0.0000  776.620   14.742  ?   ?  0.000000 14.74201 
1 1 1   10   20   19 o  771.873   7.7261  456.221   9.1280  456.796   12.807  455.627   13.014  772.149   10.836  771.146   11.025 1.003906 15.45891 
1 1 1   10   20   20 o  984.181   8.2911  741.802   12.490  737.460   17.431  746.384   17.905  980.973   11.609  986.863   11.853 -5.889587 16.59141 
1 1 1   10   20   21 o  584.417   9.1310  261.621   8.1679  253.831   13.875  265.753   10.104  575.142   15.761  588.881   11.210 -13.73901 19.34083 
1 1 1   10   20   22 o  238.796   12.176   43.829   4.4355   46.012   6.1736   41.500   6.3769  244.247   16.612  231.725   18.123 12.52229 24.58502 
1 1 1   10   20   23 o  573.495   8.0566  251.916   7.0721  254.405   9.8833  249.305   10.124  576.100   11.208  570.264   11.599 5.835876 16.12918 
1 1 1   10   20   24 o  544.342   8.2957  226.985   6.9119  226.360   9.7081  227.626   9.8431  543.339   11.673  544.845   11.803 -1.506104 16.60039 
1 1 1   10   20   25 f  725.976   9.4069  403.896   10.453  399.522   17.396  406.369   13.077  721.156   15.759  727.921   11.737 -6.765076 19.64984 
1 1 1   10   20   26 o  329.323   12.151   83.206   6.1251   89.372   10.122   79.644   7.6936  340.096   19.526  321.939   15.613 18.15775 25.00086 
1 1 1   10   20   27 o  376.080   8.4105  108.383   4.8414  114.661   5.5298   87.772   10.020  386.760   9.3411  336.929   19.512 49.83038 21.63293 
1 1 1   10   20   28 o  531.116   8.6631  216.209   7.0426  216.209   7.0426   0.0000   0.0000  531.116   8.6631  ?   ?  0.000000 8.663064 
1 1 1   10   20   29 f  184.299   13.059   26.222   3.6601   28.262   3.8802   9.7504   11.025  191.335   13.332  121.854   44.886 69.48119 46.82442 
1 1 1   10   20   30 o  342.256   8.1309   89.791   4.2595   90.787   5.0476   87.326   7.9387  344.043   9.5852  336.834   15.398 7.209290 18.13764 
1 1 1   10   20   31 f  235.229   10.588   42.472   3.8121   41.402   4.4629   45.358   7.3311  231.764   12.628  241.377   20.024 -9.612549 23.67311 
1 1 1   10   20   32 o  292.289   9.5748   65.553   4.2836   53.463   7.7590   70.854   5.1375  262.197   19.472  303.745   11.050 -41.54840 22.38939 
1 1 1   10   20   33 o  303.651   7.8764   70.700   3.6608   68.635   5.0351   73.015   5.3319  298.913   11.005  308.270   11.300 -9.357422 15.77349 
1 1 1   10   20   34 o  550.003   6.5244  231.841   5.4926  228.997   7.5915  234.964   7.9567  546.256   9.0794  553.273   9.3956 -7.017090 13.06576 
1 1 1   10   20   35 o  400.149   7.9949  122.827   4.8967  116.648   6.6369  130.209   7.2542  389.529   11.132  411.483   11.518 -21.95462 16.01788 
1 1 1   10   20   36 o  232.545   9.2007   41.525   3.2749   38.996   4.6688   43.974   4.5949  224.498   13.652  238.626   12.625 -14.12715 18.59486 
1 1 1   10   20   37 o  650.695   6.6529  324.658   6.6262  338.216   9.6584  312.602   9.1075  663.482   9.5105  637.911   9.3276 25.57123 13.32116 
1 1 1   10   20   38 o  272.805   8.5667   57.153   3.5771   54.710   5.0080   59.699   5.1112  266.425   12.281  278.353   11.997 -11.92758 17.16776 
1 1 1   10   20   39 f  440.651   7.0948  148.988   4.7852  150.494   6.8300  147.536   6.7064  442.289   10.089  437.939   10.005 4.350006 14.20846 
1 1 1   10   20   40 o  295.322   8.4226   67.011   3.8072   61.985   5.3857   72.033   5.3828  283.373   12.417  305.664   11.505 -22.29080 16.92780 
1 1 1   10   20   41 o  279.858   9.1968   60.242   3.9395   64.439   5.5964   56.119   5.5466  288.797   12.660  269.343   13.454 19.45355 18.47424 
1 1 1   10   20   42 o  146.244   14.752   16.752   3.2570   20.411   4.9514   13.963   4.3241  159.947   20.711  131.380   22.300 28.56723 30.43447 
1 1 1   10   20   43 o  233.240   10.741   41.957   3.8345   33.782   5.5317   49.517   5.3200  207.249   17.605  252.385   13.824 -45.13564 22.38361 
1 1 1   10   20   44 o  154.411   14.876   18.698   3.4724   20.955   4.8496   16.323   4.9741  162.069   19.972  141.508   23.811 20.56152 31.07771 
1 1 1   10   20   45 o  116.796   26.070   11.367   4.5424   13.499   5.0060   1.4249   10.808  127.348   26.542   94.509   40.833 32.83981 48.70128 
1 1 1   10   20   46 o   86.071   29.790   5.6873   4.7813   12.834   10.721   3.9130   5.3419  123.732   44.452   80.056   30.851 43.67625 54.10941 
1 1 1   10   20   47 o  151.878   16.414   18.257   3.7551   21.544   5.4378   15.261   5.1918  162.981   22.390  135.378   26.000 27.60304 34.31195 
1 1 1   10   20   48 o   77.734   26.601   4.6504   3.8079   11.058   5.8509  -0.0579   5.0154  113.142   32.229   63.977   27.728 49.16520 42.51501 
1 1 1   10   20   49 o  174.739   17.527   24.296   4.6246   29.004   6.5069   19.490   6.5739  188.613   23.016  151.145   29.475 37.46815 37.39654 
1 1 1   10   20   50 o   65.519   25.851   2.2977   3.8233   2.4688   5.4318   2.1297   5.3823   74.051   30.251   72.630   29.942 1.420403 42.56355 
1 1 1   10   20   51 o  187.203   14.954   27.692   4.2491   30.898   6.1470   24.759   5.8800  194.987   20.923  173.450   22.692 21.53745 30.86610 
1 1 1   10   20   52 o  148.040   18.723   17.781   4.1477   14.969   5.6008   21.196   6.1723  130.848   28.750  157.706   26.510 -26.85736 39.10706 
1 1 1   10   20   53 o   72.562   27.631   3.6026   4.2519   3.7216   5.7265   3.4564   6.3474   78.454   31.415   79.767   32.657 -1.312981 45.31432 
1 1 1   10   20   54 o   63.302   26.247   1.5881   4.1695  -2.2584   5.7718   5.7864   6.0299   60.863   27.800   86.437   32.907 -25.57413 43.07798 
1 1 1   10   20   55 o   47.025   22.337  -4.4182   4.3599  -2.4152   6.2864  -6.2744   6.0518   62.645   28.762   54.150   25.887 8.494930 38.69619 
1 1 1   10   20   56 o   82.196   27.261   5.9346   4.0006   4.0691   5.4427   8.1269   5.9004   76.646   30.650   93.775   33.053 -17.12887 45.07670 
1 1 1   10   20   57 o   81.931   29.317   5.8853   4.6588   6.0155   5.6119   5.5965   8.3563   83.812   31.784   87.449   36.773 -3.637451 48.60557 
1 1 1   10   21    0 o  285.914   15.137   63.133   6.5818   63.133   6.5818   63.133   6.5818  285.914   15.137  285.914   15.137 0.000000 0.000000 
1 1 1   10   21    1 o  393.735   9.2491  118.711   5.5741  117.174   7.8422  120.280   7.9243  391.068   13.101  396.218   13.066 -5.150116 18.50344 
1 1 1   10   21    2 o  740.231   9.4961  419.597   10.759  409.310   14.852  430.957   15.608  730.894   13.276  749.951   13.597 -19.05670 19.00320 
1 1 1   10   21    3 o  439.888   9.1130  148.171   6.1358  144.656   8.3577  152.279   9.0368  434.532   12.566  445.809   13.243 -11.27710 18.25622 
1 1 1   10   21    4 o  104.023   22.830   8.6346   3.5353   5.9557   4.7932   11.830   5.2352   90.221   29.836  121.580   28.609 -31.35887 41.33595 
1 1 1   10   21    5 o  291.022   10.636   64.867   4.7379   66.248   6.7424   63.519   6.6592  293.608   15.054  287.469   15.188 6.139404 21.38429 
1 1 1   10   21    6 o  455.070   7.8492  158.555   5.4673  160.768   6.8379  154.632   9.1033  458.183   9.7502  449.232   13.239 8.951263 16.44204 
1 1 1   10   21    7 o  1001.37   9.1215  767.854   13.981  763.185   17.147  777.115   24.148  998.172   11.223  1006.82   15.670 -8.650635 19.27408 
1 1 1   10   21    8 o  657.798   8.0138  331.300   8.0686  341.087   10.017  313.218   13.616  667.368   9.8061  639.302   13.914 28.06506 17.02266 
1 1 1   10   21    9 o  424.621   10.128  138.090   6.5824  138.090   6.5824   0.0000   0.0000  424.621   10.128  ?   ?  0.000000 10.12783 
1 1 1   10   21   10 o  984.072   11.229  741.819   16.913  741.819   16.913   0.0000   0.0000  984.072   11.229  ?   ?  0.000000 11.22869 
1 1 1   10   21   11 o  659.492   8.1064  333.023   8.1829  333.044   10.029  332.982   14.153  659.430   9.9362  659.124   14.029 0.3062134 17.19110 
1 1 1   10   21   12 o  462.596   8.4286  163.864   5.9680  161.794   7.2841  168.091   10.409  459.600   10.354  468.270   14.523 -8.669708 17.83600 
1 1 1   10   21   13 o  664.032   8.3216  337.644   8.4580  344.320   10.480  325.170   14.325  670.470   10.212  651.292   14.370 19.17792 17.62888 
1 1 1   10   21   14 o  1223.19   10.490  1146.10   19.640  1136.17   23.848  1167.04   34.623  1217.60   12.796  1233.15   18.343 -15.54944 22.36546 
1 1 1   10   21   15 o  286.379   9.7085   62.817   4.2556   69.097   5.8603   55.810   6.1900  300.265   12.751  269.362   15.074 30.90302 19.74372 
1 1 1   10   21   16 o  559.347   7.5364  239.566   6.4523  242.056   9.0687  237.013   9.1822  562.110   10.540  556.211   10.785 5.898926 15.08061 
1 1 1   10   21   17 o  544.754   7.5172  227.233   6.2680  222.462   8.6129  232.605   9.1389  538.871   10.442  550.997   10.836 -12.12573 15.04870 
1 1 1   10   21   18 o  742.173   8.7920  421.875   9.9877  419.945   16.702  422.950   12.461  739.958   14.747  742.960   10.958 -3.001953 18.37230 
1 1 1   10   21   19 o  881.357   11.351  595.302   15.313   0.0000   0.0000  595.302   15.313  ?   ?   881.357   11.351 0.000000 11.35137 
1 1 1   10   21   20 o  540.021   11.369  223.512   9.3974   0.0000   0.0000  223.512   9.3974  ?   ?   540.021   11.369 0.000000 11.36910 
1 1 1   10   21   21 o  309.558   10.262   73.433   4.8625   72.731   6.7049   74.211   7.0623  307.891   14.227  310.975   14.837 -3.084045 20.55628 
1 1 1   10   21   22 o  148.550   22.071   17.362   4.8658   21.703   8.0869   14.898   6.0920  164.320   33.294  136.099   30.047 28.22116 44.84763 
1 1 1   10   21   23 o  861.927   9.4461  569.308   12.462  536.272   20.007  590.251   15.930  835.595   15.643  877.307   11.863 -41.71161 19.63241 
1 1 1   10   21   24 o  458.458   8.7602  161.053   6.1473  160.627   8.5232  161.516   8.8745  457.589   12.169  458.812   12.637 -1.222931 17.54356 
1 1 1   10   21   25 o  350.708   10.038   94.296   5.3884   89.778   7.4088   99.370   7.8513  341.906   14.157  359.698   14.260 -17.79175 20.09426 
1 1 1   10   21   26 o  339.390   11.508   88.375   5.9784   85.996   7.4222   92.770   10.088  334.545   14.495  346.448   19.097 -11.90384 23.97515 
1 1 1   10   21   27 o   94.764   29.538   6.9598   4.7469   11.409   6.1532   0.4191   7.4603  118.925   32.759   81.293   34.494 37.63145 47.57109 
1 1 1   10   21   28 o  407.197   9.5393  127.157   5.9455  129.517   8.2541  124.611   8.5713  410.583   13.134  402.636   13.908 7.946777 19.12949 
1 1 1   10   21   29 o  214.691   11.664   35.497   3.8186   36.451   4.0394   27.472   11.710  217.508   12.182  181.982   42.765 35.52547 44.46586 
1 1 1   10   21   30 o   94.297   32.726   6.3633   5.7721   2.3162   6.5778   19.915   12.037   82.153   33.394  155.552   46.764 -73.39883 57.46373 
1 1 1   10   21   31 o  285.418   14.560   62.885   6.3398   60.891   7.2443   69.410   13.102  280.412   16.958  296.193   29.284 -15.78085 33.84008 
1 1 1   10   21   32 o  113.571   17.975   10.207   3.0207   9.9135   3.3545   11.467   6.9458  111.404   20.425  119.112   35.460 -7.707253 40.92187 
1 1 1   10   21   33 o  300.138   8.2391   69.099   3.7850   64.235   4.7638   77.428   6.2335  289.148   10.764  317.194   12.839 -28.04614 16.75414 
1 1 1   10   21   34 o  157.128   12.853   19.134   3.0641   16.433   4.1061   22.528   4.6030  144.380   19.045  169.650   18.001 -25.26990 26.20612 
1 1 1   10   21   35 o  245.878   8.4327   46.398   3.1736   47.288   4.4341   45.464   4.5443  247.903   11.686  242.705   12.272 5.198227 16.94600 
1 1 1   10   21   36 o  221.229   9.2699   37.595   3.1390   36.184   4.2554   39.279   4.6490  216.286   12.913  225.261   13.547 -8.974808 18.71518 
1 1 1   10   21   37 f   51.595   20.482   1.1331   2.4136   5.2856   3.3277  -3.4758   3.5058   81.529   24.607   44.037   20.644 37.49190 32.11917 
1 1 1   10   21   38 o  270.209   8.5771   56.088   3.5474   61.488   5.1821   51.326   4.8663  282.414   11.988  257.971   12.324 24.44333 17.19311 
1 1 1   10   21   39 o   81.426   21.591   5.3890   2.7347   10.595   3.8632   0.1598   3.8718  114.117   22.913   58.072   24.751 56.04551 33.72889 
1 1 1   10   21   40 o  204.781   11.296   32.431   3.5269   33.406   5.0882   31.528   4.8930  206.729   16.210  200.839   16.051 5.889694 22.81226 
1 1 1   10   21   41 o  234.010   10.216   42.180   3.6591   40.757   5.3767   43.408   4.9939  228.583   15.458  236.362   13.864 -7.778641 20.76494 
1 1 1   10   21   42 o  318.743   10.502   78.322   5.1236  105.754   11.593   71.663   5.7117  365.988   20.780  304.492   12.255 61.49521 24.12494 
1 1 1   10   21   43 o  294.914   9.0454   66.945   4.0831   68.015   5.8925   65.956   5.6631  296.365   12.990  291.927   12.674 4.437988 18.14841 
1 1 1   10   21   44 o  136.242   21.510   15.013   4.3368   17.152   5.0886   9.3365   8.2899  145.034   23.744  109.138   39.102 35.89586 45.74666 
1 1 1   10   21   45 o  378.215   14.608  111.335   8.4565  115.675   13.032  108.178   11.114  380.619   22.469  369.819   19.705 10.80066 29.88602 
1 1 1   10   21   46 o  145.848   16.721   16.865   3.6654   15.886   4.9381   18.066   5.4700  138.992   24.084  148.045   25.031 -9.053741 34.73631 
1 1 1   10   21   47 o  190.046   14.555   28.322   4.2018   24.764   5.9379   31.891   5.9467  174.604   22.759  199.812   19.700 -25.20750 30.10129 
1 1 1   10   21   48 o   77.713   27.221   4.5675   3.9980   1.1794   5.2098   9.4210   6.2356   68.899   29.007  105.190   33.987 -36.29094 44.68261 
1 1 1   10   21   49 f  224.697   12.486   39.385   4.2772   31.204   6.0626   47.492   6.0351  196.752   20.429  245.286   16.165 -48.53416 26.05130 
1 1 1   10   21   50 o   60.744   24.948   1.3736   3.7192   0.7139   5.3768   1.9788   5.1500   67.750   29.029   70.765   29.242 -3.015579 41.20442 
1 1 1   10   21   51 o  178.912   26.717   27.133   7.0923   30.777   10.401   23.965   9.6963  181.844   38.564  158.788   39.934 23.05576 55.51467 
1 1 1   10   21   52 o   54.376   24.355  -1.1661   4.1801  -9.8007   5.7309   8.6502   6.1105   47.710   23.358   99.355   33.698 -51.64528 41.00224 
1 1 1   10   21   53 o  263.776   11.538   54.320   4.6584   59.465   6.5499   49.052   6.6268  273.289   15.725  246.882   17.653 26.40634 23.64090 
1 1 1   10   21   54 o   70.359   27.722   3.1605   4.3910   2.1208   6.1038   4.2759   6.3216   73.534   31.201   81.126   32.823 -7.592781 45.28632 
1 1 1   10   21   55 o  140.907   20.309   16.647   4.2536   13.342   5.8229   20.429   6.2287  118.933   31.490  150.903   27.998 -31.96995 42.13666 
1 1 1   10   21   56 o   90.415   29.833   7.5343   4.7933   9.4615   5.9905   4.1048   7.9914   99.042   33.367   83.206   35.514 15.83589 48.72997 
1 1 1   10   22    0 o  377.978   13.579  109.833   7.8329  109.833   7.8329  109.833   7.8329  377.978   13.579  377.978   13.579 0.000000 0.000000 
1 1 1   10   22    1 o  799.604   9.9220  489.661   12.143  480.650   16.859  499.379   17.507  791.942   13.908  807.203   14.169 -15.26080 19.85440 
1 1 1   10   22    2 o  1377.72   13.537  1454.56   28.546  1455.97   40.390  1453.15   40.351  1377.48   19.157  1376.14   19.157 1.336426 27.09173 
1 1 1   10   22    3 o  283.888   10.939   61.732   4.7532   69.730   6.8545   54.324   6.5969  301.609   14.848  265.672   16.302 35.93790 22.04988 
1 1 1   10   22    4 o  813.420   10.009  506.742   12.462  505.120   17.493  508.414   17.758  811.827   14.078  814.455   14.245 -2.628662 20.02759 
1 1 1   10   22    5 o  224.851   13.577   38.886   4.6509   42.042   6.4689   35.510   6.6916  233.384   18.254  214.080   20.679 19.30455 27.58306 
1 1 1   10   22    6 o  136.317   21.909   14.629   4.4164   14.629   4.4164   0.0000   0.0000  136.317   21.909  ?   ?  0.000000 21.90851 
1 1 1   10   22    7 o  877.956   10.728  590.424   14.416  590.424   14.416   0.0000   0.0000  877.956   10.728  ?   ?  0.000000 10.72754 
1 1 1   10   22    8 o  829.979   8.5446  527.496   10.855  523.487   13.319  535.425   18.732  826.698   10.526  835.737   14.643 -9.039063 18.03386 
1 1 1   10   22    9 o  792.969   8.4873  481.503   10.301  469.137   12.445  508.414   18.359  782.609   10.389  814.362   14.729 -31.75214 18.02401 
1 1 1   10   22   10 o  393.587   8.8737  118.631   5.3458  122.030   6.6069  112.186   9.0973  399.124   10.815  382.495   15.539 16.62836 18.93188 
1 1 1   10   22   11 o  1043.54   9.5632  834.042   15.275  842.511   18.931  818.244   25.858  1048.62   11.795  1032.86   16.356 15.76172 20.16536 
1 1 1   10   22   12 o  931.509   9.1050  664.541   12.982  662.175   15.855  669.352   22.613  929.686   11.142  934.208   15.814 -4.522461 19.34484 
1 1 1   10   22   13 o  137.573   20.177   14.843   4.1224   14.161   4.9241   16.442   7.5377  133.519   25.013  142.993   34.774 -9.474060 42.83606 
1 1 1   10   22   14 o  644.282   8.5256  317.894   8.4075  324.353   10.383  305.594   14.327  650.687   10.425  631.268   14.828 19.41925 18.12623 
1 1 1   10   22   15 o  520.360   8.8247  207.383   7.0286  208.718   8.5088  204.514   12.471  521.943   10.651  516.324   15.780 5.619568 19.03789 
1 1 1   10   22   16 o  298.574   9.7082   68.290   4.4367   68.891   6.2609   67.684   6.2882  299.746   13.646  297.101   13.828 2.645111 19.42740 
1 1 1   10   22   17 o  1016.18   8.4136  790.874   13.086  789.649   18.471  792.109   18.544  1015.01   11.889  1016.58   11.917 -1.576111 16.83367 
1 1 1   10   22   18 o  518.260   9.1601  205.756   7.2664  206.396   12.855  205.456   8.8086  518.537   16.196  517.765   11.115 0.7722778 19.64347 
1 1 1   10   22   19 o  143.734   19.135   16.159   4.1052   16.226   5.8691   16.094   5.7441  142.523   27.903  142.008   27.419 0.5148315 39.12016 
1 1 1   10   22   20 f  1063.15   10.017  866.169   16.300  889.489   28.466  854.793   19.882  1075.95   17.285  1055.78   12.303 20.16504 21.21648 
1 1 1   10   22   21 o  436.542   9.9823  146.054   6.6700  153.597   11.161  141.864   8.3192  447.139   16.307  430.048   12.638 17.09073 20.63143 
1 1 1   10   22   22 o  489.619   8.4011  183.668   6.2960  188.527   8.8411  178.668   8.9681  495.803   11.650  482.621   12.140 13.18204 16.82577 
1 1 1   10   22   23 o  474.826   8.7603  172.771   6.3668  167.273   8.7177  179.055   9.3206  466.927   12.198  483.049   12.606 -16.12302 17.54150 
1 1 1   10   22   24 o  402.605   9.3954  124.251   5.7898  118.425   7.8176  131.328   8.6167  392.764   13.004  413.546   13.613 -20.78235 18.82580 
1 1 1   10   22   25 o  307.342   11.871   72.493   5.5845   69.963   6.8748   77.401   9.5755  301.691   14.888  316.170   19.888 -14.47925 24.84293 
1 1 1   10   22   26 o  330.150   10.670   83.623   5.3921   90.780   7.3874   75.462   7.8884  343.681   14.043  312.661   16.542 31.02005 21.69921 
1 1 1   10   22   27 o  360.076   9.9898   99.458   5.5058   96.747   7.5830  102.480   8.0070  354.742   13.966  365.059   14.330 -10.31689 20.00957 
1 1 1   10   22   28 o  324.190   10.846   80.673   5.3817   71.714   7.4878   90.247   7.7403  304.697   16.112  342.455   14.767 -37.75754 21.85561 
1 1 1   10   22   29 o  182.777   17.078   25.989   4.7224   20.943   6.5081   31.600   6.8630  161.715   27.262  200.562   22.759 -38.84750 35.51350 
1 1 1   10   22   30 o  503.457   7.3966  194.294   5.6999  191.855   6.8159  199.965   10.395  500.108   8.9041  509.839   13.320 -9.730499 16.02221 
1 1 1   10   22   31 o  711.864   7.9634  388.601   8.6769  390.053   9.6381  382.393   19.932  713.029   8.8311  703.060   18.522 9.968445 20.51938 
1 1 1   10   22   32 o  602.063   7.9878  278.016   7.3610  272.546   8.0016  308.135   18.776  595.977   8.7716  630.462   19.457 -34.48499 21.34250 
1 1 1   10   22   33 o  119.843   18.074   11.363   3.2124   15.596   3.6301  -3.9203   6.8979  140.981   17.178   67.054   30.536 73.92712 35.03587 
1 1 1   10   22   34 o  138.820   12.810   14.969   2.6912   14.458   3.5987   15.617   4.0537  135.479   17.784  140.544   19.357 -5.065231 26.28605 
1 1 1   10   22   35 o  220.411   9.0223   37.311   3.0438   38.253   4.2520   36.321   4.3592  222.466   12.538  216.637   13.209 5.828384 18.21258 
1 1 1   10   22   36 o  155.885   11.319   18.806   2.6823   27.057   3.8208   10.788   3.7665  186.763   13.456  115.593   22.093 71.16991 25.86846 
1 1 1   10   22   37 o  318.418   7.7422   77.833   3.7734   79.011   5.2577   76.581   5.4187  320.372   10.722  315.317   11.227 5.055115 15.52452 
1 1 1   10   22   38 o  451.127   7.0658  156.182   4.8790  157.995   6.9224  154.393   6.8776  453.120   9.9810  447.912   10.032 5.207153 14.15118 
1 1 1   10   22   39 o  345.749   8.2783   91.853   4.3810   90.725   6.2566   92.939   6.1365  342.887   11.921  347.132   11.549 -4.245728 16.59815 
1 1 1   10   22   40 o   80.774   22.096   5.3089   2.8108   4.3685   4.0684   6.1679   3.8880   77.881   27.447   87.457   26.643 -9.575874 38.25126 
1 1 1   10   22   41 o  390.712   7.8107  117.297   4.6711  113.643   6.5068  121.183   6.7097  383.805   11.076  396.339   11.060 -12.53354 15.65272 
1 1 1   10   22   42 o   81.550   22.504   5.4335   2.9008   6.3264   3.9638   4.4039   4.2564   88.257   26.904   78.507   28.030 9.749931 38.85280 
1 1 1   10   22   43 o  253.792   12.288   49.842   4.7736   53.865   5.5967   39.104   9.1441  263.066   13.949  218.364   28.004 44.70238 31.28570 
1 1 1   10   22   44 f   75.903   32.398   0.8677   6.6508  -4.1881   10.645   4.1052   8.5181   83.035   37.860   92.750   37.885 -9.714699 53.55993 
1 1 1   10   22   45 o  137.463   17.158   15.026   3.5316   13.946   5.0807   16.035   4.9124  129.183   26.582  139.809   23.809 -10.62672 35.68521 
1 1 1   10   22   46 o  153.714   16.582   18.719   3.8395   14.017   5.5200   23.127   5.3441  128.483   28.783  169.401   21.065 -40.91812 35.66827 
1 1 1   10   22   47 o  126.851   20.295   13.072   3.8077   13.460   4.9956   12.535   5.8820  126.378   26.664  120.230   31.562 6.148193 41.31712 
1 1 1   10   22   48 o  176.164   15.180   24.477   4.0532   23.059   5.6786   25.950   5.7871  167.946   22.670  178.820   21.579 -10.87439 31.29833 
1 1 1   10   22   49 o  237.442   12.055   43.958   4.3668   40.577   5.7771   48.466   6.6699  226.135   16.811  246.738   17.780 -20.60291 24.46905 
1 1 1   10   22   50 o   43.357   20.532  -3.8678   3.6287  -2.5825   4.8011  -5.5802   5.5417   54.978   25.202   53.394   25.310 1.583755 35.71805 
1 1 1   10   22   51 o  130.718   21.453   14.176   4.1433   16.111   5.6849   11.984   6.0514  136.026   28.229  115.063   32.776 20.96297 43.25682 
1 1 1   10   22   52 o   69.191   26.289   3.2436   3.8438   1.1320   5.3878   5.4323   5.4853   68.193   29.135   84.186   31.533 -15.99275 42.93207 
1 1 1   10   22   53 o  183.845   16.293   27.179   4.5374   25.071   6.8028   28.869   6.0900  169.650   27.110  186.110   21.791 -16.46071 34.78246 
1 1 1   10   22   54 o   95.037   26.961   8.1053   4.1032   7.3971   5.6489   8.8964   5.9700   91.141   32.318   97.890   33.308 -6.749023 46.40989 
1 1 1   10   22   55 f  139.721   21.035   16.548   4.3591   19.033   6.1121   13.975   6.2186  144.435   28.659  120.100   32.871 24.33502 43.60976 
1 1 1   10   22   56 o  131.321   24.510   15.255   4.7453   16.561   5.7950   12.598   8.2673  133.301   29.209  109.055   39.051 24.24588 48.76649 
1 1 1   10   23    0 o  1085.71   16.423  903.701   27.278  903.701   27.278  903.701   27.278  1085.71   16.423  1085.71   16.423 0.000000 0.000000 
1 1 1   10   23    1 o  524.485   9.4539  210.674   7.5895  223.525   11.014  199.055   10.473  540.057   13.324  509.634   13.426 30.42303 18.91500 
1 1 1   10   23    2 o  283.989   16.429   62.060   7.1107   62.060   7.1107   0.0000   0.0000  283.989   16.429  ?   ?  0.000000 16.42856 
1 1 1   10   23    3 o  552.310   13.274  233.784   11.222  233.784   11.222   0.0000   0.0000  552.310   13.274  ?   ?  0.000000 13.27407 
1 1 1   10   23    4 o  1748.22   23.210  2349.13   62.108  2349.13   62.108   0.0000   0.0000  1748.22   23.210  ?   ?  0.000000 23.21041 
1 1 1   10   23    5 o  811.266   14.513  504.555   18.021   0.0000   0.0000  504.555   18.021  ?   ?   811.266   14.513 0.000000 14.51272 
1 1 1   10   23    6 o  1127.78   9.8966  974.175   17.084  962.835   20.808  997.628   29.924  1120.97   12.127  1140.35   17.144 -19.38574 20.99976 
1 1 1   10   23    7 o  163.830   15.860   20.776   3.9273   19.733   4.8073   22.870   6.8100  159.039   20.204  170.291   27.030 -11.25157 33.74627 
1 1 1   10   23    8 o  256.231   11.060   50.299   4.3377   50.348   5.3170   50.201   7.5009  255.926   13.622  254.981   19.364 0.9448700 23.67530 
1 1 1   10   23    9 o  1335.27   11.089  1365.97   22.664  1361.48   27.716  1375.03   39.375  1332.71   13.587  1338.25   19.223 -5.536499 23.53969 
1 1 1   10   23   10 o  811.784   8.6419  504.676   10.738  499.969   13.073  514.437   18.826  807.855   10.572  819.042   15.017 -11.18726 18.36534 
1 1 1   10   23   11 o  714.777   8.4791  391.264   9.2766  385.387   11.249  403.757   16.400  709.271   10.362  725.607   14.767 -16.33575 18.03935 
1 1 1   10   23   12 o  331.479   10.165   84.175   5.1575   82.743   6.2394   87.264   9.1645  328.568   12.406  336.691   17.847 -8.123108 21.73539 
1 1 1   10   23   13 o  624.062   8.5750  298.274   8.1909  301.309   10.065  292.324   14.094  627.115   10.486  617.346   14.915 9.768921 18.23221 
1 1 1   10   23   14 o  259.560   12.213   51.641   4.8521   53.085   5.8899   48.592   8.5596  262.661   14.709  250.305   22.585 12.35629 26.95259 
1 1 1   10   23   15 o  829.056   9.0232  526.502   11.450  526.135   14.012  527.237   19.864  828.581   11.049  828.884   15.657 -0.3023682 19.16288 
1 1 1   10   23   16 o  554.881   15.770  236.325   13.394   0.0000   0.0000  236.325   13.394  ?   ?   554.881   15.770 0.000000 15.77021 
1 1 1   10   23   17 o  610.822   10.817  285.961   10.114   0.0000   0.0000  285.961   10.114  ?   ?   610.822   10.817 0.000000 10.81742 
1 1 1   10   23   18 o  572.044   8.9331  250.706   7.8217  264.842   13.451  243.483   9.6143  587.383   14.961  563.576   11.145 23.80725 18.65609 
1 1 1   10   23   19 o  879.039   8.1741  591.938   10.998  580.243   15.342  604.302   15.775  869.898   11.522  887.736   11.609 -17.83856 16.35653 
1 1 1   10   23   20 o  247.352   12.274   46.934   4.6469   42.859   6.3407   51.662   6.8297  235.415   17.727  258.637   17.353 -23.22249 24.80656 
1 1 1   10   23   21 f  852.045   9.3609  556.417   12.208  551.049   20.538  559.350   15.181  846.771   15.846  853.952   11.615 -7.180420 19.64700 
1 1 1   10   23   22 o  791.190   9.2985  479.817   11.261  458.627   18.117  493.156   14.374  772.494   15.322  801.747   11.713 -29.25269 19.28668 
1 1 1   10   23   23 o  577.337   9.3453  255.525   8.2583  249.501   13.381  259.231   10.496  569.675   15.346  581.218   11.798 -11.54199 19.35682 
1 1 1   10   23   24 f   61.836   26.772  -0.5669   4.6653   5.3091   5.7943 -11.3974   7.8665   90.077   32.637   60.496   29.078 29.58084 43.71114 
1 1 1   10   23   25 o  250.772   12.428   48.295   4.7703   41.812   6.3913   56.449   7.1676  232.191   18.127  270.113   17.430 -37.92154 25.14728 
1 1 1   10   23   26 o  325.956   10.585   81.534   5.2810   83.278   7.2409   79.552   7.7190  329.047   14.377  321.449   15.688 7.597778 21.27958 
1 1 1   10   23   27 o  498.673   8.8415  190.703   6.7485  187.670   9.3435  194.011   9.7577  494.213   12.352  502.438   12.688 -8.225189 17.70736 
1 1 1   10   23   28 o  234.445   13.714   42.428   4.8997   37.637   6.7811   47.663   7.0875  219.575   20.410  247.637   18.840 -28.06215 27.77610 
1 1 1   10   23   29 o  281.981   12.407   61.134   5.3550   64.055   7.4856   58.071   7.6638  287.556   17.084  273.473   18.416 14.08362 25.12006 
1 1 1   10   23   30 o  493.900   11.149  187.438   8.4281  185.936   9.8553  191.526   16.260  491.544   13.099  496.604   21.392 -5.060364 25.08378 
1 1 1   10   23   31 o   62.924   22.508   2.6410   2.7458   2.4395   3.0003   3.6801   6.8129   63.120   23.384   87.381   34.498 -24.26159 41.67686 
1 1 1   10   23   32 f  254.271   11.219   49.714   4.3663   46.874   4.6233   73.147   13.283  246.794   12.239  303.179   28.976 -56.38499 31.45441 
1 1 1   10   23   33 o  349.368   9.2493   93.736   4.9461   93.539   5.2792   95.151   14.147  348.914   9.8851  346.628   26.874 2.286896 28.63466 
1 1 1   10   23   34 o   64.660   23.724   2.6641   3.0757   2.6730   3.1566   2.4960   13.670   65.138   24.014  109.536   46.593 -44.39802 52.41751 
1 1 1   10   23   35 o   76.219   20.826   4.6830   2.4987   9.4481   3.5571   0.0411   3.5108  107.972   22.264   55.113   23.532 52.85926 32.39459 
1 1 1   10   23   36 o  463.194   7.4230  164.661   5.2627  161.110   6.8035  169.952   8.3040  457.713   9.7112  469.638   11.552 -11.92450 15.09153 
1 1 1   10   23   37 o  187.367   10.324   27.106   2.9493   26.032   4.1040   28.252   4.2413  182.754   14.798  190.467   14.661 -7.712845 20.83099 
1 1 1   10   23   38 o  199.370   10.420   30.694   3.1688   31.761   4.5017   29.646   4.4612  201.948   14.664  194.976   15.065 6.971344 21.02355 
1 1 1   10   23   39 o  262.293   8.7200   52.896   3.5008   55.401   4.9491   50.388   4.9527  267.863   12.071  255.344   12.672 12.51927 17.50123 
1 1 1   10   23   40 o  166.698   12.178   21.583   3.0856   26.223   4.5670   17.686   4.1855  182.789   16.501  149.236   18.736 33.55304 24.96660 
1 1 1   10   23   41 o  224.035   10.383   38.697   3.5605   34.179   4.8465   43.994   5.2482  209.139   15.245  237.628   14.499 -28.48825 21.03837 
1 1 1   10   23   42 o  121.335   21.358   11.949   3.8217   11.058   4.3554   14.930   7.9675  115.476   25.337  131.023   37.700 -15.54622 45.42353 
1 1 1   10   23   43 o  180.452   24.490   26.478   6.5894   16.082   10.542   33.145   8.4420  134.768   44.231  200.387   28.312 -65.61877 52.51605 
1 1 1   10   23   44 o  185.788   23.472   27.981   6.5258   47.659   10.694   16.304   8.2375  239.530   29.812  135.742   38.093 103.7879 48.37189 
1 1 1   10   23   45 o  200.536   12.617   31.321   3.8529   32.404   5.6423   30.375   5.2739  202.030   18.450  195.802   17.791 6.227783 25.63047 
1 1 1   10   23   46 o  292.009   13.643   66.389   6.0977   50.108   11.717   72.436   7.1410  242.848   32.324  303.948   15.400 -61.10077 35.80442 
1 1 1   10   23   47 o  137.371   18.110   15.147   3.7150   8.0780   5.1442   22.852   5.3706   97.789   30.793  167.817   21.395 -70.02878 37.49617 
1 1 1   10   23   48 o  328.159   12.955   83.938   6.5073   56.234   11.493   97.009   7.8946  257.663   29.685  351.893   14.657 -94.23019 33.10633 
1 1 1   10   23   49 o   92.641   24.806   7.3023   3.5876   12.911   5.0128   1.4133   5.1367  122.373   27.440   68.590   28.836 53.78356 39.80540 
1 1 1   10   23   50 o   81.868   30.470   4.9896   5.1059 -22.5102   9.7348   15.426   5.9970   55.564   27.761  132.030   30.315 -76.46652 41.10526 
1 1 1   10   23   51 o  196.324   15.071   30.611   4.4944   33.613   6.0174   26.824   6.7590  203.314   19.578  177.827   25.567 25.48730 32.20243 
1 1 1   10   23   52 f  108.166   34.522   10.907   6.4486   0.0000   0.0000   10.907   6.4486  ?   ?   108.166   34.522 0.000000 34.52203 
1 1 1   10   23   53 o  113.263   24.360   11.186   4.0978   10.556   5.6307   11.896   5.9749  106.218   31.997  112.168   32.756 -5.949554 45.78999 
1 1 1   10   23   54 o   74.335   27.202   4.4282   4.0396   4.1818   5.9408   4.6400   5.5092   78.544   31.804   79.018   31.078 -0.4743271 44.46734 
1 1 1   10   23   55 o   82.901   29.315   6.0627   4.6447   5.4796   5.6444   7.2857   8.1743   81.907   31.671   92.080   37.299 -10.17278 48.93142 
1 1 1   10   24    1 o  255.445   18.349   50.343   7.1264   0.0000   0.0000   50.343   7.1264  ?   ?   255.445   18.349 0.000000 18.34879 
1 1 1   10   24    2 o  151.595   29.578   18.324   6.6168   0.0000   0.0000   18.324   6.6168  ?   ?   151.595   29.578 0.000000 29.57849 
1 1 1   10   24    3 o  1030.01   16.142  813.820   25.448   0.0000   0.0000  813.820   25.448  ?   ?   1030.01   16.142 0.000000 16.14157 
1 1 1   10   24    4 f  379.231   15.552  110.304   9.0276   0.0000   0.0000  110.304   9.0276  ?   ?   379.231   15.552 0.000000 15.55250 
1 1 1   10   24    5 f  1277.88   18.493  1253.62   36.171   0.0000   0.0000  1253.62   36.171  ?   ?   1277.88   18.493 0.000000 18.49293 
1 1 1   10   24    6 o  898.065   8.9827  617.704   12.348  612.956   15.126  627.188   21.379  894.436   11.048  904.273   15.446 -9.836975 18.99053 
1 1 1   10   24    7 o  770.986   8.6185  455.237   10.171  445.074   12.355  476.603   17.914  762.195   10.590  788.327   14.846 -26.13202 18.23635 
1 1 1   10   24    8 o  269.026   11.163   55.457   4.5969   58.150   5.6708   50.296   7.8501  275.406   13.453  255.053   20.276 20.35298 24.33261 
1 1 1   10   24    9 o  392.921   9.2617  118.255   5.5701  115.302   6.7908  124.327   9.7376  387.897   11.438  402.552   15.804 -14.65601 19.50839 
1 1 1   10   24   10 o  640.243   8.5145  313.945   8.3440  315.523   10.260  310.865   14.340  641.728   10.445  636.621   14.716 5.106873 18.04605 
1 1 1   10   24   11 o  285.161   11.048   62.315   4.8221   54.810   5.8071   78.982   8.6541  266.944   14.264  320.226   17.725 -53.28214 22.75189 
1 1 1   10   24   12 o  200.892   17.405   31.221   5.2991   36.112   7.2435   25.590   7.7724  215.494   22.283  179.752   29.256 35.74202 36.77519 
1 1 1   10   24   13 o  590.118   10.508  266.859   9.4913  259.195   13.013  275.571   13.874  581.230   14.627  599.258   15.126 -18.02783 21.04135 
1 1 1   10   24   14 o  451.484   16.321  156.515   11.279   0.0000   0.0000  156.515   11.279  ?   ?   451.484   16.321 0.000000 16.32116 
1 1 1   10   24   15 o  740.598   15.445  421.074   17.508   0.0000   0.0000  421.074   17.508  ?   ?   740.598   15.445 0.000000 15.44466 
1 1 1   10   24   16 o  374.925   10.236  107.737   5.8742  103.846   7.0015  116.986   10.796  367.966   12.431  390.086   18.081 -22.12012 21.94188 
1 1 1   10   24   17 o  181.796   15.019   25.550   4.1417   19.271   5.7092   32.524   6.0175  156.119   24.715  204.671   19.442 -48.55215 31.44550 
1 1 1   10   24   18 o  421.177   8.5950  135.918   5.5409  134.062   7.7194  137.890   7.9581  418.056   12.064  423.967   12.263 -5.910583 17.20231 
1 1 1   10   24   19 o  515.639   8.1220  203.711   6.4103  204.391   8.9568  202.997   9.1784  516.227   11.336  514.432   11.656 1.795776 16.25940 
1 1 1   10   24   20 f  659.651   7.9499  333.398   8.0269  333.513   11.221  333.277   11.487  659.407   11.117  659.138   11.386 0.2695923 15.91350 
1 1 1   10   24   21 o  365.238   9.4455  102.267   5.2805  101.989   7.2593  102.580   7.6951  364.459   13.013  365.445   13.757 -0.9858093 18.93656 
1 1 1   10   24   22 f  525.461   9.4565  211.700   7.6057  204.329   9.2955  226.631   13.229  515.971   11.770  542.760   15.924 -26.78809 19.80195 
1 1 1   10   24   23 o  518.165   11.133  206.046   8.8299  194.538   11.919  220.043   13.145  502.844   15.487  534.686   16.062 -31.84180 22.31180 
1 1 1   10   24   24 o  494.431   9.7292  187.510   7.3630  169.314   11.479  200.227   9.5972  468.937   15.993  510.584   12.280 -41.64679 20.16394 
1 1 1   10   24   25 o  317.296   10.837   77.279   5.2629   80.489   7.1441   73.469   7.7826  323.447   14.430  308.331   16.551 15.11560 21.95854 
1 1 1   10   24   26 o  407.063   9.5991  127.129   5.9809  127.861   8.2055  126.298   8.7358  407.791   13.146  405.151   14.087 2.639618 19.26819 
1 1 1   10   24   27 o  311.111   11.614   74.363   5.5303   78.457   7.4853   69.443   8.2064  319.101   15.325  299.306   17.997 19.79480 23.63777 
1 1 1   10   24   28 o  323.803   13.045   80.665   6.4653   81.050   7.4562   79.500   12.979  324.298   15.021  317.687   26.945 6.610291 30.84951 
1 1 1   10   24   29 o  163.727   18.822   21.020   4.6310   22.183   6.4157   19.754   6.6915  166.539   26.020  156.159   29.065 10.37993 39.01016 
1 1 1   10   24   30 o  132.716   23.470   14.129   4.5932   16.397   6.3453   11.632   6.6573  141.570   30.204  119.325   34.499 22.24598 45.85199 
1 1 1   10   24   31 o  153.383   24.984   18.874   5.6637   18.597   11.009   18.973   6.6048  148.846   44.718  152.603   29.342 -3.757355 53.48530 
1 1 1   10   24   32 o  253.720   9.6738   49.456   3.7568   50.297   4.3284   46.889   7.5642  255.716   11.059  244.631   20.387 11.08521 23.19319 
1 1 1   10   24   33 o  149.094   13.871   17.302   3.1292   17.034   3.4688   18.470   7.2522  147.602   15.590  149.203   32.662 -1.601013 36.19153 
1 1 1   10   24   34 o  200.785   12.657   31.210   3.8699   31.936   4.0337   22.814   13.719  203.042   13.048  161.698   50.186 41.34349 51.85431 
1 1 1   10   24   35 o   85.660   23.774   5.9551   3.2272   5.4869   3.3125   14.701   14.316   82.683   24.459  138.102   51.097 -55.41858 56.64902 
1 1 1   10   24   36 o  141.539   12.795   15.593   2.7420   15.721   3.8258   15.457   3.9318  140.954   18.155  139.559   18.892 1.394760 26.20095 
1 1 1   10   24   37 o  146.751   12.557   16.750   2.7934   12.998   3.8033   21.145   4.1161  127.382   20.179  164.115   16.615 -36.73360 26.13915 
1 1 1   10   24   38 o   82.170   21.049   5.5060   2.6592   6.5065   3.7526   4.4969   3.7687   89.342   25.922   77.567   26.464 11.77495 37.04417 
1 1 1   10   24   39 o  155.782   12.562   18.880   2.9699   17.635   4.1258   20.219   4.2784  149.101   18.474  159.991   17.771 -10.89050 25.63415 
1 1 1   10   24   40 o  222.757   9.9038   38.230   3.3768   39.214   4.7659   37.238   4.7852  224.460   13.941  218.589   14.382 5.870728 20.02999 
1 1 1   10   24   41 o  110.000   22.307   9.9086   3.6273   11.324   4.0245   3.7808   8.3734  117.518   23.197   91.720   37.525 25.79759 44.11568 
1 1 1   10   24   42 o  226.417   19.837   40.698   6.8052   46.317   10.578   36.730   8.8887  236.551   29.883  211.207   28.200 25.34444 41.08805 
1 1 1   10   24   43 o  202.982   14.966   32.270   4.6171   18.444   10.136   35.890   5.1864  142.776   42.913  213.791   15.964 -71.01527 45.78598 
1 1 1   10   24   44 o  200.702   17.476   31.857   5.3149   31.857   5.3149   0.0000   0.0000  200.702   17.476  ?   ?  0.000000 17.47565 
1 1 1   10   24   45 o  179.242   14.729   25.236   4.0052   22.049   5.3427   29.325   6.0518  164.984   21.682  190.880   21.065 -25.89539 30.22931 
1 1 1   10   24   46 o  201.287   12.569   31.610   3.8530   35.033   5.5345   28.391   5.3672  210.180   17.359  188.469   18.859 21.71040 25.63161 
1 1 1   10   24   47 o  158.389   15.480   19.869   3.7049   20.955   5.2345   18.779   5.2445  160.106   21.937  150.735   23.497 9.371094 32.14571 
1 1 1   10   24   48 o  140.847   17.636   15.957   3.7186   23.584   5.3707   8.9337   5.1539  170.025   21.090  101.356   30.630 68.66882 37.18840 
1 1 1   10   24   49 o   57.443   24.069   0.8791   3.5593   0.2212   5.0382   1.5346   5.0291   64.017   27.768   68.214   28.598 -4.196907 39.86118 
1 1 1   10   24   50 o  123.065   22.024   12.671   3.9963   12.671   5.3088   12.670   6.0707  119.613   29.242  118.073   32.544 1.539902 43.75185 
1 1 1   10   24   51 o  135.528   22.075   15.415   4.4216   7.1588   6.0983   24.566   6.4204   92.098   33.464  169.469   25.545 -77.37043 42.09988 
1 1 1   10   24   52 o   53.655   23.816  -0.5974   3.9041   1.2164   5.6517  -2.2529   5.3994   68.794   29.625   58.368   26.746 10.42580 39.91227 
1 1 1   10   24   53 o   67.037   26.989   2.6389   4.2517   3.7084   5.7557   1.3545   6.3078   76.554   31.191   71.355   31.011 5.198647 43.98382 
1 1 1   10   24   54 o   63.161   27.581   0.6077   5.0408  -0.6598   5.4282   8.5504   13.588   61.579   27.656  101.770   44.838 -40.19118 52.68105 
1 1 1   10   25    0 o  222.016   20.971   38.804   6.9803   38.804   6.9803   38.804   6.9803  222.016   20.971  222.016   20.971 0.000000 0.000000 
1 1 1   10   25    1 o  110.959   26.656   9.8692   4.4706   13.054   6.1704   6.3500   6.4863  127.472   31.745   97.422   34.621 30.05029 46.97216 
1 1 1   10   25    2 o  750.615   10.134  431.647   11.644  439.521   16.636  424.086   16.302  757.032   14.357  743.624   14.322 13.40759 20.27944 
1 1 1   10   25    3 o  305.126   11.763   71.354   5.4936   75.895   7.8529   67.001   7.6880  314.051   16.393  294.948   17.103 19.10272 23.69065 
1 1 1   10   25    4 o  429.988   10.493  141.661   6.9062  135.527   9.5381  148.421   10.013  420.336   14.825  439.874   14.872 -19.53775 20.99872 
1 1 1   10   25    5 o  162.044   29.409   20.894   7.0257   0.0000   0.0000   20.894   7.0257  ?   ?   162.044   29.409 0.000000 29.40930 
1 1 1   10   25    6 o  379.424   16.277  110.492   9.4530   0.0000   0.0000  110.492   9.4530  ?   ?   379.424   16.277 0.000000 16.27696 
1 1 1   10   25    7 o  545.742   10.213  228.200   8.5312  217.596   11.825  239.713   12.321  532.598   14.505  559.021   14.399 -26.42206 20.43847 
1 1 1   10   25    8 o  562.450   10.270  242.398   8.8415  252.325   12.756  233.219   12.266  573.506   14.531  551.366   14.535 22.14001 20.55249 
1 1 1   10   25    9 o  295.562   12.927   66.987   5.8482   69.335   8.3832   64.761   8.1625  299.842   18.355  289.729   18.503 10.11359 26.06224 
1 1 1   10   25   10 o  1677.93   16.116  2161.55   41.391  2123.25   57.327  2203.25   59.826  1660.48   22.556  1691.21   23.111 -30.73108 32.29367 
1 1 1   10   25   11 o  572.494   8.7581  251.076   7.6745  251.680   9.4118  249.878   13.258  573.042   10.730  570.568   15.181 2.473633 18.59006 
1 1 1   10   25   12 o  539.133   11.143  222.818   9.1955  215.055   13.211  230.113   12.807  529.158   16.311  547.489   15.283 -18.33112 22.35223 
1 1 1   10   25   13 o  527.400   11.168  213.245   9.0158  225.596   13.230  202.537   12.319  541.967   15.949  513.554   15.672 28.41241 22.35992 
1 1 1   10   25   14 o  257.601   12.536   50.903   4.9427   52.801   5.9724   46.776   8.8054  261.810   14.966  245.084   23.772 16.72609 28.09038 
1 1 1   10   25   15 f  253.133   13.104   49.300   5.0599   46.408   6.0860   55.773   9.1059  245.210   16.308  268.001   22.404 -22.79080 27.71074 
1 1 1   10   25   16 o  383.521   10.246  112.762   6.0147  112.223   7.2306  113.974   10.837  382.453   12.352  384.842   18.398 -2.388428 22.15945 
1 1 1   10   25   17 o  332.200   11.182   84.641   5.6858   85.662   6.8547   82.389   10.180  334.039   13.407  326.292   20.487 7.747284 24.48359 
1 1 1   10   25   18 o  482.908   8.3081  178.698   6.1410  176.689   8.6471  180.742   8.7226  479.879   11.773  485.355   11.741 -5.476013 16.62681 
1 1 1   10   25   20 o  515.594   8.1585  203.730   6.4386  212.835   9.1099  194.642   9.1011  526.656   11.301  503.583   11.807 23.07315 16.34404 
1 1 1   10   25   21 o  582.227   9.1691  259.914   8.1713  258.179   9.9427  263.525   14.343  580.016   11.199  585.145   16.014 -5.129272 19.54142 
1 1 1   10   25   22 o  310.537   10.363   73.988   4.9256   79.318   6.7389   67.875   7.2175  321.223   13.706  296.496   15.962 24.72733 21.03934 
1 1 1   10   25   23 o  361.640   9.7323  100.328   5.3872  107.668   7.5056   92.529   7.7369  374.275   13.102  346.789   14.576 27.48682 19.59857 
1 1 1   10   25   24 o  119.279   27.237   11.532   4.8635   12.084   7.6065   11.149   6.3253  122.789   37.234  117.444   33.529 5.345108 50.10567 
1 1 1   10   25   25 o  363.266   14.231  101.570   7.9127   97.222   10.144  108.327   12.646  354.179   18.779  372.993   22.251 -18.81393 29.11630 
1 1 1   10   25   26 o   96.286   34.410   6.4004   6.4160   4.8234   8.1981   8.8930   10.307   96.995   37.983  116.437   43.301 -19.44117 57.59922 
1 1 1   10   25   27 o   64.237   26.880   0.6751   4.4303  -3.1781   6.1235   4.9073   6.4176   64.129   29.034   90.292   34.050 -26.16269 44.74764 
1 1 1   10   25   28 o   81.120   28.676   4.5743   4.4441  -0.3235   6.0127   10.472   6.5979   70.744   30.510  114.071   34.697 -43.32693 46.20388 
1 1 1   10   25   29 o  195.219   16.412   29.656   4.8585   31.851   6.9789   27.592   6.7679  200.798   23.130  186.403   24.299 14.39478 33.54718 
1 1 1   10   25   30 o  557.948   10.646  239.310   9.0916  227.008   15.910  245.274   11.078  540.708   19.224  564.292   12.826 -23.58417 23.11017 
1 1 1   10   25   31 o  337.436   11.374   87.619   5.8747   83.253   8.3668   91.864   8.2506  327.469   16.749  344.677   15.639 -17.20883 22.91471 
1 1 1   10   25   32 o  388.141   10.794  115.906   6.4128  117.257   8.9851  114.503   9.1555  389.426   15.074  384.699   15.549 4.726318 21.65602 
1 1 1   10   25   33 o  172.106   13.036   22.985   3.4087   25.770   3.8971   13.917   7.0321  182.088   14.092  128.847   34.826 53.24117 37.56944 
1 1 1   10   25   34 o  128.870   16.493   13.091   3.1786   11.785   3.5470   18.417   7.1625  121.387   19.771  148.503   32.420 -27.11587 37.97315 
1 1 1   10   25   35 o  183.948   13.848   26.314   3.8703   25.953   4.0130   31.124   14.647  182.539   14.482  185.654   50.296 -3.114716 52.33951 
1 1 1   10   25   36 o  290.430   10.883   64.997   4.8380   64.997   4.8380   0.0000   0.0000  290.430   10.883  ?   ?  0.000000 10.88317 
1 1 1   10   25   37 o  343.652   9.4896   90.880   4.9916   96.837   5.7206   71.876   10.218  354.507   10.543  301.138   22.328 53.36932 24.69159 
1 1 1   10   25   38 o  184.242   10.865   26.266   3.0504   23.991   4.1418   28.962   4.5093  175.016   15.625  192.467   15.437 -17.45035 21.96476 
1 1 1   10   25   39 f  277.157   8.7033   59.093   3.6922   58.321   5.1285   59.923   5.3198  274.661   12.199  278.340   12.487 -3.678864 17.45660 
1 1 1   10   25   40 o  139.764   18.080   15.535   3.7770   18.836   4.2942   4.2532   7.9388  153.947   18.601   91.544   36.871 62.40250 41.29768 
1 1 1   10   25   41 o  213.240   13.985   35.464   4.5393   23.027   10.148   38.575   5.0753  160.443   41.131  222.120   15.016 -61.67757 43.78603 
1 1 1   10   25   42 o  262.422   13.797   53.654   5.5226   51.977   10.495   54.296   6.4943  251.694   27.701  263.115   16.205 -11.42105 32.09279 
1 1 1   10   25   43 o  231.531   15.691   42.068   5.5280   24.696   11.050   47.867   6.3842  163.886   43.375  246.512   17.024 -82.62584 46.59644 
1 1 1   10   25   44 o  102.505   22.312   8.7011   3.4013   11.012   4.8023   6.3753   4.8182  113.880   27.795   89.179   29.925 24.70168 40.84185 
1 1 1   10   25   45 o   61.070   23.877   2.0056   3.2355  -0.5046   4.3510   5.1107   4.8392   58.271   25.530   82.849   29.855 -24.57808 39.28259 
1 1 1   10   25   46 o   48.520   21.708  -1.1269   3.3109  -1.8003   4.6206  -0.4162   4.7466   56.105   25.327   60.889   26.672 -4.784458 36.78077 
1 1 1   10   25   47 o   34.077   16.868  -7.2305   3.2727  -7.6010   4.4677  -6.8016   4.8075   42.789   20.879   46.491   22.443 -3.701405 30.65299 
1 1 1   10   25   48 o   47.503   21.445  -1.3724   3.3135  -1.9963   4.5637  -0.6768   4.8186   54.828   24.918   60.106   26.580 -5.277466 36.43319 
1 1 1   10   25   49 o  319.419   13.036   79.902   6.3734   37.209   10.666  103.611   7.9484  201.838   35.838  362.889   14.310 -161.0512 38.58923 
1 1 1   10   25   50 o  128.951   21.838   13.940   4.1564   7.0735   6.5056   18.676   5.4028   92.554   34.405  148.020   24.719 -55.46574 42.36385 
1 1 1   10   25   51 o  161.103   17.738   21.142   4.3016   19.156   6.1424   23.054   6.0259  146.719   28.378  163.871   24.800 -17.15160 37.68731 
1 1 1   10   25   52 o   71.254   26.418   3.8798   3.8307   7.5795   5.5552   0.5256   5.2893   91.705   32.089   64.665   28.245 27.03925 42.74947 
1 1 1   10   25   53 o   73.165   28.260   3.9577   4.4903   1.7085   5.4650   8.6317   7.8779   68.539   29.314   96.552   37.393 -28.01317 47.51390 
1 1 1   10   26    0 o  496.763   14.183  189.549   10.764  189.549   10.764  189.549   10.764  496.763   14.183  496.763   14.183 0.000000 0.000000 
1 1 1   10   26    1 o  1285.06   13.183  1266.48   25.931  1289.39   37.345  1245.15   36.034  1295.21   18.837  1272.90   18.495 22.31323 26.39890 
1 1 1   10   26    2 o  799.329   10.447  489.629   12.782  476.603   17.735  503.708   18.438  788.112   14.702  810.189   14.868 -22.07666 20.90928 
1 1 1   10   26    3 o  703.603   10.112  379.350   10.890  368.276   15.022  391.616   15.810  692.838   14.166  714.420   14.458 -21.58160 20.24104 
1 1 1   10   26    4 o  326.160   11.955   81.559   5.9681   75.029   8.1525   89.100   8.7607  312.073   17.133  340.609   16.804 -28.53543 23.99807 
1 1 1   10   26    5 o  707.967   10.279  384.102   11.139  404.698   16.313  366.111   15.247  726.196   14.676  690.741   14.421 35.45563 20.57580 
1 1 1   10   26    6 o  508.369   10.753  198.083   8.3673  188.702   12.400  205.926   11.337  495.700   16.343  518.037   14.298 -22.33737 21.71510 
1 1 1   10   26    7 o  307.911   13.314   72.730   6.2748   69.608   9.5247   75.123   8.3405  300.004   20.872  312.182   17.526 -12.17749 27.25438 
1 1 1   10   26    8 o  270.733   11.670   56.199   4.8359   55.326   6.0458   57.750   8.0574  268.066   14.792  273.318   19.386 -5.252289 24.38482 
1 1 1   10   26    9 f  602.291   10.710  278.072   9.8734  263.054   14.102  292.512   13.828  585.252   15.742  617.299   14.635 -32.04669 21.49445 
1 1 1   10   26   10 o  190.122   19.976   28.126   5.7263   27.388   8.3851   28.771   7.8390  185.564   30.588  190.921   27.628 -5.356857 41.21807 
1 1 1   10   26   11 o  710.326   10.958  386.853   11.914  391.804   17.307  382.393   16.426  714.150   15.833  705.624   15.208 8.525940 21.95380 
1 1 1   10   26   12 f  762.648   8.9942  445.702   10.499  444.939   12.841  447.239   18.235  761.752   11.013  762.979   15.615 -1.226990 19.10787 
1 1 1   10   26   13 o  551.763   8.9392  233.302   7.5495  237.291   9.1918  225.031   13.234  556.292   10.795  541.111   15.979 15.18134 19.28366 
1 1 1   10   26   14 o  1336.57   11.391  1370.23   23.303  1353.16   28.085  1407.97   41.753  1327.51   13.822  1351.61   20.182 -24.10022 24.46120 
1 1 1   10   26   15 o  161.695   18.492   20.391   4.4944   21.452   5.3349   17.797   8.3420  165.360   21.593  147.828   36.965 17.53189 42.80946 
1 1 1   10   26   16 o  538.118   9.1643  221.968   7.5483  215.068   9.0671  237.548   13.624  529.480   11.188  555.770   16.016 -26.29022 19.53632 
1 1 1   10   26   17 o  212.307   15.129   34.828   4.8842   38.591   5.8721   26.381   8.7981  223.221   17.322  181.046   32.963 42.17473 37.23748 
1 1 1   10   26   18 o  278.975   12.414   59.757   5.3008   56.424   6.2716   68.093   9.9181  270.441   15.213  295.966   22.052 -25.52515 26.79010 
1 1 1   10   26   19 o  372.582   10.413  106.498   5.9387  108.647   7.3321  102.398   10.126  376.096   12.737  364.438   18.152 11.65826 22.17504 
1 1 1   10   26   20 o  523.955   9.3083  210.533   7.4650  213.945   9.1336  203.667   12.956  527.927   11.303  514.219   16.461 13.70789 19.96786 
1 1 1   10   26   21 o  288.381   10.839   63.834   4.7845   64.621   6.5826   62.953   6.9664  289.396   14.911  285.448   16.009 3.948608 21.87773 
1 1 1   10   26   22 o  130.069   21.614   13.444   4.1520   16.263   5.5870   9.9673   6.2051  142.251   26.639  111.775   33.571 30.47543 42.85594 
1 1 1   10   26   23 o  584.772   9.7296  262.398   8.7087  262.007   10.366  263.336   16.056  584.012   11.596  583.962   17.963 0.5004883E-01 21.38116 
1 1 1   10   26   24 o  507.597   10.122  197.788   7.8639  196.778   9.3750  200.184   14.445  505.970   12.105  508.847   18.546 -2.876801 22.14716 
1 1 1   10   26   25 o  333.270   10.374   85.291   5.2920   90.279   7.4113   80.103   7.5589  342.379   14.142  322.332   15.321 20.04733 20.85027 
1 1 1   10   26   26 o  192.686   17.773   28.951   5.1828   23.228   8.3604   32.523   6.6051  168.335   33.624  203.487   21.534 -35.15170 39.92871 
1 1 1   10   26   27 o  265.496   13.970   54.468   5.6570   52.705   9.0109   55.615   7.2677  259.040   22.965  267.480   17.854 -8.439606 29.08853 
1 1 1   10   26   28 o  228.114   14.909   40.328   5.1768   34.607   7.3749   45.885   7.2685  209.251   23.428  242.290   19.772 -33.03906 30.65583 
1 1 1   10   26   29 o  450.683   11.739  156.321   8.0978  149.644   13.948  159.716   9.9458  438.343   20.788  454.940   14.283 -16.59726 25.22188 
1 1 1   10   26   30 o  404.999   10.385  126.120   6.4376  131.194   9.1184  121.077   9.0898  412.163   14.454  395.814   15.004 16.34842 20.83312 
1 1 1   10   26   31 o  294.474   12.811   66.873   5.7741   63.256   8.0446   70.717   8.2926  284.635   18.567  301.172   18.073 -16.53717 25.91018 
1 1 1   10   26   32 o  314.122   13.751   76.231   6.6113   84.563   10.998   71.516   8.2729  327.753   22.051  302.756   17.932 24.99677 28.42236 
1 1 1   10   26   33 o  239.036   17.106   44.625   6.2174   43.867   10.468   45.037   7.7281  232.214   30.165  238.821   21.367 -6.607559 36.96581 
1 1 1   10   26   34 o  120.665   17.067   11.536   3.0642   10.415   3.3878   16.574   7.1845  113.787   20.191  140.135   33.870 -26.34869 39.43218 
1 1 1   10   26   35 o  121.961   17.944   11.829   3.2495   11.366   3.4752   15.049   9.1658  119.044   19.766  132.846   40.986 -13.80251 45.50287 
1 1 1   10   26   36 o  237.628   10.631   43.517   3.8666   44.118   4.3573   41.291   8.3869  239.053   11.908  226.922   24.537 12.13016 27.27415 
1 1 1   10   26   37 o  182.297   14.155   25.912   3.9186   24.893   4.0331   43.086   16.563  178.479   14.899  216.383   50.866 -37.90323 53.00324 
1 1 1   10   26   38 o  109.465   17.788   9.5929   2.8781   12.941   3.7041   4.4914   4.5720  126.990   19.694   80.087   28.995 46.90312 35.05078 
1 1 1   10   26   39 o  186.907   13.972   27.256   3.9683   31.453   4.4913   12.320   8.4736  200.648   14.727  120.678   39.658 79.96981 42.30426 
1 1 1   10   26   40 o  293.185   11.170   66.412   5.0128   45.962   10.292   72.772   5.7397  236.125   29.091  306.616   12.230 -70.49054 31.55750 
1 1 1   10   26   41 o  238.720   10.250   43.982   3.7452   45.771   5.2181   42.081   5.3786  242.220   14.136  231.859   15.241 10.36092 20.78694 
1 1 1   10   26   42 o  227.619   15.562   40.644   5.3894   12.024   10.269   51.523   6.3314  120.202   43.464  256.132   16.234 -135.9303 46.39675 
1 1 1   10   26   43 o  107.457   20.939   9.4712   3.3202   9.4866   4.8135   9.4574   4.5857  105.578   28.930  105.563   27.943 0.1530457E-01 40.22116 
1 1 1   10   26   44 f   84.843   23.209   5.9897   3.1011   7.5349   4.1684   4.0745   4.6407   94.534   27.289   77.462   29.006 17.07195 39.82494 
1 1 1   10   26   45 o  374.961   9.3480  108.602   5.3650  107.365   7.3247  110.033   7.8803  371.280   12.889  375.436   13.713 -4.155518 18.81963 
1 1 1   10   26   46 o   63.356   24.330   2.4352   3.3141   6.7936   4.6063  -2.2418   4.7716   90.057   29.223   55.771   25.398 34.28558 38.71691 
1 1 1   10   26   47 o  211.660   21.952   36.680   7.0084   28.451   10.767   42.729   9.2316  172.431   41.334  224.700   27.409 -52.26956 49.59595 
1 1 1   10   26   48 o  164.608   16.905   21.736   4.1988   25.195   6.0310   18.483   5.8493  174.006   23.224  146.573   27.070 27.43318 35.66649 
1 1 1   10   26   49 o  270.214   17.138   58.551   7.0514   0.0000   0.0000   58.551   7.0514  ?   ?   270.214   17.138 0.000000 17.13776 
1 1 1   10   26   50 o  141.955   18.433   16.527   3.9106   21.994   5.7215   11.734   5.3572  160.632   24.007  113.223   30.311 47.40871 38.66655 
1 1 1   10   26   51 o  142.449   19.761   16.899   4.1926   28.414   6.7767   9.7574   5.3366  181.227   25.104  102.323   31.223 78.90377 40.06395 
1 1 1   10   26   52 o  127.628   30.806   15.312   5.9494   9.3741   9.0318   19.863   7.9074  100.009   39.646  140.725   36.427 -40.71564 53.83982 
1 1 1   10   27    0 o  857.442   15.163  564.131   19.886  564.131   19.886  564.131   19.886  857.442   15.163  857.442   15.163 0.000000 0.000000 
1 1 1   10   27    1 o  672.273   10.053  346.393   10.345  346.441   14.626  346.346   14.635  671.825   14.223  671.732   14.234 0.9277344E-01 20.12174 
1 1 1   10   27    2 o  690.836   10.085  365.793   10.664  364.228   14.919  367.428   15.249  688.861   14.150  691.844   14.400 -2.983276 20.18874 
1 1 1   10   27    3 o  694.948   10.160  370.174   10.807  355.476   14.716  387.381   15.923  680.528   14.128  710.334   14.645 -29.80609 20.34882 
1 1 1   10   27    4 o  467.065   10.273  167.217   7.3440  160.656   10.098  174.585   10.701  457.461   14.421  476.855   14.661 -19.39441 20.56449 
1 1 1   10   27    5 o  960.836   9.3929  707.490   13.814  706.210   16.963  710.010   23.803  959.638   11.549  961.281   16.177 -1.642944 19.87636 
1 1 1   10   27    6 o  240.128   16.235   44.510   5.9320   46.503   9.0539   43.011   7.8521  244.165   24.559  235.167   22.072 8.997314 33.02039 
1 1 1   10   27    7 o  417.083   11.771  133.426   7.5145  126.774   10.842  139.574   10.424  406.021   17.446  426.190   15.980 -20.16925 23.65839 
1 1 1   10   27    8 o  784.710   10.931  472.174   13.130  478.203   19.139  466.815   18.046  788.859   15.851  779.552   15.124 9.307190 21.90813 
1 1 1   10   27    9 o  554.146   8.6895  235.309   7.3704  230.999   9.0069  244.042   12.823  548.867   10.721  563.651   14.863 -14.78345 18.32618 
1 1 1   10   27   10 o  573.487   8.7460  252.036   7.6772  242.979   9.2432  272.183   13.786  562.901   10.728  595.184   15.132 -32.28351 18.54937 
1 1 1   10   27   11 o  529.464   8.9588  214.851   7.2603  212.658   8.7329  219.761   13.065  526.580   10.835  534.643   15.965 -8.063782 19.29448 
1 1 1   10   27   12 o  472.575   9.1728  171.183   6.6351  164.454   7.9877  186.161   11.917  463.009   11.271  492.058   15.823 -29.04892 19.42645 
1 1 1   10   27   13 o  633.136   8.9272  307.258   8.6513  312.797   10.674  296.653   14.770  638.573   10.921  621.145   15.535 17.42810 18.98948 
1 1 1   10   27   14 o  521.630   9.0254  208.583   7.2060  208.548   8.7715  208.655   12.638  521.379   10.991  520.829   15.854 0.5505981 19.29104 
1 1 1   10   27   15 f  495.061   9.3029  187.910   7.0493  192.643   8.5785  178.067   12.370  501.053   11.186  480.930   16.805 20.12360 20.18700 
1 1 1   10   27   16 o  446.265   9.6261  152.727   6.5753  146.579   7.8760  166.867   11.945  436.969   11.776  465.500   16.764 -28.53146 20.48667 
1 1 1   10   27   17 o  540.368   11.335  224.136   9.3751  224.136   9.3751   0.0000   0.0000  540.368   11.335  ?   ?  0.000000 11.33483 
1 1 1   10   27   18 o  196.591   19.217   30.120   5.7085   30.120   5.7085   0.0000   0.0000  196.591   19.217  ?   ?  0.000000 19.21658 
1 1 1   10   27   19 o  423.732   10.204  137.775   6.6180  134.659   7.8398  145.503   12.345  418.670   12.234  434.126   18.578 -15.45633 22.24460 
1 1 1   10   27   20 o   93.221   29.006   6.7767   4.5798   5.9697   5.4185   8.7951   8.5695   91.420   31.709  111.797   39.787 -20.37694 50.87732 
1 1 1   10   27   21 o  309.299   12.080   73.515   5.7189   74.944   6.8388   70.192   10.429  312.033   14.319  299.806   22.900 12.22662 27.00825 
1 1 1   10   27   22 o  124.284   22.844   12.367   4.1855   10.318   5.6534   14.852   6.2262  112.796   31.524  134.846   30.837 -22.04953 44.09796 
1 1 1   10   27   23 o  206.514   14.081   32.992   4.4244   35.615   6.1767   30.228   6.3407  213.685   19.086  196.207   21.463 17.47765 28.72172 
1 1 1   10   27   24 o  424.949   9.2461  138.595   6.0140  137.832   8.3080  139.435   8.7169  423.224   12.825  425.576   13.382 -2.351196 18.53523 
1 1 1   10   27   25 o  112.158   25.501   10.224   4.2788   5.2565   5.8293   16.027   6.3004   89.325   32.678  139.942   30.292 -50.61626 44.55887 
1 1 1   10   27   26 o  250.333   12.960   48.387   4.9490   47.189   6.9871   49.594   7.0107  246.030   18.694  252.356   18.274 -6.326065 26.14183 
1 1 1   10   27   27 o  434.182   13.651  145.343   9.0718   0.0000   0.0000  145.343   9.0718  ?   ?   434.182   13.651 0.000000 13.65061 
1 1 1   10   27   28 o  596.833   12.817  274.510   11.709   0.0000   0.0000  274.510   11.709  ?   ?   596.833   12.817 0.000000 12.81691 
1 1 1   10   27   29 o  149.873   23.959   18.038   5.3111   16.677   8.5714   18.886   6.7667  140.593   38.637  151.575   30.226 -10.98184 49.05599 
1 1 1   10   27   30 o  154.639   24.214   19.228   5.5432   18.974   9.0883   19.379   6.9949  149.268   39.255  153.174   30.901 -3.906708 49.95809 
1 1 1   10   27   31 o  244.603   16.681   46.649   6.2081   45.402   10.360   47.348   7.7544  236.894   29.191  245.179   20.861 -8.285233 35.87880 
1 1 1   10   27   32 o  168.297   20.525   22.471   5.1777   21.748   7.2682   23.216   7.3777  162.301   30.374  168.040   29.774 -5.739044 42.53295 
1 1 1   10   27   33 o  458.692   10.241  161.969   7.1901  162.142   10.251  161.801   10.088  457.542   14.637  457.142   14.417 0.4005127 20.54513 
1 1 1   10   27   34 o  210.225   19.351   34.842   6.1568   43.896   8.3451   24.028   9.1205  234.615   23.557  167.910   36.526 66.70493 43.46365 
1 1 1   10   27   35 o   60.353   22.864   2.1291   2.9019   0.6279   3.1615   10.159   7.3118   54.663   22.776  111.698   36.846 -57.03521 43.31689 
1 1 1   10   27   36 o  282.527   9.8967   61.479   4.2798   65.581   4.9427   49.191   8.5550  291.566   11.075  248.429   22.751 43.13710 25.30347 
1 1 1   10   27   37 o   91.606   22.920   6.9062   3.2057   6.5708   3.5192   8.5414   7.7705   89.391   24.832  105.681   37.858 -16.29013 45.27544 
1 1 1   10   27   38 o  145.328   17.739   16.759   3.8640   16.795   3.9751   16.141   16.460  145.332   18.274  140.505   54.153 4.827194 57.15277 
1 1 1   10   27   39 o  165.608   18.456   21.780   4.5988   17.960   9.3599   22.995   5.2800  142.028   40.861  169.419   20.798 -27.39066 45.84922 
1 1 1   10   27   40 o  299.242   12.412   69.381   5.6849   69.381   5.6849   0.0000   0.0000  299.242   12.412  ?   ?  0.000000 12.41158 
1 1 1   10   27   41 o  298.247   24.464   71.933   11.070   71.933   11.070   0.0000   0.0000  298.247   24.464  ?   ?  0.000000 24.46414 
1 1 1   10   27   42 o  143.754   16.012   16.369   3.4633   14.618   4.9439   18.057   4.8532  132.510   25.298  148.993   21.938 -16.48381 33.48520 
1 1 1   10   27   43 o  307.659   9.1333   73.032   4.3010   75.347   6.0121   70.605   6.1554  311.353   12.615  301.117   13.355 10.23593 18.37147 
1 1 1   10   27   44 o  116.205   19.810   11.027   3.3971   14.367   4.6288   7.1264   5.0014  131.372   23.900   92.628   30.469 38.74371 38.72447 
1 1 1   10   27   45 o  225.258   11.480   39.526   3.9449   40.252   5.2689   38.599   5.9510  225.789   15.337  219.903   17.834 5.885666 23.52142 
1 1 1   10   27   46 o  229.526   12.157   41.173   4.2558   35.040   5.7015   48.889   6.3953  209.100   17.989  247.802   16.963 -38.70216 24.72564 
1 1 1   10   27   47 o  131.510   20.366   14.242   3.9670   13.732   5.5614   14.770   5.6603  124.642   29.593  129.555   29.238 -4.912979 41.60038 
1 1 1   10   27   48 o  172.659   16.233   23.896   4.2397   29.750   5.8970   17.632   6.0999  190.334   20.569  141.135   29.200 49.19946 35.71728 
1 1 1   10   27   49 o   86.083   25.923   6.4574   3.6963   16.490   5.5363  -1.6111   4.9650  136.675   27.418   57.573   26.097 79.10181 37.85271 
1 1 1   10   27   50 o  132.706   19.378   14.642   3.8201   18.342   5.7075   11.639   5.1417  143.971   26.889  112.540   29.492 31.43100 39.90982 
1 1 1   10   27   51 o  160.606   25.964   22.726   6.1648   17.571   9.4479   26.548   8.1353  127.050   41.882  167.521   32.901 -40.47104 53.25996 
1 1 1   10   28    0 o  185.930   26.916   28.216   7.1931   28.216   7.1931   28.216   7.1931  185.930   26.916  185.930   26.916 0.000000 0.000000 
1 1 1   10   28    1 o  397.276   10.901  121.037   6.6284  125.456   9.3211  116.515   9.4279  404.086   15.070  389.343   15.820 14.74313 21.84934 
1 1 1   10   28    2 o  527.003   10.103  212.930   8.1492  206.490   11.051  220.608   12.065  518.559   13.923  535.888   14.710 -17.32867 20.25375 
1 1 1   10   28    3 o  724.187   10.371  402.125   11.496  389.263   15.760  416.745   16.804  711.878   14.464  736.495   14.906 -24.61700 20.77044 
1 1 1   10   28    4 o  452.465   10.511  156.986   7.2796  149.644   9.9211  165.550   10.715  441.346   14.686  464.161   15.081 -22.81470 21.05057 
1 1 1   10   28    5 o  586.087   8.5364  263.229   7.6579  260.917   9.3472  267.948   13.355  583.315   10.469  590.545   14.775 -7.229736 18.10795 
1 1 1   10   28    6 o  273.150   14.546   57.483   6.0595   54.399   8.9238   60.121   8.2542  264.502   22.249  278.648   19.476 -14.14606 29.56865 
1 1 1   10   28    7 o  293.986   14.249   66.396   6.4119   74.963   9.5240   59.293   8.6715  311.162   20.104  276.493   20.639 34.66962 28.81210 
1 1 1   10   28    8 o  509.374   11.188  199.046   8.7228  195.855   12.611  201.973   12.078  504.593   16.329  512.558   15.395 -7.964661 22.44171 
1 1 1   10   28    9 f  207.775   14.448   33.333   4.5662   33.787   5.6405   32.470   7.7779  208.714   17.827  203.136   25.583 5.578217 31.18154 
1 1 1   10   28   10 o  225.054   13.406   39.041   4.5972   40.994   5.6213   35.096   7.9882  230.290   16.048  211.354   25.189 18.93623 29.86661 
1 1 1   10   28   11 o  480.802   9.2755  177.237   6.8261  178.596   8.3954  174.585   11.726  482.424   11.370  476.333   16.082 6.090790 19.69540 
1 1 1   10   28   12 o  183.502   16.447   26.126   4.5706   30.105   5.6558   18.635   7.7597  196.668   19.026  151.243   34.308 45.42499 39.23059 
1 1 1   10   28   13 o  638.571   9.0198  312.645   8.8161  312.349   10.851  313.218   15.121  637.968   11.112  638.023   15.484 -0.5535889E-01 19.05882 
1 1 1   10   28   14 o  300.885   11.594   69.503   5.3394   68.493   6.5361   71.528   9.2574  298.448   14.308  303.655   20.030 -5.206970 24.61557 
1 1 1   10   28   15 o  440.119   11.793  148.745   7.9444  148.745   7.9444   0.0000   0.0000  440.119   11.793  ?   ?  0.000000 11.79289 
1 1 1   10   28   16 o  394.229   12.505  119.411   7.5457  119.411   7.5457   0.0000   0.0000  394.229   12.505  ?   ?  0.000000 12.50498 
1 1 1   10   28   17 o  715.245   9.2464  392.395   10.123  400.675   12.467  376.369   17.343  722.359   11.275  698.868   16.213 23.49170 19.74820 
1 1 1   10   28   18 o  201.107   16.353   31.381   4.9903   32.079   5.9739   29.769   9.0779  202.776   19.487  192.195   31.982 10.58081 37.45160 
1 1 1   10   28   19 o  214.726   15.288   35.699   4.9917   39.443   5.9354   26.654   9.2261  225.400   17.337  180.775   34.604 44.62511 38.70395 
1 1 1   10   28   20 o  276.904   11.151   58.901   4.7261   51.063   6.4057   68.264   7.0014  256.759   16.385  297.200   15.444 -40.44165 22.51646 
1 1 1   10   28   21 o  263.922   11.567   53.534   4.6729   53.243   6.4660   53.852   6.7607  262.187   16.192  263.559   16.847 -1.371643 23.36635 
1 1 1   10   28   22 o   79.489   27.433   4.5326   4.0531   9.1113   5.7211  -0.0813   5.7430  106.699   32.277   69.893   29.976 36.80571 44.04995 
1 1 1   10   28   23 o  282.666   11.424   61.429   4.9427   63.419   6.8290   59.240   7.1629  286.221   15.647  276.307   17.019 9.913788 23.11913 
1 1 1   10   28   24 o  210.526   14.367   34.335   4.6020   35.477   6.3921   33.106   6.6309  212.869   19.847  205.184   21.430 7.685028 29.20851 
1 1 1   10   28   25 o  213.365   14.918   35.313   4.8414   26.518   6.5878   45.641   7.1389  182.581   24.167  241.662   19.465 -59.08093 31.03114 
1 1 1   10   28   26 o  156.633   23.928   19.631   5.5547   19.623   10.067   19.634   6.6604  152.091   41.904  155.156   29.115 -3.064987 51.02553 
1 1 1   10   28   27 o  166.189   18.947   21.736   4.7334   18.404   6.6794   25.099   6.7087  149.640   30.203  176.908   25.513 -27.26819 39.53658 
1 1 1   10   28   28 o   78.703   30.424   3.4108   5.2076   5.9199   8.4186   1.8556   6.6278  100.034   38.679   80.021   33.129 20.01235 50.92751 
1 1 1   10   28   29 o   61.984   27.370  -1.2404   5.0906   1.2197   8.1300  -2.8269   6.5290   85.111   36.056   66.867   30.153 18.24356 47.00241 
1 1 1   10   28   30 f   59.722   26.893  -2.2536   5.1729   11.604   8.5662 -10.2076   6.4898  119.822   39.898   53.229   25.787 66.59296 47.50603 
1 1 1   10   28   31 o  237.406   15.425   43.871   5.5748   43.513   7.8120   44.243   7.9580  234.408   22.032  236.299   22.265 -1.890640 31.32293 
1 1 1   10   28   32 o  273.137   13.860   57.865   5.7756   59.602   8.0524   56.024   8.2886  275.552   19.212  266.665   20.463 8.887268 28.06857 
1 1 1   10   28   33 f  176.260   22.337   24.839   5.8910   29.611   7.7658   18.371   9.0410  190.781   27.379  145.658   39.538 45.12334 48.09235 
1 1 1   10   28   34 o   94.685   32.180   6.9456   5.5722   4.3447   7.8757   9.5524   7.8848   92.163   36.864  110.143   38.248 -17.97996 53.12115 
1 1 1   10   28   35 o  205.747   19.340   33.466   6.0192   23.931   8.6203   42.538   8.4085  167.705   34.725  230.219   24.226 -62.51430 42.34059 
1 1 1   10   28   36 o  123.866   17.945   12.234   3.3032   12.304   3.6399   11.910   7.8639  123.681   19.902  118.848   38.143 4.832909 43.02303 
1 1 1   10   28   37 o   57.523   26.745  -4.4680   5.6900 -13.1185   8.2034   3.5525   7.8991   58.726   28.575   89.249   36.472 -30.52234 46.33295 
1 1 1   10   28   38 o   99.307   37.166   7.0326   7.6170   11.134   8.7620  -5.6554   15.411  116.142   40.320   98.045   45.021 18.09642 60.43718 
1 1 1   10   28   39 f  207.650   26.205   35.277   8.1435   42.396   9.4206   14.230   16.199  227.079   27.676  134.299   53.140 92.77963 59.91544 
1 1 1   10   28   40 o  253.449   10.780   49.650   4.1820   50.329   5.6627   48.836   6.2025  253.725   14.643  249.276   16.347 4.448181 21.94636 
1 1 1   10   28   41 o  255.796   16.320   51.490   6.3566   0.0000   0.0000   51.490   6.3566  ?   ?   255.796   16.320 0.000000 16.32048 
1 1 1   10   28   42 o  174.834   12.972   23.905   3.4465   27.836   4.8263   19.815   4.9233  187.353   17.016  156.286   21.122 31.06654 27.12337 
1 1 1   10   28   43 o  185.157   12.645   26.803   3.5621   26.036   4.9417   27.632   5.1393  180.490   18.133  185.920   18.297 -5.429245 25.75978 
1 1 1   10   28   44 o  161.096   14.502   20.501   3.5376   10.642   4.8638   31.574   5.1546  110.724   28.524  199.092   17.080 -88.36778 33.24645 
1 1 1   10   28   45 o  207.582   12.181   33.698   3.8534   20.962   5.4188   46.727   5.4808  159.059   22.919  243.381   14.782 -84.32196 27.27290 
1 1 1   10   28   46 o  238.605   12.167   44.548   4.4288   42.698   6.0903   46.624   6.4520  230.992   17.352  241.283   17.591 -10.29095 24.70951 
1 1 1   10   28   47 o  188.022   14.394   28.042   4.1109   23.744   6.1073   31.603   5.5588  167.450   24.558  197.408   18.617 -29.95804 30.81707 
1 1 1   10   28   48 o   46.196   21.508  -2.7357   3.7000  -5.4282   5.4684  -0.4621   5.0249   52.434   24.939   61.020   27.055 -8.585426 36.79578 
1 1 1   10   28   49 o  125.251   32.084   14.747   6.1783   19.825   9.7781   11.373   7.9711  136.327   42.378  107.783   38.372 28.54399 57.16871 
1 1 1   10   28   50 o  139.153   22.005   16.509   4.5311   22.771   5.5733   4.3017   7.7818  163.122   22.957   83.968   35.407 79.15407 42.19801 
1 1 1   10   29    0 o  262.230   19.153   53.655   7.5932   53.655   7.5932   53.655   7.5932  262.230   19.153  262.230   19.153 0.000000 0.000000 
1 1 1   10   29    1 o  1048.63   11.908  843.984   19.113  836.690   26.775  851.560   27.291  1042.61   16.778  1051.77   16.952 -9.161865 23.85127 
1 1 1   10   29    2 o  376.249   11.312  108.624   6.5147  110.021   9.3252  107.292   9.1050  378.154   16.111  373.457   15.928 4.697754 22.65563 
1 1 1   10   29    3 o  466.093   10.521  166.638   7.5059  172.138   10.751  161.409   10.484  473.189   14.844  458.190   14.948 14.99854 21.06687 
1 1 1   10   29    4 o  373.009   11.280  106.765   6.4402  108.892   8.9388  104.469   9.2866  376.263   15.521  368.426   16.468 7.837219 22.62951 
1 1 1   10   29    5 o  572.582   8.8037  251.319   7.7156  242.335   9.3578  270.395   13.636  562.013   10.878  592.989   15.023 -30.97638 18.54811 
1 1 1   10   29    6 f  368.182   12.297  104.081   6.9300  103.151   10.319  104.845   9.3531  365.326   18.514  369.045   16.558 -3.719330 24.83838 
1 1 1   10   29    7 o  765.335   11.185  449.500   13.103  462.109   19.417  438.957   17.755  774.788   16.373  755.395   15.356 19.39343 22.44746 
1 1 1   10   29    8 f  501.252   11.318  192.838   8.6833  194.349   12.736  191.526   11.870  502.395   16.562  498.914   15.543 3.481598 22.71357 
1 1 1   10   29    9 o  1062.19   12.515  866.551   20.346  847.325   28.865  885.536   28.684  1048.34   17.989  1071.94   17.482 -23.59607 25.08420 
1 1 1   10   29   10 o  747.652   9.1088  428.632   10.424  424.626   12.856  436.321   17.809  743.761   11.293  752.954   15.453 -9.192627 19.13943 
1 1 1   10   29   11 o  204.853   15.303   32.474   4.7636   29.226   5.7946   39.246   8.3663  193.516   19.844  223.475   24.881 -29.95821 31.82524 
1 1 1   10   29   12 o  560.737   11.246  241.389   9.6525  241.389   9.6525   0.0000   0.0000  560.737   11.246  ?   ?  0.000000 11.24631 
1 1 1   10   29   13 o  170.344   22.291   22.856   5.6725   22.856   5.6725   0.0000   0.0000  170.344   22.291  ?   ?  0.000000 22.29063 
1 1 1   10   29   14 o  335.830   13.373   86.722   6.8740   86.722   6.8740   0.0000   0.0000  335.830   13.373  ?   ?  0.000000 13.37279 
1 1 1   10   29   15 o  148.523   21.218   17.422   4.6864   21.571   5.7508   9.2205   8.0858  165.085   23.415  112.084   38.743 53.00092 45.26918 
1 1 1   10   29   16 f  361.053   10.718  100.093   5.9234   94.525   7.0997  112.845   10.745  350.567   13.231  382.155   18.369 -31.58795 22.63830 
1 1 1   10   29   17 o  443.644   9.9110  151.068   6.7301  146.803   8.0777  160.750   12.170  437.028   12.076  456.252   17.426 -19.22427 21.20144 
1 1 1   10   29   18 o  139.059   22.912   15.416   4.7070   13.072   5.5992   21.063   8.6913  126.562   29.456  159.677   36.373 -33.11443 46.80478 
1 1 1   10   29   19 o  242.070   14.219   45.292   5.2453   43.322   6.2355   50.060   9.7003  236.149   17.373  251.907   25.510 -15.75780 30.86365 
1 1 1   10   29   20 o  396.300   10.902  120.680   6.6131  120.110   7.9367  121.974   11.960  395.006   13.127  396.620   19.702 -1.613647 23.67426 
1 1 1   10   29   21 o  408.946   9.4457  128.395   5.9125  134.305   8.1313  121.765   8.6125  417.714   12.718  397.464   14.157 20.25015 19.03036 
1 1 1   10   29   22 o  241.985   12.849   45.216   4.7422   49.829   6.6493   40.442   6.7651  253.185   17.261  227.433   19.626 25.75221 26.13634 
1 1 1   10   29   23 o  307.982   11.264   72.957   5.3101   70.652   7.4981   75.276   7.5212  301.830   16.290  311.695   15.817 -9.864532 22.70552 
1 1 1   10   29   24 o  387.340   11.994  115.510   7.1106  109.363   12.549  118.417   8.6296  373.646   22.040  391.670   14.395 -18.02405 26.32457 
1 1 1   10   29   25 o  282.660   17.521   62.200   7.5430   0.0000   0.0000   62.200   7.5430  ?   ?   282.660   17.521 0.000000 17.52090 
1 1 1   10   29   26 o  513.340   10.278  202.669   8.0759  189.643   12.799  211.284   10.410  494.504   16.910  523.370   12.994 -28.86554 21.32606 
1 1 1   10   29   27 o  253.855   13.620   49.908   5.2729   55.093   7.5243   44.904   7.3915  265.426   18.639  238.973   20.403 26.45323 27.63480 
1 1 1   10   29   28 o  164.237   20.127   21.367   4.9539   17.885   6.8094   25.281   7.2203  146.711   31.279  176.452   27.641 -29.74039 41.74200 
1 1 1   10   29   29 o  179.989   18.468   25.494   5.0158   28.547   7.1780   22.580   7.0117  188.342   25.560  166.115   28.609 22.22673 38.36373 
1 1 1   10   29   30 o  393.128   12.148  119.249   7.3099  133.927   12.134  110.887   9.1585  414.128   19.142  378.022   15.828 36.10562 24.83869 
1 1 1   10   29   31 o  179.866   24.663   26.060   6.6111   34.258   9.6386   18.776   9.0850  203.551   31.992  147.395   39.478 56.15616 50.81311 
1 1 1   10   29   32 o  153.822   26.349   19.333   5.9805   16.896   7.7152   23.002   9.4662  140.592   35.767  163.239   38.509 -22.64664 52.55695 
1 1 1   10   29   33 o  166.277   31.807   23.143   7.8002   23.143   7.8002   0.0000   0.0000  166.277   31.807  ?   ?  0.000000 31.80721 
1 1 1   10   29   34 o  293.345   14.090   66.731   6.3266   64.446   8.8094   69.164   9.0914  285.625   20.282  295.982   20.188 -10.35773 28.61694 
1 1 1   10   29   35 o  205.880   19.309   33.557   6.0137   44.132   8.6336   23.590   8.3813  234.152   24.450  166.416   34.051 67.73595 41.92007 
1 1 1   10   29   36 o   69.476   29.839   0.2867   5.7049   1.3174   8.0385  -0.7592   8.0978   83.642   35.658   78.862   34.684 4.780365 49.74350 
1 1 1   10   29   37 o  172.033   16.255   23.305   4.2294   24.195   4.3786   10.908   16.344  175.232   16.520  128.137   52.425 47.09535 54.96609 
1 1 1   10   29   38 o   83.060   25.200   5.6213   3.4834   5.9203   3.7953   4.0230   8.7750   85.296   26.383   93.203   38.305 -7.906387 46.51162 
1 1 1   10   29   39 o  206.817   31.303   36.086   9.5994   0.0000   0.0000   36.086   9.5994  ?   ?   206.817   31.303 0.000000 31.30307 
1 1 1   10   29   40 o  239.809   12.955   44.819   4.7375   47.978   5.4332   34.800   9.6764  247.622   14.397  201.850   32.417 45.77220 35.46996 
1 1 1   10   29   41 o   52.148   22.111   0.3398   3.0617   1.3596   3.8764  -1.3514   4.9919   61.930   25.457   59.884   26.733 2.046402 36.91480 
1 1 1   10   29   42 o  264.481   14.202   54.848   5.7281   54.848   5.7281   0.0000   0.0000  264.481   14.202  ?   ?  0.000000 14.20168 
1 1 1   10   29   43 o  216.200   11.348   36.407   3.7422   39.823   5.3955   33.242   5.1946  224.339   15.814  204.462   16.745 19.87683 23.03251 
1 1 1   10   29   44 o  205.469   12.449   33.049   3.8966   32.650   5.7957   33.378   5.2640  201.262   19.040  204.562   16.965 -3.300201 25.50165 
1 1 1   10   29   45 o  142.536   17.182   16.371   3.6731   23.178   5.2208   9.6991   5.1688  168.171   20.720  104.557   30.447 63.61403 36.82858 
1 1 1   10   29   46 o  210.449   13.070   34.892   4.1893   30.210   5.6889   40.439   6.1923  192.359   19.595  223.684   18.245 -31.32460 26.77433 
1 1 1   10   29   47 o   68.671   25.356   3.4762   3.5217   2.4858   5.0772   4.3945   4.8891   70.654   29.099   77.433   29.595 -6.779327 41.50422 
1 1 1   10   29   48 o  187.561   14.479   28.098   4.1244   23.786   6.0314   31.886   5.6526  166.291   24.424  197.014   18.980 -30.72261 30.93150 
1 1 1   10   29   49 o   77.504   28.168   4.9256   4.3212   11.200   5.2248  -8.6566   7.6873  109.491   30.197   58.595   28.308 50.89597 41.39130 
1 1 1   10   30    0 o  505.038   14.974  196.232   11.552  196.232   11.552  196.232   11.552  505.038   14.974  505.038   14.974 0.000000 0.000000 
1 1 1   10   30    1 o  282.535   13.544   61.357   5.8571   62.578   8.0989   60.018   8.4808  284.174   18.725  278.019   20.064 6.154541 27.44406 
1 1 1   10   30    2 o  463.638   10.864  164.973   7.7100  177.220   10.974  153.032   10.835  479.945   14.938  445.840   15.877 34.10556 21.79958 
1 1 1   10   30    3 o  472.661   10.628  171.438   7.6889  167.526   10.639  175.714   11.124  466.634   14.896  477.848   15.209 -11.21423 21.28896 
1 1 1   10   30    4 o  778.344   10.819  464.946   12.890  465.591   18.045  464.274   18.418  777.834   15.157  776.637   15.494 1.197327 21.67476 
1 1 1   10   30    5 o  323.830   10.797   80.483   5.3515   79.831   6.7160   81.617   8.8571  322.247   13.616  324.824   17.883 -2.577637 22.47685 
1 1 1   10   30    6 o  520.118   11.235  207.679   8.9440  217.314   13.428  199.996   11.991  531.091   16.519  509.719   15.369 21.37131 22.56292 
1 1 1   10   30    7 o  317.022   13.573   77.271   6.5861   70.775   9.8515   82.521   8.8561  301.629   21.479  326.605   17.782 -24.97568 27.88441 
1 1 1   10   30    8 o  418.296   12.164  134.413   7.7882  137.691   11.536  131.668   10.557  422.453   17.841  413.317   16.687 9.135284 24.42877 
1 1 1   10   30    9 o  230.325   18.348   41.208   6.4147   51.820   9.3164   31.642   8.8454  257.239   23.936  198.962   29.976 58.27695 38.35994 
1 1 1   10   30   10 o  322.104   13.928   79.813   6.8668   79.813   6.8668   0.0000   0.0000  322.104   13.928  ?   ?  0.000000 13.92801 
1 1 1   10   30   11 o  491.415   11.759  185.515   8.8447  185.515   8.8447   0.0000   0.0000  491.415   11.759  ?   ?  0.000000 11.75891 
1 1 1   10   30   12 o  317.747   11.365   77.550   5.5273   78.317   6.8047   76.064   9.4761  319.022   13.935  312.909   19.888 6.112854 24.28473 
1 1 1   10   30   13 o   88.364   28.553   5.9653   4.4011   9.2263   5.3868  -0.5821   7.6328  107.114   31.051   79.180   34.262 27.93401 46.23899 
1 1 1   10   30   14 o  440.263   9.8613  148.776   6.6453  156.401   8.3198  135.339   11.045  451.079   12.050  418.657   17.235 32.42255 21.03004 
1 1 1   10   30   15 o  311.747   11.724   74.697   5.5944   72.223   6.8610   79.603   9.6638  306.178   14.640  319.965   19.830 -13.78726 24.64874 
1 1 1   10   30   16 f  256.367   13.741   50.749   5.3724   55.908   6.6076   40.686   9.2281  268.680   16.142  226.382   27.175 42.29803 31.60766 
1 1 1   10   30   17 f  106.006   27.921   9.1415   4.5934   12.294   5.4608   1.5143   8.4935  122.599   29.466   88.483   37.134 34.11532 47.40414 
1 1 1   10   30   18 o  167.787   19.451   22.110   4.9027   23.936   5.9206   18.127   8.7455  173.877   22.795  147.437   38.380 26.44003 44.63864 
1 1 1   10   30   19 o  152.057   21.637   18.338   4.8939   11.441   5.8021   35.341   9.1101  118.069   31.517  209.847   29.150 -91.77785 42.93055 
1 1 1   10   30   20 o  298.044   12.970   68.421   5.9169   62.963   7.0607   81.297   10.844  284.938   16.257  322.200   22.122 -37.26190 27.45305 
1 1 1   10   30   21 o  199.418   17.988   31.070   5.4316   31.547   6.4693   29.929   9.9988  200.109   21.456  190.285   35.640 9.823944 41.59976 
1 1 1   10   30   22 o  174.463   25.286   24.371   6.5555   0.0000   0.0000   24.371   6.5555  ?   ?   174.463   25.286 0.000000 25.28580 
1 1 1   10   30   23 f  249.076   19.147   48.520   7.2439   0.0000   0.0000   48.520   7.2439  ?   ?   249.076   19.147 0.000000 19.14749 
1 1 1   10   30   24 o  374.867   11.496  108.209   6.5961  123.574   10.955   99.472   8.2613  398.844   17.946  358.630   15.050 40.21359 23.42103 
1 1 1   10   30   25 o  338.521   10.847   88.208   5.6206   90.424   7.9088   85.946   7.9892  341.827   15.116  333.117   15.669 8.709930 21.77155 
1 1 1   10   30   26 o  225.755   14.761   39.599   5.0725   41.763   6.9938   37.198   7.3681  230.444   20.027  216.601   22.555 13.84279 30.16306 
1 1 1   10   30   27 o   87.557   29.106   5.8919   4.5594   6.0174   6.4340   5.7653   6.4619   93.582   34.317   92.682   34.321 0.8992615 48.53455 
1 1 1   10   30   28 o  428.961   10.175  141.621   6.6809  141.157   9.3321  142.109   9.5687  427.095   14.275  428.427   14.592 -1.331879 20.41328 
1 1 1   10   30   29 o  135.263   24.970   14.915   4.9793   18.869   6.9742   10.804   7.1114  150.380   31.317  114.515   36.222 35.86434 47.88279 
1 1 1   10   30   30 o  375.376   12.432  108.832   7.1427   99.251   8.8711  126.492   12.044  357.329   16.220  401.983   19.574 -44.65421 25.42109 
1 1 1   10   30   31 o  231.616   16.549   41.957   5.8284   42.150   8.2921   41.768   8.1940  229.507   23.958  228.528   23.773 0.9788971 33.75129 
1 1 1   10   30   32 o  582.083   11.067  261.372   9.8602  270.395   16.154  256.014   12.448  588.269   17.941  574.644   14.153 13.62531 22.85095 
1 1 1   10   30   33 o  243.454   18.071   46.606   6.6860   34.889   10.316   55.093   8.7797  203.335   34.370  263.173   21.997 -59.83809 40.80672 
1 1 1   10   30   34 o  444.377   11.326  152.514   7.7037  164.350   11.176  141.800   10.633  459.276   15.898  426.417   16.292 32.85883 22.76354 
1 1 1   10   30   35 o  230.262   21.994   42.381   7.6573   35.767   8.7554   63.895   15.792  208.560   28.146  272.051   39.043 -63.49100 48.13008 
1 1 1   10   30   36 o   77.187   31.418   2.5404   5.8323  -3.8340   7.9323   10.041   8.6049   71.358   32.593  111.875   39.864 -40.51666 51.49175 
1 1 1   10   30   37 o  170.077   24.415   23.621   6.1737   29.429   8.7204   17.784   8.7413  186.545   31.674  141.250   39.101 45.29465 50.31978 
1 1 1   10   30   38 o  247.358   12.658   47.605   4.7764   47.267   5.4514   48.724   9.9097  245.830   14.553  243.395   27.058 2.435196 30.72296 
1 1 1   10   30   39 o  152.852   17.082   18.579   3.9282   21.004   4.4109   9.2788   8.6365  162.285   18.064  107.954   39.733 54.33127 43.64634 
1 1 1   10   30   40 o  206.509   13.229   33.345   4.1596   34.663   4.7087   28.666   8.8753  210.033   14.740  181.672   33.138 28.36108 36.26887 
1 1 1   10   30   41 o  210.564   13.702   34.770   4.3920   32.165   5.0036   43.514   9.1672  201.452   16.369  228.459   26.720 -27.00734 31.33530 
1 1 1   10   30   42 o  162.757   14.220   20.902   3.5070   21.652   4.9637   20.155   4.9558  163.210   20.309  157.007   21.160 6.203033 29.32927 
1 1 1   10   30   43 o  172.142   15.169   23.497   3.9560   29.575   5.6916   17.816   5.5023  191.094   19.744  144.998   25.735 46.09595 32.43596 
1 1 1   10   30   44 o  390.769   15.756  120.845   9.4238   0.0000   0.0000  120.845   9.4238  ?   ?   390.769   15.756 0.000000 15.75559 
1 1 1   10   30   45 o   94.734   23.687   7.7254   3.4255   9.8927   4.9196   5.6856   4.7726  105.085   29.420   83.462   29.694 21.62267 41.80027 
1 1 1   10   30   46 o   63.036   24.603   2.4470   3.4310   2.1184   4.9313   2.7553   4.7767   68.690   28.518   70.367   28.510 -1.676613 40.32479 
1 1 1   10   30   47 o  188.902   16.696   28.885   4.7778   17.411   9.2498   33.060   5.5797  128.690   41.375  201.085   18.330 -72.39499 45.25319 
1 1 1   10   30   48 o  201.894   15.880   32.897   4.8678   37.081   5.8882   23.865   8.6519  212.680   18.265  154.875   37.003 57.80470 41.26551 
1 1 1   10   31    0 o  333.918   17.479   86.380   8.8776   86.380   8.8776   86.380   8.8776  333.918   17.479  333.918   17.479 0.000000 0.000000 
1 1 1   10   31    1 o  337.515   12.354   87.541   6.3822   88.017   9.2831   87.114   8.7888  337.180   18.053  335.623   17.166 1.556854 24.91111 
1 1 1   10   31    2 o  346.175   12.169   92.081   6.4478   93.805   9.0161   90.276   9.2247  348.757   16.890  341.558   17.706 7.198730 24.46953 
1 1 1   10   31    3 o  152.309   21.207   18.303   4.8099   16.941   6.5162   19.934   7.1295  144.391   30.443  156.826   30.800 -12.43425 43.30616 
1 1 1   10   31    4 o  488.517   10.860  183.234   8.1204  171.950   11.256  195.479   11.726  472.432   15.566  503.796   15.206 -31.36316 21.76106 
1 1 1   10   31    5 o  213.530   14.032   35.234   4.5606   36.642   5.6824   32.686   7.6451  217.251   17.230  203.440   25.083 13.81078 30.43026 
1 1 1   10   31    6 o  624.972   16.680  301.265   15.956  301.265   15.956   0.0000   0.0000  624.972   16.680  ?   ?  0.000000 16.68030 
1 1 1   10   31    7 o   66.936   31.303  -7.4408   7.9787  -7.4408   7.9787   0.0000   0.0000   66.936   31.303  ?   ?  0.000000 31.30283 
1 1 1   10   31    8 o  388.928   19.023  116.986   11.324  116.986   11.324   0.0000   0.0000  388.928   19.023  ?   ?  0.000000 19.02261 
1 1 1   10   31    9 o  264.471   15.935   54.126   6.4206   62.916   9.8753   47.689   8.4505  283.623   22.944  246.762   22.625 36.86191 32.22343 
1 1 1   10   31   10 o  206.225   19.308   33.195   6.0236   31.538   9.2009   34.437   7.9686  197.831   31.437  208.618   25.485 -10.78653 40.46956 
1 1 1   10   31   11 o  360.696   10.635   99.920   5.8716   93.507   7.1566  113.127   10.270  348.567   13.414  382.639   17.535 -34.07233 22.07747 
1 1 1   10   31   12 o  410.273   10.041  129.238   6.3055  134.415   7.7945  119.433   10.726  418.092   12.180  393.040   17.830 25.05219 21.59299 
1 1 1   10   31   13 o  672.170   9.4203  346.792   9.6920  326.323   11.538  395.851   17.863  651.548   11.570  716.062   16.298 -64.51398 19.98675 
1 1 1   10   31   14 o  414.671   10.294  132.072   6.5334  129.753   7.9149  137.033   11.574  410.647   12.592  420.839   17.969 -10.19269 21.94175 
1 1 1   10   31   15 o  567.990   9.4950  247.685   8.2548  240.880   9.9833  262.395   14.677  559.684   11.654  582.765   16.455 -23.08173 20.16336 
1 1 1   10   31   16 o  248.087   14.113   47.596   5.3371   46.177   6.4250   50.757   9.5862  243.703   17.337  253.491   25.034 -9.787476 30.45106 
1 1 1   10   31   17 o  221.364   15.758   38.042   5.3043   32.686   6.3848   49.976   9.5297  203.997   20.736  251.380   25.103 -47.38333 32.55993 
1 1 1   10   31   18 o  410.104   10.848  129.314   6.8097  129.784   8.2119  128.280   12.185  410.419   13.072  406.336   19.591 4.082764 23.55204 
1 1 1   10   31   19 o  127.575   30.827   13.435   5.9526   12.339   7.7132   15.049   9.3603  122.778   37.551  134.757   41.392 -11.97844 55.88749 
1 1 1   10   31   20 o  321.644   23.147   81.391   11.320   0.0000   0.0000   81.391   11.320  ?   ?   321.644   23.147 0.000000 23.14744 
1 1 1   10   31   21 o  221.662   32.156   40.046   10.591   0.0000   0.0000   40.046   10.591  ?   ?   221.662   32.156 0.000000 32.15574 
1 1 1   10   31   22 o   82.672   28.231   5.0640   4.2890   7.8149   6.1071   2.3867   6.0248  100.564   33.691   78.798   31.986 21.76701 46.45610 
1 1 1   10   31   23 o  176.970   17.037   24.524   4.5578   19.764   6.2523   29.921   6.6584  155.870   27.196  194.023   22.859 -38.15295 35.52658 
1 1 1   10   31   24 o   89.930   28.575   6.3837   4.4220   7.9612   6.1279   4.6700   6.3873  101.063   33.749   88.355   33.813 12.70746 47.77360 
1 1 1   10   31   25 o  311.857   11.731   74.966   5.5997   67.761   7.6583   83.243   8.2085  294.856   17.041  327.515   16.374 -32.65900 23.63331 
1 1 1   10   31   26 o  197.870   16.837   30.634   5.0510   39.323   7.1265   21.864   7.1599  223.062   21.125  162.915   29.812 60.14679 36.53741 
1 1 1   10   31   27 o  343.776   11.528   91.128   6.0662   84.150   8.5017   98.365   8.6582  328.507   16.966  355.969   15.891 -27.46280 23.24558 
1 1 1   10   31   28 o  396.562   12.021  121.376   7.2968  115.566   9.0971  131.856   12.218  385.915   15.401  410.547   19.444 -24.63217 24.80414 
1 1 1   10   31   29 o   80.362   31.496   3.4755   5.6405   7.3024   7.1751  -2.7152   9.1259  100.170   36.314   80.118   35.928 20.05143 51.08377 
1 1 1   10   31   30 o   70.375   29.075   1.5165   5.0898  -5.4232   7.0979   8.8620   7.3025   64.367   29.908  106.328   36.815 -41.96198 47.43243 
1 1 1   10   31   31 f  434.769   10.849  145.796   7.2197  154.018   10.352  138.008   10.075  445.201   15.191  421.242   15.625 23.95856 21.79234 
1 1 1   10   31   32 o  129.480   29.945   14.119   5.8165   15.911   8.1865   12.292   8.2657  135.285   37.978  120.617   39.146 14.66814 54.54139 
1 1 1   10   31   33 o  224.827   26.267   41.082   8.8688   29.919   11.091   60.874   14.769  184.227   40.441  267.202   37.113 -82.97479 54.88998 
1 1 1   10   31   34 o  284.445   17.179   63.525   7.4445   65.900   11.738   61.928   9.6287  284.404   27.300  278.182   22.814 6.222046 35.57802 
1 1 1   10   31   35 o  171.806   23.874   23.994   6.1086   21.882   8.4035   26.361   8.8951  158.722   35.482  175.171   34.403 -16.44899 49.42181 
1 1 1   10   31   36 o  414.805   12.251  133.354   7.7783  121.278   10.622  147.316   11.421  392.930   17.662  433.336   17.220 -40.40637 24.66711 
1 1 1   10   31   37 o  238.281   22.681   45.806   8.1725   40.573   15.539   47.807   9.6089  205.114   49.957  241.308   26.449 -36.19402 56.52659 
1 1 1   10   31   38 o   95.475   34.006   7.1737   6.2613   9.5030   9.1862   5.1525   8.5570  109.430   40.842   94.626   38.221 14.80412 55.93709 
1 1 1   10   31   39 o  268.631   11.494   55.985   4.7259   61.955   5.4967   39.064   9.2538  282.160   12.727  215.459   28.779 66.70071 31.46793 
1 1 1   10   31   40 o  127.529   20.640   13.321   3.8912   16.219   4.3755   2.3645   8.5089  140.854   20.932   85.975   36.670 54.87931 42.22327 
1 1 1   10   31   41 o  103.304   25.268   9.1064   3.9623   9.8308   4.5210   6.7068   8.2285  106.656   27.513   96.834   38.014 9.821518 46.92580 
1 1 1   10   31   42 o  145.724   30.042   18.605   6.4783   21.190   10.472   17.003   8.2456  146.490   43.524  134.441   38.247 12.04878 57.94072 
1 1 1   10   31   43 o  196.358   37.476   35.910   10.853   35.910   10.853   0.0000   0.0000  196.358   37.476  ?   ?  0.000000 37.47626 
1 1 1   10   31   44 o  137.311   24.037   16.059   4.8678   10.829   9.2786   18.046   5.7179  108.506   40.937  143.975   26.937 -35.46852 49.00411 
1 1 1   10   31   45 o  204.252   16.636   33.615   5.1558   12.563   9.1945   43.271   6.2270  112.843   41.077  231.116   17.738 -118.2737 44.74337 
1 1 1   10   31   46 o  130.153   18.874   14.033   3.6502   13.364   5.2905   14.641   5.0429  121.156   28.928  128.564   26.507 -7.408531 39.23599 
1 1 1   10   32    1 o  297.792   20.201   69.025   9.1533   69.025   9.1533   0.0000   0.0000  297.792   20.201  ?   ?  0.000000 20.20085 
1 1 1   10   32    2 o  256.176   21.975   51.331   8.5331   51.331   8.5331   0.0000   0.0000  256.176   21.975  ?   ?  0.000000 21.97477 
1 1 1   10   32    3 o  491.076   15.687  185.973   11.791  185.973   11.791   0.0000   0.0000  491.076   15.687  ?   ?  0.000000 15.68667 
1 1 1   10   32    4 o  541.044   9.4893  224.662   7.8584  229.904   9.6734  214.490   13.476  546.947   11.555  527.096   16.703 19.85040 20.31051 
1 1 1   10   32    5 o   68.085   26.914   2.0705   4.1516   0.9396   5.1420   4.1882   7.0363   69.624   29.031   90.215   35.227 -20.59078 45.64857 
1 1 1   10   32    6 o  279.618   12.177   60.122   5.2117   61.269   6.4270   57.919   8.9061  281.544   14.968  272.266   21.547 9.277954 26.23554 
1 1 1   10   32    7 o  117.551   30.548   11.296   5.5466   13.430   8.3472   9.6092   7.4223  128.541   39.011  111.770   37.135 16.77058 53.85992 
1 1 1   10   32    8 o  461.716   12.120  163.946   8.5657  169.409   12.528  159.150   11.738  468.121   17.484  453.876   16.896 14.24454 24.31429 
1 1 1   10   32    9 o  149.302   25.489   17.889   5.6159   21.289   8.1425   14.804   7.7557  160.842   34.131  133.867   36.738 26.97525 50.14582 
1 1 1   10   32   10 o  647.377   11.740  322.272   11.633  326.582   17.015  318.488   15.942  649.962   17.103  642.182   16.219 7.780579 23.57014 
1 1 1   10   32   11 o  459.526   12.432  162.494   8.7445  146.444   12.314  178.820   12.420  434.803   18.503  480.955   16.871 -46.15250 25.03981 
1 1 1   10   32   12 o  551.244   9.5337  233.327   8.0440  224.637   9.6960  252.513   14.407  540.424   11.722  571.588   16.468 -31.16345 20.21333 
1 1 1   10   32   13 o  351.956   11.186   95.248   6.0260   92.928   7.2326  100.516   10.897  347.252   13.607  359.215   19.896 -11.96280 24.10424 
1 1 1   10   32   14 o  214.357   18.633   35.895   6.0528   38.315   8.1866   32.978   8.9894  219.868   24.757  202.149   29.960 17.71974 38.86524 
1 1 1   10   32   15 o  202.151   19.919   32.062   6.0832   40.837   8.2406   21.553   9.0179  227.202   24.062  160.417   37.414 66.78526 44.48359 
1 1 1   10   32   16 f  309.597   14.661   74.008   6.9473   74.060   9.4253   73.947   10.280  307.889   20.111  307.034   22.021 0.8551331 29.82219 
1 1 1   10   32   17 o  222.557   18.967   38.759   6.3995   45.242   8.7020   31.124   9.4439  239.044   24.113  194.895   32.824 44.14868 40.72905 
1 1 1   10   32   18 o  113.450   35.180   10.448   6.7434   26.635   10.082  -2.6569   9.0712  177.876   38.173   80.878   36.076 96.99822 52.52276 
1 1 1   10   32   19 o   93.626   34.554   5.8575   6.5388   12.037   9.2794  -0.2375   9.2154  122.999   41.528   86.653   37.571 36.34602 56.00135 
1 1 1   10   32   20 o   63.525   27.643  -0.5853   5.0251  -2.2504   5.9023   3.8013   9.5801   64.523   28.918   97.924   40.109 -33.40095 49.44620 
1 1 1   10   32   21 o  272.990   14.405   57.774   5.9977   57.244   7.1524   59.029   11.008  270.958   17.337  271.761   26.814 -0.8028870 31.93067 
1 1 1   10   32   22 o  204.618   18.677   32.865   5.7849   32.826   6.8977   32.959   10.622  203.348   22.541  198.432   36.309 4.916016 42.73668 
1 1 1   10   32   23 o  147.195   21.800   17.331   4.7630   13.319   6.5417   21.856   6.9484  126.029   33.381  163.351   28.845 -37.32229 44.11730 
1 1 1   10   32   24 o   84.090   29.288   5.1822   4.6248  -1.8860   6.3483   13.176   6.7514   67.896   30.240  125.163   34.247 -57.26704 45.68750 
1 1 1   10   32   25 o  174.814   18.775   24.109   4.9451   19.268   6.7684   29.651   7.2426  152.497   30.066  191.942   25.266 -39.44455 39.27254 
1 1 1   10   32   26 o   74.158   30.076   2.1811   5.3216  -3.9553   6.6923   12.734   8.7760   65.095   29.809  123.790   40.344 -58.69460 50.16203 
1 1 1   10   32   27 o  105.027   31.309   9.1110   5.4120   7.6228   6.9315   11.435   8.6621  100.842   35.795  118.575   40.122 -17.73255 53.76875 
1 1 1   10   32   28 o   94.247   30.426   7.0955   4.9983   8.0165   7.0182   6.1475   7.1203  102.445   36.055   95.614   35.904 6.831345 50.88298 
1 1 1   10   32   29 o  221.459   16.290   38.382   5.4831   45.699   7.7080   30.886   7.8015  239.996   21.201  194.764   26.887 45.23193 34.23997 
1 1 1   10   32   30 o  390.142   13.864  118.022   8.2791  120.072   9.8899  113.221   15.135  392.471   16.463  374.884   26.548 17.58691 31.23865 
1 1 1   10   32   31 o  195.101   23.785   30.691   6.9557   26.868   7.9870   42.691   14.152  179.685   30.105  219.038   43.742 -39.35304 53.10077 
1 1 1   10   32   32 o  472.957   10.989  172.728   7.9550  186.165   11.430  160.105   11.078  488.987   15.271  453.109   15.974 35.87811 22.09902 
1 1 1   10   32   33 f  248.363   17.307   48.519   6.5380   43.332   9.0133   54.280   9.4981  230.777   25.968  259.531   24.189 -28.75409 35.48816 
1 1 1   10   32   34 o  157.053   26.366   20.394   6.1134   29.231   8.8638   12.378   8.4429  185.575   32.383  119.997   39.594 65.57806 51.15017 
1 1 1   10   32   35 o  259.103   25.132   54.610   9.8418   0.0000   0.0000   54.610   9.8418  ?   ?   259.103   25.132 0.000000 25.13210 
1 1 1   10   32   36 o  239.421   26.409   47.145   9.5168   0.0000   0.0000   47.145   9.5168  ?   ?   239.421   26.409 0.000000 26.40869 
1 1 1   10   32   37 o  184.092   23.369   27.696   6.4365   24.006   9.1839   31.259   9.0235  163.462   37.503  190.785   32.035 -27.32315 49.32271 
1 1 1   10   32   38 o   90.070   33.625   5.9873   6.2270   3.9357   9.1346   7.7685   8.5112   92.366   38.619  101.706   39.006 -9.339920 54.88992 
1 1 1   10   32   39 o   63.259   29.307  -4.1818   6.7409   3.8192   11.536  -8.3298   8.3064   98.529   42.378   64.373   30.650 34.15618 52.30038 
1 1 1   10   32   40 o  107.137   24.601   9.7538   3.9490   10.030   4.4942   8.8167   8.2721  107.761   27.235  103.693   38.746 4.067093 47.36039 
1 1 1   10   32   41 f   81.552   27.149   5.4664   3.9662   7.3994   4.5883  -0.2477   7.8888   92.737   29.062   76.419   33.891 16.31857 44.64528 
1 1 1   10   32   42 o  142.607   21.645   16.910   4.5762   19.430   5.0541   5.4380   10.782  152.699   22.280   97.450   41.414 55.24867 47.02673 
1 1 1   10   32   43 o   94.977   27.465   7.9660   4.2192   9.7530   4.8936   2.7900   8.3285  104.119   29.410   83.738   36.011 20.38083 46.49489 
1 1 1   10   32   44 o  197.787   15.719   31.381   4.7196   20.869   9.0989   35.250   5.5202  143.512   39.951  208.602   17.449 -65.09023 43.59569 
1 1 1   10   32   45 o  142.842   21.808   17.258   4.6169   18.548   5.3738   13.621   9.0223  146.169   24.912  115.192   40.843 30.97691 47.84154 
1 1 1   10   33    0 o  552.821   15.295  235.384   12.919  235.384   12.919  235.384   12.919  552.821   15.295  552.821   15.295 0.000000 0.000000 
1 1 1   10   33    1 o  245.458   15.331   46.667   5.7311   45.976   7.9753   47.406   8.2412  242.167   21.748  245.829   22.140 -3.661926 31.03455 
1 1 1   10   33    2 o  181.893   19.885   25.966   5.4461   34.776   8.0868   18.654   7.3672  209.257   25.794  150.553   32.890 58.70473 41.79807 
1 1 1   10   33    3 o   93.482   31.292   6.5844   5.2684   8.0789   7.5616   5.1745   7.3446  105.848   37.406   94.590   36.244 11.25770 52.08517 
1 1 1   10   33    4 o  388.246   10.594  115.824   6.2957  122.190   8.0631  105.880   10.077  398.329   13.225  369.859   17.800 28.47012 22.17493 
1 1 1   10   33    5 o  241.721   17.552   45.445   6.4497   41.853   9.3720   48.677   8.8897  229.316   27.233  248.638   23.643 -19.32164 36.06477 
1 1 1   10   33    6 o  351.862   14.157   95.449   7.6248   89.062   11.464  100.516   10.211  337.361   22.327  359.663   18.611 -22.30154 29.06678 
1 1 1   10   33    7 o   79.586   34.039   0.2516   7.3686   0.0000   0.0000   0.2516   7.3686  ?   ?    79.586   34.039 0.000000 34.03907 
1 1 1   10   33    8 o  392.331   18.576  119.339   11.155   0.0000   0.0000  119.339   11.155  ?   ?   392.331   18.576 0.000000 18.57558 
1 1 1   10   33    9 o  152.633   35.873   19.407   8.2390   0.0000   0.0000   19.407   8.2390  ?   ?   152.633   35.873 0.000000 35.87252 
1 1 1   10   33   10 o  234.984   25.159   43.764   8.9083   0.0000   0.0000   43.764   8.9083  ?   ?   234.984   25.159 0.000000 25.15878 
1 1 1   10   33   11 o  164.852   34.427   22.513   8.4066   0.0000   0.0000   22.513   8.4066  ?   ?   164.852   34.427 0.000000 34.42707 
1 1 1   10   33   12 f  354.086   19.728   97.786   10.649   0.0000   0.0000   97.786   10.649  ?   ?   354.086   19.728 0.000000 19.72772 
1 1 1   10   33   13 f  326.797   12.057   82.239   6.0309   75.780   7.2571   96.657   10.843  313.145   15.141  351.777   20.222 -38.63266 25.26210 
1 1 1   10   33   14 o   89.690   29.904   6.1219   4.8116   6.7136   5.7090   4.6710   8.9400   94.848   32.568   98.296   39.290 -3.447578 51.03334 
1 1 1   10   33   15 o  239.799   15.683   44.681   5.7247   38.671   6.9693   57.147   10.038  221.720   20.778  268.547   24.697 -46.82654 32.27465 
1 1 1   10   33   16 o  225.034   20.154   39.785   6.8685   43.877   9.7001   35.670   9.7270  233.873   27.631  209.173   31.347 24.69977 41.78627 
1 1 1   10   33   17 o  288.254   17.774   64.782   7.8036   59.585   11.063   69.928   11.009  273.212   26.799  297.163   24.420 -23.95074 36.25689 
1 1 1   10   33   18 o  383.751   11.828  113.475   6.9477  115.558   8.4646  109.174   12.163  386.650   14.303  372.970   21.395 13.68063 25.73543 
1 1 1   10   33   19 o   78.439   30.310   3.4167   5.1668   0.5530   5.9983   11.652   10.172   72.683   30.889  122.714   43.382 -50.03094 53.25566 
1 1 1   10   33   20 o  506.533   10.804  197.538   8.3767  200.589   10.135  190.961   14.879  509.754   12.990  494.639   19.653 15.11508 23.55805 
1 1 1   10   33   21 o  297.869   14.158   68.626   6.4549   72.931   7.7255   58.672   11.748  306.051   16.553  269.625   28.918 36.42685 33.32046 
1 1 1   10   33   22 o  109.561   31.325   9.9439   5.5168   9.6429   6.5104   10.710   10.390  108.943   34.678  119.567   43.644 -10.62399 55.74400 
1 1 1   10   33   23 o   58.969   27.063  -3.5788   5.5576  -9.9006   6.4407   14.851   10.997   53.286   25.784  133.572   45.208 -80.28607 52.04370 
1 1 1   10   33   24 o  225.127   15.548   39.514   5.3250   45.979   7.3593   32.411   7.7145  241.502   20.091  200.508   25.730 40.99422 32.64514 
1 1 1   10   33   25 o  375.469   12.625  108.934   7.2557  101.205   8.8925  124.327   12.550  360.825   16.101  397.428   20.702 -36.60300 26.22659 
1 1 1   10   33   26 o  490.282   9.9792  185.112   7.4888  209.329   10.768  162.427   10.422  520.019   13.529  457.527   14.882 62.49149 20.11201 
1 1 1   10   33   27 o   71.377   29.027   1.9776   4.9730   4.8861   6.9347  -1.1017   7.1354   90.394   35.062   73.731   32.488 16.66290 47.79995 
1 1 1   10   33   28 o  339.894   14.837   89.734   7.7192   89.397   9.0913   90.605   14.612  337.798   17.644  333.730   28.890 4.068512 33.85189 
1 1 1   10   33   29 o  245.569   19.564   47.666   7.2926   49.031   8.5028   43.867   14.183  247.757   22.673  222.667   43.171 25.08981 48.76307 
1 1 1   10   33   30 o  476.667   11.057  175.444   8.0674  178.890   11.425  172.016   11.393  479.240   15.575  469.800   15.844 9.440186 22.21736 
1 1 1   10   33   31 o  291.849   15.124   66.488   6.7331   70.412   9.4183   62.385   9.6292  297.814   20.792  279.265   22.724 18.54877 30.80074 
1 1 1   10   33   32 o  157.299   25.719   20.367   5.9783   14.472   8.3610   26.535   8.5514  128.370   39.062  176.520   32.859 -48.15048 51.04482 
1 1 1   10   33   33 o  244.109   17.130   46.948   6.3600   47.432   9.0008   46.465   8.9882  241.743   24.671  239.108   24.925 2.635910 35.07023 
1 1 1   10   33   34 o  252.474   21.538   51.133   8.2436   63.698   15.609   46.273   9.7080  269.024   39.047  236.865   27.275 32.15874 47.62957 
1 1 1   10   33   35 o  140.801   30.371   17.027   6.3531   15.825   9.3646   18.052   8.6475  131.767   41.554  141.117   38.820 -9.349564 56.86558 
1 1 1   10   33   36 o  284.230   18.420   64.226   7.9706   66.963   13.504   62.762   9.8741  280.087   32.077  277.793   23.441 2.293701 39.72925 
1 1 1   10   33   37 o  133.660   34.817   16.037   7.1940   29.496   11.788   8.0499   9.0811  175.523   43.971  103.538   40.134 71.98555 59.53260 
1 1 1   10   33   38 o  181.932   25.566   27.650   6.9230   17.084   10.152   36.833   9.4649  133.621   43.385  206.734   30.856 -73.11330 53.23842 
1 1 1   10   33   39 o  260.592   17.669   54.204   7.0061   55.423   10.402   53.193   9.4785  256.816   26.860  253.223   24.772 3.592819 36.53920 
1 1 1   10   33   40 o   84.894   34.673   4.1512   7.1340   4.1468   9.4421   4.1571   10.890   91.764   38.865   95.628   41.152 -3.864494 56.60358 
1 1 1   10   33   41 o  245.665   20.228   49.281   7.5385   44.957   9.5933   56.262   12.189  228.197   28.056  250.927   32.500 -22.73007 42.93494 
1 1 1   10   33   42 o   90.839   33.354   6.9416   6.0811   3.7173   8.9953   9.6553   8.2525   87.750   37.572  103.367   38.685 -15.61647 53.92775 
1 1 1   10   33   43 o  157.571   26.841   21.759   6.2415   23.954   8.8205   19.558   8.8332  156.543   37.336  138.862   39.615 17.68047 54.43623 
1 1 1   10   33   44 f  118.381   23.956   12.177   4.1917   17.124   4.9194  -0.9320   8.0080  141.146   23.604   73.055   33.127 68.09138 40.67583 
1 1 1   10   34    0 o  373.548   18.092  108.233   10.289  108.233   10.289  108.233   10.289  373.548   18.092  373.548   18.092 0.000000 0.000000 
1 1 1   10   34    1 o  131.960   26.655   14.165   5.1985   7.4662   7.1717   21.581   7.5462  102.148   36.394  162.217   31.528 -60.06879 48.15092 
1 1 1   10   34    2 o  457.209   11.735  160.869   8.2127  174.020   11.645  147.856   11.584  474.396   16.037  436.908   17.322 37.48816 23.60627 
1 1 1   10   34    3 o  210.940   18.080   34.746   5.7810   34.832   8.2296   34.663   8.1226  208.924   26.319  208.503   26.018 0.4212494 37.00819 
1 1 1   10   34    4 o  231.872   13.882   41.616   4.9042   43.545   6.2345   38.484   7.9429  236.473   17.346  220.480   23.920 15.99255 29.54717 
1 1 1   10   34    5 o  315.596   11.984   76.678   5.7889   76.371   7.1554   77.260   9.8488  314.465   14.866  314.354   20.582 0.1107788 25.38964 
1 1 1   10   34    6 o  379.011   10.780  110.471   6.2536  110.412   7.6783  110.586   10.778  378.442   13.256  377.393   18.658 1.049316 22.88754 
1 1 1   10   34    7 o  170.957   24.126   23.333   6.1377   20.009   9.0498   26.164   8.3522  154.033   38.492  178.790   31.680 -24.75719 49.85262 
1 1 1   10   34    8 o  173.596   23.604   24.014   6.1093   27.830   9.2261   21.035   8.1528  183.604   34.085  158.985   34.494 24.61842 48.49345 
1 1 1   10   34    9 o  582.933   12.103  261.732   10.799  251.289   15.602  271.336   14.963  569.029   17.913  591.907   16.515 -22.87787 24.36474 
1 1 1   10   34   10 o  338.618   15.159   88.653   7.8568   89.871   11.415   87.556   10.830  338.313   22.167  334.241   21.280 4.072601 30.72802 
1 1 1   10   34   11 o  323.148   15.047   80.742   7.4424   80.093   10.820   81.326   10.253  319.184   22.287  322.151   20.907 -2.967773 30.55810 
1 1 1   10   34   12 o  366.180   14.096  103.565   7.9008  100.045   11.577  106.633   10.809  357.235   21.269  369.664   19.169 -12.42914 28.63280 
1 1 1   10   34   13 o  192.688   23.144   29.515   6.6893   25.402  10.0000   32.846   8.9991  173.155   38.704  200.959   30.190 -27.80391 49.08553 
1 1 1   10   34   14 o  224.341   20.268   39.578   6.8846   41.863   10.031   37.543   9.4658  227.516   29.500  215.284   29.502 12.23224 41.72082 
1 1 1   10   34   15 o  515.719   10.499  204.647   8.2878  193.986   9.9099  229.454   15.117  501.417   12.912  543.176   18.182 -41.75943 22.30057 
1 1 1   10   34   16 o  165.216   22.324   21.765   5.5008   28.821   6.6562   6.5646   9.7699  190.178   23.357  106.022   41.480 84.15592 47.60361 
1 1 1   10   34   17 o  390.596   12.042  117.629   7.1993  118.261   8.6785  116.233   12.892  390.996   14.501  384.388   22.003 6.608093 26.35213 
1 1 1   10   34   18 o  278.669   15.104   60.317   6.4184   68.205   7.7651   43.303   11.404  295.744   17.228  229.215   33.492 66.52867 37.66384 
1 1 1   10   34   19 o  207.631   19.463   33.946   6.1134   29.639   7.2395   44.649   11.413  192.037   25.241  232.908   32.933 -40.87167 41.49332 
1 1 1   10   34   20 o  528.636   11.146  215.347   9.0184  205.404   10.708  239.619   16.729  515.436   13.572  553.594   19.743 -38.15845 23.95811 
1 1 1   10   34   21 o  157.398   25.094   20.071   5.8425   17.837   6.8204   26.230   11.324  146.098   31.432  173.073   42.949 -26.97572 53.22207 
1 1 1   10   34   22 o  256.238   16.602   51.269   6.4766   57.126   7.5675   35.237   12.521  269.926   18.427  201.410   41.977 68.51543 45.84296 
1 1 1   10   34   23 o  176.778   26.663   25.426   6.9903   25.426   6.9903   0.0000   0.0000  176.778   26.663  ?   ?  0.000000 26.66339 
1 1 1   10   34   24 o  431.456   12.291  143.820   8.1167  137.941   9.4488  160.374   15.854  421.715   14.638  449.741   23.109 -28.02658 27.35546 
1 1 1   10   34   25 o  474.206   11.921  173.694   8.6528  185.218   10.478  148.985   15.343  488.831   14.004  433.095   23.230 55.73648 27.12459 
1 1 1   10   34   26 o  143.402   29.459   17.182   6.2497   21.403   7.3718   6.3952   11.784  159.716   31.274  109.618   44.644 50.09747 54.50779 
1 1 1   10   34   27 o  427.983   10.980  141.364   7.1926  146.359   10.180  136.384   10.164  433.760   15.333  418.479   15.868 15.28168 22.06537 
1 1 1   10   34   28 o   75.594   30.586   2.4830   5.4897  -4.8777   7.5911   10.553   7.9485   67.818   31.307  113.308   38.434 -45.48972 49.57090 
1 1 1   10   34   29 o  100.390   32.028   8.2878   5.5508   13.558   7.8335   2.9727   7.8667  125.118   37.751   87.331   36.119 37.78724 52.24675 
1 1 1   10   34   30 o  202.424   19.559   32.579   5.9845   26.475   8.3269   39.100   8.6069  176.864   31.934  218.856   26.215 -41.99184 41.31584 
1 1 1   10   34   31 o   83.132   31.886   4.3756   5.6878   5.6086   7.9335   3.0715   8.1588   94.996   37.316   88.261   36.666 6.735641 52.31493 
1 1 1   10   34   32 o  130.411   35.190   14.937   7.1869   25.835   13.921   10.977   8.3918  163.189   50.536  114.142   39.469 49.04646 64.12257 
1 1 1   10   34   33 o  269.012   19.777   57.688   8.0861   73.505   16.163   52.407   9.3389  290.160   37.253  253.755   24.343 36.40506 44.50106 
1 1 1   10   34   34 o  149.608   28.381   18.986   6.2614   24.485   8.7511   13.217   8.9626  166.290   35.464  121.679   40.814 44.61144 54.06931 
1 1 1   10   34   35 o  247.115   19.780   48.956   7.4187   56.385   12.305   44.713   9.2988  256.402   32.054  231.880   26.686 24.52228 41.70900 
1 1 1   10   34   36 o   86.142   33.384   4.9803   6.2826  -2.3540   8.9113   12.228   8.8589   77.205   34.983  116.884   40.544 -39.67916 53.55025 
1 1 1   10   34   37 o   80.342   32.376   3.5832   6.1247   10.560   9.3957  -1.5723   8.0764  111.039   41.333   74.859   33.667 36.18097 53.30885 
1 1 1   10   34   38 o   76.653   32.821   1.5578   6.8644  -8.1636   13.280   5.1019   8.0186   83.503   39.464   90.739   36.876 -7.235878 54.01126 
1 1 1   10   34   39 o  111.553   39.359   11.519   8.3686  -2.8225   12.984   21.713   10.946   88.713   40.949  145.447   44.775 -56.73402 60.67631 
1 1 1   10   34   40 o  225.951   19.000   41.491   6.5102   39.443   9.5564   43.265   8.8929  211.149   30.449  224.980   26.322 -13.83119 40.24921 
1 1 1   10   34   41 o  181.151   17.449   26.590   4.7785   31.575   5.7339   15.254   8.6455  196.335   19.331  123.201   40.038 73.13338 44.46013 
1 1 1   10   34   42 o  131.548   31.040   15.969   6.1491   19.371   8.8804   12.835   8.5230  137.729   39.852  113.354   39.743 24.37471 56.28186 
1 1 1   10   35    0 o  276.729   21.348   60.234   8.9187   60.234   8.9187   60.234   8.9187  276.729   21.348  276.729   21.348 0.000000 0.000000 
1 1 1   10   35    1 o  446.901   12.031  153.850   8.2294  155.197   11.772  152.562   11.509  447.340   17.192  443.608   16.950 3.732330 24.14286 
1 1 1   10   35    2 o  319.083   13.798   78.592   6.7389   90.492   9.4835   66.455   9.5776  340.836   18.245  290.842   21.670 49.99374 28.32743 
1 1 1   10   35    3 o   99.971   31.234   7.9846   5.3043   6.6436   7.0857   9.6939   8.0000   98.415   36.024  112.240   38.552 -13.82500 52.76359 
1 1 1   10   35    4 o  216.109   15.532   36.316   5.1034   36.353   6.4191   36.253   8.4136  215.191   19.707  212.820   26.395 2.371674 32.94052 
1 1 1   10   35    5 o  199.816   16.089   31.112   4.8791   35.614   6.0233   22.522   8.3210  213.246   18.641  164.484   34.167 48.76176 38.92177 
1 1 1   10   35    6 o  380.113   11.005  111.199   6.4029  108.637   7.8649  116.233   11.026  375.135   13.697  386.613   18.632 -11.47794 23.12538 
1 1 1   10   35    7 o  441.389   13.488  150.371   9.1126  147.103   13.352  153.221   12.468  434.341   20.083  443.961   18.348 -9.620026 27.20260 
1 1 1   10   35    8 o  372.372   14.112  107.118   8.0432  122.068   12.536   96.657   10.486  394.836   20.817  351.703   19.556 43.13339 28.56178 
1 1 1   10   35    9 o  166.394   24.920   22.251   6.1515   22.673   9.0716   21.891   8.3698  163.924   37.029  161.747   34.836 2.177322 50.84016 
1 1 1   10   35   10 o  123.833   32.232   12.772   6.1687   13.572   9.1062   12.094   8.3859  128.235   41.034  121.848   39.418 6.386902 56.89950 
1 1 1   10   35   11 o   83.162   32.858   3.4479   6.1849   5.9058   9.1587   1.3873   8.3859  102.259   40.118   86.743   36.676 15.51629 54.35585 
1 1 1   10   35   12 o  169.305   26.005   23.142   6.5236   16.800   9.6503   28.479   8.8527  140.516   41.790  185.853   32.292 -45.33696 52.81216 
1 1 1   10   35   13 o  203.885   23.107   33.058   7.0838   36.630   10.677   30.249   9.4680  210.309   34.353  191.032   33.608 19.27626 48.05838 
1 1 1   10   35   14 o  126.613   28.380   13.248   5.3639   9.3666   6.4633   21.835   9.6141  107.822   34.577  159.571   39.560 -51.74907 52.54086 
1 1 1   10   35   15 o  132.234   27.266   14.373   5.3353   18.451   6.4224   5.2903   9.5841  149.668   29.083  101.548   40.649 48.11987 49.98145 
1 1 1   10   35   16 o  350.847   12.736   95.033   6.8396   90.964   8.1582  104.657   12.547  342.520   15.561  364.140   22.624 -21.61990 27.45894 
1 1 1   10   35   17 o  475.385   11.276  174.172   8.2047  172.651   9.8194  177.691   14.934  472.562   13.576  476.346   20.482 -3.783936 24.57262 
1 1 1   10   35   18 o  252.191   16.329   49.609   6.2693   45.792   7.3320   59.989   12.091  241.092   20.050  271.957   29.520 -30.86438 35.68566 
1 1 1   10   35   19 o  583.928   10.991  262.792   9.8230  260.211   11.774  268.701   17.817  580.128   13.260  585.818   19.870 -5.690002 23.88822 
1 1 1   10   35   20 o  149.064   31.392   18.593   6.9362   18.593   6.9362   0.0000   0.0000  149.064   31.392  ?   ?  0.000000 31.39225 
1 1 1   10   35   21 o  436.568   14.310  147.707   9.5620  147.707   9.5620   0.0000   0.0000  436.568   14.310  ?   ?  0.000000 14.30954 
1 1 1   10   35   22 o  248.819   17.242   48.496   6.5262   45.675   7.5605   56.742   12.926  240.195   20.769  261.733   33.000 -21.53865 38.99152 
1 1 1   10   35   23 o  319.234   14.097   79.013   6.8883   73.108   8.0962   94.492   13.108  305.586   17.381  343.530   25.103 -37.94379 30.53287 
1 1 1   10   35   24 o  211.323   20.347   35.429   6.5002   36.626   7.7000   32.461   12.126  213.465   23.981  191.600   42.463 21.86490 48.76734 
1 1 1   10   35   25 o   97.039   33.678   7.2858   6.1128   7.0448   7.1377   7.9490   11.840   98.546   36.143  113.307   45.242 -14.76048 57.90643 
1 1 1   10   35   26 o  163.656   22.576   21.602   5.5046   15.961   7.5891   27.865   7.9962  135.730   35.956  183.257   29.509 -47.52699 46.51493 
1 1 1   10   35   27 o  371.898   12.099  107.017   6.8872  117.757   9.7402   96.277   9.7397  388.352   16.386  349.881   18.250 38.47104 24.52674 
1 1 1   10   35   28 o  298.653   14.061   69.327   6.4278   62.785   8.8462   76.644   9.3558  281.017   20.712  311.136   19.748 -30.11905 28.61767 
1 1 1   10   35   29 o   96.727   31.860   7.6219   5.4678   1.8266   7.3686   14.723   8.1566   81.670   34.447  129.215   38.417 -47.54476 51.59942 
1 1 1   10   35   30 o  218.359   18.251   37.790   6.0441   46.247   8.4505   28.932   8.6484  239.195   23.380  184.496   31.772 54.69891 39.44702 
1 1 1   10   35   31 o  110.421   35.801   10.453   6.9145   3.9839   12.485   13.314   8.3043  103.509   44.290  122.632   39.179 -19.12334 59.13254 
1 1 1   10   35   32 o  131.609   33.571   15.251   6.7844   22.428   10.964   10.798   8.6363  153.999   44.200  112.847   39.966 41.15281 59.58956 
1 1 1   10   35   33 o  309.993   16.703   75.891   7.8962   66.427   12.884   81.585   9.9931  280.073   30.549  318.927   20.581 -38.85425 36.83493 
1 1 1   10   35   34 o  114.338   33.687   11.577   6.2946   18.367   8.9417   4.9063   8.8625  140.505   39.779   93.895   38.532 46.61002 55.38088 
1 1 1   10   35   35 f  218.040   19.888   38.325   6.5642   36.158   9.2353   40.537   9.3318  205.178   30.321  218.698   28.559 -13.52016 41.65305 
1 1 1   10   35   36 o  243.549   26.490   49.799   9.7158   0.0000   0.0000   49.799   9.7158  ?   ?   243.549   26.490 0.000000 26.48989 
1 1 1   10   35   37 o  174.360   24.917   25.608   6.4606   23.547   9.2779   27.548   9.0017  157.306   38.780  173.675   35.070 -16.36884 52.28592 
1 1 1   10   35   38 f  152.445   31.561   20.915   7.1217   17.875   8.9004   26.324   11.874  134.666   40.152  158.137   46.175 -23.47113 61.19079 
1 1 1   10   35   39 o  149.563   31.325   20.282   6.9413   18.174   12.527   21.216   8.3384  129.584   47.827  148.659   36.834 -19.07518 60.36654 
1 1 1   10   35   40 o   87.903   34.400   5.9496   6.7211   14.484   11.760   1.8096   8.1906  118.342   45.727   80.342   35.119 38.00015 57.65693 
1 1 1   10   36    0 o  188.639   33.884   30.352   8.8446   30.352   8.8446   30.352   8.8446  188.639   33.884  188.639   33.884 0.000000 0.000000 
1 1 1   10   36    1 o  140.407   29.141   16.236   6.0575   20.743   8.5748   11.746   8.5585  156.783   36.427  120.689   39.866 36.09414 54.00183 
1 1 1   10   36    2 o  434.874   12.450  145.829   8.2869  136.468   11.282  156.797   12.212  419.120   17.587  449.186   17.762 -30.06683 24.99561 
1 1 1   10   36    3 o  302.447   14.349   70.714   6.6428   64.112   9.0940   78.267   9.7267  285.657   20.945  316.033   20.214 -30.37552 29.10804 
1 1 1   10   36    4 o  421.546   10.604  136.752   6.8423  130.299   8.3715  149.738   11.876  410.827   13.313  438.957   17.675 -28.13019 22.12794 
1 1 1   10   36    5 o   46.391   22.317  -6.7337   4.6570  -7.1140   5.7869  -6.0347   7.8454   53.618   25.544   67.883   31.508 -14.26463 40.56238 
1 1 1   10   36    6 o  213.823   16.358   35.658   5.3130   34.650   6.5714   37.562   9.0284  209.567   20.759  215.756   27.999 -6.188507 34.85513 
1 1 1   10   36    7 o  113.581   28.934   10.675   5.0443   11.253   6.1181   9.4492   8.9141  116.388   32.888  112.805   40.534 3.582619 52.19757 
1 1 1   10   36    8 o  122.561   32.704   12.551   6.2491   13.223   9.6558   12.066   8.1973  127.199   42.360  121.271   38.945 5.928314 57.54247 
1 1 1   10   36    9 f  333.137   15.944   86.056   8.1302   81.918   11.629   90.012   11.371  321.673   23.788  338.022   22.100 -16.34955 32.46906 
1 1 1   10   36   10 o  128.620   32.461   13.856   6.3908   9.5998   9.3355   17.609   8.7671  114.068   41.411  143.562   38.921 -29.49390 56.83035 
1 1 1   10   36   11 o  131.661   32.002   14.509   6.3861   22.390   9.3119   7.5114   8.7747  161.940   38.188  105.756   39.829 56.18407 55.17906 
1 1 1   10   36   12 o  247.872   19.107   48.216   7.1931   61.006   10.852   38.192   9.6067  276.259   25.969  216.542   29.772 59.71721 39.50610 
1 1 1   10   36   13 o  207.132   22.290   34.087   6.9555   32.075   10.041   35.943   9.6444  195.923   34.755  209.332   31.041 -13.40916 46.59840 
1 1 1   10   36   14 o  141.981   32.781   16.945   6.9798   16.414   10.326   17.393   9.4712  138.496   43.630  142.057   41.171 -3.560791 59.98822 
1 1 1   10   36   15 o  185.532   20.648   27.293   5.7643   25.174   6.9293   32.056   10.387  176.129   26.526  194.987   36.132 -18.85796 44.82385 
1 1 1   10   36   16 o  275.010   15.214   58.837   6.3793   56.968   7.6394   63.142   11.595  269.502   18.634  279.986   27.408 -10.48370 33.14264 
1 1 1   10   36   17 o   71.378   29.831   1.2022   5.4470   0.0402   6.5658   3.7675   9.7558   73.906   31.878   97.513   40.267 -23.60755 51.35849 
1 1 1   10   36   18 o  114.064   34.759   10.855   6.6171   10.855   6.6171   0.0000   0.0000  114.064   34.759  ?   ?  0.000000 34.75950 
1 1 1   10   36   19 o  296.884   17.850   69.045   8.0737   69.045   8.0737   0.0000   0.0000  296.884   17.850  ?   ?  0.000000 17.85012 
1 1 1   10   36   20 o  318.470   14.823   78.727   7.2257   69.764   8.3781  104.751   14.276  298.114   18.451  361.319   25.987 -63.20483 31.87125 
1 1 1   10   36   21 o  310.016   15.205   74.686   7.2149   71.105   8.5641   83.443   13.392  300.792   18.694  321.211   27.504 -20.41934 33.25515 
1 1 1   10   36   22 o  388.830   13.148  117.078   7.8250  117.492   9.3949  116.139   14.139  388.509   15.799  381.197   24.360 7.311646 29.03455 
1 1 1   10   36   23 o  219.578   20.421   38.280   6.7847   35.756   7.9461   45.072   13.034  210.197   25.200  228.750   38.601 -18.55370 46.09849 
1 1 1   10   36   24 o  439.706   12.828  149.744   8.6334  145.181   10.160  161.597   16.375  431.839   15.371  449.696   23.875 -17.85657 28.39535 
1 1 1   10   36   25 o  111.307   34.767   10.455   6.5724   12.290   7.5893   4.9533   13.144  119.712   37.355  109.108   46.012 10.60358 59.26639 
1 1 1   10   36   26 o  115.935   34.687   11.522   6.6339   10.180   7.6499   15.595   13.322  110.939   37.705  134.671   49.380 -23.73222 62.12928 
1 1 1   10   36   27 o  178.124   21.463   25.528   5.7339   21.788   7.8105   29.900   8.4446  159.223   33.127  188.782   30.246 -29.55917 44.85735 
1 1 1   10   36   28 o   62.718   28.087  -1.7057   5.5574  -1.2957   7.6116  -2.1739   8.1330   74.712   33.204   75.278   33.826 -0.5655670 47.40003 
1 1 1   10   36   29 o  299.256   17.183   70.619   7.8377   76.911   14.696   68.118   9.2655  301.538   32.345  291.859   20.879 9.678864 38.49855 
1 1 1   10   36   30 o  101.496   38.279   7.7659   8.1111   0.0000   0.0000   7.7659   8.1111  ?   ?   101.496   38.279 0.000000 38.27880 
1 1 1   10   36   31 o  193.958   23.629   30.816   6.8699   42.804   11.499   24.162   8.5667  221.062   35.163  165.184   34.972 55.87859 49.59307 
1 1 1   10   36   32 o   73.618   30.855   1.7687   5.8517   6.0013   8.4479  -2.1352   8.1133   95.970   38.248   74.352   33.563 21.61730 50.88603 
1 1 1   10   36   33 o  119.776   32.458   12.730   6.0989   30.999   9.3036  -1.0368   8.0764  187.620   33.632   76.230   34.019 111.3899 47.83770 
1 1 1   10   36   34 o   98.479   33.863   8.2486   6.1733   16.030   9.2096   1.9001   8.3188  129.799   41.238   83.526   35.956 46.27267 54.71176 
1 1 1   10   36   35 o  115.845   33.939   12.230   6.4053   8.4219   9.1234   15.931   8.9949  102.792   40.120  128.529   40.746 -25.73693 57.18259 
1 1 1   10   36   36 o  313.263   17.186   78.516   8.2092   80.573   10.471   75.236   13.224  313.086   21.990  294.306   29.764 18.78024 37.00641 
1 1 1   10   36   37 o  106.777   33.579   10.495   6.1193   11.485   8.9100   9.6111   8.4189  110.536   40.406  103.933   39.039 6.603035 56.18443 
1 1 1   10   36   38 o  213.674   20.009   37.504   6.4680   46.722   9.4681   29.439   8.8567  232.372   27.131  178.570   33.638 53.80223 43.21566 
1 1 1   10   36   39 o  132.948   29.810   16.052   5.9165   23.216   8.8518   10.267   7.9543  153.585   37.889  104.481   38.180 49.10380 53.78906 
1 1 1   10   37    0 o   86.115   45.838   8.7142   8.1836   8.7142   8.1836   8.7142   8.1836   86.115   45.838   86.115   45.838 0.000000 0.000000 
1 1 1   10   37    1 o  353.503   14.078   96.642   7.6176   89.288   10.355  105.316   11.246  337.395   20.143  366.530   20.122 -29.13474 28.47215 
1 1 1   10   37    2 o  405.631   13.715  127.180   8.5154  111.715   11.782  144.091   12.321  377.366   20.475  429.924   18.723 -52.55847 27.74509 
1 1 1   10   37    3 o  285.323   13.616   62.920   5.9466   59.055   7.3878   70.032   10.021  274.971   17.647  297.875   22.138 -22.90384 28.31070 
1 1 1   10   37    4 f   41.642   20.597 -10.7712   4.8472 -10.8363   6.0453 -10.6539   8.1117   49.561   24.206   61.959   29.714 -12.39809 38.32546 
1 1 1   10   37    5 o  263.479   14.672   53.907   5.8938   52.368   7.1412   57.194   10.437  258.694   18.150  267.502   25.812 -8.807861 31.55459 
1 1 1   10   37    6 o  457.120   10.635  160.904   7.4408  164.153   9.2161  154.821   12.611  460.996   13.061  445.648   18.487 15.34811 22.63564 
1 1 1   10   37    7 o  372.346   11.787  106.914   6.7176  108.140   8.0871  104.186   12.065  373.855   14.133  363.655   21.776 10.19949 25.96002 
1 1 1   10   37    8 o   90.199   33.837   5.2846   6.3209   8.0855   9.5047   3.0635   8.4639  109.326   41.388   91.136   37.557 18.19030 55.88779 
1 1 1   10   37    9 o  273.648   17.928   58.579   7.4679   50.785   11.200   64.818   10.021  249.913   29.871  285.923   23.094 -36.00978 37.75703 
1 1 1   10   37   10 o  558.954   13.014  241.412   11.134  223.902   15.706  259.101   15.786  535.322   19.168  576.629   17.886 -41.30762 26.21694 
1 1 1   10   37   11 o  336.776   15.958   88.076   8.2262   79.104   11.867   96.375   11.413  315.083   24.807  349.657   21.429 -34.57397 32.78089 
1 1 1   10   37   12 o  339.683   15.768   89.592   8.1980   91.951   12.059   87.565   11.179  340.539   23.274  332.870   22.066 7.669281 32.07152 
1 1 1   10   37   13 o  112.481   34.779   10.481   6.5958   13.939   9.6533   7.4540   9.0333  128.841   42.328  105.740   40.272 23.10120 58.42518 
1 1 1   10   37   14 o   59.237   27.884  -6.3861   6.5110  -1.3383   9.2779 -11.2845   9.1396   83.634   36.938   66.229   31.703 17.40546 48.67750 
1 1 1   10   37   15 o  103.912   41.373   6.0921   9.8753   6.0921   9.8753   0.0000   0.0000  103.912   41.373  ?   ?  0.000000 41.37254 
1 1 1   10   37   16 o   60.809   28.370  -5.4317   6.4904  -5.4317   6.4904   0.0000   0.0000   60.809   28.370  ?   ?  0.000000 28.36953 
1 1 1   10   37   17 o  291.787   15.284   66.318   6.8023   66.676   8.1502   65.495   12.349  291.456   18.363  283.770   28.832 7.685822 34.18348 
1 1 1   10   37   18 o  171.157   24.348   23.705   6.1988   22.153   7.5139   27.011   10.968  162.619   31.324  175.055   41.556 -12.43555 52.03900 
1 1 1   10   37   19 o  266.416   16.995   55.598   6.8940   58.282   8.2800   49.533   12.447  271.585   20.060  242.986   34.430 28.59842 39.84758 
1 1 1   10   37   20 o  170.947   24.783   23.735   6.2957   21.409   7.3630   30.061   12.141  159.598   31.259  183.128   43.887 -23.52933 53.88127 
1 1 1   10   37   21 o  104.899   34.189   9.0255   6.3023   1.8296   7.3378   29.261   12.305   82.069   34.482  179.725   44.869 -97.65632 56.58813 
1 1 1   10   37   22 o  311.472   15.903   75.836   7.5565   75.765   9.0589   75.999   13.701  309.853   19.195  304.008   29.828 5.845642 35.47068 
1 1 1   10   37   23 o   71.191   31.044  -0.3314   6.3658   6.1574   7.5741 -15.9432   11.748   96.100   36.810   71.981   34.829 24.11892 50.67567 
1 1 1   10   37   24 o  169.873   26.821   23.827   6.7423   19.226   7.7969   37.468   13.425  148.757   34.853  202.780   44.477 -54.02307 56.50638 
1 1 1   10   37   25 o  305.025   16.453   73.034   7.6532   68.768   8.9195   84.940   14.901  294.246   19.922  319.375   30.867 -25.12964 36.73747 
1 1 1   10   37   26 o  300.358   17.367   71.109   7.9502   69.882   9.4127   74.163   14.851  295.824   20.923  295.672   33.400 0.1519775 39.41227 
1 1 1   10   37   27 o  110.114   45.404   7.2243   12.379   0.0000   0.0000   7.2243   12.379  ?   ?   110.114   45.404 0.000000 45.40410 
1 1 1   10   37   29 o  180.059   23.630   26.602   6.3552   22.435   9.0101   30.727   8.9653  157.286   37.878  188.694   32.197 -31.40726 49.71279 
1 1 1   10   37   30 o  101.418   33.102   8.7824   5.9073   4.5606   8.4852   12.753   8.2291   91.968   37.717  119.102   39.079 -27.13428 54.31161 
1 1 1   10   37   31 o   50.777   24.541  -8.1803   5.7919 -11.7156   8.4889  -5.1012   7.9223   60.752   29.446   67.636   31.484 -6.883846 43.10799 
1 1 1   10   37   32 o  115.911   32.806   12.019   6.0825  -1.7685   8.6272   25.646   8.5768   76.697   34.616  169.203   34.291 -92.50635 48.72542 
1 1 1   10   37   33 o  286.323   15.878   65.009   6.9311   68.660   10.003   61.638   9.6126  289.045   22.795  273.473   23.183 15.57184 32.51251 
1 1 1   10   37   34 o   89.994   34.998   5.9901   6.9229   5.3701   8.7972   6.9985   11.220   92.747   38.263  102.130   42.760 -9.383568 57.38009 
1 1 1   10   37   35 o  151.685   32.127   20.870   7.2270   20.433   9.1806   21.581   11.719  143.755   40.170  142.166   46.634 1.589111 61.54978 
1 1 1   10   37   36 o   77.994   32.011   3.3994   6.1181  -2.3298   8.9293   8.4690   8.3996   74.994   34.375   99.730   38.615 -24.73598 51.69878 
1 1 1   10   37   37 f  309.902   21.781   79.689   10.266   79.689   10.266   0.0000   0.0000  309.902   21.781  ?   ?  0.000000 21.78057 
1 1 1   10   38    0 o  221.316   30.475   40.460   9.7662   40.460   9.7662   40.460   9.7662  221.316   30.475  221.316   30.475 0.000000 0.000000 
1 1 1   10   38    1 o   95.769   32.986   6.9842   5.8588   12.922   8.1857   0.7474   8.3892  124.130   38.804   84.642   36.264 39.48721 53.11172 
1 1 1   10   38    2 o  260.612   17.833   53.166   7.0708   61.269   10.327   46.013   9.7017  277.170   24.597  238.899   27.006 38.27116 36.52852 
1 1 1   10   38    3 f  143.706   24.055   16.729   5.1042   23.004   6.5486   7.0154   8.1475  168.274   26.284  101.997   38.386 66.27757 46.52274 
1 1 1   10   38    4 o  491.553   10.590  186.128   7.9680  186.359   9.8490  185.691   13.556  491.011   13.105  487.914   18.152 3.097168 22.38793 
1 1 1   10   38    5 o  336.077   12.712   87.260   6.5391   88.837   8.3321   84.733   10.551  338.141   16.099  327.839   21.140 10.30118 26.57157 
1 1 1   10   38    6 o   84.889   30.802   5.0099   5.1639   12.303   6.3310  -9.4869   8.9258  120.883   33.200   67.707   32.103 53.17589 46.18282 
1 1 1   10   38    7 o  561.007   10.506  242.455   9.0214  255.091   11.290  220.137   15.004  574.513   12.839  530.943   18.463 43.56921 22.48799 
1 1 1   10   38    8 o   95.954   34.347   6.7398   6.3950   10.786   9.4675   3.3449   8.6725  117.541   41.821   92.404   38.041 25.13731 56.53432 
1 1 1   10   38    9 o  261.396   19.683   53.809   7.8174   72.385   12.016   40.178   10.293  300.196   26.421  220.816   31.334 79.37981 40.98621 
1 1 1   10   38   10 o  216.663   22.725   37.436   7.4240   41.806   11.229   34.042   9.8950  223.978   33.807  202.042   33.146 21.93558 47.34572 
1 1 1   10   38   11 o  155.420   31.389   20.221   7.2100   21.863   10.270   18.626   10.125  157.695   41.853  145.751   42.661 11.94463 59.76295 
1 1 1   10   38   12 o  116.303   43.015   10.117   10.144   10.117   10.144   0.0000   0.0000  116.303   43.015  ?   ?  0.000000 43.01535 
1 1 1   10   38   13 o  163.853   43.142   23.830   10.969   23.830   10.969   0.0000   0.0000  163.853   43.142  ?   ?  0.000000 43.14167 
1 1 1   10   38   14 o  106.546   36.062   9.0830   6.9975   8.4253   10.084   9.6939   9.7184  110.812   42.467  113.887   42.107 -3.074509 59.80299 
1 1 1   10   38   15 o  157.671   32.610   21.004   7.6102   19.397   10.883   22.541   10.646  147.686   44.481  159.207   42.775 -11.52090 61.71141 
1 1 1   10   38   16 o  265.833   21.130   56.050   8.5265   65.034   12.214   47.510   11.908  282.485   28.645  238.358   33.570 44.12677 44.13010 
1 1 1   10   38   17 f  186.075   22.950   27.841   6.3979   27.133   7.7119   29.402   11.459  181.264   28.756  182.051   41.981 -0.7873535 50.88494 
1 1 1   10   38   18 o  246.484   18.166   47.845   6.8051   50.909   8.2321   41.232   12.093  252.911   21.468  219.091   37.405 33.81964 43.12801 
1 1 1   10   38   19 o  267.069   17.102   55.991   6.9543   48.886   8.4270   71.161   12.313  247.192   22.520  295.613   27.529 -48.42053 35.56662 
1 1 1   10   38   20 o  105.431   34.328   9.1976   6.3542   10.695   7.5427   5.5378   11.793  113.045   37.429  106.598   44.167 6.446854 57.89338 
1 1 1   10   38   21 o  171.902   26.392   24.324   6.7223   27.933   8.0405   15.943   12.253  182.819   29.757  134.742   47.616 48.07748 56.14950 
1 1 1   10   38   22 o  179.427   25.847   26.444   6.8936   21.126   8.1094   40.300   13.089  155.858   34.866  212.057   41.813 -56.19894 54.44187 
1 1 1   10   38   23 o  347.749   18.409   95.519   9.7635   89.796   12.754  103.622   15.175  332.641   25.237  355.032   28.156 -22.39075 37.81103 
1 1 1   10   38   24 o  113.073   38.902   10.829   8.1476   10.597   10.805   11.134   12.404  115.961   44.073  119.964   46.793 -4.003098 64.28083 
1 1 1   10   38   25 o  221.748   43.181   45.194   14.129   0.0000   0.0000   45.194   14.129  ?   ?   221.748   43.181 0.000000 43.18090 
1 1 1   10   38   26 o  131.284   41.384   15.794   9.2892   32.922   13.668   1.0917   12.663  183.900   48.033   97.771   43.170 86.12933 64.58142 
1 1 1   10   38   27 o  458.896   13.574  164.248   9.5347  170.460   11.538  150.868   16.933  465.652   16.188  428.661   25.930 36.99127 30.56763 
1 1 1   10   38   28 o   85.401   34.581   3.9769   7.0234   9.4465   8.4868  -7.9104   12.511  107.132   39.394   82.696   38.840 24.43649 55.32087 
1 1 1   10   38   29 o  254.332   17.426   51.439   6.7429   60.391   9.9324   43.787   9.1833  271.105   24.190  228.853   26.719 42.25276 36.04266 
1 1 1   10   38   30 o  210.633   20.108   35.916   6.4042   30.829   9.1784   40.741   8.9399  186.524   33.374  219.757   27.156 -33.23277 43.02642 
1 1 1   10   38   31 o  156.024   26.766   20.802   6.1621   13.242   8.7396   28.275   8.6896  118.743   40.301  177.908   33.130 -59.16488 52.17025 
1 1 1   10   38   32 o   97.280   32.756   8.2748   5.7729   10.930   8.5297   6.0302   7.8419  109.603   39.615   92.364   36.839 17.23901 54.09660 
1 1 1   10   38   33 o  184.621   26.259   29.161   7.2114   26.558   9.0980   33.562   11.828  168.213   36.393  183.113   42.944 -14.90053 56.29069 
1 1 1   10   38   34 o  197.358   20.944   32.157   6.2302   36.480   9.1743   28.457   8.4873  202.598   30.533  176.947   32.536 25.65134 44.61907 
1 1 1   10   38   35 o  197.404   20.982   32.273   6.2426   26.341   9.0998   37.547   8.5799  165.722   36.830  207.559   27.698 -41.83647 46.08274 
1 1 1   10   39    0 o  629.293   17.866  306.818   17.177  306.818   17.177  306.818   17.177  629.293   17.866  629.293   17.866 0.000000 0.000000 
1 1 1   10   39    1 o  141.860   30.284   16.825   6.3755   21.270   8.7889   11.887   9.2626  157.252   37.112  120.811   41.483 36.44169 55.66125 
1 1 1   10   39    2 o  385.543   14.356  115.229   8.4720  113.127   11.937  117.363   12.026  378.914   20.660  386.087   20.422 -7.172913 29.05009 
1 1 1   10   39    3 o  320.518   13.590   79.536   6.6670   77.812   8.1055   83.142   11.723  315.633   16.838  323.072   23.875 -7.438263 29.21580 
1 1 1   10   39    4 o  258.329   15.586   52.035   6.1339   51.183   7.5473   53.693   10.528  254.875   19.494  257.747   27.091 -2.871490 33.37553 
1 1 1   10   39    5 o  179.225   21.474   25.629   5.7735   28.881   7.1281   19.426   9.8445  189.001   25.273  148.788   41.604 40.21286 48.67875 
1 1 1   10   39    6 o   79.403   30.405   3.7744   5.1666   4.4242   6.3041   2.4451   9.0169   86.485   33.462   91.109   38.249 -4.623878 50.82084 
1 1 1   10   39    7 f  165.070   28.812   22.503   7.0149   22.503   7.0149   0.0000   0.0000  165.070   28.812  ?   ?  0.000000 28.81244 
1 1 1   10   39    8 o  343.624   15.416   91.768   8.1085   91.768   8.1085   0.0000   0.0000  343.624   15.416  ?   ?  0.000000 15.41646 
1 1 1   10   39    9 o  331.178   25.816   88.083   12.983   88.083   12.983   0.0000   0.0000  331.178   25.816  ?   ?  0.000000 25.81596 
1 1 1   10   39   10 o  288.186   28.289   67.481   12.318   67.481   12.318   0.0000   0.0000  288.186   28.289  ?   ?  0.000000 28.28899 
1 1 1   10   39   11 o  237.883   22.306   45.115   8.0268   44.724   11.839   45.449   10.920  230.649   34.602  234.444   31.206 -3.794708 46.59520 
1 1 1   10   39   12 o  127.489   35.747   13.966   7.2573   11.077   10.739   16.395   9.8458  119.738   44.264  136.797   42.524 -17.05873 61.38070 
1 1 1   10   39   13 o  240.958   22.774   46.422   8.2997   54.399   12.720   40.507   10.952  255.123   33.374  219.524   33.670 35.59917 47.40789 
1 1 1   10   39   14 o   84.910   34.907   2.8838   7.2896   6.9768   10.746  -0.6049   9.9213  107.802   43.082   87.166   38.362 20.63532 57.68591 
1 1 1   10   39   15 o  126.631   37.250   13.891   7.7020   11.953   11.103   15.689   10.693  122.379   45.050  133.900   44.576 -11.52079 63.37614 
1 1 1   10   39   16 o   74.826   33.387  -1.8316   7.7752  -6.2973   10.905   2.7858   11.089   80.853   37.394   98.393   41.911 -17.54068 56.16813 
1 1 1   10   39   17 o   94.300   37.328   5.2192   7.9956   0.3579   11.647   9.5528   10.996   95.077   41.710  114.754   44.252 -19.67631 60.81133 
1 1 1   10   39   18 o  197.674   22.472   31.473   6.6785   30.628   8.0716   33.308   11.892  192.281   28.269  192.841   41.516 -0.5598907 50.22721 
1 1 1   10   39   19 o  229.745   24.642   42.855   8.5302   32.978   11.126   56.940   13.287  193.148   38.978  258.642   34.416 -65.49352 51.99759 
1 1 1   10   39   20 o   76.168   33.448  -0.4705   7.5060  -2.9308   9.5900   3.4202   12.060   80.346   36.358  101.726   43.529 -21.37986 56.71564 
1 1 1   10   39   21 o  117.359   38.663   11.953   8.0520   14.437   10.391   8.2182   12.738  127.515   43.929  113.520   46.345 13.99536 63.85612 
1 1 1   10   39   22 o  350.135   15.649   96.000   8.3868   87.072   9.9305  118.210   15.662  330.750   19.705  379.208   27.164 -48.45728 33.55864 
1 1 1   10   39   23 o  101.009   39.239   7.1938   8.6953   16.621   11.976  -3.3148   12.645  134.074   47.106   90.486   41.259 43.58850 62.62021 
1 1 1   10   39   25 o   59.531   28.186  -6.6597   6.8330  -6.0343   8.3361  -7.9406   11.929   68.374   31.982   80.738   37.922 -12.36370 49.60781 
1 1 1   10   39   26 o  254.287   20.341   52.032   7.8509   54.820   9.5992   46.399   13.644  258.211   24.585  224.129   41.294 34.08206 48.05877 
1 1 1   10   39   27 o  278.614   19.067   62.200   8.0825   68.444   9.9433   50.041   13.876  289.743   22.599  232.666   40.432 57.07698 46.31900 
1 1 1   10   39   28 o  269.566   19.509   58.531   7.9950   66.528   10.078   44.950   13.133  284.479   23.350  218.905   40.694 65.57404 46.91678 
1 1 1   10   39   29 o  106.026   36.625   10.023   7.2252   14.175   8.9817   2.4084   12.163  121.921   40.858   95.625   42.261 26.29616 58.78218 
1 1 1   10   39   30 o  281.789   22.561   65.478   9.6494   65.478   9.6494   0.0000   0.0000  281.789   22.561  ?   ?  0.000000 22.56142 
1 1 1   10   39   31 o  120.057   35.287   13.541   6.9142   18.194   8.6871   5.4973   11.421  136.283   39.410   98.534   42.267 37.74821 57.78950 
1 1 1   10   39   32 o  148.041   27.853   19.226   6.0798   11.090   8.8037   26.644   8.4064  108.947   40.113  170.449   33.416 -61.50255 52.20806 
1 1 1   10   40    0 o   55.361   36.969  -2.1910   8.5859  -2.1910   8.5859  -2.1910   8.5859   55.361   36.969   55.361   36.969 0.000000 0.000000 
1 1 1   10   40    1 o  250.437   27.064   50.888   10.209   50.888   10.209   0.0000   0.0000  250.437   27.064  ?   ?  0.000000 27.06400 
1 1 1   10   40    2 o  343.268   16.610   91.884   8.7271   91.884   8.7271   0.0000   0.0000  343.268   16.610  ?   ?  0.000000 16.60980 
1 1 1   10   40    3 o  143.934   33.153   17.645   7.1533   17.645   7.1533   0.0000   0.0000  143.934   33.153  ?   ?  0.000000 33.15278 
1 1 1   10   40    4 o  226.126   23.217   40.965   7.9217   40.965   7.9217   0.0000   0.0000  226.126   23.217  ?   ?  0.000000 23.21690 
1 1 1   10   40    5 o  100.382   34.748   7.8750   6.5052   7.8750   6.5052   0.0000   0.0000  100.382   34.748  ?   ?  0.000000 34.74768 
1 1 1   10   40    6 o  133.563   28.630   14.921   5.6771   11.265   6.7943   23.378   10.334  115.407   35.234  162.250   41.457 -46.84343 54.40684 
1 1 1   10   40    7 o  345.095   13.485   92.322   7.1231   94.219   8.8141   88.751   12.094  347.490   16.572  333.091   23.879 14.39938 29.06630 
1 1 1   10   40    8 o  198.875   20.966   31.537   6.2860   34.903   7.6614   24.602   10.995  207.839   24.558  165.548   43.005 42.29103 49.52271 
1 1 1   10   40    9 o  160.408   33.037   21.890   7.8414   33.289   12.315   14.117   10.169  193.102   42.791  128.372   43.473 64.73083 60.99965 
1 1 1   10   40   10 o  243.818   22.631   47.578   8.3495   45.147   12.345   49.627   11.335  229.930   36.281  244.575   30.974 -14.64574 47.70404 
1 1 1   10   40   11 o  377.925   17.239  111.767   9.9723  121.315   14.889  103.998   13.430  388.225   25.191  359.803   24.532 28.42191 35.16316 
1 1 1   10   40   12 o  175.489   32.578   26.124   8.4285   23.576   12.697   28.131   11.270  159.201   48.068  176.920   42.207 -17.71849 63.96823 
1 1 1   10   40   13 o   99.637   37.512   7.0553   7.7823  -2.3633   11.335   15.454   10.704   88.839   39.926  132.454   44.602 -43.61508 59.86168 
1 1 1   10   40   14 o  144.523   44.211   19.021   10.691   0.0000   0.0000   19.021   10.691  ?   ?   144.523   44.211 0.000000 44.21100 
1 1 1   10   40   15 o  301.631   28.773   74.963   13.123   0.0000   0.0000   74.963   13.123  ?   ?   301.631   28.773 0.000000 28.77318 
1 1 1   10   40   16 o  106.275   44.311   5.5914   11.978   0.0000   0.0000   5.5914   11.978  ?   ?   106.275   44.311 0.000000 44.31110 
1 1 1   10   40   17 o  184.099   43.746   31.284   12.145   0.0000   0.0000   31.284   12.145  ?   ?   184.099   43.746 0.000000 43.74649 
1 1 1   10   40   18 o  189.976   23.669   29.418   6.7332   27.520   7.9890   34.070   12.510  180.471   29.973  192.014   43.565 -11.54364 52.87972 
1 1 1   10   40   19 o  167.832   27.458   23.558   6.8097   25.296   8.0973   19.360   12.586  171.583   32.009  142.923   48.364 28.66016 57.99705 
1 1 1   10   40   20 o  410.182   17.199  132.484   10.798  127.056   14.662  138.915   15.961  395.554   24.336  412.610   25.396 -17.05597 35.17364 
1 1 1   10   40   21 o  152.413   36.918   20.882   8.5214   20.668   11.373   21.157   12.867  147.040   45.703  147.382   48.890 -0.3428040 66.92520 
1 1 1   10   40   22 o  278.779   17.873   61.685   7.5865   49.919   8.9303   92.196   14.380  247.189   23.901  332.324   28.548 -85.13570 37.23252 
1 1 1   10   40   23 o  111.892   35.677   11.051   6.8887   7.4092   8.2227   19.623   12.616   99.775   38.322  141.437   48.418 -41.66180 61.74834 
1 1 1   10   40   24 o  258.709   19.314   53.685   7.5928   53.664   9.1587   53.731   13.578  255.778   23.662  244.384   37.495 11.39340 44.33697 
1 1 1   10   40   25 o  124.835   35.528   14.239   7.1134   19.518   8.7762   4.1298   12.145  144.149   38.883   99.940   43.232 44.20915 58.14516 
1 1 1   10   40   26 f  222.672   22.471   40.756   7.5539   47.033   9.5376   30.192   12.373  235.977   26.886  172.931   45.960 63.04636 53.24598 
1 1 1   10   40   27 o   75.830   32.542   1.5011   6.7759   13.111   8.7792 -15.6044   10.656  117.832   40.390   65.354   31.965 52.47809 51.50889 
1 1 1   10   40   28 o   80.536   33.621   3.0833   6.9079   1.5982   8.7218   5.5830   11.316   83.068   36.277   99.035   42.265 -15.96638 55.69854 
1 1 1   10   40   29 o  100.384   38.475   8.4919   8.2776   8.4919   8.2776   0.0000   0.0000  100.384   38.475  ?   ?  0.000000 38.47451 
1 1 1   10   40   30 o   62.678   29.169  -3.9860   6.7939  -9.9372   8.4759   6.7095   11.363   61.645   29.768  100.374   42.580 -38.72958 51.95358 
1 1 1   10   41    0 o  253.739   28.602   52.573   10.745   52.573   10.745   52.573   10.745  253.739   28.602  253.739   28.602 0.000000 0.000000 
1 1 1   10   41    1 o  124.912   34.349   13.459   6.7719   15.473   9.3787   11.266   9.7884  132.503   41.555  117.977   42.466 14.52594 59.41504 
1 1 1   10   41    2 o  211.459   19.790   35.531   6.3307   36.523   8.0647   33.938   10.219  211.986   25.358  199.368   34.751 12.61795 43.01933 
1 1 1   10   41    3 o  201.558   26.435   33.229   7.9588   30.070   12.525   35.369   10.307  181.135   45.295  203.867   34.245 -22.73270 56.78377 
1 1 1   10   41    4 o  275.600   27.234   61.975   11.338   0.0000   0.0000   61.975   11.338  ?   ?   275.600   27.234 0.000000 27.23448 
1 1 1   10   41    5 o  131.529   44.059   15.190   10.444   0.0000   0.0000   15.190   10.444  ?   ?   131.529   44.059 0.000000 44.05924 
1 1 1   10   41    6 o   74.774   35.344  -9.6375   10.661   0.0000   0.0000  -9.6375   10.661  ?   ?    74.774   35.344 0.000000 35.34407 
1 1 1   10   41    7 o  124.875   44.657   13.139   10.808   0.0000   0.0000   13.139   10.808  ?   ?   124.875   44.657 0.000000 44.65668 
1 1 1   10   41    8 o  238.728   32.110   47.886   11.436   0.0000   0.0000   47.886   11.436  ?   ?   238.728   32.110 0.000000 32.10979 
1 1 1   10   41    9 o  310.699   27.372   78.944   12.884   0.0000   0.0000   78.944   12.884  ?   ?   310.699   27.372 0.000000 27.37166 
1 1 1   10   41   10 o  311.203   26.841   79.095   12.660   0.0000   0.0000   79.095   12.660  ?   ?   311.203   26.841 0.000000 26.84133 
1 1 1   10   41   11 o  415.173   23.254  138.445   14.718   0.0000   0.0000  138.445   14.718  ?   ?   415.173   23.254 0.000000 23.25449 
1 1 1   10   41   12 o  165.550   35.065   23.918   8.6089  -2.4781   12.342   48.931   12.014   91.572   41.360  239.485   33.709 -147.9133 53.35630 
1 1 1   10   41   13 o   65.992   30.953  -6.4802   7.9003   4.3849   11.976 -14.8515   10.512  103.162   43.735   67.289   32.650 35.87273 54.57843 
1 1 1   10   41   14 o   56.513   27.508 -12.0091   7.6224  -0.2286   10.675 -24.2631   10.887   89.415   39.550   60.194   29.959 29.22132 49.61613 
1 1 1   10   41   15 o  146.415   37.075   19.176   8.3172   11.275   11.411   28.131   12.149  118.453   45.227  172.457   45.401 -54.00434 64.08345 
1 1 1   10   41   16 o  200.787   29.303   33.917   8.7403   30.842   11.721   37.769   13.118  182.448   42.723  201.662   43.756 -19.21429 61.15432 
1 1 1   10   41   17 o  301.829   20.660   72.957   9.4872   69.561   12.740   77.184   14.215  288.410   29.264  302.236   31.176 -13.82565 42.75853 
1 1 1   10   41   18 o   79.991   35.172  -0.0832   8.3228  -3.5877   10.841   4.9477   12.989   83.320   38.074  105.765   45.213 -22.44466 59.10892 
1 1 1   10   41   19 o   72.707   33.458  -4.1535   8.5735  -3.8540   11.509  -4.5270   12.851   85.110   39.017   88.718   40.877 -3.608467 56.50895 
1 1 1   10   41   20 o  133.744   33.488   15.920   6.8400   19.602   8.1108   6.8554   12.728  147.107   36.255  108.134   45.423 38.97259 58.11739 
1 1 1   10   41   21 f  201.890   23.717   33.591   7.1893   33.667   8.6427   33.421   12.953  198.552   29.321  184.350   46.042 14.20230 54.58582 
1 1 1   10   41   22 f  219.160   22.131   39.279   7.3221   46.398   8.9700   25.063   12.676  236.188   25.201  156.342   48.192 79.84604 54.38368 
1 1 1   10   41   23 o  148.670   31.751   19.630   7.0055   16.230   8.7374   25.750   11.722  130.479   39.977  159.716   45.661 -29.23753 60.68810 
1 1 1   10   41   24 o  100.783   36.037   8.7391   7.0379   2.6406   8.5833   21.251   12.295   85.594   36.676  142.774   47.803 -57.18037 60.25192 
1 1 1   10   41   25 o   91.949   35.359   6.4737   7.0056   5.5144   8.7100   8.2314   11.790   93.038   38.191  106.147   44.085 -13.10862 58.32698 
1 1 1   10   41   26 o  227.791   22.135   42.872   7.6203   53.620   9.5891   24.451   12.553  252.322   25.164  150.534   48.179 101.7885 54.35514 
1 1 1   10   41   27 o   65.675   31.031  -6.2809   8.2023  -6.2809   8.2023   0.0000   0.0000   65.675   31.031  ?   ?  0.000000 31.03090 
1 1 1   10   42    0 o  123.758   52.585   18.098   10.114   18.098   10.114   18.098   10.114  123.758   52.585  123.758   52.585 0.000000 0.000000 
1 1 1   10   42    1 o  256.493   20.326   52.469   7.9147   54.484   11.157   50.427   11.229  256.260   28.953  245.385   30.559 10.87476 42.09706 
1 1 1   10   42    2 o  184.226   23.376   27.589   6.4434   18.430   7.9382   45.279   11.032  144.500   36.018  231.423   31.999 -86.92322 48.17945 
1 1 1   10   42    3 o  456.458   12.217  161.565   8.5353  161.549   10.476  161.597   14.721  454.904   15.046  450.505   21.348 4.398804 26.11709 
1 1 1   10   42    4 o  153.893   26.648   19.712   6.0497   27.146   7.6923   7.6601   9.7950  180.009   28.896  105.725   41.485 74.28429 50.55641 
1 1 1   10   42    5 o  307.478   14.992   73.813   7.0559   74.006   8.6508   73.429   12.196  305.763   18.572  299.213   26.917 6.550171 32.70224 
1 1 1   10   42    6 o  251.746   17.522   50.067   6.7098   47.762   8.0572   55.284   12.120  243.776   21.824  256.073   31.592 -12.29630 38.39717 
1 1 1   10   42    7 o   95.152   33.213   7.1823   5.9491   7.6439   7.2367   6.2201   10.448   99.679   36.419  103.246   42.041 -3.566269 55.62160 
1 1 1   10   42    8 o  201.562   21.840   32.784   6.6302   38.176   8.1280   22.061   11.462  215.989   25.051  152.961   45.557 63.02756 51.98987 
1 1 1   10   42    9 o  271.843   16.822   58.255   6.9652   67.096   8.7442   42.907   11.521  290.217   19.803  222.625   34.963 67.59146 40.18122 
1 1 1   10   42   10 o  168.358   32.107   24.389   7.9718   22.983   11.162   25.854   11.389  156.230   44.518  166.011   44.081 -9.780563 62.65007 
1 1 1   10   42   11 o  183.885   29.940   28.632   8.1369   10.550   11.072   49.863   11.998  115.678   44.460  241.089   33.411 -125.4112 55.61445 
1 1 1   10   42   12 o  216.498   25.974   38.666   8.4354   36.385   11.515   41.307   12.392  201.538   38.735  214.712   39.150 -13.17477 55.07351 
1 1 1   10   42   13 o   75.101   33.441  -1.1837   7.7573 -13.2515   10.844   11.463   11.101   70.090   33.802  117.840   44.701 -47.75077 56.04210 
1 1 1   10   42   14 o  210.554   26.503   36.818   8.3521   31.406   11.516   42.823   12.131  183.950   41.844  219.351   37.479 -35.40157 56.17485 
1 1 1   10   42   15 o  137.891   37.983   17.376   8.2724   24.705   11.202   8.5853   12.269  160.579   44.187  111.565   45.507 49.01344 63.43013 
1 1 1   10   42   16 o   69.423   32.100  -4.4474   8.0283  -4.9787   10.634  -3.7430   12.243   79.756   36.900   87.481   40.155 -7.724556 54.53486 
1 1 1   10   42   17 o  139.460   38.920   18.106   8.6241   12.367   11.378   25.854   13.220  118.974   45.225  159.124   49.245 -40.15098 66.86063 
1 1 1   10   42   18 o  101.440   39.078   7.9593   8.5685   9.0191   11.440   6.6051   12.932  109.624   44.224  106.969   45.404 2.655190 63.38148 
1 1 1   10   42   19 o   78.641   35.189  -0.8860   8.7028  -5.7062   11.911   4.6343   12.747   82.471   38.461  102.107   44.229 -19.63547 58.61263 
1 1 1   10   42   20 o  226.256   21.859   41.917   7.4758   39.840   8.8466   47.105   13.982  216.727   27.272  221.415   42.805 -4.687698 50.75433 
1 1 1   10   42   21 o   63.882   29.582  -3.8598   6.8564   2.7577   8.3997 -17.0726   11.869   85.259   36.401   68.744   33.647 16.51521 49.56993 
1 1 1   10   42   22 o   82.502   33.747   3.8236   6.7709   0.2259   8.1991   11.539   12.007   78.286   34.643  114.438   45.602 -36.15198 57.26804 
1 1 1   10   42   23 o  161.204   30.110   22.964   7.1562   18.301   8.7214   32.574   12.520  137.109   39.441  177.904   45.727 -40.79552 60.38723 
1 1 1   10   42   24 o   95.154   38.592   6.4569   8.7622   6.4569   8.7622   0.0000   0.0000   95.154   38.592  ?   ?  0.000000 38.59184 
1 1 1   10   43    0 f  196.821   38.673   34.578   10.368   34.578   10.368   34.578   10.368  196.821   38.673  196.821   38.673 0.000000 0.000000 
1 1 1   10   43    1 o  276.629   16.636   60.351   7.0114   55.199   8.7287   69.721   11.771  261.634   22.001  290.839   26.742 -29.20493 34.62914 
1 1 1   10   43    2 o  365.323   13.372  103.935   7.4771   95.605   9.3115  119.057   12.546  347.816   17.547  385.363   21.353 -37.54712 27.63778 
1 1 1   10   43    3 o  104.316   32.826   9.3084   5.8470   19.856   7.4097  -8.0987   9.5188  150.786   33.019   70.970   33.501 79.81595 47.03794 
1 1 1   10   43    4 o  172.078   24.913   24.453   6.3709   19.716   7.7899   34.023   11.071  149.277   34.745  194.709   38.513 -45.43173 51.86970 
1 1 1   10   43    5 o  185.180   22.122   27.857   6.1461   27.898   7.6633   27.783   10.290  182.050   28.431  174.772   39.406 7.277649 48.59196 
1 1 1   10   43    6 o  187.993   22.210   28.728   6.2674   25.928   7.4155   35.726   11.726  175.199   28.643  198.245   40.022 -23.04585 49.21547 
1 1 1   10   43    7 o  261.386   17.343   54.120   6.8992   54.854   8.4835   52.686   11.856  260.867   21.436  248.281   31.938 12.58594 38.46513 
1 1 1   10   43    8 o   87.531   33.000   5.4558   6.0267   5.4738   7.3039   5.4173   10.668   91.341   35.829  100.610   41.872 -9.268791 55.10875 
1 1 1   10   43    9 o  371.003   13.710  107.463   7.7855  109.290   9.3863  103.433   13.938  372.522   16.462  354.389   25.874 18.13339 30.66688 
1 1 1   10   43   10 o  101.095   37.596   8.0802   7.7702  -0.1500   10.828   16.819   11.157   88.829   39.534  133.074   45.533 -44.24572 60.30107 
1 1 1   10   43   11 o  162.511   34.179   23.471   8.2324   14.550   11.312   33.515   12.003  125.639   45.589  188.275   42.642 -62.63602 62.42334 
1 1 1   10   43   12 o   97.698   37.247   7.2349   7.7325   11.642   10.714   2.4432   11.171  116.190   43.952   94.536   41.177 21.65425 60.22702 
1 1 1   10   43   13 o  144.558   36.876   19.210   8.1856   23.905   11.338   14.099   11.830  155.658   45.027  123.766   46.318 31.89262 64.59684 
1 1 1   10   43   14 o   81.152   34.789   1.8239   7.7288   1.0870   10.521   2.6879   11.392   89.295   39.392   95.090   41.495 -5.794838 57.21495 
1 1 1   10   43   15 o  196.686   30.029   33.442   8.7538   39.999   12.680   27.472   12.100  205.129   41.805  165.114   46.108 40.01477 62.23803 
1 1 1   10   43   16 o  260.963   23.955   56.349   9.4618   33.486   12.656   85.316   14.246  183.196   45.373  315.212   29.885 -132.0153 54.33041 
1 1 1   10   43   17 o   96.332   38.563   6.5706   8.6260   4.9712   11.891   8.3471   12.532   99.976   43.013  108.411   45.273 -8.435432 62.44807 
1 1 1   10   43   18 o  100.973   39.136   8.1930   8.6349   4.4696   11.780   12.517   12.695   98.337   42.557  117.795   46.906 -19.45745 63.33472 
1 1 1   10   43   19 o  204.412   31.098   36.817   9.4230   41.025   13.583   32.912   13.083  202.074   45.062  177.640   47.283 24.43394 65.31712 
1 1 1   10   43   20 o  147.243   39.283   21.029   9.0173   35.209   12.977   7.7900   12.539  184.946   46.025  105.932   44.822 79.01396 64.24407 
1 1 1   10   44    0 o   50.812   35.341  -7.1509   9.7618  -7.1509   9.7618  -7.1509   9.7618   50.812   35.341   50.812   35.341 0.000000 0.000000 
1 1 1   10   44    1 o  189.197   22.861   29.396   6.4861   31.649   8.1652   25.543   10.678  192.957   28.505  163.425   42.343 29.53117 51.04309 
1 1 1   10   44    2 o   79.124   31.722   3.5056   5.8466   2.1053   7.4161   5.8051   9.5034   80.949   34.373   97.568   39.954 -16.61865 52.70462 
1 1 1   10   44    3 o  273.682   17.091   59.496   7.1236   67.136   8.8917   45.806   11.903  288.695   20.250  226.951   35.423 61.74483 40.80237 
1 1 1   10   44    4 o  220.978   19.504   39.313   6.5293   38.837   8.1754   40.150   10.850  216.177   25.179  212.949   34.464 3.227966 42.68224 
1 1 1   10   44    5 o  270.526   17.046   58.158   7.0221   53.176   8.7452   67.199   11.781  255.079   22.634  282.770   27.571 -27.69078 35.67152 
1 1 1   10   44    6 o  114.635   33.333   11.760   6.1993   8.4963   7.4898   18.861   11.047  101.361   37.047  138.417   45.272 -37.05690 58.49844 
1 1 1   10   44    7 o   44.849   22.323 -14.0129   6.0474 -19.1935   7.3096  -2.7755   10.766   46.966   23.551   83.103   37.962 -36.13741 44.67387 
1 1 1   10   44    8 o   66.042   29.301  -0.7865   5.9030  -6.9648   6.9765   14.786   11.076   59.340   28.207  124.846   45.139 -65.50620 53.22787 
1 1 1   10   44    9 o   71.629   30.636   1.1343   5.9691   1.7831   7.1463  -0.3629   10.856   78.587   33.564   87.380   39.186 -8.792107 51.59547 
1 1 1   10   44   10 o  247.096   18.392   48.984   6.9061   52.365   8.2842   41.279   12.504  253.380   21.566  209.475   40.463 43.90482 45.85136 
1 1 1   10   44   11 o  152.817   36.537   21.629   8.4305   25.138   11.904   18.098   11.941  156.866   46.357  133.924   47.036 22.94221 66.04120 
1 1 1   10   44   12 o  240.285   24.612   48.118   8.9242   40.347   12.392   56.488   12.862  206.124   40.723  251.446   34.315 -45.32170 53.25293 
1 1 1   10   44   13 o  181.141   30.973   28.866   8.2790   36.395   11.745   21.430   11.672  195.239   40.624  144.054   46.495 51.18521 61.74186 
1 1 1   10   44   14 o  213.292   26.434   38.584   8.4451   38.644   11.867   38.522   12.021  201.795   39.835  200.792   40.510 1.002792 56.81424 
1 1 1   10   44   15 o  136.880   37.291   17.774   8.0254   18.842   11.095   16.602   11.623  135.553   45.410  128.082   46.252 7.471130 64.81733 
1 1 1   10   44   16 o  154.025   35.114   21.969   8.0945   17.581   10.933   27.294   12.042  131.240   45.068  161.720   46.295 -30.47968 64.60938 
1 1 1   10   45    0 o   41.476   29.122  -6.7017   7.0861  -6.7017   7.0861  -6.7017   7.0861   41.476   29.122   41.476   29.122 0.000000 0.000000 
1 1 1   10   45    1 o   65.984   29.443  -1.0017   6.0477  -6.2501   7.4156   9.4210   10.450   62.545   29.538  107.755   42.668 -45.21018 51.89431 
1 1 1   10   45    2 o  164.709   26.101   23.041   6.3610   35.618   8.1452   3.3797   10.184  205.062   26.575   92.259   39.749 112.8032 47.81455 
1 1 1   10   45    3 o  282.678   16.180   63.483   6.9716   57.964   8.5824   74.192   11.954  266.592   21.208  296.740   26.600 -30.14816 34.01990 
1 1 1   10   45    4 f  112.751   33.068   11.511   6.0777   10.386   7.6968   13.374   9.9053  107.659   37.766  118.970   42.730 -11.31174 57.02760 
1 1 1   10   45    5 o  106.986   42.735   9.1584   10.568   0.0000   0.0000   9.1584   10.568  ?   ?   106.986   42.735 0.000000 42.73493 
1 1 1   10   45    6 o  201.876   21.439   33.442   6.5231   37.643   7.9410   24.724   11.438  211.860   24.968  155.659   45.283 56.20108 51.70990 
1 1 1   10   45    7 o  309.783   15.304   75.814   7.2567   73.868   8.7711   80.036   12.919  302.709   19.027  306.573   27.835 -3.864319 33.71683 
1 1 1   10   45    8 o  260.202   17.595   54.258   6.9664   53.471   8.4832   55.886   12.208  255.176   21.933  251.238   32.508 3.938339 39.21475 
1 1 1   10   45    9 o  153.030   28.834   20.456   6.5060   10.046   7.7832   44.602   11.854  106.029   37.899  220.373   36.413 -114.3438 52.55711 
1 1 1   11    0    1 o  803.415   12.175  494.673   14.964  494.673   14.964  494.673   14.964  803.415   12.175  803.415   12.175 0.000000 0.000000 
1 1 1   11    0    2 o  617.205   10.552  291.947   9.9623  291.947   9.9623  291.947   9.9623  617.205   10.552  617.205   10.552 0.000000 0.000000 
1 1 1   11    0    3 o  364.182   9.2396  101.739   5.1429  101.739   5.1429  101.739   5.1429  364.182   9.2396  364.182   9.2396 0.000000 0.000000 
1 1 1   11    0    6 o  222.035   7.2008   37.858   2.4414   37.858   2.4414   37.858   2.4414  222.035   7.2008  222.035   7.2008 0.000000 0.000000 
1 1 1   11    0    7 f  253.063   5.5717   49.090   2.1558   49.090   2.1558   49.090   2.1558  253.063   5.5717  253.063   5.5717 0.000000 0.000000 
1 1 1   11    0    8 o   32.074   16.084   1.1584   0.9681   1.1584   0.9681   1.1584   0.9681   32.074   16.084   32.074   16.084 0.000000 0.000000 
1 1 1   11    0    9 o  338.810   6.3559   87.962   3.2935   87.962   3.2935   87.962   3.2935  338.810   6.3559  338.810   6.3559 0.000000 0.000000 
1 1 1   11    0   10 o  474.728   5.7740  172.581   4.1942  172.581   4.1942  172.581   4.1942  474.728   5.7740  474.728   5.7740 0.000000 0.000000 
1 1 1   11    0   11 o  523.492   5.2362  209.820   4.1947  209.820   4.1947  209.820   4.1947  523.492   5.2362  523.492   5.2362 0.000000 0.000000 
1 1 1   11    0   12 o  740.013   7.0785  419.312   8.0161  419.312   8.0161  419.312   8.0161  740.013   7.0785  740.013   7.0785 0.000000 0.000000 
1 1 1   11    0   13 o  162.879   11.081   20.595   2.7331   20.595   2.7331   20.595   2.7331  162.879   11.081  162.879   11.081 0.000000 0.000000 
1 1 1   11    0   14 o  657.935   6.7400  331.456   6.7859  331.456   6.7859  331.456   6.7859  657.935   6.7400  657.935   6.7400 0.000000 0.000000 
1 1 1   11    0   15 o  126.602   9.4339   12.474   1.8048   12.474   1.8048   12.474   1.8048  126.602   9.4339  126.602   9.4339 0.000000 0.000000 
1 1 1   11    0   16 o  894.897   6.9297  613.110   9.4908  613.110   9.4908  613.110   9.4908  894.897   6.9297  894.897   6.9297 0.000000 0.000000 
1 1 1   11    0   17 o  269.285   7.2759   55.627   2.9940   55.627   2.9940   55.627   2.9940  269.285   7.2759  269.285   7.2759 0.000000 0.000000 
1 1 1   11    0   18 o  587.656   6.8276  264.438   6.1394  264.438   6.1394  264.438   6.1394  587.656   6.8276  587.656   6.8276 0.000000 0.000000 
1 1 1   11    0   19 o   29.031   19.227  -0.5854   2.2429  -0.5854   2.2429  -0.5854   2.2429   29.031   19.227   29.031   19.227 0.000000 0.000000 
1 1 1   11    0   20 o  543.285   6.0825  225.997   5.0566  225.997   5.0566  225.997   5.0566  543.285   6.0825  543.285   6.0825 0.000000 0.000000 
1 1 1   11    0   21 o  1115.73   8.1688  953.024   13.949  953.024   13.949  953.024   13.949  1115.73   8.1688  1115.73   8.1688 0.000000 0.000000 
1 1 1   11    0   22 o  473.738   6.4068  171.870   4.6438  171.870   4.6438  171.870   4.6438  473.738   6.4068  473.738   6.4068 0.000000 0.000000 
1 1 1   11    0   23 o  1895.77   14.226  2752.48   41.274  2752.48   41.274  2752.48   41.274  1895.77   14.226  1895.77   14.226 0.000000 0.000000 
1 1 1   11    0   24 f  1163.15   8.5277  1035.78   15.180  1035.78   15.180  1035.78   15.180  1163.15   8.5277  1163.15   8.5277 0.000000 0.000000 
1 1 1   11    0   25 o  1464.65   11.606  1642.72   26.016  1642.72   26.016  1642.72   26.016  1464.65   11.606  1464.65   11.606 0.000000 0.000000 
1 1 1   11    0   26 o  433.434   10.318  144.069   6.8364  144.069   6.8364  144.069   6.8364  433.434   10.318  433.434   10.318 0.000000 0.000000 
1 1 1   11    0   27 o  1297.75   10.731  1289.68   21.312  1289.68   21.312  1289.68   21.312  1297.75   10.731  1297.75   10.731 0.000000 0.000000 
1 1 1   11    0   28 o  324.997   9.1198   81.050   4.5285   81.050   4.5285   81.050   4.5285  324.997   9.1198  324.997   9.1198 0.000000 0.000000 
1 1 1   11    0   29 o  1500.46   10.423  1723.99   23.936  1723.99   23.936  1723.99   23.936  1500.46   10.423  1500.46   10.423 0.000000 0.000000 
1 1 1   11    0   30 o  491.981   9.2079  185.501   6.9284  185.501   6.9284  185.501   6.9284  491.981   9.2079  491.981   9.2079 0.000000 0.000000 
1 1 1   11    0   31 o  865.418   7.9511  573.490   10.530  573.490   10.530  573.490   10.530  865.418   7.9511  865.418   7.9511 0.000000 0.000000 
1 1 1   11    0   32 o  656.114   9.1607  329.784   9.1958  329.784   9.1958  329.784   9.1958  656.114   9.1607  656.114   9.1607 0.000000 0.000000 
1 1 1   11    0   33 o  126.423   27.241   13.841   4.6253   13.841   4.6253   13.841   4.6253  126.423   27.241  126.423   27.241 0.000000 0.000000 
1 1 1   11    0   34 o   57.174   33.166   3.0686   4.7469   3.0686   4.7469   3.0686   4.7469   57.174   33.166   57.174   33.166 0.000000 0.000000 
1 1 1   11    0   35 o  226.054   17.935   39.924   6.1157   39.924   6.1157   39.924   6.1157  226.054   17.935  226.054   17.935 0.000000 0.000000 
1 1 1   11    0   36 o  110.970   32.667   11.629   4.8219   11.629   4.8219   11.629   4.8219  110.970   32.667  110.970   32.667 0.000000 0.000000 
1 1 1   11    0   37 o  312.218   11.494   74.993   5.4759   74.993   5.4759   74.993   5.4759  312.218   11.494  312.218   11.494 0.000000 0.000000 
1 1 1   11    0   38 o  178.012   19.991   25.248   5.2704   25.248   5.2704   25.248   5.2704  178.012   19.991  178.012   19.991 0.000000 0.000000 
1 1 1   11    0   39 o  131.932   26.024   14.858   4.6735   14.858   4.6735   14.858   4.6735  131.932   26.024  131.932   26.024 0.000000 0.000000 
1 1 1   11    0   40 o  125.885   26.445   13.702   4.4870   13.702   4.4870   13.702   4.4870  125.885   26.445  125.885   26.445 0.000000 0.000000 
1 1 1   11    0   41 o  385.485   9.8291  114.108   5.7910  114.108   5.7910  114.108   5.7910  385.485   9.8291  385.485   9.8291 0.000000 0.000000 
1 1 1   11    0   42 o   68.361   36.495   5.2573   5.2023   5.2573   5.2023   5.2573   5.2023   68.361   36.495   68.361   36.495 0.000000 0.000000 
1 1 1   11    0   43 o  610.686   8.4691  285.952   7.9129  285.952   7.9129  285.952   7.9129  610.686   8.4691  610.686   8.4691 0.000000 0.000000 
1 1 1   11    0   44 o  198.827   17.713   31.154   5.2922   31.154   5.2922   31.154   5.2922  198.827   17.713  198.827   17.713 0.000000 0.000000 
1 1 1   11    0   45 o  149.712   21.279   18.319   4.5914   18.319   4.5914   18.319   4.5914  149.712   21.279  149.712   21.279 0.000000 0.000000 
1 1 1   11    0   46 o   56.155   32.827   3.0110   4.7058   3.0110   4.7058   3.0110   4.7058   56.155   32.827   56.155   32.827 0.000000 0.000000 
1 1 1   11    0   47 o  453.712   11.857  158.481   8.2217  158.481   8.2217  158.481   8.2217  453.712   11.857  453.712   11.857 0.000000 0.000000 
1 1 1   11    0   48 o  141.456   24.923   16.909   4.8960   16.909   4.8960   16.909   4.8960  141.456   24.923  141.456   24.923 0.000000 0.000000 
1 1 1   11    0   49 o   55.457   32.931   2.7945   4.8693   2.7945   4.8693   2.7945   4.8693   55.457   32.931   55.457   32.931 0.000000 0.000000 
1 1 1   11    0   50 o  162.277   22.957   21.668   5.3732   21.668   5.3732   21.668   5.3732  162.277   22.957  162.277   22.957 0.000000 0.000000 
1 1 1   11    0   51 o  231.867   15.780   42.102   5.5409   42.102   5.5409   42.102   5.5409  231.867   15.780  231.867   15.780 0.000000 0.000000 
1 1 1   11    0   52 o   67.297   35.666   5.3150   4.9369   5.3150   4.9369   5.3150   4.9369   67.297   35.666   67.297   35.666 0.000000 0.000000 
1 1 1   11    0   53 o  314.657   14.188   76.910   6.8015   76.910   6.8015   76.910   6.8015  314.657   14.188  314.657   14.188 0.000000 0.000000 
1 1 1   11    0   54 o   97.610   36.990   10.291   5.1869   10.291   5.1869   10.291   5.1869   97.610   36.990   97.610   36.990 0.000000 0.000000 
1 1 1   11    0   55 o   73.009   39.358   6.4074   6.1059   6.4074   6.1059   6.4074   6.1059   73.009   39.358   73.009   39.358 0.000000 0.000000 
1 1 1   11    0   56 o  184.874   21.301   27.809   5.8197   27.809   5.8197   27.809   5.8197  184.874   21.301  184.874   21.301 0.000000 0.000000 
1 1 1   11    0   57 o   28.116   20.533 -12.3799   5.3654 -12.3799   5.3654 -12.3799   5.3654   28.116   20.533   28.116   20.533 0.000000 0.000000 
1 1 1   11    0   58 o  300.336   15.711   70.770   7.1773   70.770   7.1773   70.770   7.1773  300.336   15.711  300.336   15.711 0.000000 0.000000 
1 1 1   11    0   59 o   47.543   30.663   0.5815   5.1770   0.5815   5.1770   0.5815   5.1770   47.543   30.663   47.543   30.663 0.000000 0.000000 
1 1 1   11    0   60 o  267.671   14.555   56.293   5.9232   56.293   5.9232   56.293   5.9232  267.671   14.555  267.671   14.555 0.000000 0.000000 
1 1 1   11    0   61 o  300.431   15.353   71.190   7.0179   71.190   7.0179   71.190   7.0179  300.431   15.353  300.431   15.353 0.000000 0.000000 
1 1 1   11    0   62 o   88.202   37.269   9.3678   5.0848   9.3678   5.0848   9.3678   5.0848   88.202   37.269   88.202   37.269 0.000000 0.000000 
1 1 1   11    0   63 o   44.691   30.077  -1.1902   5.8852  -1.1902   5.8852  -1.1902   5.8852   44.691   30.077   44.691   30.077 0.000000 0.000000 
1 1 1   11    1    0 o  302.996   8.3951   70.446   3.8867   70.446   3.8867   70.446   3.8867  302.996   8.3951  302.996   8.3951 0.000000 0.000000 
1 1 1   11    1    1 o  502.152   6.6398  193.059   5.1034  196.608   7.3954  189.832   7.0515  506.636   9.5366  497.841   9.2538 8.795105 13.28836 
1 1 1   11    1    2 o  107.912   12.329   9.0408   1.9999   9.0408   1.9999   0.0000   0.0000  107.912   12.329  ?   ?  0.000000 12.32898 
1 1 1   11    1    3 o  369.980   9.2447  104.845   5.2353  104.845   5.2353   0.0000   0.0000  369.980   9.2447  ?   ?  0.000000 9.244702 
1 1 1   11    1    4 o  587.313   5.9257  264.074   5.3270   0.0000   0.0000  264.074   5.3270  ?   ?   587.313   5.9257 0.000000 5.925743 
1 1 1   11    1    5 o  442.751   4.6643  150.055   3.1609  147.291   6.1865  151.032   3.6772  438.521   9.2169  444.174   5.4087 -5.653168 10.68664 
1 1 1   11    1    6 o  129.935   5.3207   12.925   1.0582   14.569   1.7808   12.027   1.3157  137.662   8.4927  125.140   6.8956 12.52196 10.93962 
1 1 1   11    1    7 o  792.530   4.9656  480.816   6.0236  486.142   8.5598  475.592   8.4780  796.809   7.0184  788.115   7.0281 8.694031 9.932347 
1 1 1   11    1    8 o  563.928   3.8985  243.418   3.3650  241.653   5.0708  244.807   4.4982  561.825   5.8967  565.501   5.1968 -3.675781 7.859878 
1 1 1   11    1    9 o  378.888   3.6696  109.880   2.1281  104.698   2.7229  118.015   3.4115  369.828   4.8102  392.627   5.6767 -22.79913 7.440636 
1 1 1   11    1   10 o  610.966   4.1137  285.723   3.8470  288.841   5.8779  283.387   5.0880  614.225   6.2521  608.424   5.4635 5.800293 8.302959 
1 1 1   11    1   11 o  373.630   4.4532  106.858   2.5467  107.627   3.2455  105.627   4.1083  374.950   5.6551  371.413   7.2267 3.536377 9.176333 
1 1 1   11    1   12 o  264.355   4.0740   53.491   1.6485   53.250   2.4954   53.678   2.1958  263.733   6.1817  264.800   5.4176 -1.066711 8.219716 
1 1 1   11    1   13 o  716.988   4.9424  393.510   5.4240  396.016   9.5050  392.301   6.6051  719.109   8.6355  715.848   6.0282 3.261230 10.53146 
1 1 1   11    1   14 o  962.058   5.0701  708.492   7.4660  707.089   10.501  709.924   10.617  961.005   7.1392  962.925   7.2033 -1.920837 10.14176 
1 1 1   11    1   15 o  495.311   4.4926  187.786   3.4060  186.773   4.8046  188.809   4.8291  493.935   6.3550  496.621   6.3529 -2.685364 8.985883 
1 1 1   11    1   16 o  711.177   4.6569  387.135   5.0693  395.001   6.8418  377.560   7.5484  718.322   6.2227  702.258   7.0224 16.06409 9.382766 
1 1 1   11    1   17 o  725.440   5.1064  402.825   5.6701  400.417   6.9802  407.497   9.7219  723.235   6.3055  729.515   8.7066 -6.280029 10.75003 
1 1 1   11    1   18 o  349.483   4.8334   93.488   2.5855   90.922   4.3854   94.855   3.2011  344.605   8.3141  352.017   5.9411 -7.411285 10.21865 
1 1 1   11    1   19 o  897.645   5.3710  616.766   7.3795  610.286   9.6766  625.773   11.408  892.862   7.0806  904.074   8.2442 -11.21198 10.86747 
1 1 1   11    1   20 o  377.428   4.7018  109.033   2.7163  110.103   3.6233  107.661   4.1043  379.257   6.2416  375.015   7.1503 4.242523 9.491241 
1 1 1   11    1   21 f  557.026   4.4066  237.485   3.7571  234.772   5.3062  240.212   5.3204  553.807   6.2598  560.186   6.2050 -6.379639 8.814017 
1 1 1   11    1   22 o  1031.45   5.5277  814.339   8.7269  830.261   12.601  799.664   12.097  1041.39   7.9055  1022.03   7.7332 19.36127 11.05891 
1 1 1   11    1   23 o  641.965   5.8721  315.460   5.7700  317.560   7.5726  312.554   8.9094  644.055   7.6817  638.916   9.1103 5.138672 11.91664 
1 1 1   11    1   24 o  929.561   5.6773  661.417   8.0777  666.328   10.761  655.078   12.226  932.940   7.5357  924.984   8.6355 7.956482 11.46119 
1 1 1   11    1   25 o  106.936   15.686   8.9506   2.4911   9.6560   3.0704   7.5922   4.2611  110.681   18.796   98.003   27.360 12.67892 33.19468 
1 1 1   11    1   26 o  1953.52   10.416  2922.66   31.146  2886.65   43.420  2960.83   44.703  1940.80   14.616  1965.53   14.859 -24.73218 20.84280 
1 1 1   11    1   27 o  251.563   7.7594   48.452   2.9877   46.737   4.6221   49.683   3.9158  246.995   12.226  254.703   10.044 -7.708664 15.82284 
1 1 1   11    1   28 o  627.831   5.5197  301.732   5.3043  298.543   8.0757  304.152   7.0345  624.411   8.4497  630.291   7.2916 -5.879822 11.16084 
1 1 1   11    1   29 o  1333.33   7.2602  1361.11   14.817  1347.83   22.386  1371.46   19.766  1326.45   11.026  1338.18   9.6500 -11.72339 14.65258 
1 1 1   11    1   30 o  666.418   6.9163  340.022   7.0549  342.607   9.1802  336.294   11.026  668.855   8.9671  662.558   10.872 6.296082 14.09280 
1 1 1   11    1   31 o  443.224   6.4951  150.402   4.4063  144.379   6.7928  154.777   5.7897  434.137   10.222  449.567   8.4138 -15.43048 13.23966 
1 1 1   11    1   32 o  132.619   17.592   13.736   3.4829   10.362   4.7683   17.594   5.0995  113.689   27.664  149.523   23.020 -35.83421 35.98937 
1 1 1   11    1   33 f  392.617   6.8072  118.030   4.0908  119.060   5.9316  117.096   5.6492  394.220   9.8303  390.971   9.4401 3.249329 13.62900 
1 1 1   11    1   34 o  251.395   9.3577   48.418   3.6008   51.899   5.1792   45.162   5.0096  260.148   13.007  242.278   13.563 17.87015 18.79205 
1 1 1   11    1   35 o  510.701   6.7032  199.727   5.2399  200.576   8.1958  199.141   6.8145  511.560   10.467  509.842   8.7323 1.718140 13.63130 
1 1 1   11    1   36 o  338.571   8.1960   87.820   4.2474   85.688   5.6803   90.524   6.3967  334.290   11.101  343.529   12.165 -9.238647 16.46925 
1 1 1   11    1   37 o  212.400   10.943   34.692   3.5455   31.453   5.0736   37.782   4.9566  201.559   16.593  221.278   14.718 -19.71971 22.18005 
1 1 1   11    1   38 f   88.815   24.526   6.2973   3.4439   5.7528   4.7127   6.9212   5.0452   88.428   29.596   95.236   30.550 -6.807419 42.53522 
1 1 1   11    1   39 o  190.906   12.292   28.105   3.5727   36.490   5.4867   21.932   4.7074  217.034   16.643  167.599   18.667 49.43550 25.00937 
1 1 1   11    1   40 o  263.896   8.8730   53.407   3.5841   60.734   5.1204   46.370   5.0184  281.183   11.897  245.209   13.422 35.97400 17.93560 
1 1 1   11    1   41 f  532.954   6.1307  217.622   5.0011  223.399   7.0876  211.893   7.0578  539.695   8.5799  525.588   8.7731 14.10748 12.27116 
1 1 1   11    1   42 o  593.697   6.9017  270.176   6.2718  251.452   8.5452  292.042   9.2342  572.309   9.7548  616.768   9.7815 -44.45862 13.81429 
1 1 1   11    1   43 o  428.013   6.7551  140.435   4.4255  139.828   6.3501  141.009   6.1708  426.706   9.7227  428.551   9.4074 -1.845490 13.52883 
1 1 1   11    1   44 o  312.792   9.1444   75.132   4.3780   72.476   6.1713   77.823   6.2119  306.660   13.148  317.834   12.769 -11.17346 18.32777 
1 1 1   11    1   45 o  143.334   15.334   16.065   3.3119   16.025   4.6291   16.106   4.7402  141.588   22.080  141.812   22.597 -0.2243805 31.59341 
1 1 1   11    1   46 o  117.516   18.926   11.015   3.2888   11.180   4.6295   10.847   4.6729  116.627   26.532  114.768   27.044 1.859802 37.88564 
1 1 1   11    1   47 o  127.271   22.192   13.075   4.1659   17.082   6.1762   9.7301   5.6427  143.742   29.071  108.507   31.874 35.23447 43.13978 
1 1 1   11    1   48 o  218.104   10.775   36.667   3.5972   30.590   5.1936   42.271   4.9870  197.371   17.368  233.191   14.037 -35.81993 22.33175 
1 1 1   11    1   49 o  126.430   18.222   12.743   3.4244   9.8300   4.9038   15.516   4.7839  108.399   28.992  138.147   23.464 -29.74747 37.29677 
1 1 1   11    1   50 o  179.495   14.136   25.158   3.8522   21.692   5.4590   28.596   5.4367  164.118   22.309  190.003   18.947 -25.88437 29.26931 
1 1 1   11    1   51 o   64.484   25.095   2.2428   3.5615  -0.6537   5.0918   5.0173   4.9834   63.017   27.614   83.628   30.272 -20.61061 40.97458 
1 1 1   11    1   52 o  199.654   12.862   31.049   3.9097   34.851   5.5522   27.310   5.5064  210.090   17.423  184.978   19.753 25.11240 26.33935 
1 1 1   11    1   53 o  197.213   14.671   30.496   4.3970   29.840   6.1061   31.203   6.3370  192.669   21.048  196.919   21.367 -4.249847 29.99280 
1 1 1   11    1   54 o  136.913   19.198   15.109   3.9125   9.8398   5.4889   20.552   5.5784  106.968   31.441  158.158   23.779 -51.18971 39.42046 
1 1 1   11    1   55 o   78.121   27.477   4.6393   4.0755   0.0932   6.0633   8.3859   5.5044   69.870   30.385   99.448   31.911 -29.57787 44.06329 
1 1 1   11    1   56 o  125.455   22.071   13.020   4.0835   12.104   5.6908   13.992   5.8630  117.324   31.163  126.399   30.626 -9.075050 43.69286 
1 1 1   11    1   57 o  170.958   16.329   23.299   4.2209   23.608   5.9087   22.977   6.0317  168.626   23.534  165.792   24.507 2.833649 33.97730 
1 1 1   11    1   58 o  165.658   18.732   22.264   4.6662   28.411   6.4906   15.687   6.7131  184.560   23.510  130.971   33.387 53.58913 40.83409 
1 1 1   11    1   59 o  159.846   15.950   20.499   3.8502   22.140   5.5231   18.947   5.3701  162.464   22.841  149.240   24.349 13.22388 33.38530 
1 1 1   11    1   60 f  286.575   11.235   64.203   4.9282   62.083   6.9827   66.307   6.9565  278.035   16.481  287.871   15.849 -9.836121 22.86530 
1 1 1   11    1   61 o  109.724   25.852   10.755   4.2704   9.9304   6.0116   11.594   6.0672  101.990   33.398  109.656   33.255 -7.665657 47.13087 
1 1 1   11    1   62 o   39.418   19.045  -4.7584   3.4814  -4.9321   4.9473  -4.5881   4.8999   49.266   23.512   49.616   23.601 -0.3494759 33.31362 
1 1 1   11    1   63 o  156.379   17.977   20.405   4.2246   32.987   6.0745   8.6187   5.8793  196.944   20.449   93.592   32.994 103.3523 38.81673 
1 1 1   11    2    0 o   23.443   15.283  -0.1450   1.3341  -0.1450   1.3341  -0.1450   1.3341   23.443   15.283   23.443   15.283 0.000000 0.000000 
1 1 1   11    2    1 o  393.241   6.1519  118.389   3.7029  114.351   5.2622  122.351   5.2115  386.400   8.8973  399.701   8.5185 -13.30005 12.31773 
1 1 1   11    2    2 o  506.628   9.6596  196.608   7.4906  196.608   7.4906   0.0000   0.0000  506.628   9.6596  ?   ?  0.000000 9.659589 
1 1 1   11    2    3 o  519.721   6.9736  206.815   5.5475  197.079   7.6850  217.408   8.0160  507.221   9.8987  532.742   9.8304 -25.52185 13.95070 
1 1 1   11    2    4 f  923.138   9.4959  652.755   13.418  642.623   18.776  663.329   19.181  915.551   13.399  930.175   13.472 -14.62390 19.00044 
1 1 1   11    2    5 o  288.156   5.4349   63.566   2.3971   85.664   4.4546   54.558   2.8440  334.441   8.7019  266.935   6.9607 67.50574 11.14342 
1 1 1   11    2    6 o  145.688   6.1295   16.250   1.3668   18.268   1.9543   14.317   1.9124  154.222   8.3097  136.409   9.2132 17.81268 12.40697 
1 1 1   11    2    7 f  624.364   4.8577  298.414   4.6423  300.137   7.4149  297.302   5.9535  626.051   7.7380  623.153   6.2418 2.898315 9.941643 
1 1 1   11    2    8 f  259.248   3.9152   51.444   1.5536   48.641   2.1172   54.714   2.2867  252.067   5.4876  267.339   5.5883 -15.27213 7.832206 
1 1 1   11    2    9 o  393.285   3.9417  118.391   2.3728  112.790   3.2367  124.900   3.4888  383.840   5.5091  403.918   5.6431 -20.07803 7.886352 
1 1 1   11    2   10 o  668.430   4.6371  342.013   4.7443  353.476   6.8162  331.240   6.6076  679.469   6.5539  657.750   6.5632 21.71954 9.275198 
1 1 1   11    2   11 o  244.768   4.0017   45.858   1.4992   45.160   2.0048   46.744   2.2583  242.884   5.3927  247.097   5.9708 -4.213577 8.045625 
1 1 1   11    2   12 o  449.525   3.6607  154.668   2.5187  154.599   3.5680  154.736   3.5561  449.397   5.1871  449.597   5.1675 -0.1996460 7.321831 
1 1 1   11    2   13 o  1183.07   5.8039  1071.48   10.510  1073.64   14.891  1069.33   14.835  1184.09   8.2165  1181.71   8.2018 2.377075 11.60946 
1 1 1   11    2   14 f  528.181   4.1761  213.534   3.3762  215.215   5.2545  212.352   4.4061  530.203   6.4747  526.691   5.4655 3.512512 8.473038 
1 1 1   11    2   15 o  854.844   4.7330  559.354   6.1929  560.225   8.7751  558.489   8.7411  855.437   6.7019  854.111   6.6862 1.325806 9.466814 
1 1 1   11    2   16 o  775.866   4.8268  460.770   5.7321  455.032   7.5456  468.601   8.8142  770.972   6.3942  782.347   7.3606 -11.37427 9.750120 
1 1 1   11    2   17 o  637.446   5.3001  311.032   5.1713  307.406   6.6927  316.404   8.1464  633.679   6.9002  642.843   8.2793 -9.164185 10.77770 
1 1 1   11    2   18 f  445.307   4.7303  151.781   3.2242  152.293   4.6976  151.325   4.4331  446.025   6.8810  444.610   6.5142 1.414185 9.475380 
1 1 1   11    2   19 o  927.655   5.1070  658.684   7.2514  668.579   10.428  649.421   10.090  934.525   7.2905  921.043   7.1572 13.48175 10.21650 
1 1 1   11    2   20 o  1071.35   6.0020  878.601   9.8423  883.760   13.095  871.901   14.921  1074.42   7.9628  1067.13   9.1353 7.290894 12.11858 
1 1 1   11    2   21 o  1100.69   6.1086  927.378   10.292  924.586   13.622  931.090   15.709  1098.95   8.0982  1102.75   9.3069 -3.796265 12.33692 
1 1 1   11    2   22 o  637.608   4.8601  311.173   4.7432  312.758   6.3502  309.174   7.1339  639.198   6.4905  635.506   7.3339 3.691711 9.793537 
1 1 1   11    2   23 o  1294.37   8.1266  1282.67   16.100  1295.66   21.131  1264.70   24.860  1300.74   10.613  1284.94   12.640 15.80493 16.50499 
1 1 1   11    2   24 o  386.804   5.3349  114.523   3.1586  111.561   4.2158  118.313   4.7689  381.744   7.2150  393.113   7.9256 -11.36945 10.71782 
1 1 1   11    2   25 o  344.027   5.7258   90.596   3.0151   96.397   4.1310   83.983   4.4107  354.843   7.6059  331.190   8.7008 23.65271 11.55648 
1 1 1   11    2   26 o  689.745   4.9562  364.155   5.2324  368.050   7.5741  360.599   7.2369  693.365   7.1368  686.319   6.8891 7.045898 9.919289 
1 1 1   11    2   27 o  382.864   5.9169  112.210   3.4674  110.917   5.3877  113.124   4.5303  380.585   9.2487  384.388   7.7000 -3.802887 12.03445 
1 1 1   11    2   28 f  422.703   5.5091  136.775   3.5644  137.704   5.2025  135.953   4.8933  424.083   8.0148  421.388   7.5867 2.695221 11.03608 
1 1 1   11    2   29 o  168.668   11.550   21.897   2.9639   19.593   4.6001   23.533   3.8756  158.604   19.350  174.597   14.637 -15.99338 24.26274 
1 1 1   11    2   30 o  1089.74   7.0070  909.212   11.688  911.466   16.613  907.003   16.446  1090.86   9.9494  1088.19   9.8739 2.667236 14.01735 
1 1 1   11    2   31 o  1123.23   6.7017  965.944   11.522  919.716   17.023  1005.03   15.652  1095.73   10.150  1145.54   8.9265 -49.81201 13.51678 
1 1 1   11    2   32 o  174.456   13.115   23.463   3.4765   22.682   4.7374   24.374   5.1175  170.893   18.401  177.114   19.184 -6.221222 26.58246 
1 1 1   11    2   33 o  269.473   8.8623   55.621   3.6553   55.286   5.3344   55.917   5.0189  268.529   12.979  270.090   12.140 -1.560547 17.77157 
1 1 1   11    2   34 o  680.977   5.7206  355.039   5.9627  362.404   8.6550  348.385   8.2265  687.860   8.2205  674.440   7.9689 13.41943 11.44901 
1 1 1   11    2   35 o  641.463   6.2871  315.078   6.1729  328.610   10.029  306.823   7.8325  654.822   10.006  632.892   8.0854 21.92938 12.86422 
1 1 1   11    2   36 o  181.013   13.509   25.287   3.7159   29.287   5.0339   20.497   5.5083  194.437   17.088  161.415   22.940 33.02193 28.60489 
1 1 1   11    2   37 o  399.893   6.8486  122.489   4.1920  130.712   6.1670  115.425   5.7154  412.919   9.7575  388.032   9.6230 24.88742 13.70443 
1 1 1   11    2   38 o  209.958   11.190   33.919   3.5832   41.328   5.1684   27.063   4.9720  231.410   14.667  186.638   17.613 44.77249 22.92043 
1 1 1   11    2   39 o  313.405   8.3097   75.293   3.9862   78.124   6.2158   73.315   5.1952  318.896   12.734  309.075   10.982 9.821136 16.81547 
1 1 1   11    2   40 o  272.556   8.5542   56.963   3.5686   60.924   5.2339   53.521   4.8785  281.598   12.143  263.940   12.076 17.65787 17.12519 
1 1 1   11    2   41 o  327.972   7.5923   82.463   3.8113   83.359   5.4882   81.628   5.2970  329.451   10.884  326.042   10.614 3.409180 15.20236 
1 1 1   11    2   42 o  156.183   15.515   18.998   3.6599   20.418   5.2955   17.699   5.0641  160.612   22.128  149.148   22.916 11.46396 31.85578 
1 1 1   11    2   43 o  308.882   8.2597   73.200   3.9050   73.650   6.0056   72.871   5.1400  309.303   12.685  307.901   10.906 1.402527 16.72923 
1 1 1   11    2   44 o  123.858   19.259   12.187   3.5326   8.7599   4.6916   16.674   5.3683  103.636   28.628  143.769   25.320 -40.13365 38.21858 
1 1 1   11    2   45 o  175.591   12.306   23.872   3.2865   24.143   4.7622   23.626   4.5412  175.454   17.987  173.699   17.311 1.754868 24.96424 
1 1 1   11    2   46 o  299.668   8.3508   68.969   3.8303   69.620   5.5402   68.372   5.3015  300.510   12.045  297.878   11.628 2.632599 16.74146 
1 1 1   11    2   47 o  430.657   8.3613  142.496   5.5116  131.523   7.8949  152.928   7.6979  412.751   12.497  445.427   11.291 -32.67618 16.84182 
1 1 1   11    2   48 o  232.180   10.169   41.522   3.6140   34.773   5.1063   48.295   5.1155  210.926   15.934  249.455   13.447 -38.52948 20.85000 
1 1 1   11    2   49 o  166.667   13.865   21.676   3.5050   18.659   4.9289   24.763   4.9853  152.355   21.754  176.895   18.696 -24.53989 28.68353 
1 1 1   11    2   50 o   70.711   25.520   3.4569   3.5378  -2.3568   4.9145   9.7101   5.0969   57.298   25.969  107.501   29.892 -50.20362 39.59710 
1 1 1   11    2   51 o  187.498   13.740   27.438   3.9157   28.657   5.9551   26.510   5.1972  189.292   20.902  182.726   18.853 6.566055 28.14864 
1 1 1   11    2   52 o  198.928   13.023   30.840   3.9434   31.018   5.5599   30.659   5.5940  197.688   18.593  196.443   18.835 1.245361 26.46634 
1 1 1   11    2   53 o  162.616   17.255   20.992   4.2293   10.106   5.7938   33.408   6.1877  108.608   32.398  204.403   20.035 -95.79504 38.09290 
1 1 1   11    2   54 o  229.470   11.856   40.950   4.1501   50.078   5.9290   32.182   5.8111  252.479   15.416  200.723   19.147 51.75638 24.58141 
1 1 1   11    2   55 o  153.624   17.950   18.891   4.1413   18.375   6.2415   19.296   5.5351  146.725   28.820  152.527   24.541 -5.802872 37.85327 
1 1 1   11    2   56 o   68.402   27.307   2.4225   4.3125   4.9977   5.7353  -0.9279   6.5417   84.477   32.109   69.326   30.798 15.15130 44.49157 
1 1 1   11    2   57 o   51.074   23.149  -1.6991   3.9050   3.3850   5.5994  -6.5130   5.4486   77.405   31.040   51.118   24.472 26.28638 39.52654 
1 1 1   11    2   58 o  122.764   25.418   12.942   4.6190   1.6288   6.5275   24.288   6.5371   75.015   32.060  168.828   26.142 -93.81293 41.36679 
1 1 1   11    2   59 o  172.922   14.537   23.784   3.8118   21.398   5.4424   26.080   5.3405  159.603   22.937  178.300   19.908 -18.69743 30.37219 
1 1 1   11    2   60 o  213.127   12.454   35.797   4.0452   32.025   5.7817   39.415   5.6617  197.552   19.370  221.074   16.859 -23.52139 25.67897 
1 1 1   11    2   61 f   85.412   26.412   6.4851   3.8039   0.0196   5.1379   14.327   5.6586   62.267   27.495  124.120   30.096 -61.85286 40.76482 
1 1 1   11    2   62 o   61.330   24.870   2.0932   3.6384   1.3610   5.5287   2.6524   4.8323   67.235   29.126   68.633   28.341 -1.398102 40.63921 
1 1 1   11    2   63 o  103.393   25.954   9.8659   4.1011   16.860   5.7104   2.4154   5.8937  133.734   28.752   70.960   30.399 62.77381 41.84185 
1 1 1   11    3    0 o  500.528   6.5541  191.871   5.0193  191.871   5.0193  191.871   5.0193  500.528   6.5541  500.528   6.5541 0.000000 0.000000 
1 1 1   11    3    1 o  835.698   7.0764  534.745   9.0517  532.978   15.719  535.621   11.072  833.912   12.315  836.284   8.6495 -2.371704 15.04887 
1 1 1   11    3    2 o  837.714   8.7794  537.468   11.257  528.461   15.699  547.002   16.150  830.364   12.352  844.791   12.490 -14.42706 17.56630 
1 1 1   11    3    3 o  786.919   8.5147  474.247   10.256  472.085   14.495  476.415   14.513  784.846   12.066  788.441   12.026 -3.594177 17.03552 
1 1 1   11    3    4 o  524.749   7.1529  210.844   5.7452  205.361   8.1079  216.372   8.1420  517.746   10.231  531.458   10.009 -13.71130 14.31284 
1 1 1   11    3    5 o  1112.72   10.901  948.680   18.566  1007.98   27.976  902.007   24.819  1146.20   15.946  1084.44   14.953 61.76135 21.85994 
1 1 1   11    3    6 o  530.393   10.313  215.525   8.3723   0.0000   0.0000  215.525   8.3723  ?   ?   530.393   10.313 0.000000 10.31285 
1 1 1   11    3    7 o  530.642   5.2387  215.557   4.2550  205.415   5.7968  227.404   6.2653  517.941   7.3121  544.952   7.5113 -27.01025 10.48264 
1 1 1   11    3    8 o  923.473   6.1108  652.901   8.6376  650.606   13.602  654.453   11.182  921.596   9.6423  924.455   7.9022 -2.859497 12.46672 
1 1 1   11    3    9 o  687.383   4.3076  361.673   4.5321  372.897   7.0636  353.819   5.9087  697.882   6.6126  679.834   5.6783 18.04834 8.716095 
1 1 1   11    3   10 o  389.653   3.6849  116.212   2.1977  117.049   3.3567  115.584   2.9075  391.020   5.6084  388.579   4.8885 2.440948 7.439901 
1 1 1   11    3   11 o  520.255   4.2322  207.178   3.3702  198.344   4.6589  216.876   4.8811  509.000   5.9799  532.248   5.9915 -23.24799 8.465082 
1 1 1   11    3   12 f  525.093   4.0203  211.045   3.2312  208.877   4.9022  212.710   4.2967  522.339   6.1315  527.133   5.3253 -4.793335 8.121208 
1 1 1   11    3   13 o  896.846   5.1346  615.705   7.0485  600.379   10.494  628.302   9.5140  885.488   7.7427  905.895   6.8615 -20.40710 10.34547 
1 1 1   11    3   14 f  498.500   4.4575  190.213   3.4012  195.156   6.1550  188.040   4.0808  504.849   7.9652  495.627   5.3793 9.221680 9.611479 
1 1 1   11    3   15 o  359.150   3.8869   98.728   2.1367   98.465   3.0786   98.972   2.9679  358.651   5.6081  359.576   5.3925 -0.9251404 7.780131 
1 1 1   11    3   16 o  694.427   4.9633  369.119   5.2755  364.826   7.4537  373.428   7.4677  690.318   7.0543  698.411   6.9857 -8.092896 9.927873 
1 1 1   11    3   17 o  313.608   4.2114   75.277   2.0215   74.473   2.9338   76.004   2.7894  311.909   6.1452  315.103   5.7835 -3.193451 8.438725 
1 1 1   11    3   18 o  205.522   5.9091   32.333   1.8589   34.856   2.8025   30.351   2.4839  213.366   8.5813  199.104   8.1504 14.26169 11.83502 
1 1 1   11    3   19 o  1097.73   6.4972  922.430   10.917  909.849   13.266  948.819   19.213  1090.15   7.9503  1113.06   11.278 -22.90198 13.79830 
1 1 1   11    3   20 o  422.408   5.4819  136.576   3.5443  136.810   4.0484  135.809   7.3350  422.759   6.2563  421.108   11.380 1.651276 12.98622 
1 1 1   11    3   21 o  761.688   5.0586  444.072   5.8977  445.139   7.8744  442.708   8.9007  762.563   6.7464  760.451   7.6468 2.111877 10.19746 
1 1 1   11    3   22 o  178.288   7.6779   24.334   2.0952   22.989   3.4283   25.136   2.6472  172.748   13.062  180.931   9.5930 -8.183746 16.20633 
1 1 1   11    3   23 o  757.250   5.5831  438.927   6.4712  446.126   9.4267  432.512   8.8994  763.362   8.0678  751.636   7.7354 11.72644 11.17704 
1 1 1   11    3   24 f  446.991   5.5339  152.938   3.7861  148.386   4.6960  161.392   6.4001  440.267   6.9685  459.109   9.1076 -18.84299 11.46771 
1 1 1   11    3   25 o  684.158   4.8463  358.274   5.0750  360.282   7.3075  356.403   7.0534  686.020   6.9593  682.323   6.7536 3.697693 9.697602 
1 1 1   11    3   26 o  1198.28   6.2321  1099.18   11.430  1108.73   16.368  1090.09   15.970  1203.32   8.8867  1193.17   8.7443 10.14697 12.46743 
1 1 1   11    3   27 o  630.418   5.4310  304.219   5.2406  313.379   8.2932  298.130   6.7617  639.744   8.4692  624.033   7.0792 15.71143 11.03823 
1 1 1   11    3   28 o  382.208   5.8123  111.827   3.4003  109.345   4.9158  114.104   4.7083  377.889   8.4989  386.037   7.9683 -8.148163 11.65016 
1 1 1   11    3   29 o  717.472   5.6512  394.058   6.2061  401.385   8.4333  385.402   9.1659  724.037   7.6097  709.438   8.4410 14.59943 11.36471 
1 1 1   11    3   30 o  765.915   6.1777  449.099   7.2423  465.952   12.824  441.207   8.7758  779.896   10.742  759.094   7.5530 20.80200 13.13199 
1 1 1   11    3   31 o  675.228   5.8562  349.042   6.0525  345.558   9.4669  351.450   7.8713  671.694   9.2080  677.480   7.5906 -5.786255 11.93338 
1 1 1   11    3   32 o  219.360   10.436   36.866   3.5041   39.241   5.4717   35.215   4.5625  225.594   15.949  213.842   14.017 11.75264 21.23297 
1 1 1   11    3   33 o  960.238   6.4294  705.983   9.4498  702.077   12.598  711.008   14.289  957.408   8.5967  963.373   9.6905 -5.964966 12.95414 
1 1 1   11    3   34 o  315.304   7.8140   76.142   3.7711   72.080   5.5390   79.651   5.1487  306.632   11.802  322.394   10.434 -15.76239 15.75260 
1 1 1   11    3   35 o  171.176   14.470   22.649   3.7557   17.819   6.4812   25.091   4.6083  149.165   29.432  179.921   16.933 -30.75607 33.95533 
1 1 1   11    3   36 o  511.099   6.5641  200.055   5.1351  194.866   6.8382  206.765   7.7762  504.284   8.8592  519.380   9.7816 -15.09628 13.19717 
1 1 1   11    3   37 f  549.988   6.3589  231.669   5.3531  231.289   7.3701  232.094   7.7880  549.353   8.7650  550.265   9.2466 -0.9121704 12.74073 
1 1 1   11    3   38 o   49.028   21.522  -0.7804   3.1049  -4.5957   4.4720   2.7703   4.3142   49.607   23.274   72.365   27.766 -22.75806 36.23046 
1 1 1   11    3   39 o  385.230   7.2607  113.717   4.2812  127.565   6.8845  104.984   5.4668  407.680   11.033  369.967   9.6539 37.71335 14.66012 
1 1 1   11    3   40 o  155.324   13.764   18.701   3.2385   25.207   4.7600   13.094   4.4189  179.915   17.507  127.938   23.429 51.97696 29.24725 
1 1 1   11    3   41 o  132.753   16.046   13.785   3.1943   16.301   4.5765   11.395   4.4605  143.431   21.509  118.708   25.321 24.72298 33.22360 
1 1 1   11    3   42 o  166.170   14.197   21.426   3.5764   20.498   4.9727   22.421   5.1473  161.265   20.618  168.837   20.326 -7.572083 28.95252 
1 1 1   11    3   43 o   42.046   19.707  -3.2033   3.1923  -3.2389   4.8943  -3.1770   4.2115   55.637   25.483   50.690   23.372 4.946301 34.57755 
1 1 1   11    3   44 o  390.411   7.0171  116.887   4.1932  115.815   5.9763  117.926   5.8851  388.202   10.058  391.763   9.8143 -3.560852 14.05274 
1 1 1   11    3   45 o  238.822   10.318   43.864   3.7716   38.929   4.8637   51.306   5.9734  224.055   14.256  257.116   15.246 -33.06055 20.87338 
1 1 1   11    3   46 o  139.601   15.752   15.288   3.3069   19.880   4.8271   11.227   4.5395  158.274   20.400  116.947   26.030 41.32668 33.07156 
1 1 1   11    3   47 o  541.944   7.7272  225.537   6.4098  228.447   9.5714  223.170   8.6311  544.320   11.488  538.333   10.475 5.986694 15.54672 
1 1 1   11    3   48 o  233.301   10.230   41.929   3.6532   42.160   5.3194   41.723   5.0258  232.605   15.021  231.599   14.247 1.005936 20.70256 
1 1 1   11    3   49 o  307.831   8.8671   72.907   4.1780   72.428   5.8795   73.396   5.9379  306.004   12.553  308.032   12.594 -2.028229 17.78174 
1 1 1   11    3   50 o   75.752   25.204   4.4157   3.4185   3.6323   4.9077   5.1539   4.7644   77.419   29.636   83.754   29.682 -6.335045 41.94448 
1 1 1   11    3   51 o  146.235   16.698   16.923   3.6705   12.306   5.4468   20.763   4.9678  120.472   29.722  160.880   20.651 -40.40756 36.19178 
1 1 1   11    3   52 o   91.800   24.693   7.0121   3.5453   4.6384   5.1403   9.1657   4.8962   82.228   30.579  104.115   29.421 -21.88658 42.43454 
1 1 1   11    3   53 o  221.015   13.116   38.092   4.4172   38.230   6.1101   37.942   6.3933  219.485   18.356  218.227   19.340 1.257919 26.66441 
1 1 1   11    3   54 o  304.490   9.6460   71.597   4.4956   74.438   6.9252   69.528   5.9103  308.668   14.658  298.998   12.914 9.669189 19.53532 
1 1 1   11    3   55 o  348.825   8.8004   93.875   4.6987   96.086   6.8758   91.938   6.4359  351.348   12.785  343.927   12.226 7.421021 17.69000 
1 1 1   11    3   56 o  145.135   20.201   17.145   4.3660   20.402   5.7075   12.551   6.7784  156.424   24.655  118.209   34.994 38.21561 42.80661 
1 1 1   11    3   57 o  181.434   14.747   26.041   4.0598   22.438   5.6553   29.873   5.8316  164.496   23.098  191.802   20.166 -27.30678 30.66207 
1 1 1   11    3   58 o  104.998   27.427   9.6662   4.4562   11.446   6.3575   7.9471   6.2479  111.775   34.073   96.276   34.004 15.49844 48.13777 
1 1 1   11    3   59 o  288.865   10.838   65.032   4.7920   48.981   7.4383   76.421   6.2655  244.764   20.030  311.829   13.127 -67.06450 23.94817 
1 1 1   11    3   60 o  152.184   17.527   18.866   4.0082   20.588   5.3693   16.699   6.0238  155.694   23.243  135.721   29.812 19.97325 37.80216 
1 1 1   11    3   61 o   72.466   25.889   4.2565   3.6315  -5.2146   5.0655   14.272   5.2090   49.834   23.785  125.371   27.867 -75.53715 36.63748 
1 1 1   11    3   62 o   82.008   26.308   6.0380   3.7414   13.873   5.7635   0.3320   4.9186  119.955   31.123   61.376   27.011 58.57887 41.20995 
1 1 1   11    3   63 o   53.417   23.716  -0.2461   3.8737   0.2169   5.3607  -0.7522   5.6039   62.587   27.838   61.246   27.747 1.340935 39.30477 
1 1 1   11    4    0 o  268.392   5.9492   55.219   2.4413   55.219   2.4413   55.219   2.4413  268.392   5.9492  268.392   5.9492 0.000000 0.000000 
1 1 1   11    4    1 o  374.277   9.0029  107.292   5.1576  107.292   5.1576   0.0000   0.0000  374.277   9.0029  ?   ?  0.000000 9.002946 
1 1 1   11    4    2 o  724.865   6.4943  402.285   7.2054  391.154   8.5771  428.980   13.283  714.699   7.8406  748.192   11.599 -33.49304 14.00003 
1 1 1   11    4    3 o  771.798   8.4437  456.196   9.9748  443.098   13.810  470.485   14.423  760.377   11.865  783.509   12.027 -23.13214 16.89482 
1 1 1   11    4    4 o  818.766   8.8342  513.448   11.071  513.496   15.768  513.402   15.548  818.477   12.587  818.419   12.412 0.5725098E-01 17.67703 
1 1 1   11    4    5 o  903.585   9.4245  625.407   13.035  611.471   18.062  640.553   18.830  893.080   13.213  914.041   13.459 -20.96106 18.86054 
1 1 1   11    4    6 o  693.154   6.6902  367.868   7.0981  357.497   8.5234  391.334   12.821  683.241   8.1503  714.593   11.722 -31.35181 14.27697 
1 1 1   11    4    7 o  585.948   6.3046  262.862   5.6544  257.964   6.8427  273.407   10.040  580.408   7.7024  597.348   10.981 -16.94000 13.41305 
1 1 1   11    4    8 o  853.622   7.5670  557.973   9.8869  560.278   12.169  553.495   16.959  855.262   9.2955  849.724   13.040 5.537964 16.01366 
1 1 1   11    4    9 o  562.940   3.9672  242.566   3.4184  235.092   5.1223  248.568   4.5900  554.143   6.0391  569.829   5.2626 -15.68597 8.010315 
1 1 1   11    4   10 f  1204.15   6.2300  1110.10   11.483  1103.71   17.406  1115.02   15.279  1200.40   9.4735  1206.65   8.2724 -6.253662 12.57695 
1 1 1   11    4   11 o  202.909   5.0177   31.517   1.5584   36.959   2.2111   26.145   2.1967  219.713   6.5749  184.782   7.7669 34.93044 10.17617 
1 1 1   11    4   12 o  571.887   4.1339  250.337   3.6186  250.322   5.5474  250.348   4.7742  571.814   6.3382  571.868   5.4542 -0.5456543E-01 8.361872 
1 1 1   11    4   13 o  597.137   4.2424  272.930   3.8775  274.228   5.9582  271.977   5.1071  598.495   6.5040  596.060   5.5977 2.435120 8.581180 
1 1 1   11    4   14 o  912.807   5.6501  637.827   7.8942  624.422   13.456  644.862   9.7479  902.948   9.7360  917.770   6.9392 -14.82214 11.95587 
1 1 1   11    4   15 o  949.742   7.1182  690.568   10.348  689.399   21.171  690.935   11.861  948.393   14.585  949.941   8.1574 -1.548035 16.71080 
1 1 1   11    4   16 o  701.576   4.6289  376.747   4.9708  379.749   6.6812  373.025   7.4393  704.326   6.1974  698.039   6.9628 6.286926 9.321383 
1 1 1   11    4   17 o  628.313   4.2256  302.162   4.0638  308.418   5.8966  296.503   5.6084  634.747   6.0692  622.370   5.8874 12.37708 8.455570 
1 1 1   11    4   18 o  935.431   5.8323  669.806   8.3507  671.389   11.877  668.257   11.744  936.443   8.2860  934.259   8.2125 2.183716 11.66629 
1 1 1   11    4   19 f  565.982   4.5162  245.185   3.9124  248.769   5.2942  240.872   5.8075  570.079   6.0672  560.943   6.7639 9.135071 9.086375 
1 1 1   11    4   20 o  817.864   5.5854  512.005   6.9921  516.980   8.6500  502.625   11.877  821.792   6.8768  810.207   9.5769 11.58557 11.79009 
1 1 1   11    4   21 o  242.761   5.7438   45.110   2.1343   45.145   2.9272   45.071   3.1185  242.836   7.8753  242.631   8.3971 0.2053528 11.51225 
1 1 1   11    4   22 o   85.667   15.616   5.7998   1.9722   8.0804   3.2168   4.4263   2.4963  100.718   21.520   74.924   20.950 25.79388 30.03362 
1 1 1   11    4   23 o  430.216   5.4146  141.672   3.5655  136.980   4.4385  150.209   5.9871  423.011   6.8551  442.929   8.8310 -19.91818 11.17938 
1 1 1   11    4   24 o  495.985   5.0178  188.296   3.8093  182.263   5.0605  196.185   5.7867  487.945   6.7756  506.223   7.4683 -18.27792 10.08384 
1 1 1   11    4   25 o  250.270   6.5925   47.948   2.5254   46.086   3.7206   49.539   3.4389  245.320   9.9087  254.361   8.8328 -9.040604 13.27404 
1 1 1   11    4   26 o  660.868   4.9461  334.303   5.0032  330.703   7.1384  337.778   7.0143  657.244   7.0959  664.244   6.8990 -6.999451 9.896879 
1 1 1   11    4   27 o  311.407   6.5617   74.238   3.1276   73.836   4.9352   74.509   4.0433  310.490   10.384  311.942   8.4682 -1.451721 13.39952 
1 1 1   11    4   28 o  393.992   5.6996  118.829   3.4372  122.289   5.1384  116.026   4.6240  399.630   8.4004  389.278   7.7605 10.35196 11.43644 
1 1 1   11    4   29 o  196.762   10.384   29.738   3.1163   31.332   4.3811   28.105   4.4336  201.666   14.286  190.844   15.307 10.82205 20.93734 
1 1 1   11    4   30 o  209.186   10.372   33.520   3.3209   34.859   5.6640   32.819   4.0994  212.415   17.579  206.521   13.035 5.893799 21.88451 
1 1 1   11    4   31 o  1461.97   7.3097  1636.56   16.357  1636.31   23.264  1636.80   23.003  1461.48   10.400  1461.72   10.281 -0.2366943 14.62394 
1 1 1   11    4   32 o  1229.38   6.6055  1157.20   12.430  1155.89   17.734  1158.45   17.426  1228.41   9.4320  1229.79   9.2577 -1.379517 13.21619 
1 1 1   11    4   33 o  1056.79   7.1261  855.183   11.527  849.016   16.242  861.440   16.361  1052.67   10.081  1060.34   10.081 -7.673950 14.25634 
1 1 1   11    4   34 o  631.439   6.0216  305.281   5.8199  309.606   9.1086  302.298   7.5657  635.691   9.3613  628.245   7.8677 7.445862 12.22844 
1 1 1   11    4   35 o  162.090   16.618   20.396   4.0647   15.679   6.8412   22.970   5.0534  139.339   32.648  171.679   19.581 -32.34021 38.06971 
1 1 1   11    4   36 o  410.589   7.0725  129.125   4.4448  128.897   6.2649  129.357   6.3071  410.059   9.9815  410.786   10.031 -0.7265015 14.15101 
1 1 1   11    4   37 f  473.273   6.6560  171.564   4.8216  175.329   6.7854  167.724   6.8527  478.251   9.2694  467.739   9.5717 10.51242 13.32441 
1 1 1   11    4   38 o  300.146   7.9992   69.040   3.6749   66.667   5.3975   71.090   5.0175  294.693   11.966  304.402   10.769 -9.708832 16.09839 
1 1 1   11    4   39 o  257.547   9.4270   50.873   3.7162   51.200   5.8123   50.646   4.8331  257.549   14.806  256.780   12.297 0.7698364 19.24699 
1 1 1   11    4   40 o  221.757   9.8763   37.736   3.3523   33.842   4.9239   41.100   4.5768  209.037   15.500  230.843   13.006 -21.80634 20.23359 
1 1 1   11    4   41 o  366.718   7.5553  103.101   4.2409   99.930   5.7895  106.772   6.2296  360.743   10.485  372.837   10.916 -12.09363 15.13605 
1 1 1   11    4   42 o  424.179   7.1969  137.943   4.6727  129.813   7.9982  142.156   5.7574  410.724   12.722  430.429   8.7389 -19.70453 15.43463 
1 1 1   11    4   43 o  238.060   9.4036   43.517   3.4265   49.991   5.2050   38.566   4.5520  254.370   13.416  223.337   13.378 31.03334 18.94585 
1 1 1   11    4   44 o  242.549   9.2431   45.185   3.4315   49.030   5.1271   42.064   4.6184  251.827   13.349  233.265   12.987 18.56230 18.62406 
1 1 1   11    4   45 o   46.144   21.106  -2.1812   3.3416  -6.6256   4.4022   3.8613   5.1330   44.704   21.554   80.256   30.407 -35.55252 37.27122 
1 1 1   11    4   46 o  395.828   7.7879  120.286   4.7184  112.401   7.7766  124.880   5.9359  381.488   13.318  402.984   9.6233 -21.49646 16.43106 
1 1 1   11    4   47 o  455.255   7.2963  159.102   5.0842  168.373   7.0614  149.123   7.3263  467.741   9.8632  439.926   10.880 27.81522 14.68539 
1 1 1   11    4   48 o  345.963   7.7947   91.954   4.1276   95.670   6.0410   88.700   5.6529  352.163   11.207  339.167   10.889 12.99622 15.62598 
1 1 1   11    4   49 o  332.249   8.3597   84.885   4.2513   92.332   6.0101   77.426   6.0145  345.826   11.354  316.413   12.419 29.41299 16.82680 
1 1 1   11    4   50 o  374.517   7.7732  107.820   4.4560   99.802   6.4388  115.189   6.1730  359.321   11.707  386.422   10.437 -27.10141 15.68384 
1 1 1   11    4   51 o   39.966   19.254  -5.1224   3.4968 -10.0088   5.2248  -1.1580   4.7062   44.975   22.077   59.048   26.182 -14.07351 34.24783 
1 1 1   11    4   52 o  173.540   14.359   23.601   3.7799   26.804   5.4200   20.569   5.2740  183.240   19.630  159.310   22.235 23.93086 29.66008 
1 1 1   11    4   53 o  162.823   17.131   21.041   4.2055   21.327   5.8065   20.726   6.0992  161.155   24.294  158.012   26.131 3.142776 35.67993 
1 1 1   11    4   54 o  134.033   19.504   14.520   3.8839   13.425   5.7260   15.454   5.2857  124.682   30.301  135.606   26.415 -10.92374 40.19828 
1 1 1   11    4   55 o  158.189   16.498   19.892   3.9360   21.689   5.6314   18.175   5.5033  162.407   23.323  147.555   25.276 14.85172 34.39275 
1 1 1   11    4   56 o   60.266   25.738   0.4802   4.2017  -3.5800   5.5408   5.9745   6.4454   57.547   26.629   90.164   34.094 -32.61710 43.26109 
1 1 1   11    4   57 o  167.335   15.600   22.269   3.9494   26.697   5.5427   17.702   5.6290  181.077   20.351  144.004   26.515 37.07257 33.42439 
1 1 1   11    4   58 o  203.682   13.851   32.760   4.2925   28.697   5.5741   38.680   6.7287  187.639   19.702  217.609   20.441 -29.97070 28.39049 
1 1 1   11    4   59 o  232.331   11.447   42.163   4.0707   41.545   5.6585   42.826   5.8605  227.735   16.342  231.018   16.686 -3.283279 23.35544 
1 1 1   11    4   60 f  205.829   13.326   33.554   4.1758   37.273   5.6401   29.042   6.2123  214.547   17.323  185.939   22.271 28.60780 28.21472 
1 1 1   11    4   61 o   44.318   20.852  -3.1352   3.6332  -3.1206   5.0979  -3.1502   5.1793   54.148   25.222   54.562   25.417 -0.4145355 35.80757 
1 1 1   11    4   62 o   77.457   26.213   5.2627   3.6973   7.3426   5.5259   3.5767   4.9751   88.932   31.918   72.455   29.187 16.47715 43.25056 
1 1 1   11    4   63 o   80.962   27.320   5.9759   4.0161   6.1969   5.5956   5.7411   5.7677   83.219   31.695   81.680   31.894 1.539207 44.96489 
1 1 1   11    5    0 o  163.617   6.6816   20.595   1.6670   20.595   1.6670   20.595   1.6670  163.617   6.6816  163.617   6.6816 0.000000 0.000000 
1 1 1   11    5    1 o  638.398   5.2077  311.990   5.0887  311.710   7.2054  312.268   7.1876  638.025   7.3782  638.597   7.3534 -0.5722046 10.41688 
1 1 1   11    5    2 o  573.422   7.2099  251.776   6.3281  241.972   8.7034  262.772   9.2172  562.006   10.118  585.653   10.282 -23.64697 14.42538 
1 1 1   11    5    3 o  522.726   5.6368  209.182   4.5100  207.162   5.4186  213.737   8.1365  520.158   6.8058  528.204   10.064 -8.046265 12.14913 
1 1 1   11    5    4 o  1001.27   10.092  768.037   15.466  759.703   21.698  776.644   22.052  995.330   14.242  1006.35   14.316 -11.02588 20.19372 
1 1 1   11    5    5 o  1207.09   16.476  1118.10   30.441   0.0000   0.0000  1118.10   30.441  ?   ?   1207.09   16.476 0.000000 16.47560 
1 1 1   11    5    6 o  146.918   8.3755   16.584   1.8757   17.685   2.3247   14.531   3.1751  151.604   10.075  136.773   15.437 14.83096 18.43364 
1 1 1   11    5    7 o  1588.54   11.978  1933.92   29.124  1920.85   35.383  1961.38   51.288  1582.62   14.606  1597.48   20.975 -14.85791 25.55991 
1 1 1   11    5    8 o  640.558   6.6398  314.153   6.5100  311.302   7.9415  319.994   11.367  637.577   8.1376  646.213   11.492 -8.635376 14.08141 
1 1 1   11    5    9 o  547.771   4.7811  229.684   4.0086  229.681   5.1270  229.689   6.4297  547.729   6.1155  547.685   7.6699 0.4449463E-01 9.809545 
1 1 1   11    5   10 o  610.360   4.9827  285.173   4.6550  286.141   5.9670  283.669   7.4404  611.351   6.3767  608.640   7.9866 2.710876 10.22002 
1 1 1   11    5   11 o  964.952   5.7468  712.814   8.4880  719.497   12.156  706.455   11.857  969.322   8.1931  960.505   8.0653 8.816467 11.49672 
1 1 1   11    5   12 o  766.985   4.6963  450.291   5.5133  450.028   8.4385  450.488   7.2825  766.666   7.1910  767.100   6.2024 -0.4340820 9.496336 
1 1 1   11    5   13 o  446.470   4.7411  152.581   3.2400  154.444   5.2098  151.406   4.1374  449.127   7.5784  444.723   6.0780 4.403534 9.714686 
1 1 1   11    5   14 o  153.132   5.8318   17.950   1.3669   15.332   2.3050   19.371   1.6976  141.073   10.756  159.065   6.9725 -17.99261 12.81803 
1 1 1   11    5   15 o  930.191   6.3104  662.371   8.9846  667.367   14.527  659.276   11.434  933.492   10.167  927.937   8.0501 5.554626 12.96801 
1 1 1   11    5   16 o  308.318   4.7484   72.761   2.2409   77.981   3.3887   68.705   2.9872  319.159   6.9368  299.582   6.5145 19.57724 9.516204 
1 1 1   11    5   17 o  623.476   4.8734  297.536   4.6507  295.741   6.6363  299.269   6.5195  621.546   6.9756  625.247   6.8123 -3.700684 9.750207 
1 1 1   11    5   18 o  1079.27   6.4045  891.653   10.580  919.255   18.754  878.768   12.813  1095.58   11.184  1071.38   7.8136 24.20569 13.64292 
1 1 1   11    5   19 o  836.659   4.8433  535.786   6.2024  546.067   8.9640  526.344   8.5910  844.592   6.9340  829.204   6.7688 15.38794 9.690043 
1 1 1   11    5   20 o  1456.16   7.4736  1623.25   16.657  1622.71   21.982  1623.97   25.528  1455.76   9.8652  1456.19   11.453 -0.4311523 15.11635 
1 1 1   11    5   21 o  825.711   5.7161  521.880   7.2244  536.703   10.424  508.181   10.021  837.281   8.1341  814.733   8.0359 22.54785 11.43412 
1 1 1   11    5   22 o  458.483   5.1684  160.898   3.6270  156.444   4.4955  169.204   6.1391  452.074   6.4969  470.110   8.5316 -18.03622 10.72371 
1 1 1   11    5   23 o  625.993   5.3209  299.949   5.0983  300.813   6.3707  298.412   8.5024  626.865   6.6396  624.296   8.8977 2.568665 11.10198 
1 1 1   11    5   24 o  729.575   4.9162  407.420   5.4900  408.898   7.7859  405.958   7.7422  730.844   6.9601  728.213   6.9460 2.631470 9.833149 
1 1 1   11    5   25 o  676.956   4.8792  350.773   5.0557  346.665   7.1943  354.782   7.1062  672.927   6.9847  680.764   6.8198 -7.837524 9.761974 
1 1 1   11    5   26 f  1355.23   6.7695  1406.06   14.042  1394.84   19.742  1417.54   19.978  1349.61   9.5569  1360.54   9.5933 -10.93018 13.54127 
1 1 1   11    5   27 o  1506.42   7.8558  1737.50   18.114  1719.39   27.513  1751.36   24.065  1498.10   11.999  1512.17   10.397 -14.06104 15.87661 
1 1 1   11    5   28 o  229.530   7.9764   40.340   2.8023   38.460   4.0935   41.998   3.8444  223.729   11.997  234.154   10.727 -10.42444 16.09338 
1 1 1   11    5   29 o  413.233   6.5393  130.732   4.1361  129.669   5.9843  131.704   5.7232  411.469   9.5018  414.701   9.0164 -3.231903 13.09885 
1 1 1   11    5   30 o  762.948   5.7155  445.610   6.6745  453.861   10.552  440.107   8.6172  769.818   8.9556  758.148   7.4258 11.67053 11.63378 
1 1 1   11    5   31 o  409.652   6.2383  128.479   3.9116  132.518   5.8547  125.222   5.2570  415.951   9.1959  404.363   8.4937 11.58807 12.51826 
1 1 1   11    5   32 o  494.800   5.8959  187.437   4.4653  178.091   6.5903  195.369   6.0714  482.194   8.9292  505.091   7.8533 -22.89642 11.89134 
1 1 1   11    5   33 o  472.081   6.6432  170.645   4.8002  170.657   6.4672  170.629   7.1631  472.001   8.9517  471.913   9.9167 0.8813477E-01 13.35939 
1 1 1   11    5   34 o  1123.06   6.8348  965.848   11.749  959.869   18.293  970.046   15.328  1119.09   10.680  1125.26   8.8996 -6.170410 13.90175 
1 1 1   11    5   35 o  222.654   10.847   38.006   3.6966   40.310   5.4370   36.026   5.0411  228.560   15.635  216.051   15.344 12.50920 21.90638 
1 1 1   11    5   36 o  484.999   6.8652  180.165   5.0964  183.925   7.6172  177.117   6.8574  489.801   10.160  480.718   9.3196 9.083160 13.78718 
1 1 1   11    5   37 o  258.662   8.8736   51.282   3.5132   55.608   5.3334   47.966   4.6694  269.120   12.947  249.989   12.203 19.13094 17.79190 
1 1 1   11    5   38 o  283.535   8.2780   61.618   3.5925   63.595   5.3512   59.996   4.8473  287.798   12.148  279.595   11.327 8.202667 16.60900 
1 1 1   11    5   39 o  259.344   9.1438   51.581   3.6297   48.888   5.8561   53.262   4.6253  251.559   15.281  263.378   11.473 -11.81923 19.10907 
1 1 1   11    5   40 o  248.296   8.8644   47.286   3.3689   49.296   5.1475   45.780   4.4557  252.819   13.349  244.093   11.926 8.726028 17.90062 
1 1 1   11    5   41 o  379.540   7.4983  110.437   4.3560  116.463   5.9984  103.713   6.3362  389.485   10.062  367.400   11.267 22.08456 15.10595 
1 1 1   11    5   42 o  297.778   8.4911   68.031   3.8701   71.874   6.5695   65.989   4.7895  305.412   14.053  293.063   10.677 12.34937 17.64918 
1 1 1   11    5   43 o  370.086   7.0577  105.021   3.9979  104.462   5.9432  105.483   5.4032  368.668   10.532  370.608   9.5250 -1.939880 14.20038 
1 1 1   11    5   44 o  325.195   7.5910   81.133   3.7784   85.407   5.5559   77.455   5.1538  333.219   10.893  317.367   10.609 15.85101 15.20591 
1 1 1   11    5   45 o   44.500   20.549  -2.5406   3.2742   1.8491   4.3470  -8.2965   4.9777   67.903   27.307   46.147   22.409 21.75616 35.32465 
1 1 1   11    5   46 o  438.799   7.4449  147.787   5.0003  148.310   8.4189  147.503   6.2153  438.402   12.546  438.026   9.2702 0.3766785 15.59949 
1 1 1   11    5   47 o  400.483   7.5331  123.154   4.6177  126.041   6.3635  119.942   6.7111  404.574   10.276  394.459   11.115 10.11438 15.13775 
1 1 1   11    5   48 o  369.895   7.9135  105.134   4.4804  110.976   6.3237   99.246   6.3489  379.353   10.891  358.570   11.568 20.78293 15.88789 
1 1 1   11    5   49 o  461.011   6.9607  163.195   4.9117  165.676   7.1381  160.963   6.7690  463.667   10.058  457.142   9.6739 6.524780 13.95515 
1 1 1   11    5   50 o  527.595   6.7440  213.748   5.4461  212.487   7.9445  214.867   7.4804  525.025   9.8859  528.192   9.2525 -3.166931 13.54037 
1 1 1   11    5   51 o  123.491   19.669   12.297   3.5931   10.202   5.3653   14.000   4.8383  109.667   30.731  130.074   25.212 -20.40696 39.74988 
1 1 1   11    5   52 o  300.334   9.1679   69.527   4.2145   63.343   6.0371   75.405   5.8861  285.376   13.821  311.876   12.330 -26.50046 18.52187 
1 1 1   11    5   53 o   89.749   27.450   6.6763   4.1218   13.568   5.7530  -0.5924   5.9082  125.660   30.270   67.544   29.668 58.11593 42.38453 
1 1 1   11    5   54 o   46.058   21.536  -3.3326   3.7742  -2.9144   5.7797  -3.6435   4.9835   60.854   27.805   54.157   25.129 6.697483 37.47743 
1 1 1   11    5   55 o   51.496   23.038  -1.2151   3.7281  -1.6882   5.2860  -0.7469   5.2588   60.655   27.262   63.029   27.825 -2.373989 38.95449 
1 1 1   11    5   56 o  191.638   15.724   29.094   4.5717   25.058   5.9146   35.083   7.2057  174.597   22.667  206.673   23.178 -32.07574 32.41887 
1 1 1   11    5   57 o   52.986   24.045  -1.8211   4.2298  -2.6594   6.7637  -1.2826   5.4204   65.989   30.123   61.939   27.739 4.049889 40.94937 
1 1 1   11    5   58 o  117.710   23.467   11.773   4.0797   14.627   5.2403   7.3825   6.5005  129.493   27.299   94.117   34.496 35.37609 43.99139 
1 1 1   11    5   59 o   95.869   25.375   8.0280   3.7818   4.5554   5.2753   11.700   5.4244   79.519   30.654  113.387   30.562 -33.86839 43.28646 
1 1 1   11    5   60 o  210.039   13.151   34.923   4.2065   31.274   5.6201   39.572   6.3430  195.200   19.053  219.750   19.046 -24.55048 26.94049 
1 1 1   11    5   61 o  127.609   19.374   13.649   3.6653   14.252   5.1506   13.030   5.2170  125.204   27.618  118.630   28.979 6.574059 40.03195 
1 1 1   11    5   62 o  103.831   24.455   9.6882   3.8225   9.5945   5.6402   9.7677   5.1984   99.010   32.347  100.547   30.841 -1.537285 44.69271 
1 1 1   11    5   63 o   68.500   26.398   3.5752   3.9112   1.9023   5.3236   5.5374   5.7655   67.194   28.841   80.831   31.792 -13.63734 42.92467 
1 1 1   11    6    0 o  482.439   6.6059  178.263   4.8759  178.263   4.8759  178.263   4.8759  482.439   6.6059  482.439   6.6059 0.000000 0.000000 
1 1 1   11    6    1 o  365.887   6.2201  102.494   3.4835  102.494   3.4835   0.0000   0.0000  365.887   6.2201  ?   ?  0.000000 6.220077 
1 1 1   11    6    2 o  177.652   7.0751   24.165   1.9239   24.165   1.9239   0.0000   0.0000  177.652   7.0751  ?   ?  0.000000 7.075090 
1 1 1   11    6    3 o  155.655   9.0763   18.620   2.1530   16.000   2.9562   21.581   3.1420  143.822   13.590  167.345   12.354 -23.52290 18.36590 
1 1 1   11    6    4 o  411.348   5.3597  129.533   3.3746  124.782   3.9528  142.303   6.4805  403.710   6.3968  431.006   9.8232 -27.29678 11.72239 
1 1 1   11    6    5 o  510.370   6.8234  199.437   5.3304  195.102   6.9467  205.643   8.3124  504.709   8.9922  518.092   10.482 -13.38223 13.81066 
1 1 1   11    6    6 f  329.487   6.1444   83.114   3.0988   81.857   3.7331   85.900   5.5568  326.957   7.4595  334.835   10.842 -7.877319 13.16059 
1 1 1   11    6    7 o   78.793   15.683   4.9307   1.8249   4.9599   2.1535   4.8564   3.4374   78.812   18.217   79.957   25.171 -1.144958 31.07099 
1 1 1   11    6    8 o  185.678   8.1728   26.402   2.3228   25.188   2.7835   29.185   4.2151  181.049   10.085  194.580   14.252 -13.53040 17.45885 
1 1 1   11    6    9 o  264.700   4.7556   53.633   1.9268   54.035   2.4111   52.923   3.2050  265.674   5.9293  262.894   7.9650 2.779907 9.929598 
1 1 1   11    6   10 o  600.904   5.5956  276.419   5.1466  281.783   7.2129  270.855   7.3458  606.630   7.7681  594.739   8.0694 11.89130 11.20085 
1 1 1   11    6   11 o  700.544   6.8012  375.731   7.2927  383.372   9.0618  361.687   12.286  707.560   8.3673  687.068   11.683 20.49200 14.36985 
1 1 1   11    6   12 o  390.212   4.8673  116.553   2.9071  113.884   3.5911  121.627   4.9517  385.698   6.0829  398.551   8.1171 -12.85272 10.14345 
1 1 1   11    6   13 o  408.595   4.0094  127.784   2.5075  132.451   3.9420  124.613   3.2497  415.956   6.1916  403.476   5.2620 12.48029 8.125559 
1 1 1   11    6   14 o  850.880   5.9728  554.221   7.7788  586.245   13.167  537.051   9.6413  874.934   9.8319  837.536   7.5207 37.39764 12.37855 
1 1 1   11    6   15 f  892.656   5.6135  609.952   7.6699  608.719   10.890  611.167   10.804  891.661   7.9793  893.455   7.9004 -1.794678 11.22877 
1 1 1   11    6   16 o  1008.55   6.0712  778.623   9.3721  773.471   13.209  783.846   13.300  1005.09   8.5858  1011.81   8.5880 -6.718323 12.14369 
1 1 1   11    6   17 o  1215.69   6.9258  1131.37   12.887  1127.56   22.097  1133.33   15.865  1213.31   11.898  1216.66   8.5192 -3.344116 14.63388 
1 1 1   11    6   18 o   68.377   14.160   3.7152   1.4332   4.7325   2.7431   3.3333   1.6809   77.588   22.055   64.750   16.811 12.83805 27.73195 
1 1 1   11    6   19 o  494.713   4.8377  187.327   3.6632  185.073   6.4277  188.411   4.4581  491.663   8.5411  496.127   5.8707 -4.464020 10.36416 
1 1 1   11    6   20 o  320.487   5.5757   78.620   2.7352   76.116   3.9279   80.977   3.8109  315.312   8.1387  325.232   7.6553 -9.919434 11.17330 
1 1 1   11    6   21 o  1022.34   6.3484  800.055   9.9340  834.516   14.635  770.611   13.528  1044.00   9.1585  1003.25   8.8095 40.75238 12.70769 
1 1 1   11    6   22 o  519.171   4.4784  206.305   3.5588  214.588   5.1969  198.991   4.8835  529.460   6.4127  509.859   6.2576 19.60159 8.959952 
1 1 1   11    6   23 o  916.891   6.0413  643.528   8.4785  658.455   10.697  618.300   13.906  927.410   7.5355  898.569   10.111 28.84131 12.60977 
1 1 1   11    6   24 o  320.973   5.6120   78.861   2.7571   84.379   3.9058   73.380   3.8925  331.984   7.6864  309.585   8.2144 22.39920 11.24979 
1 1 1   11    6   25 o  691.638   5.1975  366.162   5.5023  359.187   7.2981  375.349   8.3756  684.971   6.9609  700.183   7.8151 -15.21216 10.46566 
1 1 1   11    6   26 o  813.455   5.2131  506.511   6.4908  503.581   9.1973  509.419   9.1617  811.021   7.4090  815.712   7.3378 -4.690491 10.42770 
1 1 1   11    6   27 o  439.353   6.1900  147.771   4.1627  159.794   8.3642  143.813   4.7992  456.701   11.965  433.407   7.2345 23.29416 13.98231 
1 1 1   11    6   28 o  858.620   6.1595  564.379   8.0949  567.657   11.614  561.282   11.289  860.976   8.8128  856.138   8.6147 4.837341 12.32393 
1 1 1   11    6   29 o  705.037   5.2583  380.509   5.6745  389.268   8.3984  373.151   7.6973  713.011   7.6954  698.116   7.2034 14.89581 10.54081 
1 1 1   11    6   30 o  401.200   6.4013  123.232   3.9309  124.117   6.3265  122.675   5.0169  402.521   10.268  400.246   8.1892 2.275513 13.13405 
1 1 1   11    6   31 o  213.046   9.4735   34.767   3.0893   39.807   4.7528   31.080   4.0651  227.446   13.716  200.910   13.294 26.53609 19.10170 
1 1 1   11    6   32 f  388.617   7.0888  115.642   4.2166  120.558   5.8559  110.349   6.0765  396.700   9.6442  379.500   10.461 17.20023 14.22823 
1 1 1   11    6   33 f  149.323   15.500   17.296   3.4911   19.186   4.8232   15.217   5.0595  156.607   20.623  138.453   24.785 18.15349 32.24247 
1 1 1   11    6   34 o  331.373   7.9925   84.110   4.0539   81.765   7.1643   85.214   4.9167  326.410   14.340  333.477   9.6324 -7.066193 17.27452 
1 1 1   11    6   35 o  955.432   6.8628  699.122   10.036  716.756   12.868  671.739   16.036  967.195   8.6922  935.973   11.193 31.22235 14.17184 
1 1 1   11    6   36 o  458.518   6.5419  161.020   4.5913  164.744   6.4227  157.129   6.5657  463.630   9.0506  452.757   9.4742 10.87335 13.10245 
1 1 1   11    6   37 o  473.028   6.4234  171.385   4.6507  166.650   7.0809  174.977   6.1676  466.181   9.9235  477.817   8.4330 -11.63516 13.02274 
1 1 1   11    6   38 o  343.285   7.4045   90.301   3.8906   91.476   6.0939   89.491   5.0550  345.207   11.533  341.594   9.6680 3.613190 15.04933 
1 1 1   11    6   39 o  240.681   9.5420   44.436   3.5152   44.803   5.7194   44.213   4.4562  240.709   15.608  239.594   12.192 1.115387 19.80478 
1 1 1   11    6   40 o  323.349   7.2741   80.139   3.6002   82.437   5.4015   78.302   4.8292  327.655   10.770  319.417   9.8775 8.238190 14.61383 
1 1 1   11    6   41 o  232.809   10.241   41.619   3.6492   39.040   5.0523   44.432   5.2764  224.599   14.779  239.725   14.447 -15.12662 20.66749 
1 1 1   11    6   42 o  364.818   7.2191  102.045   4.0311  111.306   6.5045   96.270   5.1365  380.524   11.168  354.108   9.4768 26.41556 14.64673 
1 1 1   11    6   43 o  360.341   7.0132   99.565   3.8681  107.008   5.7495   93.410   5.2283  373.185   10.066  348.705   9.7956 24.47937 14.04525 
1 1 1   11    6   44 o  220.465   9.7468   37.352   3.2891   35.385   4.7355   39.186   4.5717  213.555   14.574  225.023   13.333 -11.46722 19.75277 
1 1 1   11    6   45 o  500.925   6.8779  192.478   5.2735  197.668   7.0815  186.016   7.9013  507.194   9.1218  491.697   10.499 15.49762 13.90784 
1 1 1   11    6   46 o  434.617   7.3609  144.982   4.8968  144.879   8.3387  145.037   6.0497  433.257   12.574  434.366   9.0994 -1.108337 15.52135 
1 1 1   11    6   47 o  408.633   7.5177  128.225   4.7021  131.957   6.5308  124.208   6.7755  413.925   10.308  401.404   11.028 12.52121 15.09526 
1 1 1   11    6   48 o   77.529   24.492   4.7463   3.2522   2.6333   4.5688   6.9169   4.6306   71.866   28.290   92.633   29.221 -20.76738 40.67141 
1 1 1   11    6   49 o  417.520   7.1854  133.891   4.5920  131.567   6.6849  135.967   6.3186  413.021   10.574  420.092   9.8267 -7.070618 14.43534 
1 1 1   11    6   50 o  122.123   18.957   11.973   3.4287   12.730   5.0666   11.334   4.6571  123.312   27.540  116.485   26.692 6.826691 38.35238 
1 1 1   11    6   51 o   75.966   25.728   4.4117   3.5616   11.199   5.4897  -0.5220   4.6803  114.660   30.678   60.743   26.549 53.91696 40.57122 
1 1 1   11    6   52 o  155.745   16.718   19.212   3.9230   21.735   5.2235   15.947   5.9416  164.141   21.293  137.168   29.196 26.97289 36.13536 
1 1 1   11    6   53 o  200.141   13.457   31.306   4.0984   25.069   6.2944   35.896   5.4000  174.928   24.153  213.225   16.679 -38.29756 29.35178 
1 1 1   11    6   54 o   47.050   21.639  -2.3501   3.5790  -5.1821   5.2768   0.0627   4.8706   52.878   24.955   63.292   27.378 -10.41400 37.04476 
1 1 1   11    6   55 o   71.022   26.229   3.4924   3.7690   6.6103   5.4199   0.5730   5.2447   90.783   31.700   66.807   28.649 23.97647 42.72805 
1 1 1   11    6   56 o  105.189   26.207   9.4872   4.2039   15.104   5.3961   0.8140   6.7055  132.687   27.474   74.403   32.154 58.28415 42.29299 
1 1 1   11    6   57 o   70.381   27.282   3.1107   4.1963   2.8915   6.5985   3.2596   5.4375   79.357   32.971   76.079   30.560 3.278488 44.95547 
1 1 1   11    6   58 o  112.611   23.969   10.852   4.0047   9.9276   5.1393   12.281   6.3896  105.211   30.280  115.222   33.938 -10.01143 45.48275 
1 1 1   11    6   59 o  175.721   15.414   24.700   4.1038   19.393   5.3504   32.285   6.3960  151.014   23.946  197.244   21.535 -46.22984 32.20534 
1 1 1   11    6   60 o   68.064   25.737   3.3149   3.6728   0.2225   5.0289   6.8501   5.3769   62.656   27.450   88.614   31.519 -25.95785 41.79587 
1 1 1   11    6   61 o   67.046   25.272   3.3284   3.5343   9.1539   4.8907  -3.0398   5.1133   98.816   29.832   54.269   25.272 44.54701 39.09764 
1 1 1   11    6   62 o   77.466   26.207   5.2938   3.6955   7.1045   5.4116   3.7115   5.0587   87.550   31.568   73.018   29.425 14.53239 43.15494 
1 1 1   11    7    0 o  1013.03   10.002  786.001   15.506  786.001   15.506  786.001   15.506  1013.03   10.002  1013.03   10.002 0.000000 0.000000 
1 1 1   11    7    1 o  416.773   4.5523  132.962   2.9040  129.947   4.0386  136.189   4.1788  411.982   6.4045  421.758   6.4732 -9.776001 9.105997 
1 1 1   11    7    2 o  302.546   4.4281   70.065   2.0506   68.822   2.8675   71.367   2.9336  299.821   6.2484  305.314   6.2775 -5.492615 8.857183 
1 1 1   11    7    3 o  737.095   6.6850  415.980   7.5422  415.496   9.1217  417.027   13.410  736.593   8.0905  737.682   11.876 -1.089355 14.37036 
1 1 1   11    7    4 f  468.100   6.7317  167.767   4.8232  158.679   6.1487  182.303   7.7764  455.176   8.8253  487.811   10.415 -32.63547 13.65134 
1 1 1   11    7    5 o  899.919   7.6582  620.138   10.549  607.008   12.539  651.941   19.515  890.231   9.2018  922.126   13.826 -31.89471 16.60825 
1 1 1   11    7    6 o  305.381   7.8453   71.412   3.6671   71.509   5.0360   71.302   5.3503  305.511   10.769  305.047   11.459 0.4642639 15.72525 
1 1 1   11    7    7 o  427.125   7.7002  139.695   5.0341  135.809   6.9821  143.903   7.2650  421.031   10.834  433.391   10.952 -12.35974 15.40537 
1 1 1   11    7    8 o  613.233   6.3667  287.902   5.9760  279.996   6.9908  309.359   11.517  604.711   7.5528  635.396   11.842 -30.68488 14.04524 
1 1 1   11    7    9 o  448.520   6.4017  154.012   4.3949  152.172   5.2893  158.115   7.8983  445.797   7.7516  454.284   11.359 -8.487518 13.75177 
1 1 1   11    7   10 o  262.339   5.2672   52.682   2.1150   51.931   2.4020   55.274   4.4619  260.453   6.0253  268.616   10.852 -8.163513 12.41263 
1 1 1   11    7   11 o  435.818   4.7460  145.387   3.1659  146.169   3.9853  144.050   5.2123  436.966   5.9586  433.744   7.8511 3.222656 9.856209 
1 1 1   11    7   12 o  328.969   4.8755   82.837   2.4550   82.395   3.0776   83.609   4.0709  328.074   6.1287  330.449   8.0485 -2.375153 10.11625 
1 1 1   11    7   13 o  800.943   5.8015  491.070   7.1124  497.451   9.2156  481.670   11.185  806.069   7.4694  793.101   9.2135 12.96832 11.86089 
1 1 1   11    7   14 o  329.914   6.0645   83.319   3.0624   83.623   4.4281   83.041   4.2399  330.473   8.7541  329.326   8.4113 1.146210 12.14018 
1 1 1   11    7   15 o  802.115   5.3922  492.481   6.6202  496.994   9.3546  487.954   9.3702  805.713   7.5853  798.348   7.6680 7.364624 10.78594 
1 1 1   11    7   16 o  111.973   7.6896   9.6440   1.3099   10.279   2.2316   9.3101   1.6180  115.122   12.886  109.835   9.7247 5.286522 16.14342 
1 1 1   11    7   17 f  552.240   4.6848  233.425   3.9600  240.427   6.8797  229.956   4.8426  560.396   8.0205  548.103   5.7723 12.29266 9.881735 
1 1 1   11    7   18 o  858.477   5.2172  564.106   6.8555  552.095   10.288  573.697   9.1939  849.209   7.9153  865.697   6.9385 -16.48761 10.52588 
1 1 1   11    7   19 o  1188.49   6.3954  1081.24   11.634  1097.18   18.061  1069.94   15.210  1197.04   9.8577  1182.17   8.4058 14.87268 12.95499 
1 1 1   11    7   20 o  406.117   5.7799  126.246   3.5929  127.646   4.5963  124.047   5.7610  408.340   7.3538  402.506   9.3509 5.833374 11.89611 
1 1 1   11    7   21 o  1516.12   7.7235  1759.73   17.923  1739.28   27.050  1775.73   23.930  1506.96   11.727  1522.81   10.267 -15.84338 15.58646 
1 1 1   11    7   22 o  235.104   6.1854   42.311   2.2259   42.348   3.6827   42.290   2.7939  235.163   10.231  235.030   7.7664 0.1327820 12.84510 
1 1 1   11    7   23 o  591.388   5.3031  267.705   4.8003  265.711   6.9935  269.482   6.6009  589.125   7.7557  593.304   7.2686 -4.179199 10.62936 
1 1 1   11    7   24 o  898.269   5.6315  617.645   7.7428  610.361   11.834  623.096   10.238  892.835   8.6597  902.158   7.4143 -9.322693 11.40015 
1 1 1   11    7   25 o  494.884   4.8520  187.462   3.6753  193.601   5.3506  181.979   5.0572  502.880   6.9514  487.555   6.7767 15.32492 9.707990 
1 1 1   11    7   26 o  1261.76   6.8829  1218.82   13.293  1234.91   17.961  1199.33   19.766  1269.89   9.2407  1251.37   10.319 18.52405 13.85215 
1 1 1   11    7   27 o  655.289   6.9678  328.750   6.9888  339.758   10.614  320.323   9.2861  666.020   10.411  646.740   9.3807 19.27979 14.01403 
1 1 1   11    7   28 o  156.258   11.714   18.812   2.7812   20.465   3.9197   17.135   3.9470  162.583   15.956  148.397   17.728 14.18593 23.85120 
1 1 1   11    7   29 o  636.620   5.2662  310.245   5.1315  310.085   7.4903  310.387   7.0443  636.370   7.6899  636.698   7.2282 -0.3283691 10.55376 
1 1 1   11    7   30 o  509.491   5.7600  198.722   4.4919  207.295   7.2342  193.343   5.7304  520.245   9.0847  502.496   7.4505 17.74924 11.74911 
1 1 1   11    7   31 o  531.118   5.5683  215.952   4.5267  219.875   6.7011  212.659   6.1392  535.824   8.1706  526.981   7.6111 8.843079 11.16635 
1 1 1   11    7   32 o  294.773   7.4351   66.540   3.3546   74.218   5.0194   60.342   4.5097  311.221   10.537  280.623   10.499 30.59756 14.87484 
1 1 1   11    7   33 o  724.489   6.7373  401.927   7.4712  406.048   10.956  398.345   10.215  727.963   9.8326  721.073   9.2550 6.889465 13.50319 
1 1 1   11    7   34 o  978.587   6.0358  733.265   9.0408  730.558   12.964  735.829   12.615  976.512   8.6731  980.060   8.4092 -3.547424 12.08048 
1 1 1   11    7   35 f  260.965   9.4198   52.194   3.7626   51.754   5.1999   52.678   5.4513  259.356   13.142  261.612   13.661 -2.255219 18.95602 
1 1 1   11    7   36 o  272.789   8.1043   57.018   3.3839   59.223   5.1242   55.314   4.5062  277.809   12.051  268.545   10.963 9.263947 16.29108 
1 1 1   11    7   37 o  406.243   6.4409  126.411   4.0050  136.833   6.0821  118.433   5.3216  422.450   9.4061  393.064   8.8452 29.38638 12.91175 
1 1 1   11    7   38 o  492.183   6.0250  185.551   4.5389  182.789   6.6911  187.906   6.1776  488.254   8.9533  495.120   8.1516 -6.865753 12.10827 
1 1 1   11    7   39 o  230.840   10.119   40.892   3.5753   34.067   6.3289   44.091   4.3328  208.944   20.035  239.581   11.815 -30.63719 23.25939 
1 1 1   11    7   40 o  124.365   18.183   12.197   3.3590   11.774   4.6586   12.656   4.8478  120.600   26.002  125.095   26.159 -4.495033 36.88396 
1 1 1   11    7   41 o  326.070   7.8039   81.532   3.8948   87.798   6.3812   77.812   4.9169  337.862   12.339  318.330   10.091 19.53223 15.94038 
1 1 1   11    7   42 f  209.740   10.286   33.797   3.3022   35.042   5.0726   32.881   4.3502  212.461   15.710  206.098   13.871 6.362900 20.95691 
1 1 1   11    7   43 o  410.868   6.5942  129.422   4.1470  132.166   6.1993  127.199   5.5791  414.768   9.7648  407.023   8.9552 7.744598 13.24943 
1 1 1   11    7   44 o   95.156   20.926   7.3314   2.9650   14.008   4.3893   1.7279   4.0211  132.079   22.519   65.525   26.294 66.55311 34.61952 
1 1 1   11    7   45 o  277.306   9.1589   59.097   3.8875   58.449   5.0883   60.007   6.0253  275.357   12.073  278.270   14.193 -2.913055 18.63338 
1 1 1   11    7   46 o   83.728   25.026   5.6308   3.4545   8.4339   6.3000   4.4256   4.1310  103.244   34.208   78.580   27.661 24.66499 43.99251 
1 1 1   11    7   47 o   76.369   24.804   4.5208   3.3183   0.0711   4.3245   10.892   5.1749   60.755   26.033  114.197   29.423 -53.44244 39.28668 
1 1 1   11    7   48 o  110.576   19.620   9.8597   3.1991   5.2148   4.5281   14.489   4.5203   83.560   28.987  133.596   22.931 -50.03643 36.96046 
1 1 1   11    7   49 o  191.523   12.040   28.467   3.5115   24.162   5.1341   32.251   4.8134  174.343   19.578  202.978   15.613 -28.63519 25.04066 
1 1 1   11    7   50 o  101.317   21.988   8.4350   3.3120   6.3670   4.7809   10.343   4.5925   89.642   29.805  111.071   27.225 -21.42872 40.36718 
1 1 1   11    7   51 o  170.555   14.347   22.788   3.7105   21.812   5.6782   23.515   4.9018  163.819   23.302  171.837   18.952 -8.018433 30.03603 
1 1 1   11    7   52 o  257.046   11.029   51.106   4.3394   54.783   5.7969   46.418   6.5445  264.800   14.356  242.349   17.766 22.45076 22.84171 
1 1 1   11    7   53 o   63.076   25.149   1.9043   3.6536  -2.6970   5.7020   5.1094   4.7589   61.002   27.773   82.754   29.629 -21.75264 40.61061 
1 1 1   11    7   54 o   91.702   24.919   7.0704   3.5889   8.6025   5.2554   5.7314   4.9130  100.479   31.040   85.862   30.170 14.61697 43.28687 
1 1 1   11    7   55 o  244.818   12.234   46.625   4.5844   43.157   5.9476   51.702   7.1958  233.340   16.764  254.513   18.600 -21.17281 25.04035 
1 1 1   11    7   56 o  306.657   10.343   72.901   4.8548   70.182   6.2113   77.171   7.7832  299.517   13.549  312.150   16.347 -12.63342 21.23170 
1 1 1   11    7   57 o  236.264   13.712   43.937   4.9373   39.910   7.1033   47.701   6.8674  220.895   21.272  243.457   18.569 -22.56111 28.23656 
1 1 1   11    7   58 o   79.582   26.263   5.2806   3.7147   4.7408   5.1341   5.8737   5.3815   80.210   30.405   85.658   31.389 -5.448761 43.70053 
1 1 1   11    7   59 o   98.690   25.369   8.5330   3.8532   11.288   5.0676   4.7569   5.9326  111.777   29.273   81.993   32.249 29.78410 43.55341 
1 1 1   11    7   60 o  146.711   17.115   17.568   3.7710   18.848   5.1876   16.133   5.4914  148.069   23.688  134.165   27.660 13.90349 36.41695 
1 1 1   11    7   61 o   55.212   23.528   0.7609   3.4972  -1.4129   4.7966   3.2280   5.1099   56.176   25.536   72.028   29.373 -15.85128 38.92150 
1 1 1   11    7   62 o  112.065   22.715   11.065   3.7630   11.955   5.6186   10.342   5.0674  110.181   31.646  103.473   30.151 6.708107 43.71009 
1 1 1   11    8    0 o   70.155   15.226   4.2605   1.4332   4.2605   1.4332   4.2605   1.4332   70.155   15.226   70.155   15.226 0.000000 0.000000 
1 1 1   11    8    1 o  1100.98   7.5629  928.183   12.745  904.861   17.497  954.542   18.602  1086.79   10.518  1116.19   10.888 -29.39526 15.13886 
1 1 1   11    8    2 o  916.099   7.6667  642.631   10.750  639.555   13.023  649.211   19.046  913.785   9.3111  920.247   13.522 -6.462341 16.41757 
1 1 1   11    8    3 o  394.004   6.5878  118.854   3.9730  115.010   5.1658  124.421   6.2161  387.522   8.7090  403.018   10.077 -15.49673 13.31880 
1 1 1   11    8    4 o  929.885   9.5259  662.301   13.558  657.870   18.638  667.282   19.760  926.425   13.144  932.950   13.837 -6.524231 19.08488 
1 1 1   11    8    5 o  325.031   5.6261   80.874   2.7990   79.486   3.2069   85.316   5.7350  322.213   6.5024  333.697   11.228 -11.48392 12.97518 
1 1 1   11    8    6 o  828.833   7.5197  526.002   9.5398  524.280   11.605  529.590   16.752  827.376   9.1640  831.232   13.167 -3.855957 16.04198 
1 1 1   11    8    7 o  253.751   6.9895   49.299   2.7147   50.664   3.2005   45.797   5.1255  257.222   8.1290  244.039   13.778 13.18344 15.99733 
1 1 1   11    8    8 o  786.987   7.4078  474.211   8.9233  464.486   10.670  496.838   16.275  778.794   8.9511  805.144   13.206 -26.35095 15.95387 
1 1 1   11    8    9 o  907.831   8.0300  631.060   11.158  629.589   13.556  634.153   19.648  906.660   9.7683  909.567   14.113 -2.907166 17.16384 
1 1 1   11    8   10 o  955.089   7.0437  698.377   10.297  697.519   11.824  701.069   20.947  954.446   8.0939  956.371   14.310 -1.925232 16.44026 
1 1 1   11    8   11 o  1144.84   8.1208  1003.53   14.230  1008.40   20.179  998.719   20.071  1147.34   11.490  1141.82   11.484 5.517944 16.24536 
1 1 1   11    8   12 o  572.412   5.0795  250.803   4.4504  250.910   5.6353  250.624   7.2549  572.504   6.4309  572.125   8.2845 0.3788452 10.48758 
1 1 1   11    8   13 o  491.945   5.7667  185.253   4.3423  179.329   6.0577  191.514   6.2276  483.964   8.1776  500.137   8.1351 -16.17300 11.53486 
1 1 1   11    8   14 o  807.491   5.9162  499.122   7.3122  495.335   9.3229  505.174   11.787  804.368   7.5723  812.238   9.4811 -7.870239 12.13384 
1 1 1   11    8   15 o  415.671   5.0987  132.253   3.2440  130.140   4.0825  135.871   5.3430  412.319   6.4688  421.268   8.2863 -8.948761 10.51229 
1 1 1   11    8   16 o  680.667   5.0905  354.626   5.3035  351.687   7.3509  357.817   7.6592  677.795   7.0855  683.670   7.3192 -5.875122 10.18704 
1 1 1   11    8   17 o  821.636   6.0192  516.752   7.5698  519.422   11.731  514.847   9.9089  823.646   9.3051  820.063   7.8942 3.583069 12.20260 
1 1 1   11    8   18 o  914.484   6.4879  640.159   9.0813  633.047   11.452  652.206   14.906  909.329   8.2281  922.881   10.552 -13.55182 13.38081 
1 1 1   11    8   19 o  849.114   5.6779  551.880   7.3795  546.077   10.336  557.912   10.539  844.568   7.9958  853.669   8.0656 -9.100952 11.35724 
1 1 1   11    8   20 o  600.032   5.2104  275.583   4.7854  272.745   6.6741  278.585   6.8650  596.893   7.3051  603.246   7.4350 -6.352661 10.42320 
1 1 1   11    8   21 f  564.177   4.7517  243.627   4.1033  239.968   6.3187  246.294   5.3959  559.876   7.3734  567.232   6.2149 -7.356628 9.643245 
1 1 1   11    8   22 o  624.174   4.9070  298.203   4.6880  300.778   7.2538  296.355   6.1434  626.803   7.5608  622.205   6.4507 4.598022 9.938634 
1 1 1   11    8   23 o  925.138   6.0731  655.166   8.5998  657.254   12.399  653.230   11.938  926.499   8.7433  923.673   8.4438 2.825928 12.15499 
1 1 1   11    8   24 o  432.295   5.2318  143.047   3.4618  145.113   5.5393  141.722   4.4345  435.348   8.3128  430.264   6.7334 5.083282 10.69776 
1 1 1   11    8   25 o  692.697   5.2659  367.290   5.5832  355.291   8.5774  376.112   7.3547  681.194   8.2265  700.920   6.8553 -19.72552 10.70841 
1 1 1   11    8   26 o  451.077   5.7622  155.757   3.9784  158.756   7.2403  154.460   4.7617  455.275   10.390  449.171   6.9259 6.103729 12.48680 
1 1 1   11    8   27 f  283.239   10.884   61.454   4.7188   71.326   7.4654   54.885   6.0895  304.555   16.072  267.149   14.952 37.40683 21.95145 
1 1 1   11    8   28 o  231.198   7.9395   40.929   2.8096   39.665   4.0932   42.056   3.8636  227.219   11.810  234.307   10.773 -7.087906 15.98532 
1 1 1   11    8   29 o  1606.33   8.9272  1976.14   21.949  1962.72   30.905  1989.80   31.179  1600.30   12.617  1611.30   12.642 -10.99585 17.86071 
1 1 1   11    8   30 o  402.307   6.0102  123.910   3.7010  125.004   5.4285  122.960   5.0590  403.999   8.7787  400.701   8.2484 3.298340 12.04582 
1 1 1   11    8   31 o  711.599   5.4317  387.654   5.9162  397.905   8.7062  378.859   8.0642  720.823   7.8909  703.383   7.4903 17.44012 10.87987 
1 1 1   11    8   32 o  246.732   8.4739   46.629   3.2002   51.939   4.6331   41.784   4.4256  260.307   11.628  233.119   12.448 27.18759 17.03440 
1 1 1   11    8   33 o  481.835   7.1918  177.799   5.3040  180.117   7.8540  175.855   7.1917  484.776   10.585  479.055   9.8078 5.721375 14.43021 
1 1 1   11    8   34 o  388.145   6.7775  115.378   4.0265  116.451   5.6362  114.260   5.7545  389.820   9.4461  386.120   9.7367 3.700867 13.56583 
1 1 1   11    8   35 o  499.519   6.1987  191.085   4.7394  190.749   6.6926  191.424   6.7125  498.917   8.7639  499.798   8.7745 -0.8813171 12.40151 
1 1 1   11    8   36 o  105.573   18.509   8.8339   2.8819   8.0326   4.3348   9.4687   3.8580  100.144   27.458  108.560   23.868 -8.415588 36.38193 
1 1 1   11    8   37 f   86.023   21.118   5.9443   2.7600   1.4165   4.0056   10.037   3.8085   64.620   26.133  111.879   23.008 -47.25916 34.81819 
1 1 1   11    8   38 o   40.270   18.616  -2.2132   2.6984  -1.3291   4.0207  -2.9377   3.6398   54.628   24.212   46.824   21.637 7.803627 32.47185 
1 1 1   11    8   39 o  207.094   10.034   32.914   3.1806   34.446   5.2038   32.000   4.0185  210.771   16.256  203.605   12.962 7.166901 20.79098 
1 1 1   11    8   40 o  170.799   12.544   22.553   3.2564   21.014   4.5179   24.217   4.6980  163.872   18.326  176.190   17.658 -12.31786 25.44874 
1 1 1   11    8   41 o  205.892   9.9131   32.551   3.1241   31.966   4.8382   32.969   4.0913  202.935   15.698  206.561   13.007 -3.626266 20.38639 
1 1 1   11    8   42 o  458.691   6.4942  161.276   4.5595  165.787   7.2327  158.301   5.8736  464.527   10.172  454.191   8.4489 10.33514 13.22343 
1 1 1   11    8   43 o   42.679   19.535  -1.9335   2.8699   1.7405   4.4501  -4.5496   3.7552   68.208   27.559   43.688   20.746 24.51932 34.49467 
1 1 1   11    8   44 o  120.682   22.043   11.729   3.9217   11.514   6.4967   11.853   4.9190  118.012   34.069  120.129   27.364 -2.116661 43.69720 
1 1 1   11    8   45 o  284.541   10.787   62.332   4.6979   56.801   7.2255   66.383   6.1833  269.753   17.596  293.091   13.783 -23.33780 22.35169 
1 1 1   11    8   46 f  170.119   13.040   22.490   3.3697   20.285   4.6507   24.927   4.8892  160.014   19.384  177.929   18.209 -17.91437 26.59520 
1 1 1   11    8   47 o  311.665   8.2541   74.656   3.9376   75.522   5.6052   73.812   5.5326  312.796   11.707  309.239   11.689 3.556976 16.54354 
1 1 1   11    8   48 o  147.880   14.257   17.114   3.1870   15.591   4.6741   18.437   4.3567  138.704   22.809  152.256   19.116 -13.55234 29.76047 
1 1 1   11    8   49 f  290.353   8.5985   64.863   3.8214   69.251   5.6107   61.066   5.2190  299.199   12.251  280.992   12.134 18.20715 17.24365 
1 1 1   11    8   50 f   62.508   23.970   2.2382   3.2139  -3.0731   4.7086   6.8712   4.3976   53.992   24.827   91.639   28.409 -37.64694 37.72850 
1 1 1   11    8   51 o   89.822   24.702   6.6962   3.5020   10.949   5.6390   4.0264   4.4681  113.176   31.432   77.051   28.538 36.12569 42.45440 
1 1 1   11    8   52 o  166.897   15.692   21.964   3.9616   24.345   5.4112   19.214   5.8159  173.967   20.730  152.208   25.891 21.75888 33.16712 
1 1 1   11    8   53 o  138.820   17.399   15.389   3.6157   15.638   5.5178   15.202   4.7867  136.085   27.437  135.568   23.943 0.5161285 36.41558 
1 1 1   11    8   54 o  166.635   14.882   21.893   3.7559   24.241   5.5006   19.843   5.1409  172.906   21.230  155.821   22.181 17.08543 30.70366 
1 1 1   11    8   55 o  219.573   12.270   37.632   4.1072   38.101   5.9659   37.210   5.6628  218.522   17.997  216.297   17.248 2.225403 24.92724 
1 1 1   11    8   56 o  115.911   24.420   11.387   4.1958   10.830   5.3389   12.285   6.7855  110.766   30.516  116.366   35.141 -5.600021 46.54115 
1 1 1   11    8   57 o  145.061   21.062   17.373   4.5397   11.149   6.6797   22.717   6.1886  110.432   35.124  163.639   25.542 -53.20751 43.42900 
1 1 1   11    8   58 o  183.060   14.391   26.604   3.9998   30.874   5.3485   21.185   6.0249  195.319   18.096  157.025   25.976 38.29413 31.65752 
1 1 1   11    8   59 o   92.948   25.217   7.5715   3.6787   14.417   5.1306   0.3287   5.2775  127.764   27.077   64.603   28.216 63.16132 39.10575 
1 1 1   11    8   60 o   73.903   25.628   4.5256   3.5395   3.6704   4.8646   5.4876   5.1595   73.540   29.114   81.859   30.598 -8.319748 42.23561 
1 1 1   11    8   61 o   67.039   24.877   3.4483   3.3984   5.7968   4.6012   0.6295   5.0410   81.449   29.137   63.015   27.548 18.43415 40.09750 
1 1 1   11    8   62 o  166.988   16.623   22.946   4.1923   17.989   5.7034   28.774   6.1831  139.443   27.698  181.990   22.690 -42.54613 35.80526 
1 1 1   11    9    0 o  257.225   6.7650   50.752   2.6593   50.752   2.6593   50.752   2.6593  257.225   6.7650  257.225   6.7650 0.000000 0.000000 
1 1 1   11    9    1 o  222.617   4.9364   37.936   1.6821   34.394   2.3056   41.966   2.4594  211.945   7.1071  234.121   6.8632 -22.17577 9.879964 
1 1 1   11    9    2 o  856.318   9.0219  561.585   11.825  567.048   16.659  556.037   16.788  860.181   12.653  851.767   12.877 8.413940 18.05298 
1 1 1   11    9    3 o  528.496   7.1654  213.853   5.7963  209.031   7.7568  219.949   8.7223  522.409   9.7007  535.835   10.635 -13.42523 14.39449 
1 1 1   11    9    4 o  569.172   6.0754  248.006   5.2929  242.864   6.2414  261.172   9.9872  563.203   7.2402  583.867   11.175 -20.66357 13.31575 
1 1 1   11    9    5 o  868.748   7.5366  577.873   10.022  579.372   12.144  574.672   17.745  869.779   9.1216  865.897   13.389 3.881348 16.20052 
1 1 1   11    9    6 o  538.000   6.3876  221.589   5.2601  222.329   6.3955  220.043   9.2472  538.855   7.7541  535.932   11.273 2.923767 13.68223 
1 1 1   11    9    7 o  320.613   6.5704   78.695   3.2244   76.671   3.7948   83.951   6.1148  316.440   7.8348  331.014   12.069 -14.57404 14.38899 
1 1 1   11    9    8 o  336.971   6.6091   86.930   3.4088   85.984   4.0146   89.372   6.4535  335.112   7.8268  341.533   12.345 -6.421295 14.61706 
1 1 1   11    9    9 o  423.467   7.6832  137.298   4.9800  137.298   4.9800   0.0000   0.0000  423.467   7.6832  ?   ?  0.000000 7.683229 
1 1 1   11    9   10 o  571.570   8.0986  250.135   7.0852  250.135   7.0852   0.0000   0.0000  571.570   8.0986  ?   ?  0.000000 8.098601 
1 1 1   11    9   11 o  899.499   7.0005  619.413   9.6383  620.741   13.573  618.063   13.689  900.321   9.8496  898.370   9.9549 1.950134 14.00410 
1 1 1   11    9   12 o  706.867   6.3024  382.492   6.8189  370.924   9.3301  395.755   9.9904  696.016   8.7578  718.922   9.0788 -22.90674 12.61447 
1 1 1   11    9   13 o  333.873   6.0431   85.329   3.0882   85.673   4.3096   84.966   4.4276  334.511   8.4169  333.124   8.6836 1.387268 12.09334 
1 1 1   11    9   14 o  1158.59   7.3547  1027.62   13.043  1019.52   16.594  1040.70   21.095  1153.90   9.3955  1165.66   11.823 -11.75415 15.10186 
1 1 1   11    9   15 f  420.494   5.1421  135.338   3.3096  140.128   4.2067  127.559   5.3614  427.852   6.4236  408.177   8.5814 19.67444 10.71933 
1 1 1   11    9   16 o  546.510   6.7833  228.634   5.6742  228.514   6.5742  228.984   11.236  546.344   7.8615  546.734   13.426 -0.3907471 15.55864 
1 1 1   11    9   17 o  1215.35   7.7417  1130.79   14.402  1105.32   18.024  1175.76   23.952  1201.48   9.8007  1238.96   12.630 -37.48767 15.98669 
1 1 1   11    9   18 o  632.741   5.1226  306.444   4.9612  305.756   6.8556  307.201   7.1885  631.991   7.0871  633.475   7.4138 -1.483459 10.25628 
1 1 1   11    9   19 o  699.994   6.7016  375.087   7.1803  391.071   10.455  360.820   9.8782  714.665   9.5580  686.472   9.4013 28.19250 13.40668 
1 1 1   11    9   20 o  660.750   5.3174  334.181   5.3779  338.594   7.5830  329.716   7.6281  665.049   7.4493  656.268   7.5939 8.780457 10.63764 
1 1 1   11    9   21 o  599.138   5.3059  274.766   4.8658  277.045   6.8562  272.453   6.9068  601.570   7.4461  596.561   7.5640 5.009216 10.61404 
1 1 1   11    9   22 o  554.856   5.1649  235.651   4.3864  234.366   6.4332  236.768   5.9965  553.289   7.5964  556.131   7.0445 -2.841553 10.36003 
1 1 1   11    9   23 o  680.580   5.0714  354.543   5.2830  352.842   8.1319  355.786   6.9492  678.869   7.8259  681.731   6.6596 -2.862427 10.27600 
1 1 1   11    9   24 o  340.010   5.6474   88.495   2.9391   86.051   4.7557   90.005   3.7384  335.222   9.2686  342.877   7.1233 -7.654541 11.68965 
1 1 1   11    9   25 o  548.737   5.5398  230.496   4.6530  231.639   8.4127  229.992   5.5850  549.960   9.9939  548.110   6.6571 1.849976 12.00814 
1 1 1   11    9   26 o  555.902   6.5302  236.579   5.5564  239.005   9.7756  235.422   6.7533  558.558   11.434  554.497   7.9570 4.061035 13.93039 
1 1 1   11    9   27 o  1059.76   7.5429  859.915   12.235  871.906   20.272  853.043   15.346  1066.71   12.416  1055.38   9.4998 11.33008 15.63321 
1 1 1   11    9   28 o  280.522   7.3209   60.253   3.1434   59.491   5.4624   60.630   3.8436  278.611   12.809  281.367   8.9248 -2.755951 15.61161 
1 1 1   11    9   29 o  430.320   6.4680  141.772   4.2602  151.615   8.1026  138.012   5.0084  444.802   11.901  424.540   7.7074 20.26190 14.17893 
1 1 1   11    9   30 o  1052.26   6.9147  847.799   11.137  853.829   16.266  842.476   15.280  1055.71   10.066  1048.73   9.5193 6.985962 13.85421 
1 1 1   11    9   31 o  1054.75   6.9517  851.865   11.223  846.629   16.214  856.681   15.550  1051.20   10.077  1057.47   9.6070 -6.275269 13.92291 
1 1 1   11    9   32 o  743.146   6.5979  422.882   7.5049  434.905   10.946  412.214   10.310  753.421   9.4915  733.530   9.1827 19.89130 13.20647 
1 1 1   11    9   33 o  305.500   7.4981   71.482   3.5062   67.390   4.9870   75.483   4.9304  296.493   10.989  313.825   10.264 -17.33154 15.03703 
1 1 1   11    9   34 o  875.760   6.1049  587.307   8.1835  612.034   11.545  562.335   11.602  893.766   8.4390  856.662   8.8480 37.10400 12.22717 
1 1 1   11    9   35 o  463.844   6.1878  164.771   4.3932  167.293   6.2184  162.259   6.2074  467.223   8.6953  460.131   8.8137 7.092133 12.38106 
1 1 1   11    9   36 o  184.844   10.443   26.290   2.9426   27.628   4.4742   25.270   3.9063  188.896   15.615  180.787   14.232 8.109283 21.12720 
1 1 1   11    9   37 o  216.969   9.2106   36.097   3.0588   43.243   4.6686   30.723   4.0490  236.902   12.924  199.513   13.336 37.38905 18.57046 
1 1 1   11    9   38 o  279.868   7.5762   60.033   3.2455   57.554   4.7979   62.124   4.4066  273.769   11.450  284.537   10.118 -10.76740 15.27977 
1 1 1   11    9   39 o  471.109   7.5434  170.135   5.4395  172.486   8.6011  168.568   7.0221  473.782   11.861  468.672   9.7888 5.110352 15.37835 
1 1 1   11    9   40 o  740.315   6.8775  420.074   7.7932  435.441   11.998  408.859   10.250  753.004   10.410  729.938   9.1739 23.06567 13.87545 
1 1 1   11    9   41 o  131.292   14.605   13.452   2.8853   13.678   4.4354   13.286   3.7989  130.646   23.022  129.440   19.804 1.206421 30.36755 
1 1 1   11    9   42 o  227.298   8.9862   39.664   3.1264   40.190   4.6101   39.216   4.2540  228.000   13.268  225.358   12.380 2.642242 18.14654 
1 1 1   11    9   43 o  210.475   9.7989   34.044   3.1568   35.389   4.7157   32.951   4.2494  213.589   14.511  206.252   13.535 7.336990 19.84352 
1 1 1   11    9   44 o   91.200   22.840   6.7742   3.1813   2.8193   4.1515   12.401   4.9517   71.018   27.241  122.909   27.054 -51.89053 38.39250 
1 1 1   11    9   45 o  422.599   7.7190  137.108   4.9930  126.747   9.4408  141.132   5.8831  404.476   15.249  428.519   8.9694 -24.04288 17.69144 
1 1 1   11    9   46 o  214.056   11.247   35.422   3.6721   35.793   5.1707   35.045   5.2157  214.115   15.891  211.770   16.214 2.344513 22.70259 
1 1 1   11    9   47 o  284.107   8.3265   62.048   3.6209   62.601   5.4308   61.606   4.8583  284.589   12.467  282.582   11.232 2.007629 16.78103 
1 1 1   11    9   48 o  243.024   9.4323   45.474   3.5086   50.913   5.2786   41.170   4.6962  255.990   13.520  230.158   13.388 25.83240 19.02719 
1 1 1   11    9   49 o  218.085   10.354   36.687   3.4564   37.949   5.1365   35.642   4.6725  220.276   15.330  213.726   14.366 6.549927 21.00967 
1 1 1   11    9   50 o  313.166   8.3864   75.471   4.0199   73.151   5.9291   77.446   5.4688  307.251   12.607  316.530   11.288 -9.279663 16.92223 
1 1 1   11    9   51 o  277.841   10.794   59.659   4.5902   55.435   6.6272   63.555   6.3638  265.675   16.377  285.258   14.624 -19.58258 21.95610 
1 1 1   11    9   52 o  131.096   18.820   13.823   3.6681   14.548   5.7265   13.318   4.7768  130.594   29.362  126.233   25.598 4.361221 38.95350 
1 1 1   11    9   53 o  156.071   15.283   19.234   3.6040   17.733   5.3933   20.445   4.8443  146.140   25.010  159.135   20.355 -12.99457 32.24634 
1 1 1   11    9   54 o   93.671   24.927   7.4032   3.6367   15.413   5.5874   1.5157   4.7903  134.395   28.067   67.595   28.089 66.80029 39.70850 
1 1 1   11    9   55 f   56.178   24.047   0.2813   3.6830   0.1903   5.4061   0.3601   5.0312   66.331   28.768   64.773   27.923 1.557991 40.09088 
1 1 1   11    9   56 o   58.974   26.321  -1.1124   4.8359   3.3444   7.2073  -4.7620   6.5220   83.159   34.497   60.584   28.323 22.57491 44.63430 
1 1 1   11    9   57 o   88.972   26.325   6.8239   3.8367   11.067   5.1525   1.5435   5.7481  111.407   29.682   71.268   30.262 40.13838 42.38839 
1 1 1   11    9   58 o  138.648   18.284   15.698   3.7855   13.616   5.1374   18.170   5.5992  124.185   27.729  144.925   26.206 -20.73964 38.15291 
1 1 1   11    9   59 o   90.295   25.068   7.1492   3.5876   7.7582   5.0134   6.5101   5.1360   93.064   30.501   87.150   30.825 5.914902 43.36448 
1 1 1   11    9   60 o  188.498   13.320   28.281   3.8183   26.844   5.4079   29.709   5.3920  179.386   20.038  189.694   18.819 -10.30824 27.48968 
1 1 1   11    9   61 o  116.680   20.644   11.658   3.5520   13.248   4.8606   9.8365   5.2035  120.263   27.059  101.165   30.823 19.09806 41.01538 
1 1 1   11    9   62 o   57.405   24.812   0.7293   3.9940   7.5331   5.6616  -6.0113   5.6352   88.973   32.257   51.035   24.550 37.93830 40.53671 
1 1 1   11   10    0 o  674.916   11.235  349.076   11.599  349.076   11.599  349.076   11.599  674.916   11.235  674.916   11.235 0.000000 0.000000 
1 1 1   11   10    1 o  549.081   5.9246  230.800   4.9793  230.490   8.5316  230.960   6.1320  548.562   10.161  549.232   7.2942 -0.6700439 12.50801 
1 1 1   11   10    2 o  963.448   8.0103  710.753   11.813  715.189   14.503  702.010   20.360  966.328   9.8056  957.013   13.899 9.314026 17.00968 
1 1 1   11   10    3 o  281.969   5.7933   60.863   2.5003   62.487   2.9597   56.818   4.6725  285.691   6.7684  272.338   11.209 13.35272 13.09418 
1 1 1   11   10    4 o  143.946   7.8142   15.912   1.7152   17.147   1.9424   11.539   3.6550  149.399   8.5296  120.940   20.475 28.45929 22.18074 
1 1 1   11   10    5 o  288.860   5.9157   63.875   2.6156   61.938   3.0033   69.956   5.3219  284.434   6.8984  302.188   11.506 -17.75461 13.41548 
1 1 1   11   10    6 o  450.718   6.3241  155.516   4.3629  153.846   5.2502  159.244   7.8430  448.261   7.6520  455.944   11.238 -7.683472 13.59607 
1 1 1   11   10    7 o  483.862   6.3692  179.229   4.7171  176.906   5.6670  184.467   8.5117  480.685   7.7024  490.730   11.332 -10.04459 13.70179 
1 1 1   11   10    8 o  286.548   8.1683   62.869   3.5826   62.869   3.5826   0.0000   0.0000  286.548   8.1683  ?   ?  0.000000 8.168307 
1 1 1   11   10    9 f  552.061   6.6515  233.313   5.6205  230.561   6.6785  239.995   10.406  548.760   7.9510  559.721   12.146 -10.96075 14.51717 
1 1 1   11   10   10 o  697.249   7.2027  372.183   7.6869  375.328   9.3321  365.546   13.557  700.136   8.7082  690.760   12.822 9.375916 15.49961 
1 1 1   11   10   11 o  343.190   5.9964   90.158   3.1499   86.183   4.3061   94.733   4.6197  335.505   8.3853  351.750   8.5804 -16.24493 11.99736 
1 1 1   11   10   12 o  762.661   6.5223  445.255   7.6138  439.521   10.543  451.506   11.007  757.646   9.0912  767.896   9.3650 -10.24939 13.05193 
1 1 1   11   10   13 o  483.319   5.1216  178.801   3.7889  177.630   4.6911  180.999   6.4259  481.715   6.3623  486.215   8.6345 -4.500519 10.72536 
1 1 1   11   10   14 o  364.241   5.7813  101.554   3.2232  100.159   3.5235  108.704   7.9778  361.724   6.3640  376.687   13.837 -14.96246 15.23004 
1 1 1   11   10   15 f  402.542   5.8147  124.034   3.5827  124.031   3.9463  124.045   8.5449  402.531   6.4051  402.393   13.874 0.1377258 15.28072 
1 1 1   11   10   16 o  1036.12   11.080  822.119   17.571   0.0000   0.0000  822.119   17.571  ?   ?   1036.12   11.080 0.000000 11.07962 
1 1 1   11   10   17 o  780.941   6.0124  466.829   7.1868  459.890   9.0241  478.862   11.884  775.072   7.6066  790.819   9.8175 -15.74701 12.41949 
1 1 1   11   10   18 o  666.196   5.7264  339.719   5.8392  337.103   7.3514  344.190   9.6115  663.592   7.2377  670.469   9.3657 -6.876160 11.83640 
1 1 1   11   10   19 f  1266.10   7.3039  1227.17   14.154  1229.31   19.954  1225.00   20.082  1267.03   10.289  1264.80   10.373 2.228882 14.61039 
1 1 1   11   10   20 o  632.036   5.3129  305.769   5.1397  304.204   7.1366  307.455   7.4083  630.370   7.3965  633.722   7.6375 -3.352844 10.63202 
1 1 1   11   10   21 o  435.286   5.3424  145.031   3.5594  146.498   4.9459  143.456   5.1265  437.448   7.3867  432.874   7.7373 4.573425 10.69715 
1 1 1   11   10   22 o  352.754   6.1727   95.255   3.3329   92.315   4.3895   99.256   5.1214  347.236   8.2590  360.031   9.2935 -12.79553 12.43303 
1 1 1   11   10   23 f  729.603   6.2341  407.497   6.9620  396.026   10.650  416.059   9.2002  719.130   9.6751  737.160   8.1539 -18.03021 12.65276 
1 1 1   11   10   24 o  177.635   10.349   24.249   2.8015   22.848   4.4706   25.155   3.5950  171.748   17.239  180.718   13.085 -8.969925 21.64246 
1 1 1   11   10   25 o  591.388   5.6763  267.725   5.1381  265.017   7.3923  270.256   7.1467  588.313   8.2092  594.112   7.8590 -5.799500 11.36467 
1 1 1   11   10   26 o  739.635   6.6251  418.817   7.5003  420.000   12.699  418.184   9.2946  740.440   11.205  739.006   8.2169 1.433289 13.89522 
1 1 1   11   10   27 o  632.416   5.4496  306.164   5.2752  315.941   8.6077  300.283   6.6757  642.308   8.7554  626.264   6.9642 16.04401 11.18738 
1 1 1   11   10   28 o  1255.54   7.0037  1206.95   13.459  1200.85   20.684  1211.44   17.726  1251.98   10.793  1257.67   9.2082 -5.683228 14.18764 
1 1 1   11   10   29 o  242.467   8.6779   45.026   3.2206   43.072   6.0950   45.783   3.7934  236.301   16.965  244.464   10.138 -8.163254 19.76284 
1 1 1   11   10   30 o  319.103   7.1335   77.971   3.4842   85.965   5.9321   73.761   4.3050  334.916   11.572  310.317   9.0636 24.59869 14.69881 
1 1 1   11   10   31 o  258.394   8.3755   51.140   3.3126   52.347   5.7125   50.528   4.0660  260.826   14.364  256.789   10.345 4.036835 17.70150 
1 1 1   11   10   32 o  740.515   7.8983  420.011   8.9524  425.422   10.768  407.898   16.111  745.140   9.4410  729.065   14.437 16.07495 17.25025 
1 1 1   11   10   33 o  252.410   9.1218   48.819   3.5242   41.029   5.9197   53.095   4.3862  230.443   16.901  263.165   10.889 -32.72202 20.10477 
1 1 1   11   10   34 o  681.489   6.3845  355.677   6.6597  370.327   10.415  345.543   8.6619  695.060   9.7897  671.539   8.4270 23.52020 12.91714 
1 1 1   11   10   35 o  347.565   6.5466   92.527   3.4828   92.017   5.2062   92.940   4.6856  346.430   9.8183  348.225   8.7909 -1.795563 13.17875 
1 1 1   11   10   36 o  256.947   7.9004   50.595   3.1071   50.399   4.6418   50.755   4.1823  256.233   11.835  257.212   10.623 -0.9789734 15.90376 
1 1 1   11   10   37 o  417.760   6.0877  133.685   3.8927  137.756   5.8674  130.484   5.2026  423.844   9.0442  412.576   8.2384 11.26886 12.23396 
1 1 1   11   10   38 o  178.253   10.583   24.476   2.8745   18.855   4.3694   28.765   3.8168  155.122   18.786  193.000   12.996 -37.87764 22.84298 
1 1 1   11   10   39 o  187.530   12.008   27.140   3.4288   28.498   5.0860   26.009   4.6423  191.298   17.566  182.829   16.776 8.469894 24.28997 
1 1 1   11   10   40 o  581.902   5.6928  259.422   5.0705  265.254   7.5289  254.581   6.8593  588.041   8.3648  576.179   7.7777 11.86115 11.42198 
1 1 1   11   10   41 o  195.777   9.8943   29.513   2.9553   31.160   4.4604   28.225   3.9457  200.471   14.638  190.922   13.591 9.548660 19.97408 
1 1 1   11   10   42 o  347.421   6.8288   92.549   3.6314   92.476   5.2576   92.617   5.0216  346.922   9.9011  347.248   9.4479 -0.3260193 13.68551 
1 1 1   11   10   43 o  234.155   8.7449   42.105   3.1342   45.154   4.6607   39.588   4.2348  241.710   12.642  226.349   12.269 15.36176 17.61630 
1 1 1   11   10   44 o  176.635   14.952   24.310   4.0045   26.157   6.4167   23.132   5.1251  180.941   23.742  171.079   19.947 9.861526 31.00865 
1 1 1   11   10   45 o  185.578   11.240   26.635   3.1777   32.170   4.6757   21.885   4.3318  203.206   15.142  166.910   17.202 36.29591 22.91688 
1 1 1   11   10   46 o  175.537   12.102   23.901   3.2316   26.859   4.7388   21.329   4.4184  185.007   16.922  164.456   17.839 20.55081 24.58812 
1 1 1   11   10   47 o  147.834   13.607   17.066   3.0445   9.4138   4.4620   23.731   4.1644  106.365   27.277  173.995   15.809 -67.62973 31.52710 
1 1 1   11   10   48 o  121.549   16.530   11.720   2.9956   15.647   4.4186   8.3801   4.0750  139.325   21.404  100.424   26.226 38.90040 33.85165 
1 1 1   11   10   49 f  117.761   17.478   11.074   3.0548   10.920   4.4651   11.209   4.1883  114.474   26.067  116.511   24.274 -2.036148 35.61873 
1 1 1   11   10   50 o  249.787   9.4916   48.097   3.6289   49.371   5.3494   47.010   4.9393  251.663   13.942  245.793   13.177 5.869568 19.18322 
1 1 1   11   10   51 o  233.782   12.387   42.494   4.4168   44.430   6.4677   40.803   6.0461  237.050   17.959  227.293   17.514 9.757370 25.08479 
1 1 1   11   10   52 o  285.334   9.3184   62.810   4.0697   65.105   6.1938   61.067   5.3987  289.050   13.999  280.428   12.578 8.621979 18.81966 
1 1 1   11   10   53 o  388.296   7.8209  116.090   4.6482  118.784   6.7866  113.710   6.3795  391.479   11.326  383.215   10.876 8.264923 15.70245 
1 1 1   11   10   54 o   60.635   24.547   1.5693   3.5379   10.461   5.4533  -4.8930   4.6490  109.566   31.081   49.044   23.229 60.52242 38.80243 
1 1 1   11   10   55 o  185.624   13.533   27.073   3.8186   28.240   5.6493   26.092   5.1817  186.779   20.075  179.925   19.108 6.854675 27.71497 
1 1 1   11   10   56 o   99.813   29.317   8.7193   4.7739  -1.7269   6.8455   18.610   6.6610   68.378   30.851  144.998   30.955 -76.61929 43.70331 
1 1 1   11   10   57 o  156.631   17.191   19.787   4.0536   18.169   5.2420   22.195   6.3932  146.465   24.230  160.441   26.992 -13.97603 36.27173 
1 1 1   11   10   58 o  108.211   22.724   9.9921   3.6440   8.4064   5.0686   11.688   5.2426   96.904   30.572  113.712   29.771 -16.80820 42.67276 
1 1 1   11   10   59 o   76.604   25.859   4.9273   3.5980   6.0251   4.9759   3.7244   5.2087   84.399   30.288   75.299   30.026 9.100197 42.64915 
1 1 1   11   10   60 f  131.178   20.180   14.518   3.9220   14.341   4.8691   14.843   6.6182  126.695   25.981  122.805   34.032 3.889687 42.81575 
1 1 1   11   10   61 o   47.010   21.331  -1.1904   3.3280  -2.3598   4.5896   0.1061   4.8327   52.316   24.218   60.172   26.613 -7.855850 35.98305 
1 1 1   11   11    0 o   31.363   18.993   0.6988   1.6832   0.6988   1.6832   0.6988   1.6832   31.363   18.993   31.363   18.993 0.000000 0.000000 
1 1 1   11   11    1 o  746.351   6.8820  426.455   7.8619  423.232   9.5326  433.310   13.902  743.466   8.3768  752.061   12.077 -8.595825 14.69794 
1 1 1   11   11    2 o  816.319   7.2592  510.177   9.0702  502.894   10.900  526.578   16.356  810.400   8.7871  829.003   12.890 -18.60291 15.60026 
1 1 1   11   11    3 o  794.125   7.1635  482.807   8.7073  487.574   10.689  473.403   15.012  797.966   8.7515  786.066   12.477 11.89941 15.24048 
1 1 1   11   11    4 o  550.917   6.1560  232.341   5.1911  224.953   6.1243  251.195   9.7834  542.056   7.3814  572.664   11.161 -30.60730 13.38148 
1 1 1   11   11    5 o  1022.80   8.4560  800.999   13.238  804.585   16.193  793.773   22.986  1024.97   10.322  1017.68   14.757 7.291687 18.00828 
1 1 1   11   11    6 o  584.851   6.6354  261.852   5.9399  254.464   7.0789  279.430   10.919  576.503   8.0222  603.973   11.812 -27.47009 14.27828 
1 1 1   11   11    7 o  641.172   8.3035  314.760   8.1490  314.760   8.1490   0.0000   0.0000  641.172   8.3035  ?   ?  0.000000 8.303476 
1 1 1   11   11    8 o  360.538   6.6348   99.509   3.6614   99.935   4.3336   98.445   6.8444  361.290   7.8366  358.484   12.474 2.806702 14.73114 
1 1 1   11   11    9 f  373.922   6.6999  107.033   3.8346  110.373   4.5796   99.198   7.0141  379.692   7.8799  359.851   12.734 19.84131 14.97526 
1 1 1   11   11   10 o  407.826   6.7431  127.322   4.2093  128.850   5.0130  123.668   7.7505  410.246   7.9833  401.802   12.602 8.443939 14.91809 
1 1 1   11   11   11 o   85.790   17.911   5.8541   2.2760   6.7754   2.5784   2.6032   4.8437   92.323   18.883   74.979   29.242 17.34483 34.80877 
1 1 1   11   11   12 o  246.353   8.4064   46.464   3.1698   48.439   3.6812   40.799   6.2344  251.520   9.5619  230.004   17.849 21.51636 20.24843 
1 1 1   11   11   13 o  659.138   6.2918  332.569   6.3477  331.984   8.8533  333.187   9.1061  658.494   8.7838  659.678   9.0184 -1.184570 12.58921 
1 1 1   11   11   14 o  393.042   6.1333  118.250   3.6898  118.943   5.1030  117.491   5.3414  394.156   8.4584  391.736   8.9083 2.420685 12.28422 
1 1 1   11   11   15 o  784.878   6.6026  471.564   7.9320  463.704   10.723  481.062   11.787  778.234   9.0020  792.639   9.7157 -14.40515 13.24508 
1 1 1   11   11   16 o  863.548   6.2849  570.823   8.3072  586.561   10.778  547.791   13.039  875.314   8.0445  845.811   10.071 29.50323 12.88985 
1 1 1   11   11   17 o  566.060   6.4302  245.278   5.5713  241.532   7.7454  249.295   8.0198  561.661   9.0094  570.611   9.1823 -8.950012 12.86410 
1 1 1   11   11   18 o  704.297   5.8762  379.693   6.3346  379.350   8.0191  380.262   10.331  703.939   7.4425  704.715   9.5773 -0.7764282 12.12917 
1 1 1   11   11   19 o  761.032   6.0965  443.340   7.1016  445.859   9.0530  439.311   11.451  763.141   7.7503  757.437   9.8767 5.704346 12.55452 
1 1 1   11   11   20 f  795.485   5.7063  484.381   6.9479  477.518   9.5694  492.032   10.104  789.759   7.9163  801.659   8.2345 -11.90009 11.42252 
1 1 1   11   11   21 o  949.141   6.7586  689.643   9.8188  689.010   12.702  690.583   15.477  948.614   8.7481  949.587   10.649 -0.9735107 13.78118 
1 1 1   11   11   22 o  814.951   6.4053  508.417   7.9899  514.667   12.563  504.171   10.354  819.787   10.012  811.466   8.3359 8.320496 13.02791 
1 1 1   11   11   23 o  681.625   6.2827  355.672   6.5548  364.019   8.4665  343.182   10.356  689.518   8.0221  669.406   10.108 20.11267 12.90409 
1 1 1   11   11   24 f  479.767   6.5124  176.212   4.7823  183.751   6.1438  164.620   7.6181  489.878   8.1936  463.595   10.736 26.28348 13.50534 
1 1 1   11   11   25 o  1239.80   9.2578  1177.15   17.568  1185.54   25.091  1169.07   24.606  1243.79   13.180  1235.14   13.015 8.646729 18.52318 
1 1 1   11   11   26 o  1916.15   11.333  2812.93   33.240  2835.95   53.226  2798.21   42.560  1922.40   18.089  1910.48   14.554 11.92761 23.21695 
1 1 1   11   11   27 o  735.938   6.6371  414.659   7.4763  435.437   12.009  401.511   9.5533  753.939   10.407  724.081   8.6198 29.85828 13.51306 
1 1 1   11   11   28 o  307.316   7.1861   72.314   3.3802   71.637   6.2407   72.594   4.0212  305.694   13.338  307.881   8.5330 -2.187286 15.83363 
1 1 1   11   11   29 o  634.254   5.6680  307.970   5.5026  315.002   8.8127  303.477   7.0445  641.295   8.9780  629.542   7.3107 11.75336 11.57801 
1 1 1   11   11   30 o  352.435   6.7026   95.108   3.6157   90.081   6.0786   97.860   4.4980  342.823   11.584  357.454   8.2211 -14.63028 14.20480 
1 1 1   11   11   31 o  928.205   6.6261  659.727   9.4139  698.214   14.240  629.849   12.547  954.592   9.7459  906.729   9.0403 47.86322 13.29319 
1 1 1   11   11   32 o  593.244   6.5149  269.505   5.9158  272.456   8.6116  266.867   8.1406  596.289   9.4353  590.174   9.0117 6.115112 13.04748 
1 1 1   11   11   33 o  462.246   6.1670  163.625   4.3633  172.940   7.4561  158.773   5.3810  474.967   10.256  455.263   7.7220 19.70486 12.83805 
1 1 1   11   11   34 o  278.965   8.2698   59.631   3.5311   57.913   6.1255   60.486   4.3214  274.169   14.650  280.875   10.052 -6.705841 17.76656 
1 1 1   11   11   35 o  132.368   15.033   13.642   2.9917   19.979   5.1248   10.366   3.6847  159.413   21.556  113.955   21.921 45.45771 30.74394 
1 1 1   11   11   36 o  427.603   6.6857  140.077   4.3758  140.519   7.3487  139.834   5.4467  427.882   11.221  427.112   8.3314 0.7698669 13.97550 
1 1 1   11   11   37 o  276.145   8.6320   58.471   3.6486   64.080   7.0763   56.440   4.2582  287.963   16.119  271.201   10.258 16.76221 19.10653 
1 1 1   11   11   38 o  297.929   10.617   68.149   4.8416   90.991   13.931   65.011   5.1635  340.295   26.966  290.899   11.597 49.39594 29.35394 
1 1 1   11   11   39 o  226.600   8.8298   39.394   3.0626   39.532   4.6424   39.287   4.0751  226.238   13.467  225.768   11.834 0.4698944 17.92756 
1 1 1   11   11   40 o  545.122   5.9158  227.696   4.9360  223.616   7.5621  230.725   6.5155  539.759   9.1532  548.496   7.7607 -8.737061 12.00040 
1 1 1   11   11   41 o  146.106   12.296   16.546   2.7243   16.680   4.0253   16.433   3.7006  145.561   18.483  144.770   17.026 0.7913361 25.12980 
1 1 1   11   11   42 o  220.736   8.8956   37.415   3.0055   40.344   4.4626   34.983   4.0659  228.452   12.814  212.730   12.543 15.72202 17.93080 
1 1 1   11   11   43 o  205.628   9.4800   32.496   2.9837   32.020   4.3928   32.903   4.0654  203.103   14.220  206.142   12.950 -3.039124 19.23347 
1 1 1   11   11   44 o  119.619   21.267   11.519   3.7511   6.6299   5.7435   15.155   4.9535   94.192   32.647  136.698   24.578 -42.50562 40.86492 
1 1 1   11   11   45 o   87.497   21.402   6.2453   2.8426   5.8662   3.9052   6.6726   4.1456   85.839   26.797   90.868   27.473 -5.029716 38.37793 
1 1 1   11   11   46 o  106.314   17.630   9.0385   2.7683   12.896   4.0924   5.7847   3.7588  126.245   21.977   84.953   26.253 41.29169 34.23716 
1 1 1   11   11   47 o  147.094   13.366   16.889   2.9765   23.276   4.5533   12.123   3.9332  171.798   17.563  122.256   21.819 49.54144 28.00908 
1 1 1   11   11   48 o  193.419   10.899   28.964   3.2134   28.386   4.9027   29.399   4.2548  189.907   17.048  194.042   14.429 -4.135040 22.33448 
1 1 1   11   11   49 o  283.875   8.4360   62.009   3.6655   64.937   5.5700   59.772   4.8682  289.546   12.568  278.077   11.438 11.46954 16.99338 
1 1 1   11   11   50 o  219.579   11.220   37.376   3.7584   40.173   6.2383   35.781   4.7090  225.374   18.240  213.930   14.466 11.44385 23.28031 
1 1 1   11   11   51 f   71.976   25.151   3.8356   3.4119   8.7686   4.6096  -2.1418   5.0741  101.822   28.468   58.567   26.480 43.25475 38.87947 
1 1 1   11   11   52 o  270.821   9.4533   56.606   3.9186   60.120   6.1155   54.158   5.1042  277.191   14.464  264.033   12.630 13.15787 19.20217 
1 1 1   11   11   53 o   63.313   24.084   2.4585   3.2282   3.0621   4.6564   1.8999   4.4794   73.017   28.617   67.466   27.506 5.550507 39.69247 
1 1 1   11   11   54 o  109.681   20.988   9.9348   3.3952   2.0428   4.9055   17.191   4.7039   69.932   28.679  144.708   21.924 -74.77623 36.09875 
1 1 1   11   11   55 o   72.250   25.266   3.9949   3.4435   0.2221   4.8476   7.8376   4.8923   63.117   27.308   95.506   30.023 -32.38918 40.58420 
1 1 1   11   11   56 o   99.959   30.424   8.8075   5.0716   7.2786   6.8260   10.691   7.5773   94.795   35.241  108.687   37.509 -13.89185 51.46689 
1 1 1   11   11   57 o  144.912   17.266   16.990   3.7543   18.317   5.1128   15.438   5.5306  147.375   23.451  132.446   28.149 14.92891 36.63756 
1 1 1   11   11   58 f   94.018   23.888   7.6652   3.4447   3.3163   4.7977   12.292   4.9488   72.755   28.878  117.396   27.944 -44.64185 40.18459 
1 1 1   11   11   59 o   84.631   25.135   6.2988   3.4930   2.8621   4.8474   10.010   5.0377   70.466   28.658  103.980   29.995 -33.51376 41.48468 
1 1 1   11   11   60 o  163.837   15.989   21.835   3.9585   9.8063   6.0299   30.945   5.2476  100.441   33.476  193.901   17.883 -93.46023 37.95302 
1 1 1   11   11   61 o   59.221   24.458   1.7030   3.5999   4.6249   4.6723  -2.5657   5.6472   75.625   28.925   57.654   26.751 17.97046 39.39833 
1 1 1   11   12    0 o  917.157   9.6061  644.166   13.482  644.166   13.482  644.166   13.482  917.157   9.6061  917.157   9.6061 0.000000 0.000000 
1 1 1   11   12    1 o  662.477   6.5636  335.969   6.6555  346.070   8.3356  318.206   11.054  672.313   8.1002  644.556   11.205 27.75641 13.82615 
1 1 1   11   12    2 o  346.839   5.8951   92.085   3.1296   89.030   3.7344   99.292   5.7360  341.020   7.1544  360.072   10.408 -19.05234 12.62946 
1 1 1   11   12    3 o   44.333   16.758   1.0722   1.5569   0.3546   1.8009   3.1952   3.0976   41.875   17.297   68.573   23.964 -26.69799 29.55446 
1 1 1   11   12    4 o  558.018   6.2594  238.364   5.3463  239.862   6.4878  235.196   9.4371  559.737   7.5725  554.153   11.126 5.584229 13.45851 
1 1 1   11   12    5 o  1366.27   10.595  1429.57   22.156  1492.78   28.373  1330.80   35.469  1395.88   13.280  1317.44   17.589 78.43323 22.03930 
1 1 1   11   12    6 f  681.371   8.5578  355.463   8.9252  355.463   8.9252   0.0000   0.0000  681.371   8.5578  ?   ?  0.000000 8.557832 
1 1 1   11   12    7 o  934.312   8.2166  668.331   11.750  680.331   14.603  646.294   19.789  942.568   10.122  918.434   14.077 24.13391 17.33845 
1 1 1   11   12    8 o  790.657   7.5640  478.581   9.1540  475.356   11.050  485.638   16.344  787.929   9.1620  796.191   13.412 -8.261780 16.24230 
1 1 1   11   12    9 o  620.636   6.9448  294.869   6.5973  291.079   7.9109  303.524   11.955  616.598   8.3821  629.497   12.408 -12.89862 14.97356 
1 1 1   11   12   10 o  618.303   7.0473  292.656   6.6695  288.762   7.9483  301.924   12.261  614.139   8.4554  627.827   12.759 -13.68781 15.30649 
1 1 1   11   12   11 o  768.472   7.6407  452.093   8.9873  453.542   10.907  449.027   15.863  769.648   9.2582  765.613   13.537 4.034790 16.39999 
1 1 1   11   12   12 o  675.529   6.3107  349.315   6.5251  351.377   9.1523  347.184   9.3054  677.453   8.8264  673.393   9.0281 4.060547 12.62582 
1 1 1   11   12   13 o  114.507   12.501   10.162   2.1555   13.544   2.9787   6.4447   3.1231  132.107   14.996   89.912   22.692 42.19510 27.19989 
1 1 1   11   12   14 o  399.810   7.3189  122.368   4.4789  121.033   7.4667  123.118   5.5978  397.526   12.271  401.003   9.1201 -3.477448 15.28934 
1 1 1   11   12   15 o  585.708   7.3211  262.617   6.5634  263.054   11.169  262.387   8.1118  586.041   12.451  585.409   9.0529 0.6322632 15.39431 
1 1 1   11   12   16 o  731.899   5.8980  410.036   6.6073  412.091   8.3793  406.658   10.744  733.690   7.4615  728.766   9.6315 4.923462 12.18359 
1 1 1   11   12   17 o  611.094   5.6516  285.846   5.2863  285.036   6.5925  287.305   8.8474  610.198   7.0584  612.556   9.4362 -2.358276 11.78407 
1 1 1   11   12   18 o  1462.94   8.9296  1638.67   19.995  1651.29   25.889  1620.01   31.478  1468.35   11.519  1454.09   14.143 14.25085 18.24071 
1 1 1   11   12   19 o  224.193   7.4469   38.479   2.5554   39.228   3.1100   36.922   4.4837  226.348   8.9766  219.118   13.434 7.229553 16.15671 
1 1 1   11   12   20 o  428.378   7.2877  140.487   4.7784  141.429   5.7757  138.445   8.5069  429.779   8.7799  425.096   13.074 4.682983 15.74872 
1 1 1   11   12   21 o  462.880   7.3644  164.032   5.2176  174.461   6.4879  144.939   8.7788  477.329   8.8801  434.936   13.187 42.39282 15.89799 
1 1 1   11   12   22 o  785.736   6.5329  472.629   7.8570  482.132   12.780  466.855   9.9618  793.411   10.524  780.850   8.3349 12.56067 13.42474 
1 1 1   11   12   23 o  216.822   9.0024   36.000   2.9877   36.688   3.6100   34.504   5.3229  218.856   10.776  211.476   16.577 7.380402 19.77197 
1 1 1   11   12   24 f  241.494   9.1607   44.661   3.3861   46.532   4.1380   40.870   5.8910  246.465   10.969  230.229   16.834 16.23618 20.09214 
1 1 1   11   12   25 o  313.068   8.3188   75.052   3.9863   71.433   7.0663   76.741   4.8278  305.230   15.125  316.532   9.9647 -11.30225 18.11252 
1 1 1   11   12   26 o  455.393   6.2962  158.767   4.3887  167.457   6.2994  150.572   6.1177  467.613   8.8012  443.404   9.0140 24.20892 12.59818 
1 1 1   11   12   27 o  850.677   6.4141  554.032   8.3517  548.290   11.686  560.025   11.940  846.101   9.0235  855.100   9.1227 -8.999451 12.83149 
1 1 1   11   12   28 o  659.566   6.6467  333.079   6.7101  348.459   10.669  323.015   8.6307  674.412   10.336  649.425   8.6825 24.98682 13.49877 
1 1 1   11   12   29 o  647.141   6.9544  320.675   6.8886  324.558   9.0051  315.197   10.695  650.929   9.0382  641.345   10.895 9.584229 14.15612 
1 1 1   11   12   30 o  681.543   7.0154  355.699   7.3184  348.839   9.3726  366.416   11.714  674.804   9.0743  691.429   11.069 -16.62518 14.31276 
1 1 1   11   12   31 o  516.575   6.5811  204.343   5.2035  200.214   7.3811  208.423   7.3370  511.171   9.4338  521.561   9.1905 -10.38989 13.17050 
1 1 1   11   12   32 o   85.380   20.910   5.8391   2.7109   4.0373   4.6869   6.7450   3.3233   80.167   29.306   91.763   23.544 -11.59629 37.59193 
1 1 1   11   12   33 f  675.559   6.2060  349.506   6.4172  351.790   9.8027  347.793   8.4890  677.466   9.4534  673.732   8.2318 3.734070 12.53516 
1 1 1   11   12   34 f  134.852   13.801   14.113   2.8086   16.285   5.1640   13.201   3.3469  143.105   24.454  129.840   17.269 13.26404 29.93670 
1 1 1   11   12   35 o  539.336   6.0330  222.794   4.9804  227.922   8.2678  219.874   6.2395  545.140   9.9085  535.665   7.6100 9.475525 12.49368 
1 1 1   11   12   36 o  428.389   7.0379  140.618   4.6148  149.365   8.3492  136.770   5.5375  440.956   12.370  422.365   8.5656 18.59097 15.04645 
1 1 1   11   12   37 o  141.486   13.850   15.545   2.9609   12.397   5.3575   16.930   3.5528  123.482   28.864  147.370   16.008 -23.88770 33.00554 
1 1 1   11   12   38 o  242.576   11.438   45.211   4.2468   46.539   9.8119   44.905   4.7110  242.591   26.876  241.300   12.801 1.290482 29.76900 
1 1 1   11   12   39 o  213.620   9.7335   35.034   3.1826   34.582   5.8610   35.222   3.7900  210.627   18.363  213.740   11.629 -3.113693 21.73566 
1 1 1   11   12   40 o  433.148   6.9463  143.839   4.6053  142.377   8.6169  144.424   5.4488  429.976   13.093  433.877   8.2047 -3.901031 15.45136 
1 1 1   11   12   41 o  236.069   9.1326   42.793   3.2999   45.725   5.9426   41.486   3.9679  242.651   16.091  232.244   11.162 10.40724 19.58389 
1 1 1   11   12   42 o  409.792   6.9696  128.796   4.3716  128.507   7.5785  128.941   5.3517  408.442   12.122  409.802   8.5320 -1.359802 14.82375 
1 1 1   11   12   43 o  280.955   8.5009   60.625   3.6557   62.167   6.5992   59.943   4.3911  282.987   15.292  279.141   10.277 3.846405 18.42469 
1 1 1   11   12   44 o  170.506   13.195   22.589   3.4169   22.481   4.1834   22.806   5.9223  169.423   16.334  168.627   23.591 0.7964325 28.69415 
1 1 1   11   12   45 o  263.971   8.4330   53.554   3.4073   54.641   4.8642   52.506   4.7742  266.073   11.944  260.819   11.959 5.253662 16.90179 
1 1 1   11   12   46 o  191.463   10.470   28.335   3.0568   29.592   4.5777   27.323   4.1064  194.554   15.501  187.164   14.446 7.389893 21.18873 
1 1 1   11   12   47 o   51.864   21.528   0.6259   2.8090   1.6542   4.2286  -0.1862   3.7581   65.904   26.780   55.766   24.086 10.13763 36.01819 
1 1 1   11   12   48 o  246.960   8.7783   46.941   3.3182   46.403   4.8559   47.411   4.5449  244.382   13.029  247.591   11.993 -3.208817 17.70801 
1 1 1   11   12   49 o  151.368   13.552   17.924   3.1065   16.186   4.5547   19.435   4.2479  141.370   21.746  156.401   18.078 -15.03101 28.27845 
1 1 1   11   12   50 o   59.171   24.589   0.9299   3.6708  -5.3477   5.4165   6.2624   4.9921   53.761   25.345   89.252   30.458 -35.49145 39.62373 
1 1 1   11   12   51 o  110.511   19.940   9.9478   3.2488   16.215   5.0702   5.5824   4.2316  140.051   24.547   83.899   28.045 56.15290 37.27006 
1 1 1   11   12   52 o  162.539   13.493   20.709   3.3266   20.641   4.8685   20.768   4.5560  159.926   20.350  161.004   18.844 -1.078171 27.73471 
1 1 1   11   12   53 o  146.077   15.463   16.910   3.4047   18.674   5.0007   15.385   4.6485  150.965   22.314  136.466   23.077 14.49919 32.10114 
1 1 1   11   12   54 o   74.440   24.810   4.3994   3.3121   5.1378   4.7547   3.7033   4.6163   82.178   29.595   75.207   28.754 6.971481 41.26342 
1 1 1   11   12   55 o  160.231   20.467   20.965   4.9050   15.990   7.1195   25.461   6.7674  132.341   34.715  173.511   26.307 -41.17029 43.55659 
1 1 1   11   12   56 o  115.116   21.695   11.105   3.6825   13.644   4.8017   7.4777   5.7383  125.895   25.785   93.645   32.623 32.24976 41.58294 
1 1 1   11   12   57 o   82.506   24.815   5.8249   3.3887   5.8662   4.7427   5.7818   4.8437   84.222   29.639   84.010   29.911 0.2117081 42.10910 
1 1 1   11   12   58 o   84.117   25.047   6.1474   3.4652   11.283   5.0179   1.4659   4.7909  111.530   29.091   65.667   27.741 45.86289 40.19724 
1 1 1   11   12   59 o  120.472   19.263   12.146   3.4324   7.5073   4.7019   17.438   5.0220   90.839   29.527  141.777   23.998 -50.93764 38.04943 
1 1 1   11   12   60 o  190.855   14.360   29.291   4.1643   19.256   6.2916   37.114   5.5554  143.709   29.589  212.790   17.204 -69.08113 34.22646 
1 1 1   11   12   61 o  136.319   21.143   16.003   4.2687   20.375   6.2967   12.285   5.8068  147.502   28.923  111.038   32.253 36.46362 43.32251 
1 1 1   11   13    0 o  489.153   10.566  183.432   7.9025  183.432   7.9025  183.432   7.9025  489.153   10.566  489.153   10.566 0.000000 0.000000 
1 1 1   11   13    1 o  1508.68   11.460  1743.23   26.463  1741.47   32.368  1746.79   45.953  1507.63   14.027  1509.08   19.894 -1.448608 24.34197 
1 1 1   11   13    2 o  451.562   5.9988  156.086   4.1462  158.502   5.0765  151.244   7.1858  455.022   7.2890  444.409   10.564 10.61331 12.83453 
1 1 1   11   13    3 o   43.653   17.111   0.8422   1.6649  -0.2229   1.9263   3.9867   3.3099   40.061   17.274   74.290   24.803 -34.22885 30.22545 
1 1 1   11   13    4 o  929.642   9.7754  661.762   13.910  661.762   13.910   0.0000   0.0000  929.642   9.7754  ?   ?  0.000000 9.775357 
1 1 1   11   13    5 o  938.019   9.8506  673.743   14.143  673.743   14.143   0.0000   0.0000  938.019   9.8506  ?   ?  0.000000 9.850622 
1 1 1   11   13    6 o  567.761   6.7385  246.762   5.8559  247.277   7.1792  245.736   10.123  568.319   8.2530  566.442   11.675 1.877380 14.29777 
1 1 1   11   13    7 o  1120.70   9.3095  961.657   15.969  938.797   19.060  1015.51   29.254  1107.19   11.247  1151.08   16.604 -43.89294 20.05441 
1 1 1   11   13    8 o  490.709   6.7463  184.328   5.0671  183.736   6.1370  185.596   8.9817  489.893   8.1844  492.271   11.920 -2.377899 14.45952 
1 1 1   11   13    9 o  1136.37   9.4446  988.736   16.428  978.202   19.835  1011.75   29.315  1130.18   11.466  1148.96   16.669 -18.78223 20.23179 
1 1 1   11   13   10 o  490.586   6.9148  184.237   5.1924  180.782   6.1189  193.126   9.8141  485.940   8.2266  502.134   12.769 -16.19437 15.18971 
1 1 1   11   13   11 o  689.123   7.3873  363.542   7.7920  364.267   9.4207  361.970   13.864  689.767   8.9230  687.424   13.176 2.343201 15.91337 
1 1 1   11   13   12 o  448.794   6.1120  154.176   4.1986  155.757   5.7659  152.391   6.1259  451.053   8.3515  446.140   8.9707 4.912476 12.25653 
1 1 1   11   13   13 o  1026.78   9.0052  807.190   14.153  819.844   24.812  801.088   17.231  1034.36   15.672  1022.79   11.007 11.57397 19.15059 
1 1 1   11   13   14 o  538.756   7.2428  222.200   5.9727  208.467   9.8038  230.305   7.5317  521.708   12.277  548.455   8.9719 -26.74634 15.20599 
1 1 1   11   13   15 o  1858.98   12.134  2646.85   34.527  2620.00   48.150  2675.27   49.536  1848.83   17.015  1868.17   17.323 -19.34351 24.28193 
1 1 1   11   13   16 o  178.910   10.139   24.589   2.7651   23.147   3.8601   26.109   3.9627  173.187   14.701  184.057   14.175 -10.86983 20.42164 
1 1 1   11   13   17 o  983.618   7.8036  740.702   11.749  727.947   16.329  754.391   16.917  974.948   10.943  992.486   11.136 -17.53796 15.61237 
1 1 1   11   13   18 o  985.047   7.6820  742.860   11.583  743.596   16.044  742.058   16.738  985.377   10.638  984.327   11.110 1.049866 15.38125 
1 1 1   11   13   19 o  476.338   6.4984  173.694   4.7380  186.839   6.4656  158.448   6.9630  493.986   8.5512  454.871   10.001 39.11533 13.15832 
1 1 1   11   13   20 o  1318.11   9.2614  1330.41   18.685  1331.53   21.581  1327.03   37.345  1318.54   10.693  1315.32   18.549 3.219238 21.41081 
1 1 1   11   13   21 o  459.932   6.2412  161.936   4.3937  166.473   5.4811  153.780   7.3492  466.298   7.6795  448.083   10.715 18.21481 13.18313 
1 1 1   11   13   22 o  259.995   7.8573   51.756   3.1268   51.982   3.7664   51.257   5.6088  260.535   9.4449  258.214   14.246 2.320770 17.09289 
1 1 1   11   13   23 o  492.707   6.4608  185.847   4.8724  184.516   6.0621  188.276   8.1895  490.896   8.0679  495.775   10.792 -4.879181 13.47435 
1 1 1   11   13   24 o  1551.53   9.5962  1843.66   22.789  1861.82   36.629  1832.19   29.109  1558.25   15.357  1546.32   12.299 11.92383 19.67506 
1 1 1   11   13   25 o  543.143   5.9894  225.840   4.9793  226.279   6.9913  225.389   7.0933  543.589   8.4027  542.514   8.5422 1.075134 11.98224 
1 1 1   11   13   26 o  834.438   6.9158  533.110   8.8330  532.446   11.311  534.148   14.141  833.801   8.8629  834.966   11.065 -1.164978 14.17668 
1 1 1   11   13   27 o  596.455   6.5914  272.383   6.0176  263.774   9.0625  279.172   8.0479  586.786   10.090  603.746   8.7088 -16.96002 13.32871 
1 1 1   11   13   28 o  481.357   7.0604  177.421   5.2020  172.780   6.5360  185.440   8.5921  474.942   8.9909  491.904   11.412 -16.96216 14.52801 
1 1 1   11   13   29 o  115.514   18.769   10.515   3.2045   13.261   4.1424   6.4232   5.0571  129.560   21.653   93.139   30.639 36.42039 37.51765 
1 1 1   11   13   30 o  542.461   6.3723  225.324   5.2910  234.500   7.6803  217.035   7.2994  553.245   9.0696  532.252   8.9599 20.99377 12.74902 
1 1 1   11   13   31 f  453.820   6.8035  157.726   4.7259  160.627   6.8709  155.121   6.5105  457.806   9.8053  449.914   9.4540 7.891602 13.62070 
1 1 1   11   13   32 o  538.904   6.5693  222.420   5.4188  217.009   7.7250  227.662   7.6031  532.101   9.4849  545.035   9.1138 -12.93469 13.15388 
1 1 1   11   13   33 o  154.750   15.016   18.576   3.5119   16.252   4.8431   21.153   5.0999  143.301   22.848  164.321   20.739 -21.02007 30.85641 
1 1 1   11   13   34 o  503.193   6.7875  193.967   5.2277  187.616   7.4989  199.972   7.2917  494.616   9.9051  510.703   9.3280 -16.08749 13.60598 
1 1 1   11   13   35 f  253.293   9.9966   49.216   3.8757   52.761   6.1318   46.857   5.0014  261.393   15.394  246.573   13.301 14.82056 20.34415 
1 1 1   11   13   36 o  248.717   8.4760   47.431   3.2268   39.489   5.8055   50.982   3.8816  225.689   16.929  257.774   9.8378 -32.08478 19.58009 
1 1 1   11   13   37 f  201.617   11.165   31.316   3.4319   32.540   5.2509   30.404   4.5345  204.672   16.913  198.107   15.067 6.565231 22.65085 
1 1 1   11   13   38 o  288.318   9.1056   63.786   4.0184   52.975   9.7637   65.990   4.4091  259.439   24.893  293.195   9.8248 -33.75638 26.76148 
1 1 1   11   13   39 o  594.476   6.8420  270.906   6.2257  268.217   10.611  272.317   7.6880  590.581   11.738  595.770   8.4308 -5.188660 14.45231 
1 1 1   11   13   40 f  246.459   9.3482   46.643   3.5265   41.149   6.4116   49.026   4.2225  229.679   18.392  252.521   10.925 -22.84183 21.39213 
1 1 1   11   13   41 o  225.459   9.0884   39.038   3.1363   40.087   5.5052   38.534   3.8162  227.107   15.938  223.803   11.140 3.304749 19.44549 
1 1 1   11   13   42 o  414.714   6.7616  131.906   4.2920  134.270   7.2994  130.656   5.3063  417.589   11.420  412.505   8.4041 5.083923 14.17908 
1 1 1   11   13   43 o   90.156   25.834   6.5964   3.7483   2.9893   5.2726   10.282   5.3297   77.186   30.389  111.426   30.404 -34.23971 42.98664 
1 1 1   11   13   44 o  168.004   12.132   21.892   3.0989   26.199   5.7971   20.169   3.6667  181.562   21.263  160.622   15.091 20.94025 26.07374 
1 1 1   11   13   45 o  109.973   19.972   9.7570   3.2380   4.4547   6.1445   11.796   3.8100   86.081   33.111  120.797   21.389 -34.71624 39.41894 
1 1 1   11   13   46 o  296.203   8.5672   67.470   3.8842   68.552   7.2384   67.033   4.6030  296.382   16.015  294.946   10.196 1.436249 18.98553 
1 1 1   11   13   47 o   57.499   22.904   1.4642   3.0278   7.6292   5.9858  -0.6555   3.5099   98.247   33.353   52.187   22.896 46.05981 40.45531 
1 1 1   11   13   48 o  253.707   9.6394   49.606   3.7433   51.504   6.9015   48.815   4.4556  255.835   17.734  251.288   11.584 4.546921 21.18213 
1 1 1   11   13   49 o   91.164   24.014   6.8946   3.3974   8.4840   7.2639   6.4496   3.8438  103.616   36.658   88.516   26.385 15.10041 45.16587 
1 1 1   11   13   50 o  290.136   12.731   65.330   5.6537   44.504   12.985   70.201   6.2803  224.558   39.204  300.445   13.657 -75.88705 41.51472 
1 1 1   11   13   51 o  115.815   18.734   10.840   3.2076   13.071   4.9265   9.1984   4.2262  124.583   26.642  104.348   26.431 20.23449 37.52828 
1 1 1   11   13   52 o  300.560   8.7740   69.665   4.0364   79.709   6.2672   62.545   5.2765  320.134   12.790  283.803   12.147 36.33167 17.63893 
1 1 1   11   13   53 o  122.073   18.573   12.065   3.3609   6.5278   4.9536   16.789   4.5750   89.528   30.341  143.216   21.537 -53.68826 37.20816 
1 1 1   11   13   54 o   86.904   24.326   6.3781   3.3637   7.3983   4.8872   5.4599   4.6366   93.380   30.080   83.264   29.305 10.11668 41.99542 
1 1 1   11   13   55 o   57.584   25.741  -1.1473   4.6443  -4.9427   6.3147   3.3244   6.8544   58.987   27.669   81.621   33.732 -22.63392 43.62848 
1 1 1   11   13   56 o   84.169   25.246   6.0536   3.5110   2.0989   4.7279   10.916   5.2424   68.296   28.098  110.312   30.176 -42.01610 41.23228 
1 1 1   11   13   57 o  110.110   21.335   10.223   3.4659   9.8578   4.8943   10.590   4.9088  104.667   29.359  108.582   28.991 -3.915169 41.26081 
1 1 1   11   13   58 o   60.992   24.033   2.2083   3.3002   3.6879   4.6368   0.6893   4.6982   73.203   28.593   62.380   26.936 10.82372 39.28294 
1 1 1   11   13   59 o  125.003   18.202   12.981   3.3803   8.6930   4.6407   17.827   4.9337   96.859   29.019  143.599   23.241 -46.74001 37.17852 
1 1 1   11   13   60 o  113.105   19.814   10.897   3.3053   8.8967   4.5898   13.052   4.7638   97.182   28.801  119.437   26.726 -22.25423 39.29107 
1 1 1   11   14    0 o  1667.88   21.683  2132.67   55.333  2132.67   55.333  2132.67   55.333  1667.88   21.683  1667.88   21.683 0.000000 0.000000 
1 1 1   11   14    1 o  847.009   7.6117  549.221   9.8682  576.291   12.593  506.155   15.884  867.559   9.4836  812.900   12.766 54.65936 15.90314 
1 1 1   11   14    2 o  754.727   8.7469  436.107   10.104  436.107   10.104   0.0000   0.0000  754.727   8.7469  ?   ?  0.000000 8.746897 
1 1 1   11   14    3 o  1029.70   10.523  811.919   16.586  811.919   16.586   0.0000   0.0000  1029.70   10.523  ?   ?  0.000000 10.52336 
1 1 1   11   14    4 o  254.638   6.8921   49.636   2.6862   49.445   3.1738   50.117   5.0437  254.137   8.1592  255.463   12.941 -1.326294 15.29846 
1 1 1   11   14    5 o  971.669   8.3268  722.821   12.384  738.058   15.393  694.857   20.852  981.769   10.243  952.361   14.305 29.40796 17.59420 
1 1 1   11   14    6 o  466.392   6.7758  166.511   4.8371  163.860   5.8365  172.326   8.6439  462.638   8.2422  474.350   11.905 -11.71243 14.48000 
1 1 1   11   14    7 o  851.657   7.9486  555.275   10.362  550.327   12.613  565.542   18.170  847.787   9.7202  859.217   13.816 -11.43005 16.89301 
1 1 1   11   14    8 f  1061.03   9.0532  861.933   14.703  846.464   17.656  896.924   26.554  1051.36   10.972  1081.87   16.036 -30.51099 19.42997 
1 1 1   11   14    9 o  940.098   8.4458  676.616   12.153  674.300   14.805  681.399   21.279  938.406   10.308  943.069   14.741 -4.663391 17.98746 
1 1 1   11   14   10 o  802.473   7.8446  492.986   9.6354  485.888   11.578  508.979   17.378  796.617   9.4954  815.113   13.929 -18.49591 16.85767 
1 1 1   11   14   11 o  1686.93   12.844  2179.71   33.163  2169.76   40.350  2200.43   58.216  1682.73   15.666  1693.46   22.459 -10.73267 27.38335 
1 1 1   11   14   12 o  1423.98   13.802  1553.38   30.082  1554.79   42.588  1551.97   42.497  1423.93   19.540  1422.64   19.516 1.290161 27.61703 
1 1 1   11   14   13 o  765.183   7.8903  448.242   9.2412  459.191   16.118  442.879   11.279  774.222   13.601  760.528   9.6895 13.69318 16.69938 
1 1 1   11   14   14 o  745.828   6.7920  425.820   7.7536  408.015   10.513  447.061   11.482  729.985   9.4086  764.099   9.8175 -34.11456 13.59795 
1 1 1   11   14   15 o  294.730   8.7545   66.508   3.9494   66.634   6.9013   66.447   4.8159  294.477   15.365  294.563   10.681 -0.8602905E-01 18.71259 
1 1 1   11   14   16 o  382.431   8.0578  111.972   4.7167  117.268   8.3036  109.449   5.7311  391.226   13.867  378.061   9.9039 13.16534 17.04016 
1 1 1   11   14   17 f  195.704   10.245   29.411   3.0581   28.730   4.2760   30.123   4.3753  193.081   14.576  197.734   14.559 -4.652451 20.60144 
1 1 1   11   14   18 o  779.332   7.1430  464.970   8.5206  465.662   11.985  464.262   12.116  779.789   10.041  778.610   10.167 1.178711 14.28940 
1 1 1   11   14   19 o  528.586   6.3999  213.889   5.1780  217.491   5.9675  202.914   10.416  532.996   7.3148  514.618   13.224 18.37799 15.11195 
1 1 1   11   14   20 o  818.063   6.4753  512.318   8.1080  518.888   10.334  501.798   13.077  823.220   8.2016  809.426   10.555 13.79395 13.36667 
1 1 1   11   14   21 o  643.089   6.1569  316.593   6.0604  317.745   7.5777  314.548   10.096  644.208   7.6849  640.850   10.292 3.358215 12.84472 
1 1 1   11   14   22 o  324.389   7.1742   80.565   3.5621   81.643   4.2892   78.167   6.3949  326.526   8.5819  319.380   13.081 7.145355 15.64527 
1 1 1   11   14   23 o  319.954   9.5497   78.403   4.6768   79.948   6.5960   76.842   6.6322  322.977   13.342  316.629   13.685 6.347839 19.11259 
1 1 1   11   14   24 o  778.911   6.1057  464.466   7.2793  464.067   10.153  464.887   10.442  778.459   8.5209  779.133   8.7560 -0.6737671 12.21778 
1 1 1   11   14   25 o  331.257   7.0626   84.017   3.5810   89.918   5.0550   78.072   5.0735  342.627   9.6390  319.238   10.383 23.38876 14.16748 
1 1 1   11   14   26 o  234.738   9.1114   42.204   3.2737   36.520   4.7459   47.364   4.5216  217.763   14.318  248.602   11.883 -30.83916 18.60704 
1 1 1   11   14   27 o  211.995   11.397   34.541   3.6845   35.883   5.0036   32.951   5.4457  215.735   15.251  206.443   17.396 9.291656 23.13480 
1 1 1   11   14   28 o  389.121   6.9431  115.945   4.1353  116.222   5.8140  115.662   5.8831  389.480   9.7525  388.534   9.8925 0.9453735 13.89146 
1 1 1   11   14   29 o  142.477   13.812   15.719   2.9743   16.102   4.2928   15.365   4.1247  143.300   20.126  139.977   19.804 3.322952 28.23626 
1 1 1   11   14   30 o  569.010   6.3584  247.932   5.5378  240.998   7.7687  255.096   7.8961  560.829   9.0500  577.009   8.9404 -16.17981 12.72138 
1 1 1   11   14   31 o  810.744   6.5261  503.393   8.0986  511.978   11.663  495.401   11.254  817.333   9.3229  804.013   9.1447 13.31976 13.05917 
1 1 1   11   14   32 o  378.127   7.5477  109.538   4.3684  106.928   6.0055  112.471   6.3658  373.413   10.507  382.943   10.861 -9.530151 15.11140 
1 1 1   11   14   33 o   92.129   21.294   6.8156   2.9426   5.8602   4.3462   7.6241   3.9985   87.950   28.370   97.480   26.225 -9.529869 38.63408 
1 1 1   11   14   34 o   65.094   24.069   2.5768   3.1757   7.4919   4.8423  -1.1328   4.2068   97.676   29.728   56.690   24.964 40.98662 38.81945 
1 1 1   11   14   35 o  295.444   8.7602   66.932   3.9615   60.238   5.7696   72.902   5.4489  279.913   13.467  308.119   11.554 -28.20578 17.74357 
1 1 1   11   14   36 o  229.864   12.256   40.721   4.2965   41.808   5.3279   38.700   7.2653  232.516   15.051  222.416   21.614 10.09975 26.33837 
1 1 1   11   14   37 o  361.387   9.3601  100.219   5.1775  101.966   10.569   99.667   5.9389  362.500   19.116  360.234   10.771 2.265625 21.94184 
1 1 1   11   14   38 o  257.294   9.6073   50.821   3.7836   51.869   5.6769   49.984   5.0751  259.045   14.374  254.500   13.072 4.545334 19.42923 
1 1 1   11   14   39 o   62.292   23.840   2.1067   3.1753   3.2160   4.8096   1.2496   4.2276   76.362   29.313   65.015   26.638 11.34684 39.60905 
1 1 1   11   14   40 o  322.850   7.5074   79.954   3.7099   84.474   6.0320   77.203   4.7050  331.278   11.896  317.007   9.6966 14.27127 15.34725 
1 1 1   11   14   41 o  122.888   15.773   11.871   2.8983   11.097   5.1385   12.232   3.5100  116.035   29.010  124.044   19.100 -8.009346 34.73270 
1 1 1   11   14   42 o  289.509   8.8612   64.394   3.9267   67.713   6.2836   62.267   5.0297  296.050   13.867  284.305   11.558 11.74518 18.05208 
1 1 1   11   14   43 o  211.817   11.873   34.706   3.8338   39.239   5.6730   30.895   5.2013  224.161   16.653  198.602   17.283 25.55905 24.00049 
1 1 1   11   14   44 o  156.298   13.032   19.012   3.0893   22.513   5.4899   17.389   3.7372  167.845   21.890  148.616   16.719 19.22964 27.54486 
1 1 1   11   14   45 o  289.113   8.3033   64.251   3.6744   68.405   6.4847   62.287   4.4593  297.046   14.263  284.334   10.246 12.71213 17.56166 
1 1 1   11   14   46 o  238.202   9.6387   43.698   3.5143   38.645   6.3701   45.908   4.2135  221.268   18.993  243.869   11.288 -22.60068 22.09387 
1 1 1   11   14   47 o  118.196   17.546   11.151   3.0779   19.997   6.1085   8.1407   3.5633  155.842   26.561   99.222   23.774 56.62003 35.64648 
1 1 1   11   14   48 o  259.035   9.7812   51.734   3.8781   62.012   8.1259   48.703   4.4131  280.125   19.065  250.979   11.488 29.14616 22.25863 
1 1 1   11   14   49 o  106.235   26.909   9.4941   4.3805   24.340   12.137   7.2706   4.6971  161.359   46.560   93.921   29.400 67.43806 55.06533 
1 1 1   11   14   50 o  173.386   15.205   23.650   3.9945   26.033   11.718   23.337   4.2490  166.846   44.898  171.862   16.349 -5.016357 47.78194 
1 1 1   11   14   51 o  119.882   20.458   11.717   3.6192   5.0815   7.2843   13.892   4.1703   90.535   35.695  130.334   21.665 -39.79831 41.75539 
1 1 1   11   14   52 o  172.140   14.483   23.318   3.7804   25.161   7.4075   22.669   4.3960  172.183   29.147  168.747   17.263 3.436157 33.87542 
1 1 1   11   14   53 o  114.839   21.765   10.927   3.6858   10.259   7.1611   11.168   4.2990  108.447   36.482  114.844   25.152 -6.397186 44.31239 
1 1 1   11   14   54 o  143.955   18.404   16.756   3.9624   12.717   7.5966   18.265   4.6443  117.734   37.458  149.292   20.897 -31.55774 42.89262 
1 1 1   11   14   55 o   87.360   31.700   6.1118   5.4694   6.9696   7.5264   5.1519   7.9616   94.896   36.606   90.206   36.711 4.689865 51.84335 
1 1 1   11   14   56 o  165.829   14.102   21.817   3.5454   24.316   5.3426   19.850   4.7394  171.774   20.740  155.157   20.455 16.61659 29.12989 
1 1 1   11   14   57 o   44.776   20.646  -2.0622   3.2871   6.8774   4.7943  -9.9928   4.5156   88.817   29.851   39.312   19.520 49.50488 35.66661 
1 1 1   11   14   58 o  144.883   15.699   16.988   3.4257   17.682   4.8613   16.303   4.8282  143.735   22.862  137.295   23.840 6.439560 33.03049 
1 1 1   11   14   59 o  172.946   13.049   23.847   3.4288   19.859   4.7996   28.004   4.9001  152.948   21.060  184.604   17.553 -31.65616 27.41633 
1 1 1   11   14   60 o   72.779   26.035   4.4595   3.6738   4.8841   5.0573   3.9852   5.3458   77.577   29.984   74.807   30.212 2.770424 42.56522 
1 1 1   11   15    1 o  560.572   8.0693  240.572   6.9237  257.313   10.180  226.161   9.4448  579.653   11.473  543.436   11.355 36.21667 16.14219 
1 1 1   11   15    2 o  619.742   8.2758  294.043   7.8504  291.853   11.047  296.277   11.159  617.325   11.691  621.985   11.721 -4.659546 16.55447 
1 1 1   11   15    3 o  865.122   9.5771  573.051   12.682  562.625   17.615  584.271   18.273  857.026   13.428  873.342   13.670 -16.31683 19.16169 
1 1 1   11   15    4 o  1045.48   8.7609  836.835   14.020  831.333   17.018  848.455   24.732  1041.94   10.671  1052.30   15.355 -10.35449 18.69873 
1 1 1   11   15    5 o  473.464   6.4569  171.594   4.6793  168.154   5.5784  179.761   8.5954  468.672   7.7762  484.488   11.591 -15.81595 13.95770 
1 1 1   11   15    6 o  438.452   6.8165  147.158   4.5746  145.785   5.5646  150.021   8.0346  436.376   8.3311  442.592   11.860 -6.215881 14.49385 
1 1 1   11   15    7 o  281.395   7.6885   60.618   3.3115   64.347   3.9819   52.253   5.9635  289.907   8.9734  260.720   15.007 29.18707 17.48534 
1 1 1   11   15    8 o  502.144   6.9202  193.020   5.3188  187.024   6.4149  206.208   9.5139  494.253   8.4795  518.890   11.979 -24.63620 14.67636 
1 1 1   11   15    9 o  1239.25   10.098  1175.94   19.154  1160.21   23.123  1210.33   34.189  1230.78   12.274  1256.55   17.776 -25.77075 21.60184 
1 1 1   11   15   10 o  798.422   7.8615  488.027   9.6074  472.275   11.419  526.202   17.776  785.373   9.4990  828.773   14.013 -43.39996 16.92895 
1 1 1   11   15   11 o  248.458   16.476   47.519   6.2304   0.0000   0.0000   47.519   6.2304  ?   ?   248.458   16.476 0.000000 16.47643 
1 1 1   11   15   12 o  820.329   9.9045  515.284   12.436  509.826   17.302  521.120   17.888  815.765   13.856  824.732   14.170 -8.966492 19.81920 
1 1 1   11   15   13 o  714.877   9.5277  391.311   10.425  379.758   14.161  404.981   15.404  704.084   13.140  727.052   13.842 -22.96808 19.08592 
1 1 1   11   15   14 o  629.039   13.573  303.147   13.069   0.0000   0.0000  303.147   13.069  ?   ?   629.039   13.573 0.000000 13.57315 
1 1 1   11   15   15 o  444.886   6.7207  151.514   4.5765  160.768   6.5262  142.560   6.4194  458.214   9.3052  431.477   9.7201 26.73788 13.45607 
1 1 1   11   15   16 o  465.025   9.5362  165.591   6.7877  165.591   6.7877   0.0000   0.0000  465.025   9.5362  ?   ?  0.000000 9.536187 
1 1 1   11   15   17 o  289.295   8.3286   64.079   3.6879   64.532   5.1716   63.611   5.2606  290.253   11.641  288.168   11.927 2.084473 16.66583 
1 1 1   11   15   18 o  537.323   7.8250  221.049   6.4356  225.926   8.1174  212.796   10.560  543.156   9.7638  527.002   13.091 16.15387 16.33100 
1 1 1   11   15   19 o  427.980   7.3922  140.234   4.8425  137.673   6.7638  142.927   6.9361  423.974   10.423  431.986   10.490 -8.012543 14.78763 
1 1 1   11   15   20 f  879.216   7.6585  591.858   10.306  577.338   14.125  608.392   15.072  868.191   10.629  891.205   11.049 -23.01398 15.33185 
1 1 1   11   15   21 o  184.699   9.9954   26.204   2.8152   26.424   3.2696   25.575   5.5357  185.356   11.582  181.396   20.285 3.959854 23.35879 
1 1 1   11   15   22 o  325.211   9.4005   80.999   4.6794   78.607   6.4974   83.578   6.7448  320.259   13.255  330.226   13.344 -9.966766 18.80820 
1 1 1   11   15   23 o  1045.56   7.4594  837.045   11.938  841.806   15.217  829.424   19.252  1048.38   9.4826  1040.39   12.089 7.989502 15.36468 
1 1 1   11   15   24 o  731.334   6.6978  409.495   7.4975  418.398   9.5353  395.076   12.135  739.154   8.4281  718.091   11.040 21.06305 13.88945 
1 1 1   11   15   25 o  434.628   8.0972  144.661   5.3867  149.381   5.8925  120.657   13.289  441.638   8.7169  395.519   22.039 46.11942 23.69999 
1 1 1   11   15   26 o  276.163   9.1048   58.418   3.8486   58.065   5.0911   58.889   5.8791  275.236   12.085  276.764   13.923 -1.528320 18.43582 
1 1 1   11   15   27 o   42.585   19.293  -1.5733   2.7094   0.3460   3.8498  -3.4569   3.8138   59.427   24.973   47.098   21.897 12.32830 33.21354 
1 1 1   11   15   28 o  1134.70   7.2442  986.033   12.582  994.285   17.879  977.937   17.709  1139.05   10.255  1129.65   10.242 9.400879 14.49336 
1 1 1   11   15   29 o  425.316   6.5855  138.526   4.2871  140.996   6.0648  136.059   6.0610  428.962   9.2370  421.378   9.3973 7.584656 13.17695 
1 1 1   11   15   30 o  282.780   8.2296   61.264   3.5620   58.620   4.9812   64.031   5.0956  276.453   11.772  288.945   11.522 -12.49136 16.47192 
1 1 1   11   15   31 f  680.533   6.7934  354.729   7.0763  358.777   9.5402  349.777   10.551  684.180   9.1100  675.417   10.205 8.763245 13.68007 
1 1 1   11   15   32 o  136.834   15.037   14.565   3.0974   14.206   4.3977   14.919   4.3633  133.853   22.246  137.400   21.448 -3.546722 30.90116 
1 1 1   11   15   33 o  195.776   11.244   29.512   3.3551   28.618   5.1128   30.188   4.4464  191.926   17.600  197.580   14.810 -5.653976 23.00238 
1 1 1   11   15   34 o  402.744   7.1443  124.292   4.4041  121.668   6.3571  126.714   6.1071  398.188   10.430  406.423   9.8172 -8.235352 14.32373 
1 1 1   11   15   35 o  397.008   8.4573  120.860   5.1393  119.253   6.3169  124.005   8.8384  394.156   10.471  401.404   14.385 -7.248413 17.79245 
1 1 1   11   15   36 o  183.143   14.565   25.992   4.0491   26.353   4.9701   25.280   6.9821  183.844   17.889  178.098   26.413 5.746155 31.90112 
1 1 1   11   15   37 o  151.373   17.576   17.944   3.9964   21.814   8.9865   16.989   4.4619  162.231   37.008  146.647   20.433 15.58421 42.27469 
1 1 1   11   15   38 o   91.287   22.673   6.7471   3.1537   10.764   4.6965   3.4487   4.2560  114.858   27.144   74.803   27.823 40.05468 38.87108 
1 1 1   11   15   39 o  331.771   8.7054   84.491   4.4207   80.355   6.7906   87.533   5.8239  322.834   13.742  337.350   11.279 -14.51553 17.77809 
1 1 1   11   15   40 o  238.591   10.235   43.763   3.7379   42.699   5.4349   44.718   5.1491  234.557   15.220  240.299   14.061 -5.742798 20.72101 
1 1 1   11   15   41 o  228.630   11.784   40.373   4.1097   38.048   5.7210   42.853   5.9075  220.815   17.059  234.541   16.562 -13.72650 23.77635 
1 1 1   11   15   42 f   98.408   23.152   7.9117   3.4291   8.6852   5.0146   7.2324   4.6996  102.951   29.992   94.912   29.359 8.038269 41.96991 
1 1 1   11   15   43 o   99.323   23.911   8.0964   3.5915   11.495   5.3947   5.3910   4.8132  117.375   29.934   85.587   29.874 31.78795 42.29083 
1 1 1   11   15   44 o  166.710   15.341   21.753   3.8707   28.267   5.4781   15.259   5.4700  189.136   19.188  135.958   27.235 53.17816 33.31551 
1 1 1   11   15   45 o  359.324   7.3747   99.165   4.0560  100.538   7.0493   98.486   4.9591  360.521   12.774  357.768   9.0559 2.752991 15.65877 
1 1 1   11   15   46 o  223.070   9.9706   38.350   3.4044   33.974   5.9722   40.456   4.1435  207.254   19.039  228.479   11.889 -21.22461 22.44621 
1 1 1   11   15   47 o  104.038   19.942   8.7933   3.0601   6.2722   5.9353   9.7060   3.5713   92.022   33.074  108.809   22.195 -16.78687 39.83097 
1 1 1   11   15   48 o  109.721   22.982   9.9274   3.7360   11.711   6.1507   8.8847   4.7030  116.842   32.961  102.766   28.763 14.07592 43.74649 
1 1 1   11   15   49 o  117.961   22.067   11.412   3.8379   11.807   12.396   11.370   4.0362  122.362   47.040  117.343   23.294 5.018967 52.49117 
1 1 1   11   15   50 o   65.308   24.914   2.5768   3.4608   6.8144   7.5710   1.4575   3.8911   97.430   36.925   62.589   25.590 34.84172 44.92589 
1 1 1   11   15   51 o   95.833   24.359   7.7116   3.5807   5.2013   7.1336   8.5572   4.1401   90.299   35.412  100.502   26.526 -10.20247 44.24496 
1 1 1   11   15   52 o  205.664   12.397   33.016   3.8842   28.641   7.4791   34.632   4.5452  184.745   27.268  210.013   14.223 -25.26765 30.75503 
1 1 1   11   15   53 o  231.576   12.008   41.842   4.2416   34.528   6.9785   46.127   5.3414  205.345   22.576  242.141   14.478 -36.79625 26.81938 
1 1 1   11   15   54 f  116.542   27.044   11.765   4.7310   11.814   6.5597   11.713   6.8299  114.014   34.578  113.390   35.445 0.6240005 49.51789 
1 1 1   11   15   55 o   76.547   26.583   4.6780   3.8088  -0.7788   6.3586   7.7315   4.7566   67.788   30.223   94.065   29.609 -26.27712 42.30984 
1 1 1   11   15   56 o  104.922   24.290   9.5121   3.8238   4.5087   7.5003   11.269   4.4448   86.007   35.388  113.521   26.123 -27.51344 43.98593 
1 1 1   11   15   57 o   53.154   23.489  -0.4384   3.7568   5.0802   7.2121  -2.4935   4.4011   85.836   34.938   51.645   23.840 34.19083 42.29639 
1 1 1   11   15   58 o   50.526   22.696  -0.9361   3.6580  -6.1444   6.5786   1.3949   4.4011   56.701   27.074   62.772   26.557 -6.071201 37.92481 
1 1 1   11   15   59 o  103.988   23.952   9.6297   3.7338   13.075   6.9807   8.2488   4.4191  112.745   35.911   94.094   28.346 18.65068 45.75061 
1 1 1   11   16    0 o  881.909   13.686  595.942   18.464  595.942   18.464  595.942   18.464  881.909   13.686  881.909   13.686 0.000000 0.000000 
1 1 1   11   16    1 o  1365.08   13.070  1427.35   27.308  1443.74   39.098  1411.74   38.158  1372.30   18.614  1357.03   18.371 15.26270 26.15279 
1 1 1   11   16    2 o  504.268   6.5425  194.651   5.0498  191.324   6.1023  201.879   8.9947  499.914   7.9749  513.431   11.446 -13.51700 13.94986 
1 1 1   11   16    3 o  1676.76   12.657  2153.45   32.485  2189.79   40.561  2088.43   54.250  1690.49   15.676  1650.01   21.480 40.48413 26.59201 
1 1 1   11   16    4 o  802.726   7.5556  493.287   9.2834  491.980   11.306  495.991   16.264  801.605   9.2147  804.684   13.205 -3.078369 16.10208 
1 1 1   11   16    5 o  445.693   6.5515  152.057   4.4693  151.518   5.4057  153.221   7.9453  444.880   7.9385  447.291   11.605 -2.410797 14.06053 
1 1 1   11   16    6 o  473.034   8.2882  171.308   6.0010  171.762   8.3360  170.820   8.6458  473.583   11.500  472.270   11.960 1.312317 16.59212 
1 1 1   11   16    7 o  1576.50   14.799  1904.24   35.711  1918.08   50.868  1890.79   50.147  1581.31   21.016  1570.05   20.867 11.26587 29.61627 
1 1 1   11   16    8 o  476.292   8.5391  173.681   6.2252  169.409   8.4971  178.632   9.1463  470.315   11.804  482.931   12.373 -12.61591 17.10043 
1 1 1   11   16    9 o  435.709   12.401  145.409   8.2703   0.0000   0.0000  145.409   8.2703  ?   ?   435.709   12.401 0.000000 12.40098 
1 1 1   11   16   10 o  527.209   8.9301  212.812   7.2062  201.690   10.074  224.466   10.313  513.130   12.826  541.342   12.446 -28.21228 17.87214 
1 1 1   11   16   11 o  240.152   9.3580   44.160   3.4398   44.551   4.0591   43.162   6.4791  241.192   10.995  236.582   18.028 4.610199 21.11631 
1 1 1   11   16   12 o  1210.19   10.073  1121.51   18.658  1143.52   23.318  1082.33   31.108  1221.82   12.468  1188.21   17.105 33.60547 21.16660 
1 1 1   11   16   13 o  556.462   7.5927  237.061   6.4670  234.866   7.8263  241.784   11.483  553.835   9.2322  561.777   13.354 -7.941467 16.23439 
1 1 1   11   16   14 o  971.365   8.9525  722.467   13.311  726.427   16.263  714.434   23.165  973.906   10.910  965.458   15.676 8.448425 19.09885 
1 1 1   11   16   15 f  486.450   7.9088  181.171   5.8887  181.014   7.0075  181.549   10.864  486.198   9.4163  486.725   14.582 -0.5271606 17.35806 
1 1 1   11   16   16 o  490.626   6.9807  184.281   5.2423  192.102   7.3180  176.037   7.5133  500.859   9.5456  479.437   10.238 21.42233 13.99798 
1 1 1   11   16   17 o  436.178   8.0945  145.668   5.4041  150.154   6.8151  138.068   8.8698  442.790   10.055  424.472   13.652 18.31851 16.95551 
1 1 1   11   16   18 o  1147.09   8.6282  1007.55   15.149  1013.11   21.441  1002.01   21.408  1149.95   12.181  1143.62   12.230 6.322144 17.26120 
1 1 1   11   16   19 o  444.034   7.5346  150.958   5.1209  154.308   7.1918  147.513   7.2934  448.845   10.468  438.837   10.858 10.00790 15.08249 
1 1 1   11   16   20 o  1099.65   8.5719  925.974   14.428  963.571   21.075  892.811   19.793  1121.41   12.278  1079.48   11.979 41.93030 17.15395 
1 1 1   11   16   21 o  331.033   9.0444   83.922   4.5827   87.569   6.4035   80.092   6.5612  338.051   12.375  323.267   13.260 14.78357 18.13802 
1 1 1   11   16   22 o  542.257   6.4437  225.116   5.3482  223.155   6.5013  229.222   9.4066  539.843   7.8680  546.978   11.235 -7.135925 13.71645 
1 1 1   11   16   23 o  240.737   9.8551   44.393   3.6314   42.542   3.8119   62.559   11.941  235.648   10.568  283.560   27.872 -47.91168 29.80872 
1 1 1   11   16   24 o  595.794   9.3847  271.899   8.5582  270.307   10.038  276.136   16.376  593.948   11.042  599.740   17.840 -5.792114 20.98024 
1 1 1   11   16   25 o  563.169   7.4677  242.870   6.4372  246.742   8.5013  237.667   9.8550  567.520   9.7867  556.874   11.562 10.64551 15.14788 
1 1 1   11   16   26 o  986.045   7.4382  744.581   11.226  750.716   14.377  734.997   17.969  989.900   9.4890  979.178   11.989 10.72247 15.28993 
1 1 1   11   16   27 o  547.958   6.1523  229.903   5.1601  236.088   7.2885  223.688   7.3065  555.153   8.5774  540.361   8.8340 14.79156 12.31299 
1 1 1   11   16   28 o  1156.31   7.3244  1024.05   12.963  1035.59   18.443  1012.78   18.225  1162.36   10.366  1149.49   10.358 12.87109 14.65449 
1 1 1   11   16   29 o  356.954   7.0540   97.591   3.8541   95.551   5.3682   99.760   5.5367  353.066   9.9335  360.754   10.027 -7.688080 14.11429 
1 1 1   11   16   30 o  459.966   6.5287  162.039   4.5964  171.416   6.5632  153.013   6.4393  472.922   9.0668  446.790   9.4160 26.13104 13.07164 
1 1 1   11   16   31 o  302.240   8.3986   70.008   3.8853   69.696   5.5044   70.317   5.4851  301.354   11.933  302.699   11.839 -1.344849 16.80947 
1 1 1   11   16   32 o  656.259   6.7880  329.934   6.8185  322.067   10.285  336.104   9.1075  647.953   10.370  662.116   8.9866 -14.16290 13.72241 
1 1 1   11   16   33 o  239.981   9.2563   44.166   3.4000   44.683   4.9397   43.701   4.6870  240.732   13.460  238.137   12.907 2.594894 18.64823 
1 1 1   11   16   34 o  213.704   11.999   35.195   3.9089   35.383   4.7704   34.811   6.8194  213.913   14.658  210.942   21.418 2.971237 25.95351 
1 1 1   11   16   35 o  140.539   17.123   15.465   3.6073   16.181   4.2888   13.733   6.6692  143.214   20.120  129.454   33.426 13.75893 39.01449 
1 1 1   11   16   36 o  530.604   7.8956  215.895   6.4125  228.350   11.974  210.886   7.5931  544.448   14.368  524.186   9.4638 20.26190 17.20487 
1 1 1   11   16   37 o  405.421   7.3078  126.027   4.5349  133.070   6.6587  119.934   6.1931  416.192   10.453  395.146   10.240 21.04620 14.63239 
1 1 1   11   16   38 o   92.170   22.617   6.8873   3.1669   10.432   4.8051   4.1652   4.2108  112.902   27.954   78.047   27.878 34.85478 39.47901 
1 1 1   11   16   39 o  179.158   12.259   24.833   3.3416   19.579   4.7649   29.917   4.6876  157.374   20.251  196.087   15.751 -38.71265 25.65551 
1 1 1   11   16   40 o  338.316   8.9923   87.922   4.6565   83.855   6.2565   92.973   6.9722  329.849   12.392  347.170   13.121 -17.32126 18.04759 
1 1 1   11   16   41 o  220.621   10.996   37.478   3.7131   33.366   5.5319   40.849   5.0091  206.459   17.676  229.413   14.337 -22.95319 22.75932 
1 1 1   11   16   42 o  192.725   12.285   28.777   3.6051   27.580   5.4026   29.738   4.8404  187.027   19.142  195.023   16.367 -7.996735 25.18499 
1 1 1   11   16   43 o  387.933   8.5033  115.675   5.0491  113.941   6.9367  117.628   7.3633  384.246   11.794  390.263   12.327 -6.016907 17.06031 
1 1 1   11   16   44 o  290.120   10.129   64.838   4.4979   63.936   6.3673   65.738   6.3546  286.747   14.555  291.196   14.257 -4.448700 20.37442 
1 1 1   11   16   45 o   56.282   23.761   0.4221   3.5112   8.4017   5.2471  -6.0483   4.7249  100.960   30.987   47.894   22.890 53.06537 38.52523 
1 1 1   11   16   46 o  175.148   16.034   24.104   4.2509   30.075   6.5459   19.749   5.5901  193.546   22.517  155.748   24.237 37.79759 33.08243 
1 1 1   11   16   47 o  219.780   12.996   37.578   4.3523   42.759   6.7678   33.925   5.6834  232.336   19.203  207.188   18.103 25.14798 26.39096 
1 1 1   11   16   48 o   85.030   30.497   5.3303   5.0440   7.4540   6.0031   0.2306   9.3023   96.857   33.388   85.766   37.460 11.09063 50.17960 
1 1 1   11   16   49 o  174.445   19.903   24.384   5.2192   10.442   11.910   27.697   5.8064  117.642   45.861  185.686   20.786 -68.04411 50.35180 
1 1 1   11   16   50 o   44.617   21.572  -6.7194   4.4859  -7.8956   7.0721  -5.9276   5.8026   59.139   28.192   54.942   26.002 4.197155 38.35266 
1 1 1   11   16   51 o  125.131   19.472   12.704   3.6082   8.1223   7.0776   14.313   4.1942  100.482   36.116  132.222   21.460 -31.74021 42.01083 
1 1 1   11   16   52 o   91.127   25.226   7.0258   3.6384   8.5296   6.5298   6.3487   4.3815  100.737   34.817   87.595   28.505 13.14142 44.99674 
1 1 1   11   16   53 o  207.087   13.132   33.644   4.1410   24.522   6.7526   39.141   5.2425  170.099   26.825  222.389   15.498 -52.28995 30.97987 
1 1 1   11   16   54 o   71.014   27.429   3.2520   4.2300   5.5801   5.8640   0.7264   6.1077   86.107   32.530   70.721   30.625 15.38609 44.67758 
1 1 1   11   16   55 o  132.091   19.156   14.320   3.7599   6.4868   6.4970   18.265   4.6104   90.489   34.227  148.598   20.844 -58.10970 40.07443 
1 1 1   11   16   56 o   72.524   25.855   4.1248   3.6202  -6.2700   6.3427   9.1473   4.4089   56.064   26.719  101.286   27.659 -45.22215 38.45700 
1 1 1   11   16   57 o   60.039   24.453   1.7694   3.5359   3.6790   6.0955   0.8009   4.3409   77.724   31.932   60.665   26.041 17.05815 41.20441 
1 1 1   11   16   58 o  158.830   17.581   20.765   4.2024   8.3980   9.6102   23.688   4.6728   97.139   40.024  169.243   18.331 -72.10416 44.02203 
1 1 1   11   16   59 o   72.619   27.677   4.1355   4.2686   5.9543   6.9961   3.0569   5.3876   85.303   34.523   71.805   29.810 13.49773 45.61205 
1 1 1   11   17    0 o  458.615   11.324  161.315   7.9382  161.315   7.9382  161.315   7.9382  458.615   11.324  458.615   11.324 0.000000 0.000000 
1 1 1   11   17    1 o  1307.06   12.666  1308.57   25.340  1317.62   36.062  1299.74   35.615  1311.02   17.971  1302.11   17.870 8.914185 25.34319 
1 1 1   11   17    2 o  1964.42   14.550  2956.57   43.750  2988.24   54.277  2897.83   73.920  1974.33   17.961  1942.74   24.859 31.59607 30.66835 
1 1 1   11   17    3 o  572.360   6.7659  250.775   5.9274  255.099   7.3053  242.443   10.141  577.239   8.2682  562.634   11.775 14.60559 14.38823 
1 1 1   11   17    4 o  236.982   7.9047   42.995   2.8673   41.776   3.4364   45.787   5.2020  233.580   9.6117  244.072   13.983 -10.49167 16.96764 
1 1 1   11   17    5 o  119.409   13.223   11.056   2.3762   9.3171   2.8285   15.228   4.3806  108.873   17.571  139.314   21.213 -30.44068 27.54539 
1 1 1   11   17    6 o  667.303   8.8961  340.936   9.0864  342.488   12.846  339.382   12.855  668.678   12.551  665.636   12.617 3.041748 17.79624 
1 1 1   11   17    7 o  644.470   7.3827  317.962   7.2826  320.488   9.0152  313.218   12.355  646.974   9.1038  639.459   12.623 7.514526 15.56350 
1 1 1   11   17    8 o  329.807   9.6873   83.289   4.8903   81.504   6.9843   85.005   6.8494  326.161   13.990  333.107   13.434 -6.945892 19.39560 
1 1 1   11   17    9 o  300.587   8.3144   69.175   3.8253   66.112   4.6652   75.462   6.6830  293.823   10.373  313.837   13.912 -20.01425 17.35376 
1 1 1   11   17   10 o  365.986   7.7599  102.547   4.3470  103.910   5.3357   99.857   7.4965  368.378   9.4630  361.023   13.566 7.354767 16.54042 
1 1 1   11   17   11 f  483.750   7.4952  179.155   5.5497  183.961   6.8147  169.691   9.5631  490.157   9.0832  470.630   13.275 19.52731 16.08543 
1 1 1   11   17   12 o  298.456   9.0148   68.205   4.1182   64.106   4.8137   79.396   7.9536  289.315   10.870  321.423   16.219 -32.10767 19.52462 
1 1 1   11   17   13 o  538.810   7.6708  222.267   6.3262  224.705   7.6813  217.125   11.154  541.711   9.2640  532.324   13.689 9.387024 16.52918 
1 1 1   11   17   14 o  1353.83   9.5415  1403.55   19.772  1424.60   28.363  1383.64   27.577  1363.52   13.590  1343.80   13.407 19.72253 19.09053 
1 1 1   11   17   15 f  1365.14   9.6616  1427.15   20.188  1486.77   29.696  1375.93   27.527  1392.88   13.929  1340.02   13.421 52.86133 19.34259 
1 1 1   11   17   16 o  607.566   9.7574  282.695   9.0739  282.695   9.0739   0.0000   0.0000  607.566   9.7574  ?   ?  0.000000 9.757359 
1 1 1   11   17   17 o  1009.64   9.3540  780.639   14.456  815.728   18.296  722.339   23.583  1031.90   11.583  970.620   15.874 61.28333 19.65069 
1 1 1   11   17   18 o  412.057   7.7632  130.003   4.8963  141.477   6.9216  118.511   6.9273  429.773   10.522  393.314   11.507 36.45892 15.59221 
1 1 1   11   17   19 o  1450.35   10.180  1611.20   22.599  1629.63   32.223  1593.36   31.702  1458.01   14.439  1441.71   14.366 16.30408 20.36820 
1 1 1   11   17   20 o  891.183   7.8736  608.134   10.740  636.440   15.527  582.164   14.872  911.450   11.129  871.718   11.146 39.73230 15.75138 
1 1 1   11   17   21 o  385.514   10.259  113.848   6.0535  111.051   6.9979  122.162   12.066  380.684   12.010  398.841   19.765 -18.15753 23.12764 
1 1 1   11   17   22 o  600.760   9.0689  276.424   8.3392  275.670   9.8740  278.301   15.574  599.846   10.754  602.224   16.895 -2.378052 20.02777 
1 1 1   11   17   23 o  608.052   6.5640  283.079   6.1091  281.082   7.5440  286.884   10.412  605.833   8.1354  611.878   11.118 -6.045227 13.77638 
1 1 1   11   17   24 o  573.396   7.3238  251.768   6.4278  263.255   8.6315  237.467   9.6310  586.208   9.6198  556.650   11.304 29.55780 14.84296 
1 1 1   11   17   25 o  542.073   6.7329  225.002   5.5864  229.186   6.9465  217.342   9.3989  547.014   8.2966  532.490   11.532 14.52356 14.20610 
1 1 1   11   17   26 o  400.284   7.5587  122.716   4.6311  125.953   5.6813  116.304   7.9949  405.460   9.1545  389.378   13.414 16.08258 16.24042 
1 1 1   11   17   27 o  656.496   6.8864  330.066   6.9198  333.291   8.6846  324.459   11.452  659.570   8.6024  650.499   11.502 9.070313 14.36264 
1 1 1   11   17   28 o  623.460   6.1034  297.657   5.8244  291.389   8.0561  304.522   8.4306  616.685   8.5347  630.411   8.7370 -13.72559 12.21383 
1 1 1   11   17   29 o  157.134   11.534   19.042   2.7547   23.664   3.8645   14.269   3.9276  174.915   14.567  134.702   19.626 40.21367 24.44142 
1 1 1   11   17   30 o  502.466   7.2737  193.422   5.5941  206.542   8.1206  181.571   7.7174  518.966   10.223  486.571   10.362 32.39554 14.55636 
1 1 1   11   17   31 o  130.514   14.224   13.247   2.7955   11.217   3.9089   15.371   3.9995  118.534   22.365  139.892   19.184 -21.35779 29.46533 
1 1 1   11   17   32 o  243.554   8.6596   45.479   3.2282   42.950   4.4885   48.189   4.6465  236.134   12.463  250.491   12.119 -14.35689 17.38340 
1 1 1   11   17   33 o  229.410   11.023   40.406   3.8705   44.887   4.6256   29.943   7.0688  241.356   12.564  194.876   24.221 46.47931 27.28559 
1 1 1   11   17   34 o  338.613   8.9570   87.953   4.6423   92.702   5.7113   78.704   7.9697  347.461   10.739  319.046   16.375 28.41479 19.58230 
1 1 1   11   17   35 o  332.929   9.5704   85.073   4.8770   63.715   8.9989   93.954   5.8031  285.904   20.704  349.735   10.841 -63.83124 23.37012 
1 1 1   11   17   36 o  317.275   8.1725   77.216   3.9688   69.686   5.6602   84.498   5.5665  300.976   12.287  331.596   10.967 -30.62006 16.46951 
1 1 1   11   17   37 o  210.405   10.624   34.110   3.4103   34.334   5.1329   33.933   4.5630  210.193   16.076  209.283   14.331 0.9107666 21.53637 
1 1 1   11   17   38 o   50.204   21.333   0.0955   2.8603  -0.3035   4.0310   0.5001   4.0593   57.814   24.958   60.924   25.625 -3.110428 35.77052 
1 1 1   11   17   39 o  188.063   12.259   27.363   3.5096   22.498   4.6155   34.032   5.4039  169.298   18.091  208.848   17.053 -39.54910 24.86205 
1 1 1   11   17   40 o  345.451   8.2368   91.634   4.3553   91.289   6.3397   91.942   5.9935  344.153   12.035  345.519   11.333 -1.366211 16.53103 
1 1 1   11   17   41 o  390.737   7.9397  117.241   4.7485  123.628   6.9623  111.686   6.4931  400.530   11.357  380.745   11.142 19.78561 15.90936 
1 1 1   11   17   42 o  195.272   12.060   29.540   3.5869   30.593   5.3313   28.670   4.8484  197.341   17.843  191.293   16.727 6.047958 24.45730 
1 1 1   11   17   43 o  176.332   13.444   24.199   3.6011   24.687   5.0681   23.701   5.1176  176.663   19.044  172.867   19.693 3.796219 27.39469 
1 1 1   11   17   44 o  159.460   14.695   19.898   3.5462   21.413   5.2171   18.596   4.8349  163.568   21.347  152.263   21.331 11.30501 30.17798 
1 1 1   11   17   45 o  301.621   10.042   70.122   4.6359   63.170   7.1138   75.253   6.1120  284.150   16.426  311.770   12.808 -27.62009 20.82953 
1 1 1   11   17   46 o  308.437   10.052   73.363   4.7458   77.046   6.7430   69.747   6.6806  314.971   13.987  299.492   14.573 15.47873 20.19924 
1 1 1   11   17   47 o  238.423   16.321   44.630   5.9202   45.402   6.7742   42.136   12.180  239.584   18.619  220.460   37.435 19.12407 41.80963 
1 1 1   11   17   48 o  141.696   25.708   16.658   5.3703 -10.4080   12.281   23.057   5.9715   80.050   37.868  168.068   23.885 -88.01745 44.77132 
1 1 1   11   17   49 o   86.174   27.839   6.0247   4.1839   10.478   6.6851   3.1570   5.3645  110.464   35.138   76.817   30.522 33.64672 46.54334 
1 1 1   11   17   50 o   71.321   27.009   3.2655   4.0484   3.3095   6.1125   3.2311   5.4035   80.249   32.343   77.036   30.625 3.213257 44.54152 
1 1 1   11   17   51 o  146.494   20.308   17.425   4.4310   21.220   6.6498   14.395   5.9426  157.900   28.566  128.557   30.635 29.34286 41.88682 
1 1 1   11   17   52 o  210.918   15.153   35.130   4.8594   35.081   6.5835   35.189   7.2027  207.895   20.976  206.972   23.132 0.9223328 31.22594 
1 1 1   11   17   53 o  172.041   18.679   23.917   4.8396   12.083   6.3403   40.438   7.4913  115.438   33.752  221.843   22.367 -106.4049 40.49007 
1 1 1   11   17   54 o  157.710   20.134   20.397   4.7494   16.106   6.2625   26.207   7.2864  133.905   31.143  173.842   28.362 -39.93658 42.12225 
1 1 1   11   17   55 o   97.780   28.036   8.4718   4.4132   9.5917   6.3593   7.4314   6.1294  102.592   34.380   93.235   33.600 9.356834 48.07172 
1 1 1   11   17   56 o  107.954   26.056   10.327   4.2562   8.3323   6.0254   12.314   6.0130   95.872   33.427  114.277   32.714 -18.40530 46.77134 
1 1 1   11   17   57 o   82.860   28.065   6.0272   4.2382   9.9093   6.0207   2.2138   5.9671  101.659   33.430   72.256   30.761 29.40273 45.42873 
1 1 1   11   17   58 o   77.818   28.596   5.0930   4.4711   5.0625   6.7872   5.1163   5.9428   82.595   33.787   80.923   32.134 1.672249 46.62757 
1 1 1   11   18    0 o   73.024   32.629   5.9077   3.8776   5.9077   3.8776   5.9077   3.8776   73.024   32.629   73.024   32.629 0.000000 0.000000 
1 1 1   11   18    1 o  841.201   9.6093  541.830   12.373  546.343   17.581  537.402   17.415  844.478   13.601  837.540   13.585 6.937500 19.22349 
1 1 1   11   18    2 o  467.783   8.1881  167.530   5.8627  172.891   8.3253  162.256   8.2574  475.124   11.448  460.270   11.721 14.85327 16.38393 
1 1 1   11   18    3 o  666.397   7.1638  339.963   7.3071  345.582   9.0310  329.311   12.434  671.833   8.7822  655.685   12.390 16.14722 15.18646 
1 1 1   11   18    4 o  816.151   7.7687  509.952   9.7049  517.135   11.985  496.273   16.540  821.807   9.5278  804.855   13.426 16.95148 16.46322 
1 1 1   11   18    5 o  824.554   9.5871  520.605   12.100  535.802   17.303  506.061   16.927  836.284   13.517  812.737   13.607 23.54675 19.17962 
1 1 1   11   18    6 o  967.782   14.932  717.728   22.118   0.0000   0.0000  717.728   22.118  ?   ?   967.782   14.932 0.000000 14.93159 
1 1 1   11   18    7 o  674.848   12.972  348.888   13.399   0.0000   0.0000  348.888   13.399  ?   ?   674.848   12.972 0.000000 12.97172 
1 1 1   11   18    8 o  468.062   7.5677  167.724   5.4217  168.829   6.7090  165.644   9.2046  469.559   9.3347  464.995   12.933 4.563599 15.94960 
1 1 1   11   18    9 o  1546.72   12.082  1832.54   28.604  1858.71   35.670  1785.38   47.878  1557.35   14.964  1525.40   20.506 31.95349 25.38549 
1 1 1   11   18   10 o  510.839   7.6049  199.787   5.9463  194.691   7.1706  211.008   10.640  504.237   9.2907  524.794   13.246 -20.55719 16.17968 
1 1 1   11   18   11 o  693.169   7.8538  367.867   8.3328  371.750   10.266  360.370   14.266  696.747   9.6264  685.796   13.590 10.95142 16.65427 
1 1 1   11   18   12 o  1126.78   9.7318  972.279   16.784  993.445   20.991  934.759   27.948  1138.79   12.043  1104.17   16.536 34.61902 20.45688 
1 1 1   11   18   13 o  713.229   8.0746  389.485   8.8149  391.217   10.769  385.969   15.345  714.735   9.8440  709.675   14.126 5.059509 17.21781 
1 1 1   11   18   14 o  652.982   9.7047  326.536   9.6995  326.536   9.6995   0.0000   0.0000  652.982   9.7047  ?   ?  0.000000 9.704658 
1 1 1   11   18   15 o  595.377   8.0315  271.411   7.3191  265.946   8.8224  283.477   13.108  589.284   9.7812  608.169   14.082 -18.88452 17.14546 
1 1 1   11   18   16 o  660.627   7.1598  334.135   7.2398  341.592   10.202  326.571   10.275  667.836   9.9807  652.972   10.281 14.86346 14.32861 
1 1 1   11   18   17 o  649.701   8.3320  323.225   8.2857  321.266   9.8706  327.900   15.246  647.653   9.9571  653.962   15.231 -6.309448 18.19722 
1 1 1   11   18   18 o  1180.08   10.291  1066.71   18.588  1078.04   22.874  1044.69   31.893  1186.08   12.600  1166.82   17.858 19.25891 21.85525 
1 1 1   11   18   19 o  324.471   10.750   80.654   5.3391   81.880   6.2246   77.241   10.386  326.872   12.441  316.328   21.579 10.54449 24.90841 
1 1 1   11   18   20 o  406.908   9.9937  126.831   6.2243  127.912   7.2680  123.856   12.055  408.574   11.622  401.590   19.612 6.983673 22.79673 
1 1 1   11   18   21 o  1116.67   8.7920  955.017   15.027  941.712   20.801  969.542   21.733  1108.47   12.260  1124.68   12.625 -16.21045 17.59809 
1 1 1   11   18   22 o  615.976   7.7274  290.559   7.2856  289.081   10.081  292.175   10.542  614.233   10.722  617.482   11.154 -3.248962 15.47151 
1 1 1   11   18   23 o  594.459   9.1427  270.699   8.3189  275.759   14.324  268.124   10.219  599.457   15.611  591.481   11.287 7.975769 19.26451 
1 1 1   11   18   24 o   59.401   22.708   1.8479   2.8789   1.7082   3.2946   2.2992   5.9203   61.452   24.075   79.384   31.888 -17.93288 39.95519 
1 1 1   11   18   25 o  141.969   14.552   15.630   3.1175   15.659   3.5631   15.533   6.4387  141.804   16.739  138.897   31.064 2.906769 35.28672 
1 1 1   11   18   26 o  310.666   8.4061   73.940   3.9972   74.431   4.6856   72.627   7.6607  311.637   9.8232  307.019   16.361 4.617615 19.08311 
1 1 1   11   18   27 o  283.755   8.8675   61.700   3.8514   61.226   4.4565   63.098   7.6551  282.600   10.303  285.886   17.579 -3.286011 20.37573 
1 1 1   11   18   28 o  558.209   7.6385  238.719   6.5264  243.324   8.4527  231.922   10.270  563.376   9.8023  549.757   12.204 13.61902 15.65352 
1 1 1   11   18   29 o  428.755   8.5010  140.890   5.5789  135.103   6.3790  159.715   11.506  419.749   9.9287  455.602   16.499 -35.85239 19.25587 
1 1 1   11   18   30 o  533.326   6.5926  217.889   5.3817  219.051   7.0609  216.280   8.3133  534.565   8.6296  530.999   10.228 3.565918 13.38243 
1 1 1   11   18   31 o  290.273   7.6513   64.574   3.3995   65.405   4.6899   63.655   4.9345  291.954   10.495  287.968   11.195 3.985901 15.34521 
1 1 1   11   18   32 o  204.869   11.712   32.341   3.6575   33.080   4.2840   30.353   7.0245  206.964   13.599  196.310   23.869 10.65334 27.47107 
1 1 1   11   18   33 o  156.181   14.760   18.948   3.4866   15.955   3.9887   28.643   7.1788  142.488   18.743  190.154   25.292 -47.66629 31.48038 
1 1 1   11   18   34 o  375.274   8.5127  108.022   4.8897  104.631   8.9990  109.443   5.8246  368.298   15.963  377.564   10.079 -9.266357 18.87886 
1 1 1   11   18   35 o  207.749   12.282   33.314   3.8881   39.457   7.9526   31.384   4.4572  223.799   23.570  201.267   14.567 22.53195 27.70798 
1 1 1   11   18   36 o  455.502   10.706  159.462   7.4641  144.797   10.845  172.658   10.288  432.833   16.370  473.217   14.204 -40.38428 21.67356 
1 1 1   11   18   37 o   65.692   23.797   2.8279   3.0805  -0.3785   4.3249   6.1300   4.3889   59.666   25.804   88.846   28.493 -29.18042 38.44101 
1 1 1   11   18   38 o   90.380   22.513   6.6372   3.1028   6.9410   4.1851   6.2664   4.6237   92.887   27.496   89.971   29.282 2.915749 40.16802 
1 1 1   11   18   39 o  485.013   7.1165  180.469   5.2831  177.689   7.5553  183.128   7.3903  480.632   10.270  488.021   9.8936 -7.389099 14.26031 
1 1 1   11   18   40 o  157.597   13.046   19.306   3.1187   18.246   4.4500   20.328   4.3719  151.696   19.625  160.638   18.096 -8.942520 26.69512 
1 1 1   11   18   41 o  342.301   8.4090   90.035   4.4058   96.350   6.5404   84.789   5.9612  353.341   12.093  331.544   11.747 21.79742 16.85921 
1 1 1   11   18   42 o  317.358   9.0653   77.467   4.4035   75.446   6.0941   79.675   6.3702  312.429   12.743  321.013   12.965 -8.583313 18.17906 
1 1 1   11   18   43 o  230.011   10.948   40.803   3.8545   36.622   5.5945   44.581   5.3183  216.096   17.052  239.286   14.590 -23.19048 22.44235 
1 1 1   11   18   44 o  299.954   9.8505   69.320   4.5226   71.611   6.9792   67.662   5.9380  303.529   15.022  295.581   13.125 7.948578 19.94811 
1 1 1   11   18   45 o  380.105   8.4629  111.155   4.9237  121.055   7.2445  102.656   6.7122  395.639   11.963  364.309   12.037 31.32941 16.97079 
1 1 1   11   18   46 o  166.977   18.580   22.161   4.6682   21.157   5.4448   24.946   9.0698  161.687   22.620  169.535   36.061 -7.848526 42.56802 
1 1 1   11   18   47 o  306.821   10.166   72.671   4.7740   77.011   7.2719   69.383   6.3289  314.217   15.120  298.706   13.842 15.51093 20.49936 
1 1 1   11   18   48 o  214.837   16.390   36.364   5.3489   27.638   12.035   38.512   5.9710  171.822   45.166  220.553   17.840 -48.73094 48.56150 
1 1 1   11   18   49 o  201.614   15.265   31.967   4.6759   33.904   6.8801   30.304   6.3742  204.644   22.327  193.561   21.900 11.08311 31.27486 
1 1 1   11   18   50 o  197.536   16.029   30.839   4.8047   25.526   6.9366   35.739   6.6614  174.708   26.795  210.481   20.955 -35.77335 34.01608 
1 1 1   11   18   51 o  102.172   28.504   9.0020   4.6265   2.2113   6.3691   16.588   6.7316   77.158   32.253  136.885   32.596 -59.72623 45.85615 
1 1 1   11   18   52 o   84.409   28.485   5.8311   4.3659   1.3406   6.2008   10.246   6.1482   73.369   31.299  107.359   33.641 -33.98969 45.94949 
1 1 1   11   18   53 o  102.727   28.014   9.2535   4.5263   9.7882   6.0176   8.5569   6.8689  104.522   33.347   99.709   35.607 4.812805 48.78430 
1 1 1   11   18   54 o   69.009   27.579   2.6830   4.4037  -6.8254   6.2875   11.838   6.1697   55.192   26.386  113.391   33.335 -58.19839 42.51394 
1 1 1   11   18   55 o  149.981   19.721   18.574   4.4176   20.331   6.2806   16.854   6.2147  151.734   28.077  136.151   30.570 15.58228 41.50703 
1 1 1   11   18   56 o   97.108   28.116   8.5701   4.4191   10.691   6.7989   7.0187   5.8148  105.119   35.547   89.498   32.653 15.62095 48.26797 
1 1 1   11   18   57 o  103.870   27.464   9.9075   4.4330   13.498   7.0341   7.5422   5.7096  115.342   35.958   90.647   32.454 24.69441 48.43748 
1 1 1   11   18   58 o   54.516   24.887  -1.5399   4.6174  -0.9856   5.6727  -2.6282   7.9485   61.492   27.883   67.895   31.581 -6.403111 42.12873 
1 1 1   11   19    0 o  113.841   29.821   11.764   4.4898   11.764   4.4898   11.764   4.4898  113.841   29.821  113.841   29.821 0.000000 0.000000 
1 1 1   11   19    1 o  961.001   10.449  707.251   15.369  692.975   21.314  722.716   22.183  950.950   14.643  971.117   14.924 -20.16742 20.90819 
1 1 1   11   19    2 o  695.326   8.9889  370.194   9.5668  365.076   13.339  375.616   13.729  690.338   12.624  700.223   12.809 -9.885193 17.98419 
1 1 1   11   19    3 o  592.170   8.6536  268.492   7.8436  263.713   10.867  273.689   11.332  586.748   12.100  597.731   12.386 -10.98254 17.31586 
1 1 1   11   19    4 o  448.888   8.4237  154.279   5.7878  148.327   7.8398  161.409   8.5805  440.056   11.639  459.033   12.212 -18.97668 16.87054 
1 1 1   11   19    5 o  394.761   7.2855  119.303   4.4021  114.490   5.2611  130.539   8.0387  386.685   8.8889  412.792   12.723 -26.10623 15.52044 
1 1 1   11   19    6 o  970.018   8.8601  720.467   13.155  714.106   16.078  733.351   22.881  965.604   10.878  978.174   15.283 -12.56927 18.75880 
1 1 1   11   19    7 o  499.601   7.6660  191.095   5.8622  186.122   7.1696  201.126   10.183  493.008   9.5010  512.365   12.984 -19.35703 16.08909 
1 1 1   11   19    8 o  750.944   9.6864  431.838   11.134  434.627   15.652  428.980   15.841  753.143   13.577  748.217   13.832 4.925659 19.38216 
1 1 1   11   19    9 o  548.585   9.1591  230.447   7.6907  227.478   10.644  233.690   11.125  544.897   12.762  552.268   13.161 -7.370483 18.33194 
1 1 1   11   19   10 o   83.529   24.351   5.4586   3.3046   10.959   3.9704  -6.9429   5.9616  117.455   22.908   55.947   26.441 61.50779 34.98374 
1 1 1   11   19   11 o  1543.23   12.131  1824.52   28.654  1835.15   35.364  1804.20   48.890  1547.31   14.932  1533.09   20.835 14.22852 25.63286 
1 1 1   11   19   12 o  386.983   8.6280  114.672   5.1106  118.164   6.2161  107.386   8.9778  392.787   10.339  374.259   15.672 18.52762 18.77543 
1 1 1   11   19   13 o  1390.26   13.827  1481.30   29.424  1481.30   29.424   0.0000   0.0000  1390.26   13.827  ?   ?  0.000000 13.82744 
1 1 1   11   19   14 o  1221.31   10.403  1142.47   19.448  1163.26   24.134  1103.98   32.843  1232.10   12.797  1199.58   17.887 32.52075 21.99338 
1 1 1   11   19   15 o  551.540   8.3747  232.935   7.0700  232.321   8.4672  234.348   12.848  550.746   10.044  552.861   15.183 -2.115051 18.20454 
1 1 1   11   19   16 o  1029.11   9.5135  811.122   14.986  817.792   18.384  797.914   25.870  1033.14   11.625  1019.93   16.572 13.21613 20.24268 
1 1 1   11   19   17 o  855.512   8.9112  560.515   11.669  554.364   14.034  574.295   21.005  850.672   10.778  865.328   15.859 -14.65668 19.17484 
1 1 1   11   19   18 o  787.561   7.6505  474.937   9.2224  469.129   12.758  481.293   13.347  782.539   10.651  792.593   11.002 -10.05408 15.31302 
1 1 1   11   19   19 o  1095.72   10.013  919.701   16.793  912.613   20.247  935.324   30.060  1091.25   12.122  1103.86   17.791 -12.61340 21.52823 
1 1 1   11   19   20 o  463.443   9.5183  164.523   6.7519  173.338   8.0507  143.621   12.397  475.621   11.059  432.443   18.729 43.17865 21.75031 
1 1 1   11   19   21 o  289.486   10.590   64.212   4.6925   65.164   6.3660   63.078   6.9438  291.482   14.269  286.264   15.910 5.218109 21.37136 
1 1 1   11   19   22 o  792.247   9.2808  480.832   11.254  504.743   19.811  469.440   13.675  810.916   15.961  782.605   11.416 28.31116 19.62358 
1 1 1   11   19   23 o  136.505   21.317   14.680   4.3084   15.961   5.8888   13.203   6.3201  141.265   28.222  128.044   32.261 13.22044 42.86350 
1 1 1   11   19   24 o  604.246   8.1284  279.681   7.5178  281.533   10.551  277.772   10.714  605.978   11.376  601.893   11.630 4.084534 16.26822 
1 1 1   11   19   25 o  285.320   11.555   62.429   5.0462   62.337   7.0648   62.525   7.2101  284.363   16.300  284.752   16.615 -0.3892822 23.27507 
1 1 1   11   19   26 o  448.540   7.6643  154.123   5.2619  146.261   6.4941  169.152   8.9783  436.820   9.7128  469.520   12.493 -32.70038 15.82461 
1 1 1   11   19   27 o  502.609   7.6320  193.537   5.8713  193.587   7.3925  193.452   9.6629  502.517   9.6110  502.040   12.575 0.4767761 15.82711 
1 1 1   11   19   28 o  654.723   7.5227  328.436   7.5387  325.731   8.5322  338.064   16.098  651.914   8.5507  662.952   15.864 -11.03821 18.02170 
1 1 1   11   19   29 o  641.422   7.5496  315.262   7.4120  311.988   8.4083  326.676   15.698  637.962   8.6108  651.565   15.740 -13.60303 17.94163 
1 1 1   11   19   30 o  456.961   7.3023  160.013   5.1075  157.848   6.1609  164.772   9.1331  453.720   8.8713  463.077   12.885 -9.357147 15.64385 
1 1 1   11   19   31 o  140.292   15.100   15.325   3.1914   17.215   3.6718   9.4872   6.4540  148.566   16.421  109.923   34.471 38.64310 38.18295 
1 1 1   11   19   32 o  344.392   7.2786   90.908   3.8368   96.146   5.2905   85.097   5.5726  353.960   9.7650  332.886   10.937 21.07361 14.66178 
1 1 1   11   19   33 o  307.533   9.8589   72.599   4.6408   65.581   8.0888   76.042   5.6661  290.676   18.273  314.542   11.769 -23.86591 21.73533 
1 1 1   11   19   34 o  136.895   17.483   14.717   3.5796   13.802   7.6241   14.976   4.0542  129.552   36.750  137.626   19.817 -8.074203 41.75249 
1 1 1   11   19   35 o  378.273   7.2723  109.721   4.2106  111.846   5.8817  107.488   6.0305  381.579   10.070  374.006   10.534 7.572601 14.57339 
1 1 1   11   19   36 o  132.235   16.083   13.713   3.1883   12.168   4.2764   15.646   4.7841  122.787   23.612  139.757   23.176 -16.97015 33.08546 
1 1 1   11   19   37 o  298.224   8.3963   68.274   3.8327   60.178   5.4318   76.300   5.4087  279.437   12.700  314.889   11.222 -35.45212 16.94727 
1 1 1   11   19   38 o  377.759   7.5384  109.505   4.3587  110.028   6.2929  109.024   6.0431  378.110   10.873  376.454   10.488 1.656067 15.10690 
1 1 1   11   19   39 o  357.044   7.9527   97.881   4.3462  104.381   6.4354   92.430   5.8931  368.072   11.423  346.422   11.114 21.64917 15.93748 
1 1 1   11   19   40 o  316.362   8.4586   76.905   4.0959   80.815   5.9577   73.400   5.6403  323.644   12.027  308.455   11.947 15.18860 16.95164 
1 1 1   11   19   41 o  153.677   13.661   18.416   3.1798   20.463   4.5330   16.432   4.4616  160.805   18.770  143.264   20.967 17.54131 28.14111 
1 1 1   11   19   42 o  246.983   9.9512   46.978   3.7619   46.703   5.4416   47.229   5.2066  244.969   14.578  246.549   13.853 -1.579773 20.11062 
1 1 1   11   19   43 o  460.894   9.6279  163.594   6.7921  174.616   8.5905  145.214   11.093  475.419   11.805  431.482   16.797 43.93765 20.53039 
1 1 1   11   19   44 o  396.711   8.5381  121.076   5.1845  128.702   7.9754  115.496   6.8228  407.696   12.780  386.631   11.529 21.06433 17.21216 
1 1 1   11   19   45 o  431.406   9.5616  143.432   6.3137  144.768   7.6260  140.520   11.258  432.735   11.513  423.633   17.361 9.101807 20.83209 
1 1 1   11   19   46 o  153.110   20.619   18.859   4.7093   20.081   5.5231   15.604   9.0135  156.893   23.741  132.530   40.603 24.36261 47.03451 
1 1 1   11   19   47 o  190.476   17.223   28.696   4.9670   38.010   11.673   26.636   5.4886  207.931   38.082  182.444   19.981 25.48666 43.00544 
1 1 1   11   19   48 o  248.831   12.335   48.055   4.6979   50.832   7.5402   46.292   6.0061  252.553   19.660  242.476   16.277 10.07707 25.52415 
1 1 1   11   19   49 o   64.664   25.796   2.0425   3.8461  -4.9684   5.6497   8.0980   5.2506   55.695   26.140   98.008   31.137 -42.31282 40.65477 
1 1 1   11   19   50 o  126.867   23.036   13.361   4.3085   10.137   5.8295   17.242   6.3963  107.760   32.578  140.923   30.536 -33.16270 44.65148 
1 1 1   11   19   51 o  133.456   22.663   14.790   4.4638   15.366   6.0081   14.080   6.6692  132.402   30.302  124.985   33.972 7.416939 45.52192 
1 1 1   11   19   52 o  113.363   26.634   11.128   4.5430   8.8493   5.8915   14.470   7.1350  100.420   33.072  125.083   35.576 -24.66271 48.57341 
1 1 1   11   19   53 f  188.736   16.306   28.486   4.6644   22.288   6.1374   36.960   7.1767  161.764   25.643  211.255   22.543 -49.49020 34.14286 
1 1 1   11   19   54 o   92.267   28.068   7.4920   4.3174   6.5085   6.1228   8.4647   6.0889   89.405   33.349   97.487   33.625 -8.082642 47.35791 
1 1 1   11   19   55 f   98.624   27.568   8.7493   4.3233   8.3741   6.2399   9.0958   5.9955   96.015   33.975   99.085   33.381 -3.070221 47.62962 
1 1 1   11   19   56 o   68.509   27.777   2.7622   4.5381  -2.0791   7.0598   6.1714   5.9243   66.284   30.450   85.704   32.620 -19.42095 44.62346 
1 1 1   11   19   57 o   82.594   29.439   6.0296   4.6931   8.2956   5.6427   0.9448   8.4529   93.483   32.362   76.760   34.489 16.72328 47.29525 
1 1 1   11   20    0 o  1973.39   25.477  2988.18   76.925  2988.18   76.925  2988.18   76.925  1973.39   25.477  1973.39   25.477 0.000000 0.000000 
1 1 1   11   20    1 o  1290.86   12.753  1276.61   25.198  1283.74   35.815  1269.62   35.458  1293.76   18.086  1286.64   18.005 7.120972 25.52019 
1 1 1   11   20    2 o  254.572   10.687   49.635   4.1642   46.634   5.6775   53.128   6.1261  246.201   15.139  262.831   15.294 -16.63019 21.51985 
1 1 1   11   20    3 o  176.454   13.592   23.999   3.6427   23.143   4.9983   24.969   5.3200  172.622   19.245  179.323   19.707 -6.700760 27.54519 
1 1 1   11   20    4 o  379.299   7.6320  110.147   4.4309  107.403   5.3245  116.327   7.9906  374.509   9.2885  389.637   13.398 -15.12781 16.30301 
1 1 1   11   20    5 o  850.852   8.1613  554.298   10.629  553.679   12.965  555.566   18.562  850.283   9.9617  851.434   14.243 -1.150513 17.38081 
1 1 1   11   20    6 o  897.388   8.6182  616.624   11.838  619.798   14.677  610.718   20.023  899.573   10.660  892.652   14.655 6.921448 18.12145 
1 1 1   11   20    7 o  665.932   7.8465  339.536   7.9979  340.531   9.8366  337.594   13.738  666.836   9.6374  663.746   13.523 3.089294 16.60557 
1 1 1   11   20    8 o  733.588   7.9930  412.041   8.9750  408.334   10.965  419.569   15.624  730.197   9.8103  739.929   13.795 -9.731445 16.92767 
1 1 1   11   20    9 o  820.480   10.174  515.584   12.778  508.790   17.741  522.908   18.419  814.766   14.225  825.963   14.569 -11.19684 20.36233 
1 1 1   11   20   10 o  596.999   9.6243  272.951   8.7946  276.701   12.338  269.077   12.539  600.893   13.415  592.533   13.825 8.359863 19.26403 
1 1 1   11   20   11 o  559.182   13.235  239.619   11.328  239.619   11.328   0.0000   0.0000  559.182   13.235  ?   ?  0.000000 13.23525 
1 1 1   11   20   12 o  713.319   10.070  389.717   10.995  389.717   10.995   0.0000   0.0000  713.319   10.070  ?   ?  0.000000 10.07006 
1 1 1   11   20   13 o  618.611   8.1972  293.028   7.7617  286.595   9.2855  307.947   14.141  611.707   9.9172  633.795   14.576 -22.08807 17.63015 
1 1 1   11   20   14 o  1022.08   9.4479  800.078   14.781  799.386   18.044  801.491   25.769  1021.45   11.541  1022.21   16.470 -0.7593994 20.11071 
1 1 1   11   20   15 o  1205.15   10.408  1112.57   19.199  1102.10   23.245  1135.04   34.056  1199.20   12.664  1216.08   18.297 -16.87891 22.25181 
1 1 1   11   20   16 f  469.176   7.7491  168.556   5.5649  170.602   7.7073  166.327   8.0434  471.902   10.670  465.923   11.279 5.978607 15.52625 
1 1 1   11   20   17 o  742.797   7.5456  422.486   8.5790  413.586   11.832  432.352   12.457  734.746   10.521  751.207   10.834 -16.46112 15.10176 
1 1 1   11   20   18 o  231.286   11.744   41.100   4.1437   36.859   5.7209   45.781   6.0100  218.462   17.249  243.731   16.202 -25.26967 23.66536 
1 1 1   11   20   19 o  906.920   8.0560  629.905   11.183  620.534   15.565  639.903   16.077  899.851   11.301  913.766   11.495 -13.91449 16.11978 
1 1 1   11   20   20 o  760.119   7.8456  442.492   9.1280  439.122   12.559  446.266   13.290  756.980   10.839  763.061   11.379 -6.080566 15.71520 
1 1 1   11   20   21 o  405.494   13.282  126.108   8.2439  128.186   11.121  123.574   12.283  408.472   17.787  400.852   20.020 7.620850 26.77965 
1 1 1   11   20   22 o  327.881   11.932   82.432   5.9883   77.488   6.9171   97.222   11.964  317.772   14.221  354.587   22.155 -36.81555 26.32681 
1 1 1   11   20   23 o  523.032   8.3299  209.572   6.6686  210.015   9.2448  209.091   9.6286  523.343   11.541  522.144   12.048 1.198364 16.68350 
1 1 1   11   20   24 o  655.305   9.3779  329.103   9.4063  320.559   15.490  334.095   11.839  645.937   15.667  659.998   11.719 -14.06061 19.56560 
1 1 1   11   20   25 o  727.701   9.5004  405.904   10.582  408.181   17.744  404.648   13.183  728.714   15.908  726.258   11.859 2.456482 19.84199 
1 1 1   11   20   26 o  577.823   8.4184  255.864   7.4455  252.232   10.231  259.955   10.856  573.355   11.658  581.997   12.187 -8.642334 16.86471 
1 1 1   11   20   27 o  215.731   10.581   35.700   3.4939   35.503   3.8627   36.583   8.1936  214.755   11.796  215.804   25.285 -1.048569 27.90090 
1 1 1   11   20   28 o  162.711   13.012   20.467   3.2136   18.694   3.4606   31.576   8.6621  155.224   14.742  199.217   29.281 -43.99344 32.78262 
1 1 1   11   20   29 o  413.884   7.4910  131.279   4.7456  132.701   5.6692  127.949   8.6745  416.002   8.9034  407.919   13.893 8.083374 16.50123 
1 1 1   11   20   30 o  246.219   9.6012   46.510   3.6184   49.075   4.2010   39.140   7.1220  252.829   10.856  223.880   21.030 28.94955 23.66636 
1 1 1   11   20   31 o  292.492   8.9133   65.623   3.9905   65.399   4.7069   66.196   7.5246  291.860   10.536  292.429   16.883 -0.5686951 19.90071 
1 1 1   11   20   32 o  448.104   7.8429  153.967   5.3793  152.092   9.5690  154.833   6.5043  444.428   14.067  449.168   9.4607 -4.739990 16.95236 
1 1 1   11   20   33 o  266.765   10.255   54.656   4.1873   39.151   7.8302   60.865   4.9554  223.006   23.283  281.383   11.506 -58.37746 25.97052 
1 1 1   11   20   34 o  625.026   7.0513  299.519   6.7459  290.579   8.5891  313.912   10.898  615.252   9.1207  638.999   11.143 -23.74731 14.39943 
1 1 1   11   20   35 o  269.246   9.2185   55.667   3.7991   53.180   5.2180   58.473   5.5421  262.730   12.975  275.470   13.144 -12.74020 18.46960 
1 1 1   11   20   36 o  311.444   7.6237   74.420   3.6343   68.896   4.9633   80.804   5.3361  299.282   10.835  324.128   10.756 -24.84604 15.26696 
1 1 1   11   20   37 o  117.148   15.761   10.809   2.7544   7.7988   3.8573   13.941   3.9344   97.679   25.519  132.317   20.055 -34.63789 32.45623 
1 1 1   11   20   38 o  187.225   11.083   27.088   3.1618   26.425   4.5636   27.700   4.3847  183.860   16.388  188.518   15.328 -4.657944 22.43926 
1 1 1   11   20   39 o   59.844   22.423   2.1556   2.7742   0.6923   4.0169   3.4900   3.8358   61.067   25.578   72.570   26.514 -11.50241 36.84069 
1 1 1   11   20   40 o  569.645   7.1421  249.091   6.2273  257.967   9.0425  241.084   8.5885  578.797   10.207  559.596   10.027 19.20062 14.30812 
1 1 1   11   20   41 o  147.896   14.749   17.128   3.2943   22.230   4.8451   12.742   4.4925  167.480   19.250  124.779   24.396 42.70144 31.07669 
1 1 1   11   20   42 o  240.939   10.361   44.746   3.8211   47.615   5.8767   42.645   5.0294  246.958   15.627  234.097   14.102 12.86017 21.04958 
1 1 1   11   20   43 o  178.480   12.844   24.786   3.4855   24.338   5.0960   25.180   4.7778  175.053   19.342  178.604   17.711 -3.550430 26.22564 
1 1 1   11   20   44 o   42.891   19.789  -2.2423   3.0272  -3.5929   4.1901  -0.7676   4.3784   48.971   22.829   58.079   25.524 -9.107803 34.24403 
1 1 1   11   20   45 o  283.465   12.007   62.205   5.2096   66.890   6.2450   51.483   9.4470  293.376   13.907  252.198   24.793 41.17725 28.42715 
1 1 1   11   20   46 o  147.458   21.056   17.572   4.6175   11.376   10.719   18.984   5.1165  118.790   44.162  152.801   22.555 -34.01129 49.58797 
1 1 1   11   20   47 o  144.154   23.928   17.099   5.0944   27.915   19.088   16.269   5.2862  164.391   59.286  139.847   25.641 24.54445 64.59312 
1 1 1   11   20   48 o  115.415   23.823   11.098   4.0690   19.755   6.1344   4.2972   5.4372  153.463   27.107   81.355   31.182 72.10770 41.31724 
1 1 1   11   20   49 o  119.223   23.914   11.880   4.2121   8.7448   5.9083   15.120   6.0066  101.379   33.106  132.030   30.357 -30.65186 44.91689 
1 1 1   11   20   50 o   80.024   26.290   5.1985   3.7240   6.1295   5.1782   4.2011   5.3596   87.770   30.961   79.988   30.881 7.782097 43.72885 
1 1 1   11   20   51 o   96.236   26.432   7.9783   4.0128   7.6143   5.7156   8.3321   5.6352   94.896   32.586   98.128   32.346 -3.231789 45.91422 
1 1 1   11   20   52 f  152.601   20.420   19.122   4.6499   20.266   6.3732   17.820   6.7994  152.708   28.309  140.520   32.290 12.18855 42.94257 
1 1 1   11   20   53 f  249.104   13.311   48.890   5.0570   36.338   6.3850   70.016   8.2832  210.819   20.027  294.466   18.471 -83.64667 27.24506 
1 1 1   11   20   54 o   89.067   28.857   6.9928   4.4928   6.7476   5.8478   7.3459   7.0190   89.260   32.719   93.326   35.510 -4.066040 48.28500 
1 1 1   11   20   55 o  175.849   18.941   25.529   5.0177   30.906   6.8472   19.293   7.3742  189.568   24.146  141.162   34.436 48.40581 42.05796 
1 1 1   11   20   56 o   40.898   19.869  -5.8193   3.9256  -1.8952   5.4527 -10.0414   5.6560   58.650   26.876   45.931   22.630 12.71896 35.13418 
1 1 1   11   21    0 o  591.202   13.015  268.042   11.765  268.042   11.765  268.042   11.765  591.202   13.015  591.202   13.015 0.000000 0.000000 
1 1 1   11   21    1 o  846.717   10.044  549.071   13.017  550.107   18.413  548.037   18.404  847.211   14.199  845.614   14.219 1.597534 20.09495 
1 1 1   11   21    2 o  1525.31   14.591  1783.26   34.066  1729.85   46.417  1845.61   50.152  1501.24   20.200  1550.45   21.133 -49.20520 29.23448 
1 1 1   11   21    3 o  528.673   9.1489  214.031   7.4033  214.490   10.348  213.549   10.596  529.089   12.778  527.910   13.114 1.178589 18.30951 
1 1 1   11   21    4 o  1032.99   9.1310  817.139   14.437  822.631   17.745  806.385   24.831  1036.30   11.187  1025.55   15.818 10.74988 19.37450 
1 1 1   11   21    5 o  368.497   7.9579  103.970   4.4885  100.987   5.3833  110.774   8.1301  363.132   9.6853  380.179   13.971 -17.04758 17.00005 
1 1 1   11   21    6 o  580.639   7.8640  258.138   6.9891  251.747   8.5451  271.054   12.148  573.336   9.7373  594.730   13.344 -21.39423 16.51932 
1 1 1   11   21    7 o  747.068   8.1903  427.347   9.3655  430.925   11.615  420.698   15.833  750.089   10.117  740.876   13.962 9.213745 17.24240 
1 1 1   11   21    8 o  833.223   8.5101  531.624   10.853  534.669   13.442  525.920   18.397  835.484   10.511  828.301   14.511 7.182922 17.91770 
1 1 1   11   21    9 o  1092.56   11.918  914.573   19.931  914.573   19.931   0.0000   0.0000  1092.56   11.918  ?   ?  0.000000 11.91820 
1 1 1   11   21   10 o  337.332   11.496   87.180   5.9358   87.180   5.9358   0.0000   0.0000  337.332   11.496  ?   ?  0.000000 11.49611 
1 1 1   11   21   11 o  364.778   11.084  101.938   6.1886   95.716   8.3430  109.551   9.2278  353.302   15.428  377.948   15.951 -24.64658 22.19150 
1 1 1   11   21   12 o  1472.44   14.421  1662.20   32.503  1649.85   45.327  1675.26   46.631  1465.72   20.204  1476.85   20.629 -11.13611 28.87473 
1 1 1   11   21   13 o  736.968   8.5605  415.926   9.6564  402.156   11.505  448.745   17.762  724.557   10.374  764.965   15.170 -40.40833 18.37783 
1 1 1   11   21   14 f  554.966   8.4749  235.861   7.1990  238.031   8.6992  231.149   12.823  557.430   10.196  548.991   15.260 8.439697 18.35284 
1 1 1   11   21   15 o  802.139   8.7832  492.786   10.784  487.447   13.018  504.461   19.252  797.644   10.662  810.956   15.510 -13.31207 18.82113 
1 1 1   11   21   16 o  607.192   7.5171  282.317   6.9863  278.664   9.7471  286.176   10.019  603.085   10.559  611.150   10.710 -8.064514 15.04003 
1 1 1   11   21   17 o  664.800   7.6033  338.444   7.7368  337.019   10.797  339.948   11.092  663.205   10.636  666.062   10.880 -2.857117 15.21515 
1 1 1   11   21   18 o  820.748   7.8200  515.892   9.8240  512.302   13.781  519.601   14.008  817.611   11.012  823.404   11.115 -5.792725 15.64614 
1 1 1   11   21   19 o  410.333   10.028  129.015   6.2984  129.503   10.647  128.752   7.8118  410.647   16.939  409.779   12.455 0.8675232 21.02528 
1 1 1   11   21   20 o  950.923   9.6748  692.884   14.082  711.798   24.930  684.022   17.065  962.606   16.920  944.540   11.803 18.06598 20.63041 
1 1 1   11   21   21 o  222.590   13.292   38.148   4.5080   47.437   6.4286   29.161   6.3231  247.877   17.048  193.361   21.742 54.51619 27.62810 
1 1 1   11   21   22 o  619.944   11.521  294.733   10.932  299.665   14.662  288.559   16.406  624.619   15.336  612.602   17.496 12.01605 23.26589 
1 1 1   11   21   23 o  100.122   33.661   7.3497   6.0963   8.8751   7.6903   4.7698   10.001  110.629   37.803  104.749   41.658 5.880066 56.25318 
1 1 1   11   21   24 o  655.553   8.1633  329.290   8.1911  334.710   11.498  323.703   11.672  660.553   11.372  649.551   11.740 11.00177 16.34472 
1 1 1   11   21   25 o  138.888   21.028   15.218   4.3303   7.7612   5.9388   23.683   6.3277  101.421   33.195  173.235   24.551 -71.81419 41.28701 
1 1 1   11   21   26 o  435.088   9.9407  145.180   6.6201  141.602   8.1368  152.185   11.386  429.445   12.379  444.607   16.731 -15.16183 20.81236 
1 1 1   11   21   27 o  352.550   11.102   95.393   5.9910   92.891   7.3787  100.233   10.263  347.619   13.868  359.974   18.691 -12.35513 23.27354 
1 1 1   11   21   28 o  274.301   8.8805   57.697   3.7285   55.768   4.3179   63.351   7.3924  269.573   10.465  286.190   16.951 -16.61722 19.92115 
1 1 1   11   21   29 o  203.982   10.784   32.033   3.3551   30.584   3.8479   36.626   6.8524  199.074   12.694  216.508   20.939 -17.43495 24.48647 
1 1 1   11   21   30 o  274.420   8.9855   57.769   3.7742   58.268   4.3599   56.276   7.5392  275.499   10.339  269.235   18.405 6.263519 21.11017 
1 1 1   11   21   31 o   99.652   28.960   7.9666   4.6806   16.092   6.7455   0.4218   6.5000  140.092   32.141   75.736   32.170 64.35583 45.47457 
1 1 1   11   21   32 o  202.649   16.383   31.916   5.0381   38.469   7.1645   25.506   7.0861  221.502   21.398  178.579   26.747 42.92249 34.25362 
1 1 1   11   21   33 o  386.810   7.4490  114.741   4.4103  115.327   5.6880  113.858   6.9837  387.537   9.5891  384.718   11.860 2.819336 15.25127 
1 1 1   11   21   34 f  211.847   9.4863   34.470   3.0760   34.187   4.3916   34.742   4.3099  210.128   13.730  211.902   13.356 -1.773087 19.15455 
1 1 1   11   21   35 o  180.359   10.169   25.085   2.7959   26.684   3.8590   23.318   4.0564  185.483   13.689  172.989   15.484 12.49374 20.66732 
1 1 1   11   21   36 o  174.597   10.665   23.540   2.8366   23.171   3.9238   23.944   4.1053  172.462   15.014  175.245   15.464 -2.782547 21.55346 
1 1 1   11   21   37 o   45.571   19.860  -0.4287   2.6018   1.7102   3.6162  -2.7245   3.7463   62.825   25.029   47.972   22.091 14.85302 33.38331 
1 1 1   11   21   38 o  193.357   10.425   28.866   3.0740   33.183   4.3957   24.735   4.3004  206.660   13.979  177.847   15.968 28.81232 21.22188 
1 1 1   11   21   39 o  253.125   9.1652   49.277   3.5510   48.972   5.0085   49.585   5.0352  251.377   13.062  252.954   13.049 -1.576981 18.46369 
1 1 1   11   21   40 o  116.407   17.753   10.798   3.0630   9.9449   4.3468   11.640   4.3169  109.597   26.257  119.135   24.492 -9.538277 35.90632 
1 1 1   11   21   41 o  166.588   13.354   21.621   3.3764   19.975   4.8827   23.129   4.6740  158.125   20.669  171.108   18.122 -12.98257 27.48823 
1 1 1   11   21   42 o  190.779   11.815   28.230   3.4331   28.911   5.0745   27.654   4.6620  191.590   17.497  187.670   16.394 3.919891 23.97744 
1 1 1   11   21   43 o   79.288   23.174   5.1088   2.9895   3.4425   4.2508   6.7397   4.2052   73.681   27.727   90.779   27.720 -17.09810 39.20735 
1 1 1   11   21   44 o  161.600   18.092   20.733   4.3982   18.217   5.0672   28.421   8.8570  149.753   22.829  182.970   32.832 -33.21742 39.98829 
1 1 1   11   21   45 o  177.115   13.527   24.510   3.6394   19.775   5.1558   29.213   5.1380  156.201   22.188  192.134   17.669 -35.93315 28.36417 
1 1 1   11   21   46 o  222.569   15.412   38.883   5.2179   28.323   11.351   41.713   5.8756  175.719   42.636  230.026   16.804 -54.30763 45.82767 
1 1 1   11   21   47 o   91.798   25.818   7.0631   3.7796   5.0494   5.5451   8.8104   5.1654   84.885   31.722  101.795   30.642 -16.91005 44.10482 
1 1 1   11   21   48 f  255.999   15.874   51.634   6.1893   49.290   12.348   52.421   7.1527  237.704   34.985  256.742   18.322 -19.03801 39.49201 
1 1 1   11   21   49 o  176.726   14.955   24.663   4.0073   32.550   5.8795   17.821   5.4763  201.246   19.325  145.683   25.487 55.56221 31.98529 
1 1 1   11   21   50 o   94.202   25.925   7.5993   3.8557   6.0029   5.5665   9.0716   5.3458   87.738   31.958  101.820   31.282 -14.08218 44.71996 
1 1 1   11   21   51 o  203.795   13.683   32.724   4.2434   24.197   5.7182   43.175   6.3306  170.968   22.389  231.902   17.975 -60.93478 28.71209 
1 1 1   11   21   52 o  109.663   26.979   10.537   4.4974   9.1819   5.9427   12.354   6.8805  101.252   33.209  115.087   35.511 -13.83469 48.61944 
1 1 1   11   21   53 o  205.837   16.936   34.144   5.2885   20.475   9.2877   40.702   6.4332  142.276   40.632  223.438   18.990 -81.16211 44.85114 
1 1 1   11   21   54 f  160.968   19.381   21.445   4.6791   22.150   6.9326   20.856   6.3414  155.885   30.146  152.703   28.169 3.181335 41.25808 
1 1 1   11   21   55 o   82.205   28.773   5.8911   4.4665   4.7660   5.7294   7.6344   7.1315   79.803   31.595   92.518   35.648 -12.71452 47.63478 
1 1 1   11   21   56 o   71.381   29.138   3.1932   5.0346   4.9032   5.4564  -6.6003   13.058   79.001   30.974   78.610   37.699 0.3911362 48.79123 
1 1 1   11   22    0 o  700.448   13.620  376.181   14.590  376.181   14.590  376.181   14.590  700.448   13.620  700.448   13.620 0.000000 0.000000 
1 1 1   11   22    1 o  179.751   16.017   24.973   4.3605   28.752   6.1561   21.167   6.1773  192.327   21.268  163.989   25.434 28.33757 33.15437 
1 1 1   11   22    2 o  687.239   9.5990  361.717   10.097  364.793   14.320  358.676   14.240  689.907   13.561  684.095   13.599 5.812134 19.20502 
1 1 1   11   22    3 o  1111.19   11.750  945.989   19.985  940.594   28.100  951.511   28.429  1107.42   16.578  1113.81   16.676 -6.394165 23.51385 
1 1 1   11   22    4 o  1188.37   12.254  1082.09   22.289  1095.51   31.818  1069.16   31.232  1194.99   17.396  1180.55   17.284 14.44214 24.52253 
1 1 1   11   22    5 o  691.707   7.8678  366.353   8.3300  366.843   10.174  365.358   14.508  692.084   9.6043  690.415   13.729 1.669128 16.75499 
1 1 1   11   22    6 o  897.208   10.833  616.654   14.877  616.654   14.877   0.0000   0.0000  897.208   10.833  ?   ?  0.000000 10.83275 
1 1 1   11   22    7 o  994.492   11.409  757.724   17.366  757.724   17.366   0.0000   0.0000  994.492   11.409  ?   ?  0.000000 11.40860 
1 1 1   11   22    8 o  516.052   10.108  203.986   7.9843  203.986   7.9843   0.0000   0.0000  516.052   10.108  ?   ?  0.000000 10.10821 
1 1 1   11   22    9 o  596.543   8.1982  272.506   7.4856  274.279   9.2644  269.171   12.705  598.390   10.115  592.553   14.008 5.837280 17.27841 
1 1 1   11   22   10 o  611.457   8.2272  286.307   7.6999  275.691   9.2761  309.829   13.808  599.922   10.102  635.703   14.191 -35.78046 17.41918 
1 1 1   11   22   11 o  1011.53   9.4311  783.703   14.602  780.337   17.824  790.573   25.462  1009.15   11.539  1015.12   16.387 -5.969727 20.04254 
1 1 1   11   22   12 o  568.539   10.129  247.618   8.8148  242.254   12.033  253.831   12.950  562.101   13.986  575.318   14.706 -13.21729 20.29416 
1 1 1   11   22   13 o  336.330   12.315   86.700   6.3399   94.492   8.6520   77.664   9.3166  350.934   16.107  317.403   19.268 33.53088 25.11386 
1 1 1   11   22   14 o  148.065   24.253   17.313   5.3062   15.444   6.9196   19.981   8.2672  138.542   33.086  157.544   35.174 -19.00211 48.28969 
1 1 1   11   22   15 o  658.841   8.6598  332.471   8.7328  332.224   10.642  332.982   15.282  658.465   10.558  658.794   15.155 -0.3289185 18.47056 
1 1 1   11   22   16 o  345.751   10.431   91.603   5.5204   93.624   6.6589   87.161   9.8719  349.452   12.449  336.213   19.263 13.23944 22.93596 
1 1 1   11   22   17 o  1147.88   8.9768  1009.39   15.772  1013.89   22.334  1004.92   22.277  1149.86   12.689  1144.77   12.714 5.098145 17.96260 
1 1 1   11   22   18 o  585.065   9.1804  262.257   8.2212  243.290   13.734  272.851   10.263  562.885   15.940  596.600   11.239 -33.71521 19.50406 
1 1 1   11   22   19 o  782.010   9.1869  468.577   10.996  430.580   17.964  491.348   13.906  748.782   15.674  800.535   11.349 -51.75275 19.35121 
1 1 1   11   22   20 o  788.028   9.1193  475.852   10.999  457.591   17.927  486.877   13.930  771.899   15.173  796.819   11.421 -24.92004 18.99133 
1 1 1   11   22   21 o  432.095   12.635  143.262   8.3563   0.0000   0.0000  143.262   8.3563  ?   ?   432.095   12.635 0.000000 12.63469 
1 1 1   11   22   22 o  757.547   8.0363  439.698   9.3182  435.935   12.959  443.725   13.408  753.890   11.231  760.553   11.518 -6.662842 16.08683 
1 1 1   11   22   23 o  681.953   8.0638  356.358   8.4171  351.907   11.606  361.295   12.225  677.292   11.196  686.201   11.639 -8.908386 16.14978 
1 1 1   11   22   24 o  308.592   12.592   73.118   5.9477   75.593   6.9270   66.173   11.603  313.613   14.431  290.842   26.350 22.77103 30.04307 
1 1 1   11   22   25 o   82.923   31.226   4.0079   5.3928   4.0079   5.3928   0.0000   0.0000   82.923   31.226  ?   ?  0.000000 31.22551 
1 1 1   11   22   26 o   74.783   27.800   3.3827   4.2476   1.6667   5.8403   5.3097   6.1890   76.323   31.295   91.405   33.636 -15.08239 45.94297 
1 1 1   11   22   27 o  445.551   9.1012  152.252   6.2068  139.952   8.4405  166.735   9.1590  426.712   12.923  465.768   12.847 -39.05542 18.22231 
1 1 1   11   22   28 o  486.962   9.1093  181.897   6.7897  174.500   9.2845  190.401   9.9546  476.438   12.732  497.612   13.070 -21.17407 18.24574 
1 1 1   11   22   29 f  266.951   9.0991   54.673   3.7179   50.008   4.2279   70.584   7.8086  255.180   10.825  301.938   16.965 -46.75896 20.12394 
1 1 1   11   22   30 o  116.675   27.093   11.075   4.7456   16.338   6.6186   5.5061   6.8081  141.271   31.420   94.024   35.147 47.24744 47.14409 
1 1 1   11   22   31 o  176.419   13.379   24.102   3.5859   25.564   3.7503   8.5156   12.243  181.690   13.584  120.128   46.590 61.56218 48.53033 
1 1 1   11   22   32 o  283.341   9.7609   61.659   4.2332   62.752   4.4563   51.557   13.550  285.796   10.187  251.277   36.280 34.51949 37.68352 
1 1 1   11   22   33 o  137.776   16.178   14.874   3.3468   13.328   3.8255   19.918   6.9098  129.508   19.938  156.143   30.002 -26.63576 36.02293 
1 1 1   11   22   34 o  329.537   7.3769   83.306   3.7209   79.531   5.1156   87.546   5.4222  321.612   10.392  337.411   10.499 -15.79941 14.77216 
1 1 1   11   22   35 o  383.618   7.0341  112.887   4.1303  113.151   5.7787  112.612   5.9055  383.641   9.8410  382.683   10.082 0.9577942 14.08873 
1 1 1   11   22   36 o   71.904   20.634   4.1391   2.3897   0.3474   3.2178   8.8018   3.5683   54.047   22.778  103.907   23.040 -49.85949 32.39891 
1 1 1   11   22   37 o  142.208   12.591   15.731   2.7123   15.669   3.7776   15.796   3.8968  140.777   17.939  141.219   18.470 -0.4423065 25.74822 
1 1 1   11   22   38 o   92.513   19.485   6.9348   2.6720   7.9886   3.8742   5.9787   3.6902   98.496   25.498   86.137   25.893 12.35953 36.34003 
1 1 1   11   22   39 o  128.171   15.589   12.938   2.9952   8.8395   4.2973   16.810   4.1770  103.309   26.908  145.393   19.242 -42.08449 33.08065 
1 1 1   11   22   40 o  248.393   9.4956   47.497   3.6102   41.946   5.0188   53.449   5.1971  232.175   14.191  262.845   12.918 -30.66913 19.18982 
1 1 1   11   22   41 o   61.410   22.620   2.4309   2.8000   1.6976   3.9000   3.2110   4.0224   64.143   25.840   71.690   26.973 -7.547592 37.35331 
1 1 1   11   22   42 o   67.347   23.012   3.3638   2.8497   4.3552   3.9899   2.3315   4.0716   77.213   27.184   67.777   26.698 9.435997 38.10186 
1 1 1   11   22   43 o   71.220   26.744   3.2270   3.9507   5.4380   4.5629  -3.3947   7.8964   84.388   29.108   72.082   32.766 12.30598 43.82764 
1 1 1   11   22   44 o   79.432   24.688   5.0867   3.3188   3.3341   4.9041   6.5676   4.5079   75.831   29.465   89.957   28.880 -14.12646 41.25830 
1 1 1   11   22   45 o  191.774   16.378   28.999   4.7613   17.308   11.165   31.598   5.2640  137.674   45.536  199.879   17.379 -62.20436 48.73974 
1 1 1   11   22   46 o  107.560   22.620   9.5849   3.6060   9.7794   5.3793   9.4262   4.8596  106.848   31.045  105.149   29.170 1.698776 42.59945 
1 1 1   11   22   47 o  255.239   11.570   50.529   4.5202   47.859   5.9281   54.239   6.9864  246.527   15.793  261.661   17.545 -15.13403 23.60661 
1 1 1   11   22   48 o   46.548   21.409  -2.2729   3.5041  -1.7663   4.8801  -2.8122   5.0347   57.847   26.079   56.217   25.784 1.630215 36.67325 
1 1 1   11   22   49 o  160.486   15.705   20.470   3.8083   20.203   5.2620   20.764   5.5188  156.420   22.636  158.173   23.510 -1.753082 32.63623 
1 1 1   11   22   50 o  278.812   11.944   60.612   5.0973   63.393   7.0126   57.497   7.4221  282.486   16.288  267.759   18.218 14.72675 24.43750 
1 1 1   11   22   51 o  205.050   18.423   33.957   5.7204   0.5857   10.422   48.343   6.8432   86.653   38.660  244.928   18.388 -158.2752 42.81002 
1 1 1   11   22   52 o  165.148   16.613   21.970   4.1424   23.150   5.8990   20.822   5.8184  165.313   24.016  155.882   25.249 9.431519 34.84662 
1 1 1   11   22   53 o  195.470   15.926   30.741   4.7235   34.824   7.2738   27.763   6.2114  202.201   23.969  181.118   22.918 21.08307 33.16259 
1 1 1   11   22   54 o  158.453   17.317   20.552   4.1316   21.301   5.8305   19.797   5.8556  155.962   25.290  149.290   26.601 6.672119 36.70401 
1 1 1   11   22   55 o   83.744   29.095   6.2536   4.5629   4.9989   5.4566   9.1708   8.3202   79.616   31.041   97.881   38.283 -18.26462 49.28585 
1 1 1   11   23    0 o  1584.99   21.499  1927.49   52.135  1927.49   52.135  1927.49   52.135  1584.99   21.499  1584.99   21.499 0.000000 0.000000 
1 1 1   11   23    1 f  619.520   9.5988  293.965   9.1021  292.889   12.837  295.053   12.908  618.140   13.568  620.418   13.592 -2.278320 19.20523 
1 1 1   11   23    2 o  706.896   9.7735  382.745   10.575  393.593   15.142  372.417   14.775  716.548   13.806  697.002   13.849 19.54596 19.55525 
1 1 1   11   23    3 o  628.685   13.380  302.959   12.876  302.959   12.876   0.0000   0.0000  628.685   13.380  ?   ?  0.000000 13.38028 
1 1 1   11   23    4 o  804.774   14.278  496.555   17.587  496.555   17.587   0.0000   0.0000  804.774   14.278  ?   ?  0.000000 14.27755 
1 1 1   11   23    5 f  947.206   15.331  688.081   22.228  688.081   22.228   0.0000   0.0000  947.206   15.331  ?   ?  0.000000 15.33124 
1 1 1   11   23    6 o  493.206   8.2820  186.280   6.2522  186.801   7.7576  185.314   10.561  493.812   10.264  491.639   14.034 2.173645 17.38696 
1 1 1   11   23    7 o  277.524   10.310   59.002   4.3797   60.664   5.4259   55.895   7.4193  281.337   12.600  269.240   18.109 12.09680 22.06102 
1 1 1   11   23    8 o  381.388   9.0131  111.406   5.2615  109.940   6.4397  114.351   9.1255  378.795   11.107  386.109   15.441 -7.314392 19.02073 
1 1 1   11   23    9 o  163.200   16.549   20.646   4.0767   16.479   4.8928   30.108   7.3726  144.634   22.861  196.170   25.132 -51.53577 33.97378 
1 1 1   11   23   10 o  467.152   8.6299  167.140   6.1707  164.849   7.5470  171.762   10.718  463.849   10.630  473.223   14.797 -9.374237 18.21923 
1 1 1   11   23   11 o  956.941   9.2943  701.456   13.614  693.545   16.550  718.010   23.940  951.317   11.366  967.285   16.170 -15.96759 19.76461 
1 1 1   11   23   12 o  907.767   9.1643  631.227   12.733  633.612   15.689  626.623   21.795  909.268   11.273  903.645   15.758 5.623352 19.37494 
1 1 1   11   23   13 o  785.098   8.8552  472.145   10.641  463.004   12.904  491.567   18.811  777.288   10.846  800.367   15.355 -23.07898 18.79947 
1 1 1   11   23   14 o  523.937   10.685  210.374   8.5688  209.031   11.663  211.949   12.631  521.952   14.598  525.477   15.704 -3.524475 21.44167 
1 1 1   11   23   15 o  775.417   10.869  460.852   12.900  445.168   17.519  479.426   19.065  761.588   15.029  790.236   15.762 -28.64813 21.77850 
1 1 1   11   23   16 o  371.104   18.733  106.163   10.606   0.0000   0.0000  106.163   10.606  ?   ?   371.104   18.733 0.000000 18.73302 
1 1 1   11   23   17 o  749.476   15.764  431.427   18.084   0.0000   0.0000  431.427   18.084  ?   ?   749.476   15.764 0.000000 15.76419 
1 1 1   11   23   18 o  950.521   8.3833  692.200   12.197  670.111   16.759  717.073   17.784  934.752   11.714  966.898   12.017 -32.14667 16.78122 
1 1 1   11   23   19 o  332.715   9.6797   84.850   4.9295   78.869   6.7087   91.868   7.2675  320.530   13.674  345.933   13.725 -25.40295 19.37450 
1 1 1   11   23   20 o  568.952   7.9785  248.014   6.9481  236.842   9.4348  261.254   10.270  555.700   11.092  583.590   11.498 -27.89020 15.97616 
1 1 1   11   23   21 o  274.583   10.963   57.832   4.6076   57.965   6.3443   57.685   6.7027  274.200   15.175  273.410   16.087 0.7898254 22.11552 
1 1 1   11   23   22 o  523.424   8.2322  209.962   6.5954  198.908   8.8885  223.504   9.8382  509.140   11.406  539.638   11.911 -30.49805 16.49115 
1 1 1   11   23   23 o  505.493   8.4623  195.859   6.5475  199.783   9.0832  191.615   9.4466  510.181   11.632  499.549   12.355 10.63184 16.96857 
1 1 1   11   23   24 o  449.632   9.8383  155.072   6.7709  146.092   8.1280  175.432   12.239  436.160   12.175  477.222   16.756 -41.06235 20.71189 
1 1 1   11   23   25 o  527.697   9.7825  213.621   7.9014  214.481   9.1961  211.196   15.444  528.538   11.367  522.896   19.296 5.642151 22.39525 
1 1 1   11   23   26 o  219.081   16.942   37.229   5.6370   35.157   6.3940   44.460   11.943  212.309   19.908  235.178   34.178 -22.86989 39.55338 
1 1 1   11   23   27 o  330.235   10.912   83.745   5.5155   84.154   7.4131   83.237   8.2546  330.594   14.650  328.531   16.415 2.062103 22.00195 
1 1 1   11   23   28 o  173.314   18.178   23.466   4.7504   21.211   6.4273   26.181   7.0521  162.724   26.734  181.330   26.166 -18.60588 37.40796 
1 1 1   11   23   29 o  233.756   17.014   42.432   6.0457   43.913   6.9573   37.863   12.217  237.336   19.319  214.399   38.650 22.93660 43.20989 
1 1 1   11   23   30 o  268.565   9.8916   55.390   4.0662   55.851   4.3000   51.491   12.501  269.630   10.419  252.657   33.125 16.97362 34.72466 
1 1 1   11   23   31 o  135.746   14.717   14.380   3.0089   15.908   3.3793   8.5351   6.6099  142.668   15.737  105.304   35.047 37.36366 38.41775 
1 1 1   11   23   32 o  252.131   9.9905   48.849   3.8555   48.426   4.5113   49.995   7.4255  250.843   11.750  252.968   19.324 -2.125000 22.61554 
1 1 1   11   23   33 o  295.172   9.0244   66.918   4.0772   66.228   4.6369   69.270   8.5607  293.485   10.322  297.956   18.868 -4.471466 21.50732 
1 1 1   11   23   34 o  102.851   19.984   8.5174   3.0327   8.4546   3.3497   8.8029   7.1423  102.054   22.085  106.901   36.432 -4.847031 42.60306 
1 1 1   11   23   35 o  249.864   8.6834   47.965   3.3210   49.527   4.5149   46.123   4.9020  253.513   11.635  244.062   13.171 9.450150 17.57423 
1 1 1   11   23   36 o   64.996   21.354   3.1923   2.4568   3.3690   3.4336   3.0069   3.5167   70.149   25.162   68.571   25.334 1.577965 35.70585 
1 1 1   11   23   37 o   62.913   21.803   2.8337   2.5616   5.7967   3.7623   0.2734   3.4974   85.157   26.256   55.747   23.634 29.40995 35.32677 
1 1 1   11   23   38 o  145.696   13.390   16.557   2.9527   19.768   4.1980   13.412   4.1538  158.308   17.624  128.895   21.834 29.41235 28.05927 
1 1 1   11   23   39 o  126.171   15.081   12.530   2.8547   10.603   3.8949   14.767   4.1963  113.847   23.140  135.559   20.896 -21.71265 31.17838 
1 1 1   11   23   40 o  272.831   8.9886   57.282   3.7537   65.243   5.5172   50.421   5.1218  290.452   12.410  254.841   13.176 35.61090 18.09998 
1 1 1   11   23   41 o  305.237   8.7551   71.700   4.0904   79.489   5.8772   64.383   5.6964  320.620   11.976  288.310   12.908 32.30984 17.60826 
1 1 1   11   23   42 o  119.864   22.258   11.739   3.9332   15.566   4.4484  -1.9726   8.4201  138.665   21.668   77.567   34.667 61.09788 40.88141 
1 1 1   11   23   43 o  335.351   10.282   86.809   5.2776   88.350   6.3151   83.240   9.6100  337.721   12.217  324.306   19.450 13.41452 22.96809 
1 1 1   11   23   44 o   89.722   27.819   6.6204   4.2167  -2.7526   9.9868   8.6539   4.6517   82.381   37.207  101.267   28.698 -18.88590 46.98896 
1 1 1   11   23   45 o  285.724   12.575   63.384   5.4995   68.335   6.7950   53.983   9.3637  295.391   15.079  257.938   23.992 37.45346 28.33722 
1 1 1   11   23   46 o   84.330   26.457   5.8388   3.8014   10.231   5.3623   1.4016   5.3897  108.870   30.799   70.496   29.583 38.37413 42.70452 
1 1 1   11   23   47 o   87.967   26.244   6.4903   3.8016   9.7014   5.4085   3.3546   5.3446  105.740   31.246   76.927   30.497 28.81314 43.66220 
1 1 1   11   23   48 o  110.204   22.480   10.152   3.6634   9.5720   5.1462   10.747   5.2163  104.710   30.348  110.784   30.016 -6.074364 42.68473 
1 1 1   11   23   49 o  220.083   13.106   38.016   4.3950   34.307   5.8850   42.693   6.6089  206.306   18.845  230.259   18.919 -23.95313 26.70294 
1 1 1   11   23   50 o   77.409   27.251   4.7260   4.0096   0.4572   5.5119   9.5239   5.8435   66.984   29.050  103.216   32.854 -36.23196 43.85519 
1 1 1   11   23   51 o  222.327   13.190   38.962   4.4684   37.560   6.4850   40.229   6.1655  214.302   20.002  223.039   18.219 -8.736649 27.05561 
1 1 1   11   23   52 o  128.290   22.364   13.979   4.2318   12.693   6.2777   15.050   5.7291  115.765   33.509  128.707   29.687 -12.94199 44.76812 
1 1 1   11   23   53 o  173.408   16.443   24.392   4.3122   23.835   6.3405   24.872   5.8820  164.830   25.993  170.635   23.116 -5.805191 34.78444 
1 1 1   11   23   54 o   75.465   28.929   4.3960   4.6805   6.6163   5.6706  -0.3494   8.2903   86.716   32.144   74.132   33.650 12.58398 46.53507 
1 1 1   11   24    2 f  817.283   14.637  512.273   18.310   0.0000   0.0000  512.273   18.310  ?   ?   817.283   14.637 0.000000 14.63657 
1 1 1   11   24    3 o  396.594   15.367  120.657   9.3284   0.0000   0.0000  120.657   9.3284  ?   ?   396.594   15.367 0.000000 15.36713 
1 1 1   11   24    4 o  433.376   10.378  143.893   6.8842  131.574   9.4045  158.115   10.105  414.175   14.835  454.051   14.539 -39.87524 20.77165 
1 1 1   11   24    5 o  285.211   12.162   62.349   5.3095   55.331   7.1937   70.747   7.8691  267.881   17.643  303.118   17.030 -35.23703 24.52133 
1 1 1   11   24    6 o  520.761   8.3838  207.699   6.6827  202.561   8.1850  217.972   11.573  514.177   10.400  533.120   14.183 -18.94281 17.58754 
1 1 1   11   24    7 f  562.396   8.3385  242.241   7.1780  241.134   8.8817  244.325   12.188  560.998   10.343  564.420   14.108 -3.422058 17.49325 
1 1 1   11   24    8 o  463.041   8.6985  164.225   6.1650  164.473   7.6408  163.762   10.436  463.288   10.775  462.027   14.757 1.260895 18.27179 
1 1 1   11   24    9 o  581.268   8.5057  258.790   7.5676  256.184   9.2992  263.901   13.021  578.208   10.507  586.520   14.505 -8.311462 17.91054 
1 1 1   11   24   10 o  538.009   10.303  221.800   8.4847  220.419   11.690  223.337   12.334  536.026   14.248  539.498   14.937 -3.472168 20.64241 
1 1 1   11   24   11 o  541.188   10.389  224.446   8.6061  225.031   11.918  223.808   12.441  541.566   14.377  540.026   15.051 1.539856 20.81424 
1 1 1   11   24   12 o  491.194   10.667  184.918   8.0201  179.761   10.999  190.773   11.720  483.967   14.848  498.520   15.359 -14.55356 21.36263 
1 1 1   11   24   13 o  576.113   10.476  254.388   9.2383  252.136   12.793  256.842   13.355  573.161   14.583  578.427   15.084 -5.266113 20.98043 
1 1 1   11   24   14 o  781.607   9.1384  468.092   10.933  445.011   13.070  521.873   19.950  761.865   11.208  824.313   15.812 -62.44781 19.38148 
1 1 1   11   24   15 o  431.072   12.536  142.548   8.2716  128.845   11.827  155.668   11.573  409.219   18.882  450.052   16.800 -40.83298 25.27390 
1 1 1   11   24   16 o  452.656   11.563  157.143   8.0112  150.397   10.490  166.585   12.410  442.462   15.489  465.432   17.420 -22.97031 23.30993 
1 1 1   11   24   17 f  540.315   10.956  223.876   9.0610  228.890   12.414  218.161   13.256  545.870   14.858  532.728   16.256 13.14142 22.02345 
1 1 1   11   24   18 o  559.377   7.9601  239.739   6.8154  247.255   9.5729  232.014   9.7053  567.784   11.015  549.950   11.530 17.83429 15.94574 
1 1 1   11   24   19 o  653.315   7.9351  327.042   7.9349  332.866   11.113  320.987   11.333  658.740   11.022  646.820   11.447 11.91980 15.89102 
1 1 1   11   24   20 o  144.127   19.002   16.284   4.0898   13.429   5.5792   19.601   6.0129  128.898   28.982  156.986   25.929 -28.08772 38.88821 
1 1 1   11   24   21 o  104.268   25.712   8.7692   4.0777   3.5275   5.6882   14.311   5.8488   82.375   31.810  132.984   29.505 -50.60900 43.38715 
1 1 1   11   24   22 o  561.600   9.2307  241.849   7.9347  242.583   9.7101  240.372   13.766  562.180   11.284  558.769   16.095 3.411011 19.65690 
1 1 1   11   24   23 o  527.755   9.5290  213.634   7.6975  207.991   9.2705  226.161   13.812  520.455   11.637  541.773   16.656 -21.31793 20.31902 
1 1 1   11   24   24 o  493.546   8.5987  186.781   6.4958  177.945   8.7562  197.596   9.6869  481.309   11.886  507.093   12.480 -25.78452 17.23456 
1 1 1   11   24   25 o   64.858   26.617   1.1529   4.2292   1.6664   5.7359   0.5412   6.2605   75.616   31.011   74.923   31.684 0.6933746 44.33465 
1 1 1   11   24   26 o  465.893   8.9688  166.511   6.3958  174.391   8.8678  157.968   9.2332  476.316   12.163  453.139   13.312 23.17743 18.03222 
1 1 1   11   24   27 o  467.445   10.695  167.829   7.6524  166.121   8.9885  172.326   14.587  464.730   12.636  471.490   20.213 -6.759918 23.83758 
1 1 1   11   24   28 o  389.187   12.038  116.487   7.1708  122.656   8.5007  101.269   13.352  399.031   13.918  359.379   24.419 39.65231 28.10676 
1 1 1   11   24   29 o   98.542   28.694   7.8152   4.5908   11.766   6.3542   3.5012   6.6398  119.772   33.402   85.947   34.018 33.82478 47.67480 
1 1 1   11   24   30 o  132.904   24.163   14.225   4.7343   9.8293   6.5999   18.884   6.7951  110.904   34.872  151.951   30.279 -41.04700 46.18315 
1 1 1   11   24   31 o  483.304   8.3360  179.282   6.1667  176.200   7.7831  184.478   10.107  478.702   10.622  489.113   13.501 -10.41165 17.17857 
1 1 1   11   24   32 o  479.231   7.5788  176.216   5.5593  171.529   6.5745  187.973   10.414  472.550   9.0896  493.502   13.786 -20.95200 16.51292 
1 1 1   11   24   33 o  282.546   9.3301   61.353   4.0350   60.530   4.5967   64.116   8.4238  280.459   10.708  286.255   19.339 -5.796173 22.10568 
1 1 1   11   24   34 o  337.033   8.6877   87.273   4.4817   89.047   5.1754   81.954   8.9614  340.236   9.9379  324.003   18.143 16.23303 20.68645 
1 1 1   11   24   35 o  274.282   9.6272   57.870   4.0417   55.870   4.6003   64.637   8.4627  269.266   11.162  287.043   19.375 -17.77704 22.36021 
1 1 1   11   24   36 o  154.794   12.116   18.604   2.8477   17.537   3.9710   19.733   4.0860  149.026   17.759  158.359   17.130 -9.333374 24.67409 
1 1 1   11   24   37 o  105.521   17.441   8.8957   2.7185   6.8840   3.6372   11.442   4.0921   91.608   25.167  118.407   23.408 -26.79918 34.36998 
1 1 1   11   24   38 o   49.525   20.355   0.6869   2.4781   0.6637   3.3741   0.7140   3.6514   56.342   23.507   58.506   24.435 -2.163933 33.90678 
1 1 1   11   24   39 o  351.585   7.7874   94.992   4.1908   92.436   5.8870   97.619   5.9671  346.085   11.113  355.696   10.960 -9.610535 15.60852 
1 1 1   11   24   40 o   78.344   25.474   4.8099   3.4997   6.1578   3.8741  -1.1705   8.1604   87.071   26.610   78.324   34.615 8.747398 43.66127 
1 1 1   11   24   41 o  137.618   19.013   15.149   3.8980   16.485   4.3883   10.152   8.4861  143.140   20.625  112.255   39.632 30.88532 44.67701 
1 1 1   11   24   42 o  220.107   10.744   37.423   3.6198   36.289   4.9751   38.699   5.2764  215.249   15.198  222.175   15.615 -6.926239 21.79023 
1 1 1   11   24   43 o  344.715   14.729   92.627   7.7717   90.361   11.922   94.302   10.249  335.169   23.385  344.976   19.489 -9.807526 30.44136 
1 1 1   11   24   44 f  272.533   11.138   57.483   4.6464   56.770   6.3336   58.313   6.8372  269.048   15.445  272.238   16.486 -3.189789 22.59025 
1 1 1   11   24   45 o  145.570   17.755   16.939   3.8741   17.859   5.1921   15.782   5.8190  147.148   23.870  136.018   28.844 11.13007 37.44052 
1 1 1   11   24   46 o  204.697   12.837   32.749   4.0016   31.984   5.6949   33.495   5.6240  199.919   18.833  204.951   18.114 -5.031937 26.13018 
1 1 1   11   24   47 o  107.943   23.210   9.7862   3.7209   15.468   5.5538   5.1591   5.0120  134.200   27.945   82.938   30.307 51.26253 41.22455 
1 1 1   11   24   48 o  152.414   30.270   20.334   6.8126   20.125   10.315   20.495   9.0732  143.009   43.358  146.926   39.494 -3.916946 58.64887 
1 1 1   11   24   49 o   54.740   23.996  -0.3413   3.8479   0.9407   5.4665  -1.6004   5.4174   68.276   29.263   60.945   27.476 7.330849 40.14043 
1 1 1   11   24   50 o  224.698   14.078   39.927   4.8175   40.506   6.5415   39.241   7.1215  223.201   19.339  218.095   21.618 5.106262 29.00540 
1 1 1   11   24   51 o  208.936   14.563   34.756   4.6282   48.539   7.4005   25.903   5.9313  243.027   20.074  175.480   22.609 67.54726 30.23462 
1 1 1   11   24   52 o   57.914   24.683   0.8021   3.8500  -1.4042   5.3523   3.1677   5.5421   59.847   27.115   74.181   30.459 -14.33362 40.77973 
1 1 1   11   24   53 o   55.920   25.065  -0.7844   4.4355   0.7147   5.4115  -3.8532   7.7426   65.358   28.558   65.795   30.791 -0.4374313 41.99546 
1 1 1   11   25    0 o  986.594   16.006  746.621   24.157  746.621   24.157  746.621   24.157  986.594   16.006  986.594   16.006 0.000000 0.000000 
1 1 1   11   25    1 o   96.445   27.236   7.3685   4.1972   7.5227   5.8976   7.2102   5.9747  100.649   33.086   99.432   33.324 1.216980 46.95896 
1 1 1   11   25    2 o  481.696   10.120  177.788   7.4616  170.538   10.392  185.502   10.720  471.484   14.401  491.748   14.242 -20.26404 20.25365 
1 1 1   11   25    3 o  650.057   9.9547  323.778   9.9048  317.829   13.721  330.253   14.313  643.699   13.926  656.124   14.252 -12.42450 19.92626 
1 1 1   11   25    4 o  957.083   11.106  702.063   16.269  682.058   22.225  725.163   23.881  942.710   15.402  971.924   16.053 -29.21454 22.24693 
1 1 1   11   25    5 o  174.311   18.008   23.591   4.7353   25.308   6.5666   21.731   6.8349  179.568   24.533  165.512   27.977 14.05620 37.20968 
1 1 1   11   25    6 o  859.327   15.239  566.766   20.044   0.0000   0.0000  566.766   20.044  ?   ?   859.327   15.239 0.000000 15.23861 
1 1 1   11   25    7 o  473.705   10.400  171.970   7.5404  165.644   10.528  178.632   10.805  464.585   14.806  482.470   14.631 -17.88586 20.81498 
1 1 1   11   25    8 o  630.796   8.6114  304.816   8.3145  299.908   10.251  314.253   14.213  625.531   10.707  639.916   14.511 -14.38525 18.03374 
1 1 1   11   25    9 o   54.376   24.131  -1.4294   4.0056  -0.2905   4.9479  -3.5952   6.8233   64.814   27.811   68.093   30.754 -3.279266 41.46439 
1 1 1   11   25   10 o  383.185   9.6355  112.518   5.6513  117.103   6.9956  103.904   9.5882  390.794   11.695  367.716   17.035 23.07806 20.66364 
1 1 1   11   25   11 o  481.959   8.9344  177.978   6.5909  183.688   8.2782  168.091   10.893  489.479   11.049  467.865   15.211 21.61426 18.80033 
1 1 1   11   25   12 o  309.152   14.484   73.378   6.8537   79.387   10.127   68.300   9.3098  320.365   20.764  297.081   20.601 23.28412 29.24955 
1 1 1   11   25   13 o  152.772   25.616   18.524   5.7779   17.242   8.3899   19.680   7.9686  145.748   37.417  155.962   34.313 -10.21426 50.76800 
1 1 1   11   25   14 o  145.325   20.577   16.593   4.4492   15.906   5.2310   18.390   8.4601  141.380   25.092  150.387   37.005 -9.007202 44.70996 
1 1 1   11   25   15 o  374.342   10.311  107.445   5.9081  105.426   7.1207  111.904   10.584  370.643   12.552  381.289   18.135 -10.64600 22.05512 
1 1 1   11   25   16 o  298.717   12.007   68.472   5.4898   67.161   6.5057   71.716   10.231  295.672   14.375  303.960   22.143 -8.287201 26.40027 
1 1 1   11   25   17 o  804.730   11.159  496.812   13.745  491.003   18.839  503.426   20.101  799.138   15.401  808.978   16.233 -9.840454 22.37679 
1 1 1   11   25   18 o  592.117   11.121  269.003   10.079  281.030   13.865  255.525   14.678  604.583   14.983  576.186   16.644 28.39716 22.39434 
1 1 1   11   25   19 o  569.564   8.1584  248.630   7.1124  254.895   10.147  242.580   9.9720  576.283   11.504  562.177   11.589 14.10596 16.32899 
1 1 1   11   25   20 o  453.865   8.5898  157.919   5.9673  154.710   8.2416  161.454   8.6515  448.869   11.996  458.504   12.328 -9.635437 17.20073 
1 1 1   11   25   21 o  315.947   11.708   76.652   5.6621   73.704   6.7610   83.575   10.361  309.561   14.269  328.102   20.738 -18.54123 25.17279 
1 1 1   11   25   22 o  230.751   13.202   41.066   4.6435   44.099   6.2742   37.391   6.9050  238.511   17.304  218.848   20.866 19.66284 27.10770 
1 1 1   11   25   23 o  134.025   21.305   14.248   4.2243   12.452   5.6457   16.533   6.3674  123.628   30.114  142.670   30.104 -19.04156 42.58078 
1 1 1   11   25   24 o  159.290   24.851   20.210   5.8612   20.210   5.8612   0.0000   0.0000  159.290   24.851  ?   ?  0.000000 24.85072 
1 1 1   11   25   25 o  282.798   13.752   61.563   5.9528   61.382   6.8592   62.116   11.982  281.654   15.976  280.121   28.337 1.533051 32.53002 
1 1 1   11   25   26 o  153.193   23.243   18.669   5.2789   18.117   6.0308   20.480   10.917  149.855   27.298  156.286   43.851 -6.431198 51.65354 
1 1 1   11   25   27 o  158.124   19.000   19.644   4.5064   15.337   6.3068   24.137   6.4414  136.737   30.865  174.073   24.884 -37.33553 39.64699 
1 1 1   11   25   28 o  324.539   13.105   81.124   6.5099   89.153   7.8289   63.133   11.719  339.875   15.049  282.042   27.496 57.83389 31.34526 
1 1 1   11   25   29 o  247.084   16.874   47.466   6.3435   43.405   7.2497   60.733   13.104  235.385   20.321  274.623   31.760 -39.23779 37.70448 
1 1 1   11   25   30 o  346.208   13.895   92.490   7.3631  108.422   12.665   84.355   9.0497  371.799   22.359  329.241   18.026 42.55814 28.72030 
1 1 1   11   25   31 o  414.072   10.300  131.855   6.5284  133.663   9.2110  130.030   9.2541  415.925   14.468  410.159   14.741 5.765808 20.65477 
1 1 1   11   25   32 o  245.816   14.591   46.888   5.4653   38.703   7.6790   55.291   7.7803  220.906   23.050  265.708   19.261 -44.80241 30.03816 
1 1 1   11   25   33 o  393.701   8.2158  119.045   4.9509  119.189   5.8205  118.669   9.4159  393.672   9.6595  391.237   15.724 2.435120 18.45366 
1 1 1   11   25   34 o  128.719   16.804   13.085   3.2317   12.916   3.6015   13.786   7.3226  127.315   19.068  127.715   35.942 -0.4003372 40.68662 
1 1 1   11   25   35 o  321.652   8.9454   79.547   4.4041   78.673   5.1067   82.084   8.6999  319.613   10.439  324.144   17.601 -4.530518 20.46380 
1 1 1   11   25   36 f  280.995   10.149   60.809   4.3651   63.528   4.8168   48.319   10.324  287.058   10.963  244.036   28.156 43.02216 30.21506 
1 1 1   11   25   37 o   52.574   20.943   1.1816   2.5318   3.2548   3.5132  -1.0585   3.6518   69.678   25.387   52.013   23.063 17.66542 34.29904 
1 1 1   11   25   38 o  425.517   7.9576  139.169   5.1829  127.958   6.5425  158.058   8.4925  407.373   10.493  452.139   12.271 -44.76666 16.14568 
1 1 1   11   25   39 o   92.914   23.623   7.1283   3.3670   8.5532   3.7441   1.1038   7.6985  101.633   24.381   81.717   34.867 19.91690 42.54592 
1 1 1   11   25   40 o   90.785   20.714   6.7583   2.8148   8.8916   3.7862   4.1223   4.2087  103.531   24.308   76.730   27.813 26.80117 36.93818 
1 1 1   11   25   41 o  185.448   11.786   26.717   3.3281   25.894   4.6437   27.586   4.7721  181.129   16.947  187.029   16.851 -5.899216 23.89860 
1 1 1   11   25   42 o  230.143   13.933   41.346   4.8851   19.823   10.139   47.853   5.5749  147.418   42.561  247.351   14.793 -99.93298 45.05827 
1 1 1   11   25   43 o  299.409   15.728   70.317   7.1828   0.0000   0.0000   70.317   7.1828  ?   ?   299.409   15.728 0.000000 15.72841 
1 1 1   11   25   44 o  204.802   12.775   32.729   3.9846   34.647   5.9736   31.191   5.3482  208.409   18.933  198.123   17.827 10.28603 26.00503 
1 1 1   11   25   45 o  113.974   26.977   11.082   4.6331   3.6023   11.212   12.622   5.0878   97.965   41.947  121.391   27.959 -23.42626 50.41059 
1 1 1   11   25   46 f  202.359   12.654   32.031   3.8998   28.733   5.4579   35.472   5.5741  188.994   19.131  211.008   17.414 -22.01364 25.86966 
1 1 1   11   25   47 o  146.032   17.532   17.160   3.8405   16.570   5.6093   17.680   5.2693  138.890   27.359  145.012   24.620 -6.122147 36.80585 
1 1 1   11   25   48 o  108.240   23.324   9.9323   3.7502   9.4124   5.5210   10.378   5.1099  102.961   31.817  108.205   29.872 -5.244293 43.64209 
1 1 1   11   25   49 f  263.366   12.614   54.326   5.0849   58.402   7.3909   50.664   7.0067  269.358   18.031  250.554   18.399 18.80417 25.76101 
1 1 1   11   25   50 o  176.500   16.313   25.075   4.3573   38.131   6.9503   16.622   5.5928  214.329   21.475  137.193   27.590 77.13612 34.96235 
1 1 1   11   25   51 o  126.317   21.319   13.501   3.9751   20.575   5.8272   7.3447   5.4365  153.517   25.708   90.799   31.746 62.71745 40.85007 
1 1 1   11   25   52 o   89.267   29.467   7.2316   4.6763   12.657   5.9036  -1.9053   7.6611  114.829   32.257   69.134   31.745 45.69485 45.25756 
1 1 1   11   26    0 o  225.025   21.424   39.915   7.2254   39.915   7.2254   39.915   7.2254  225.025   21.424  225.025   21.424 0.000000 0.000000 
1 1 1   11   26    1 o  291.362   12.044   65.100   5.3713   71.829   7.6702   58.625   7.5241  305.344   16.473  275.579   17.935 29.76443 24.35197 
1 1 1   11   26    2 o  759.025   10.236  441.558   11.892  436.039   16.632  447.333   17.012  753.725   14.416  763.402   14.559 -9.676758 20.48864 
1 1 1   11   26    3 o  1223.53   12.759  1148.33   23.894  1134.10   33.388  1163.27   34.210  1214.56   17.960  1230.02   18.171 -15.45801 25.54846 
1 1 1   11   26    4 o  789.466   10.407  477.724   12.575  471.426   17.521  484.414   18.059  783.658   14.607  794.339   14.853 -10.68079 20.83212 
1 1 1   11   26    5 o  434.565   10.380  144.753   6.9042  147.668   9.7592  141.833   9.7687  438.589   14.537  429.808   14.849 8.781372 20.78038 
1 1 1   11   26    6 o  322.360   13.037   79.728   6.4324   76.874   9.4804   82.163   8.7563  315.420   19.736  326.442   17.589 -11.02213 26.43661 
1 1 1   11   26    7 o  550.383   8.6083  232.090   7.2519  235.660   9.0756  225.784   12.061  554.431   10.694  542.292   14.531 12.13843 18.04216 
1 1 1   11   26    8 o  341.333   10.036   89.305   5.2432   87.088   6.4544   93.608   8.9910  336.923   12.516  348.964   16.833 -12.04102 20.97583 
1 1 1   11   26    9 o  785.019   8.8925  472.227   10.685  458.681   12.953  501.073   18.902  773.426   10.942  807.640   15.290 -34.21387 18.80198 
1 1 1   11   26   10 o  127.027   28.307   12.995   5.3629   9.2130   7.7891   16.404   7.3948  112.203   38.047  142.239   34.353 -30.03632 51.26069 
1 1 1   11   26   11 f  290.561   14.399   64.842   6.4038   62.305   9.6218   66.860   8.5801  283.249   22.375  294.031   19.169 -10.78229 29.46392 
1 1 1   11   26   12 o  700.973   8.8115  376.569   9.4541  369.880   11.504  390.487   16.594  694.475   10.822  712.833   15.209 -18.35730 18.66639 
1 1 1   11   26   13 o  268.562   12.095   55.349   4.9720   56.805   5.9578   52.008   9.0245  271.542   14.386  258.414   23.058 13.12827 27.17765 
1 1 1   11   26   14 o  147.063   19.975   16.979   4.3800   17.451   5.1410   15.727   8.3655  148.474   23.396  139.159   38.141 9.315445 44.74457 
1 1 1   11   26   15 o  397.555   9.8850  121.198   6.0151  121.357   7.2422  120.845   10.800  397.639   11.899  396.093   17.815 1.545654 21.42309 
1 1 1   11   26   16 o  358.502   10.638   98.598   5.8374   97.565   7.0299  100.892   10.476  356.419   12.886  361.206   19.016 -4.787323 22.97045 
1 1 1   11   26   17 o  274.560   12.676   57.900   5.3269   59.823   6.3954   53.543   9.6261  278.476   15.060  261.693   24.310 16.78311 28.59669 
1 1 1   11   26   18 o  625.812   9.2381  300.331   8.8491  295.886   10.705  309.924   15.725  620.860   11.265  634.409   16.194 -13.54840 19.72670 
1 1 1   11   26   19 o  567.885   15.484  248.278   13.459  248.278   13.459   0.0000   0.0000  567.885   15.484  ?   ?  0.000000 15.48422 
1 1 1   11   26   20 o  553.110   11.194  234.897   9.4766  234.725   12.867  235.102   14.010  552.145   15.224  552.281   16.574 -0.1360474 22.50469 
1 1 1   11   26   21 o  227.289   12.965   39.846   4.4916   38.507   6.0910   41.442   6.6500  222.610   18.031  230.806   18.992 -8.196365 26.18830 
1 1 1   11   26   22 o  673.558   9.4756  348.110   9.7691  349.483   11.692  344.935   17.780  674.511   11.325  668.436   17.378 6.075073 20.74272 
1 1 1   11   26   23 o  192.379   17.657   28.827   5.1413   31.036   5.9969   22.701   9.9875  199.214   19.935  165.109   39.952 34.10516 44.64950 
1 1 1   11   26   24 o  545.514   8.4794  228.278   7.0801  242.371   10.119  214.759   9.9103  561.495   11.773  528.446   12.252 33.04871 16.99208 
1 1 1   11   26   25 o  263.035   12.350   53.228   4.9723   55.981   6.8697   50.198   7.2063  268.651   16.790  253.929   18.672 14.72209 25.11093 
1 1 1   11   26   26 o  330.554   10.625   83.967   5.3755   82.871   7.3769   85.208   7.8495  327.775   14.704  332.232   15.436 -4.457031 21.31810 
1 1 1   11   26   27 o  244.591   13.394   46.239   4.9954   45.249   7.0107   47.260   7.1196  240.709   19.188  246.064   19.052 -5.354462 27.03950 
1 1 1   11   26   28 o  128.746   24.587   13.408   4.6684   13.010   6.5761   13.812   6.6285  125.289   33.600  129.005   33.331 -3.716049 47.32807 
1 1 1   11   26   29 o  703.690   18.426  384.652   19.846  384.652   19.846   0.0000   0.0000  703.690   18.426  ?   ?  0.000000 18.42564 
1 1 1   11   26   30 o  260.852   17.031   53.004   6.7628   53.799   7.7564   50.484   13.810  262.111   19.472  246.376   37.831 15.73553 42.54803 
1 1 1   11   26   31 o  106.158   33.714   9.0726   6.1561   11.788   6.9809  -0.4258   13.056  119.197   35.564  101.123   44.267 18.07380 56.78337 
1 1 1   11   26   32 o  685.341   17.368  365.264   18.219  365.264   18.219   0.0000   0.0000  685.341   17.368  ?   ?  0.000000 17.36836 
1 1 1   11   26   33 o   77.325   30.921   2.7307   5.5396   14.428   9.5813  -3.1427   6.7893  130.982   42.109   67.470   30.556 63.51225 52.02769 
1 1 1   11   26   34 o  333.840   8.7144   85.672   4.4530   86.943   5.1915   82.134   8.6617  336.054   10.093  324.256   17.517 11.79861 20.21661 
1 1 1   11   26   35 f  190.902   12.600   28.284   3.6611   30.942   3.9676   13.044   9.4991  199.610   13.058  125.272   42.018 74.33777 44.00036 
1 1 1   11   26   36 o   96.410   21.086   7.5864   3.0250   6.1729   3.3073   14.822   7.4829   86.840   24.055  131.472   36.089 -44.63207 43.37097 
1 1 1   11   26   37 o  195.461   12.484   29.666   3.7154   32.870   4.1961   18.040   7.9940  205.561   13.410  144.516   36.213 61.04428 38.61578 
1 1 1   11   26   38 o  288.981   10.464   64.415   4.6287   66.169   5.3441   59.146   9.2606  292.547   11.935  272.301   22.418 20.24567 25.39685 
1 1 1   11   26   39 o  334.751   8.9880   86.287   4.6053   80.901   5.9553   94.299   7.2634  323.354   12.033  348.570   13.614 -25.21695 18.16911 
1 1 1   11   26   40 o  108.515   18.698   9.5042   2.9935   10.481   4.0387   8.3128   4.4595  112.465   24.181   99.605   28.055 12.85928 37.03718 
1 1 1   11   26   41 o  105.870   27.919   9.4681   4.5889   19.347   9.3437   6.3278   5.2680  146.544   40.368   90.171   31.266 56.37319 51.06046 
1 1 1   11   26   42 o  220.740   17.426   38.527   5.8398   0.0000   0.0000   38.527   5.8398  ?   ?   220.740   17.426 0.000000 17.42590 
1 1 1   11   26   43 o   84.312   24.294   5.8998   3.3065   9.2707   4.9089   3.1005   4.4735  104.137   29.471   72.503   28.150 31.63459 40.75489 
1 1 1   11   26   44 o   85.409   24.523   6.0954   3.3743   9.6709   4.9596   3.0140   4.6042  105.904   29.501   72.479   28.441 33.42568 40.97797 
1 1 1   11   26   45 o  196.899   13.688   30.441   4.0996   29.076   5.6084   32.008   6.0076  189.935   19.572  199.160   19.977 -9.224747 27.96649 
1 1 1   11   26   46 o  122.175   19.664   12.226   3.5525   11.215   4.9016   13.345   5.1560  113.449   28.316  124.146   27.823 -10.69687 39.69787 
1 1 1   11   26   47 o  122.222   20.566   12.346   3.7107   14.994   5.3565   9.9026   5.1454  131.562   27.486  105.735   30.259 25.82700 40.87916 
1 1 1   11   26   48 o  239.237   18.467   46.207   6.7100   46.207   6.7100   0.0000   0.0000  239.237   18.467  ?   ?  0.000000 18.46710 
1 1 1   11   26   49 o  126.248   20.927   13.340   3.9023   12.008   5.5211   14.670   5.5163  114.517   30.819  127.996   28.847 -13.47919 42.21363 
1 1 1   11   26   50 o   49.304   22.563  -1.8483   3.8259  -3.2503   5.9722  -0.8724   4.9825   59.200   27.483   59.323   26.579 -0.1229439 38.23278 
1 1 1   11   26   51 o  132.402   24.743   15.365   4.8299   16.343   6.2260   13.887   7.6543  131.798   31.324  116.684   37.650 15.11415 48.97681 
1 1 1   11   27    0 o  1239.73   18.246  1180.21   34.606  1180.21   34.606  1180.21   34.606  1239.73   18.246  1239.73   18.246 0.000000 0.000000 
1 1 1   11   27    1 o  208.551   15.736   33.610   4.9863   31.284   7.0464   35.943   7.0570  199.943   23.471  214.801   21.765 -14.85764 32.00913 
1 1 1   11   27    2 o  604.509   9.9327  280.127   9.1905  278.207   12.817  282.159   13.185  601.961   13.911  606.180   14.211 -4.219055 19.88613 
1 1 1   11   27    3 o  398.480   10.573  121.748   6.4489  113.221   8.9596  130.915   9.2897  383.886   15.248  412.850   14.701 -28.96402 21.18056 
1 1 1   11   27    4 o  494.551   10.218  187.512   7.7345  182.585   10.640  193.032   11.263  487.604   14.257  501.308   14.678 -13.70398 20.46218 
1 1 1   11   27    5 o  167.065   18.131   21.729   4.5619   17.430   6.1392   27.030   6.8169  147.531   28.215  185.396   24.632 -37.86513 37.45444 
1 1 1   11   27    6 o  875.103   11.288  587.389   15.120  574.201   21.715  599.800   21.067  864.152   16.417  883.411   15.580 -19.25928 22.63308 
1 1 1   11   27    7 f  412.848   11.700  130.762   7.3936  131.480   10.958  130.162   10.018  413.379   17.318  411.474   15.906 1.904816 23.51408 
1 1 1   11   27    8 o  957.003   11.730  702.685   17.183  696.646   24.630  708.410   23.982  951.592   16.910  959.764   16.325 -8.171448 23.50459 
1 1 1   11   27    9 o  674.143   10.851  348.582   11.197  348.982   16.354  348.229   15.362  673.683   15.860  673.141   14.910 0.5428467 21.76767 
1 1 1   11   27   10 o  555.997   8.8791  236.945   7.5563  237.810   9.2366  235.196   13.139  556.802   10.838  553.073   15.521 3.729370 18.93040 
1 1 1   11   27   11 o  396.098   9.6337  120.296   5.8407  123.488   7.2407  114.351   9.8823  401.133   11.793  385.462   16.750 15.67035 20.48479 
1 1 1   11   27   12 o  329.741   10.623   83.407   5.3615   85.870   6.6594   78.869   9.0392  334.379   13.011  319.349   18.573 15.02945 22.67678 
1 1 1   11   27   13 o  339.854   10.685   88.612   5.5585   82.486   6.6529  102.774   10.115  327.678   13.265  365.168   18.097 -37.49054 22.43807 
1 1 1   11   27   14 o  355.679   10.573   97.061   5.7562   96.214   6.9482   98.916   10.278  353.914   12.826  357.602   18.843 -3.688812 22.79450 
1 1 1   11   27   15 f  197.095   15.956   30.099   4.7722   26.149   5.7035   39.322   8.7145  182.786   20.754  223.486   25.959 -40.69919 33.23539 
1 1 1   11   27   16 o  459.175   9.5353  161.719   6.7017  162.445   8.1352  160.185   11.822  459.966   11.555  455.904   16.941 4.062042 20.50640 
1 1 1   11   27   17 o  573.309   11.227  252.353   9.8521  252.353   9.8521   0.0000   0.0000  573.309   11.227  ?   ?  0.000000 11.22712 
1 1 1   11   27   18 o  205.039   18.568   32.727   5.7641   32.727   5.7641   0.0000   0.0000  205.039   18.568  ?   ?  0.000000 18.56775 
1 1 1   11   27   19 o  538.680   9.5459  222.639   7.8707  221.946   9.4725  224.184   14.145  537.532   11.513  539.031   17.145 -1.499451 20.65170 
1 1 1   11   27   20 o  287.130   15.063   63.685   6.5968   62.709   8.7260   64.987   10.078  283.866   20.215  288.296   23.031 -4.430511 30.64423 
1 1 1   11   27   21 o  356.820   10.924   97.798   5.9661   96.657   9.6517   98.503   7.5899  353.204   17.911  357.706   13.862 -4.502441 22.64919 
1 1 1   11   27   22 f  154.679   18.637   18.774   4.3236   11.994   5.8875   26.711   6.3700  121.032   31.482  183.860   23.148 -62.82796 39.07641 
1 1 1   11   27   23 o  407.416   9.1943  127.400   5.7336  137.052   8.0686  117.555   8.1491  422.053   12.490  390.684   13.627 31.36893 18.48530 
1 1 1   11   27   24 o  337.078   10.463   87.300   5.3982   85.326   7.3919   89.555   7.9020  332.640   14.518  340.669   15.154 -8.029053 20.98646 
1 1 1   11   27   25 o  379.605   9.9641  110.701   5.7895  112.701   8.1876  108.701   8.1875  382.316   13.991  375.417   14.248 6.898743 19.96948 
1 1 1   11   27   26 o   75.404   28.180   3.4870   4.3761   12.082   6.2396  -4.8340   6.1392  120.974   32.850   60.398   27.977 60.57532 43.14909 
1 1 1   11   27   27 o  409.305   11.915  128.999   7.4647  138.068   13.941  125.354   8.8385  419.941   21.763  402.932   14.331 17.00879 26.05796 
1 1 1   11   27   28 o   88.463   32.176   5.3274   5.6396   20.150   10.054  -1.4778   6.8123  153.553   41.700   71.829   31.692 81.72440 52.37629 
1 1 1   11   27   29 o  243.002   13.949   45.768   5.1667   50.094   7.2854   41.391   7.3283  252.954   18.954  229.159   21.131 23.79500 28.38635 
1 1 1   11   27   30 o  361.908   12.502  101.052   6.9257  104.374   11.419   99.119   8.7107  364.785   20.535  357.537   15.917 7.248260 25.98151 
1 1 1   11   27   31 o  263.507   21.397   54.789   8.5556   59.651   10.835   46.738   13.943  273.009   26.253  234.527   40.294 38.48251 48.09188 
1 1 1   11   27   32 o  282.620   16.689   62.296   7.1874   69.567   8.2789   40.046   14.482  298.185   18.227  213.339   45.725 84.84633 49.22361 
1 1 1   11   27   33 o   69.291   29.020   1.0364   5.1701  -1.9190   7.2475   4.0988   7.3774   72.619   32.330   89.724   35.748 -17.10468 48.19924 
1 1 1   11   27   34 o  234.210   17.847   43.046   6.3496   37.863   8.2629   50.521   9.9228  216.823   25.378  250.405   26.281 -33.58179 36.53394 
1 1 1   11   27   35 o   66.564   23.346   3.1590   2.9412   1.4126   3.2034   12.539   7.4241   58.510   23.472  121.552   36.769 -63.04239 43.62202 
1 1 1   11   27   36 o  267.292   11.701   55.193   4.7872   55.193   4.7872   0.0000   0.0000  267.292   11.701  ?   ?  0.000000 11.70110 
1 1 1   11   27   37 o  151.062   15.143   17.922   3.4542   16.829   3.8167   22.873   8.1208  145.717   17.460  163.888   33.504 -18.17096 37.78019 
1 1 1   11   27   38 o  290.286   10.165   64.999   4.5167   67.228   5.2444   58.598   8.8877  294.867   11.620  271.151   21.594 23.71667 24.52138 
1 1 1   11   27   39 o  329.347   8.5534   83.501   4.3118   78.959   5.8920   88.738   6.3269  319.346   12.054  338.493   12.212 -19.14728 17.15874 
1 1 1   11   27   40 o   90.094   28.632   6.6255   4.4395  -5.9569   9.5189   10.123   5.0188   74.900   34.745  109.166   29.386 -34.26657 45.50498 
1 1 1   11   27   41 o  302.875   22.910   73.888   10.543   0.0000   0.0000   73.888   10.543  ?   ?   302.875   22.910 0.000000 22.91049 
1 1 1   11   27   42 o  129.703   17.783   13.490   3.4375   4.9512   4.8461   22.137   4.8769   82.194   29.837  166.011   19.569 -83.81747 35.68133 
1 1 1   11   27   43 o  144.268   16.219   16.555   3.5194   13.160   4.7184   20.812   5.2837  124.996   25.525  159.527   22.244 -34.53103 33.85747 
1 1 1   11   27   44 o  187.837   15.656   27.934   4.4603   24.422   5.2102   37.568   8.6294  173.743   19.954  211.440   27.302 -37.69705 33.81646 
1 1 1   11   27   45 o   63.250   24.227   2.4722   3.2808  -0.1642   4.7120   4.9526   4.5706   61.082   26.670   80.482   29.013 -19.40018 39.40851 
1 1 1   11   27   46 o  437.712   11.203  149.061   7.5055  112.700   12.679  168.676   9.3125  371.057   22.429  464.228   13.106 -93.17081 25.97766 
1 1 1   11   27   47 o  252.836   16.936   51.159   6.5162   51.159   6.5162   0.0000   0.0000  252.836   16.936  ?   ?  0.000000 16.93569 
1 1 1   11   27   48 o  151.816   17.594   18.734   4.0126   17.515   5.8844   19.793   5.4859  140.579   28.326  152.273   24.358 -11.69305 37.35905 
1 1 1   11   27   49 o   49.157   22.319  -1.4660   3.6504   2.7902   5.4300  -4.9758   4.9310   72.742   30.040   49.719   23.657 23.02288 38.23722 
1 1 1   11   27   50 o  232.109   14.915   43.179   5.2709   64.178   7.3066   20.392   7.6112  281.255   17.053  144.765   34.783 136.4901 38.73829 
1 1 1   11   28    0 o   98.808   42.234   10.757   6.5172   10.757   6.5172   10.757   6.5172   98.808   42.234   98.808   42.234 0.000000 0.000000 
1 1 1   11   28    1 o  427.029   10.350  139.848   6.7651  146.821   9.7453  133.362   9.3987  437.102   14.566  416.566   14.741 20.53586 20.72331 
1 1 1   11   28    2 o  623.628   10.040  298.225   9.5838  293.642   13.318  303.147   13.802  618.234   14.074  628.112   14.356 -9.877991 20.10414 
1 1 1   11   28    3 o  819.821   10.618  515.511   13.324  526.108   19.024  505.308   18.667  827.289   15.024  810.766   15.042 16.52258 21.25974 
1 1 1   11   28    4 o  819.648   10.706  515.325   13.431  507.849   18.704  523.284   19.300  812.784   15.035  824.981   15.284 -12.19727 21.43927 
1 1 1   11   28    5 o  686.339   8.7261  361.063   9.1671  362.285   11.435  358.864   15.337  687.210   10.871  683.293   14.664 3.917297 18.25393 
1 1 1   11   28    6 o  390.333   9.3617  116.813   5.5932  113.413   6.8728  123.480   9.6247  384.420   11.680  400.670   15.694 -16.24991 19.56361 
1 1 1   11   28    7 o  424.468   11.869  138.295   7.7115  138.445   11.247  138.162   10.593  423.994   17.331  423.709   16.334 0.2849426 23.81516 
1 1 1   11   28    8 o  236.870   15.931   43.364   5.7425   44.140   8.4887   42.710   7.7975  237.609   23.655  234.021   22.028 3.587494 32.32310 
1 1 1   11   28    9 o  706.977   8.8758  383.178   9.6047  388.378   11.960  373.734   16.118  711.433   10.983  697.072   15.106 14.36011 18.67698 
1 1 1   11   28   10 o  466.676   9.2494  166.996   6.6069  170.411   8.1742  160.562   11.221  471.196   11.334  456.714   16.051 14.48212 19.64909 
1 1 1   11   28   11 o  461.833   9.2935  163.561   6.5696  163.026   8.0738  164.609   11.301  460.840   11.446  462.409   15.967 -1.569397 19.64617 
1 1 1   11   28   12 o  194.822   15.825   29.412   4.6783   31.092   5.7925   26.258   7.9339  199.788   19.178  181.128   29.643 18.66025 35.30580 
1 1 1   11   28   13 o  360.951   10.581   99.985   5.8458  100.148   7.1896   99.669   10.042  360.989   13.012  358.931   18.340 2.057678 22.48706 
1 1 1   11   28   14 o  510.264   9.4690  199.721   7.3955  203.278   9.1533  193.032   12.551  514.491   11.623  500.508   16.383 13.98257 20.08735 
1 1 1   11   28   15 o  353.332   12.991   95.971   7.0260   95.971   7.0260   0.0000   0.0000  353.332   12.991  ?   ?  0.000000 12.99129 
1 1 1   11   28   16 o  596.750   11.246  273.485   10.273  273.485   10.273   0.0000   0.0000  596.750   11.246  ?   ?  0.000000 11.24648 
1 1 1   11   28   17 o  149.443   20.974   17.632   4.6654   18.404   5.5716   15.821   8.5347  151.867   24.827  138.707   38.721 13.16017 45.99652 
1 1 1   11   28   18 o  235.954   14.262   43.021   5.1266   43.007   6.0659   43.058   9.5906  235.450   16.945  233.099   27.403 2.351440 32.21922 
1 1 1   11   28   19 o  137.578   22.651   15.087   4.6039   12.754   5.3906   21.374   8.8509  125.082   28.757  160.742   36.771 -35.65999 46.68090 
1 1 1   11   28   20 o  267.691   13.014   55.147   5.3322   52.684   6.3085   61.307   9.9783  260.824   15.877  279.561   23.538 -18.73694 28.39252 
1 1 1   11   28   21 o  258.632   11.736   51.435   4.6459   46.183   6.4343   57.157   6.7151  243.791   17.356  271.581   16.228 -27.78952 23.76150 
1 1 1   11   28   22 o  143.874   22.261   16.482   4.7439   22.503   7.6903   12.784   6.0274  166.051   31.408  124.652   31.560 41.39857 44.52504 
1 1 1   11   28   23 o  252.306   14.262   49.251   5.4851   50.107   8.7848   48.703   7.0221  252.355   22.996  249.980   18.483 2.374832 29.50309 
1 1 1   11   28   24 o  446.741   9.2725  153.271   6.3405  146.116   8.7047  161.359   9.2541  435.445   13.060  457.558   13.214 -22.11298 18.57868 
1 1 1   11   28   25 o  299.596   11.734   69.097   5.3809   79.488   7.7729   59.535   7.4563  320.564   15.842  276.522   17.710 44.04166 23.76114 
1 1 1   11   28   26 o  340.747   12.920   89.531   6.7386   82.794   11.890   92.720   8.1791  323.829   24.161  346.207   15.435 -22.37790 28.67048 
1 1 1   11   28   27 o   70.007   28.825   1.4534   4.9807   4.0752   8.1295  -0.1222   6.3020   93.236   37.397   72.476   31.247 20.75964 48.73257 
1 1 1   11   28   28 o  232.306   16.658   42.087   5.8838   47.566   9.4338   38.600   7.5272  244.064   25.636  220.676   22.604 23.38786 34.17808 
1 1 1   11   28   29 o  193.370   17.138   29.278   5.0199   29.617   7.0750   28.934   7.1238  192.254   24.607  189.809   25.139 2.445160 35.17789 
1 1 1   11   28   30 o  274.282   13.429   58.147   5.6379   44.761   7.7513   73.183   8.2153  237.930   21.517  306.150   17.606 -68.21964 27.80168 
1 1 1   11   28   31 o  286.319   13.258   63.374   5.8104   66.560   8.3066   60.322   8.1306  291.417   18.722  277.170   19.285 14.24649 26.87769 
1 1 1   11   28   32 o  182.287   19.815   26.316   5.4396   27.454   7.6379   25.145   7.7489  183.260   28.128  174.451   30.108 8.809311 41.20284 
1 1 1   11   28   33 o  119.433   36.830   12.002   7.4023   12.002   7.4023   0.0000   0.0000  119.433   36.830  ?   ?  0.000000 36.82969 
1 1 1   11   28   34 o  223.297   21.429   39.645   7.2343   38.221   8.2183   44.545   15.247  217.713   25.123  223.102   46.170 -5.388947 52.56287 
1 1 1   11   28   35 o  172.849   22.743   24.042   5.8709   22.111   8.1062   26.173   8.5141  161.117   33.942  176.199   32.776 -15.08205 47.18391 
1 1 1   11   28   36 o  128.157   17.416   13.066   3.3279   13.216   3.6618   12.357   7.9771  128.387   19.225  120.398   38.393 7.988754 42.93744 
1 1 1   11   28   37 o  362.676   13.021  101.975   7.2283   97.224   9.9797  107.218   10.484  351.322   18.625  368.983   18.622 -17.66028 26.33784 
1 1 1   11   28   38 o  158.229   32.469   21.392   7.6001   22.750   8.7559   17.242   15.305  161.378   36.324  140.415   52.658 20.96341 63.97075 
1 1 1   11   28   39 o  273.957   21.201   59.946   8.8210   53.013   10.272   79.415   17.213  254.398   26.783  302.593   38.003 -48.19516 46.49263 
1 1 1   11   28   40 o  138.877   16.325   15.309   3.4040   19.969   4.9222   11.038   4.7125  157.197   20.981  114.163   27.331 43.03480 34.45581 
1 1 1   11   28   41 o  237.429   15.142   44.274   5.4743   0.0000   0.0000   44.274   5.4743  ?   ?   237.429   15.142 0.000000 15.14225 
1 1 1   11   28   42 o  205.161   12.020   32.811   3.7581   31.080   5.2760   34.594   5.3543  197.595   17.630  208.862   16.893 -11.26694 24.41677 
1 1 1   11   28   43 o  275.605   9.8856   58.786   4.1702   56.469   6.0009   60.950   5.7995  267.955   14.687  279.264   13.568 -11.30945 19.99500 
1 1 1   11   28   44 o  169.291   14.451   22.648   3.7086   24.670   5.4272   20.878   5.0796  173.925   20.799  159.581   21.330 14.34352 29.79198 
1 1 1   11   28   45 o  152.928   16.834   18.764   3.8751   22.147   5.8372   16.099   5.1816  162.586   24.193  137.509   25.559 25.07649 35.19353 
1 1 1   11   28   46 o   56.073   24.071   0.3441   3.7096  -0.6277   5.2450   1.3167   5.2474   62.294   27.630   68.094   28.914 -5.799854 39.99290 
1 1 1   11   28   47 o  103.723   23.762   9.2901   3.6915   8.3680   5.3014   10.158   5.1433   96.535   31.351  105.731   30.251 -9.196014 43.56653 
1 1 1   11   28   48 o   61.672   25.218   1.8062   3.7794  -1.2677   5.5435   4.4760   5.1662   61.435   27.736   78.177   30.280 -16.74206 41.06295 
1 1 1   11   28   49 o   71.811   27.658   3.7165   4.2914   1.2170   5.2485   8.7580   7.4540   66.417   28.575   97.440   36.707 -31.02217 46.51865 
1 1 1   11   29    0 o  716.044   14.867  393.875   16.279  393.875   16.279  393.875   16.279  716.044   14.867  716.044   14.867 0.000000 0.000000 
1 1 1   11   29    1 o  362.202   11.550  100.704   6.4033   92.092   9.0192  109.457   9.0927  345.758   17.042  377.128   15.752 -31.36926 23.20683 
1 1 1   11   29    2 o  769.253   10.576  454.023   12.453  446.768   17.454  461.544   17.772  762.117   14.962  774.610   14.989 -12.49341 21.17890 
1 1 1   11   29    3 o   69.957   27.916   1.9712   4.5053   1.6235   6.4760   2.2974   6.2719   79.594   32.832   80.742   32.684 -1.147591 46.32697 
1 1 1   11   29    4 o  405.482   11.223  126.195   6.9652  119.527   9.5887  133.645   10.135  394.050   15.898  416.672   15.891 -22.62241 22.47794 
1 1 1   11   29    5 o  238.779   12.963   43.934   4.7199   42.333   5.7839   47.124   8.1663  233.916   16.255  245.820   21.934 -11.90424 27.30093 
1 1 1   11   29    6 o  477.753   9.1019  175.025   6.6559  172.937   8.2863  178.820   11.174  474.631   11.406  482.071   15.143 -7.440186 18.95836 
1 1 1   11   29    7 o  557.365   11.119  238.458   9.4863  235.196   14.144  241.125   12.789  552.505   16.725  559.808   14.926 -7.302612 22.41662 
1 1 1   11   29    8 o  398.613   12.407  122.061   7.5697  117.927   11.189  125.551   10.279  390.870   18.702  403.665   16.637 -12.79428 25.03070 
1 1 1   11   29    9 o  334.011   10.665   85.624   5.4523   84.746   6.7164   87.321   9.3372  332.042   13.215  335.906   18.229 -3.864197 22.51507 
1 1 1   11   29   10 o  277.761   12.017   59.264   5.1090   61.367   6.3878   55.528   8.5111  281.990   14.852  267.061   20.990 14.92825 25.71331 
1 1 1   11   29   11 o  766.402   9.2028  450.526   10.796  449.208   13.298  453.074   18.488  764.835   11.359  766.922   15.750 -2.087524 19.41871 
1 1 1   11   29   12 o  373.768   10.445  107.232   5.9756  110.263   7.3386  101.269   10.294  378.752   12.659  361.591   18.663 17.16071 22.55142 
1 1 1   11   29   13 o   76.577   30.125   2.7443   5.1777   2.7443   5.1777   0.0000   0.0000   76.577   30.125  ?   ?  0.000000 30.12500 
1 1 1   11   29   14 o  644.493   11.207  319.045   11.055  319.045   11.055   0.0000   0.0000  644.493   11.207  ?   ?  0.000000 11.20657 
1 1 1   11   29   15 o  347.082   10.921   92.524   5.8016   90.769   6.9739   96.469   10.455  343.483   13.265  352.524   19.451 -9.040985 23.54337 
1 1 1   11   29   16 o  285.409   12.266   62.634   5.3583   62.208   6.4176   63.613   9.7363  283.754   14.828  285.224   22.484 -1.469452 26.93303 
1 1 1   11   29   17 o  438.692   9.9232  147.755   6.6632  142.912   8.0156  158.585   11.987  431.101   12.148  453.022   17.287 -21.92090 21.12831 
1 1 1   11   29   18 o  461.819   10.009  163.776   7.0753  162.701   8.5485  166.115   12.607  459.935   12.143  463.426   17.773 -3.491028 21.52481 
1 1 1   11   29   19 o  244.048   14.372   46.069   5.3448   44.847   6.3040   49.194   10.080  240.214   17.260  249.056   26.867 -8.841461 31.93392 
1 1 1   11   29   20 o  479.560   10.108  176.669   7.4194  175.978   8.8132  178.350   13.747  478.245   12.040  479.649   18.725 -1.404022 22.26133 
1 1 1   11   29   21 o  207.429   17.478   33.546   5.4974   33.110   6.5076   34.635   10.273  205.231   21.012  205.898   33.767 -0.6664429 39.77094 
1 1 1   11   29   22 o  515.794   8.8183  204.251   6.9620  202.934   9.6997  205.651   9.9985  513.351   12.345  516.698   12.642 -3.346985 17.66970 
1 1 1   11   29   23 o  240.820   15.516   45.020   5.6887   45.242   8.9755   44.872   7.3545  238.795   24.924  239.236   20.275 -0.4411469 32.12890 
1 1 1   11   29   24 f   88.714   34.037   4.5943   6.4823   0.0000   0.0000   4.5943   6.4823  ?   ?    88.714   34.037 0.000000 34.03665 
1 1 1   11   29   25 o   76.249   32.317   0.7564   6.5361   0.0000   0.0000   0.7564   6.5361  ?   ?    76.249   32.317 0.000000 32.31688 
1 1 1   11   29   26 o  103.797   30.411   8.8125   5.1425   12.536   8.2900   6.4832   6.5565  123.331   39.118   95.940   34.723 27.39109 52.30657 
1 1 1   11   29   27 o  302.462   11.820   70.523   5.4720   74.057   7.7083   66.934   7.7693  308.505   16.383  292.937   17.406 15.56790 23.90300 
1 1 1   11   29   28 o  175.003   18.539   24.124   4.8902   22.645   6.8076   25.702   7.0295  166.660   27.656  178.163   26.591 -11.50287 38.36606 
1 1 1   11   29   29 o  214.807   15.935   36.005   5.2020   36.197   7.2839   35.805   7.4317  213.327   22.654  211.932   23.294 1.394669 32.49335 
1 1 1   11   29   30 o   82.497   30.298   4.5902   5.0179   2.4334   6.8904   7.0258   7.3221   82.484   33.927   99.663   36.599 -17.17809 49.90515 
1 1 1   11   29   31 o  252.046   16.116   49.584   6.1849   54.449   8.1061   42.804   9.5683  262.702   20.317  229.696   27.780 33.00540 34.41674 
1 1 1   11   29   32 o  181.966   21.168   26.387   5.7855   28.132   7.5803   23.952   8.9540  185.553   27.524  167.368   36.019 18.18478 45.33186 
1 1 1   11   29   33 o  359.439   12.183   99.862   6.7028   89.711   9.2324  111.175   9.7468  338.315   17.892  377.548   16.866 -39.23392 24.58886 
1 1 1   11   29   34 o  354.340   15.530   97.727   8.4229   99.219   9.7737   93.419   16.604  355.585   18.016  335.685   32.733 19.90015 37.36353 
1 1 1   11   29   35 o  158.525   32.019   21.292   7.5018   15.295   8.5936   40.498   15.378  132.194   39.463  208.976   48.938 -76.78201 62.86662 
1 1 1   11   29   36 o   71.026   31.786  -1.9840   7.1041  -6.3019   8.3153   9.6845   13.669   68.873   32.125  120.542   48.442 -51.66906 58.12565 
1 1 1   11   29   37 o  197.009   26.545   31.859   7.8009   37.292   8.8803   13.496   16.325  212.624   27.965  132.791   53.088 79.83333 60.00345 
1 1 1   11   29   38 o  180.889   14.619   25.660   4.0129   23.921   4.4335   33.544   9.4401  173.917   16.867  198.839   32.112 -24.92206 36.27172 
1 1 1   11   29   39 o  244.471   12.808   46.552   4.7759   50.423   5.5118   34.888   9.5667  253.946   14.238  202.451   31.931 51.49548 34.96141 
1 1 1   11   29   40 o  238.022   12.780   44.180   4.6390   44.134   5.3739   44.314   9.1898  237.118   14.882  231.592   26.396 5.526184 30.30242 
1 1 1   11   29   41 o  203.301   11.889   32.213   3.6833   29.899   5.0786   34.781   5.3501  193.887   17.295  209.422   16.833 -15.53503 24.13373 
1 1 1   11   29   42 f  117.429   19.780   11.291   3.4290   9.1974   4.9003   13.299   4.7999  102.927   29.552  125.100   25.919 -22.17320 39.30788 
1 1 1   11   29   43 o  236.025   13.967   43.804   5.0235   48.559   6.1326   34.106   8.7583  247.379   16.287  199.091   29.645 48.28773 33.82463 
1 1 1   11   29   44 o  133.350   18.391   14.447   3.6538   13.795   5.3864   15.003   4.9729  125.473   28.673  132.684   25.412 -7.211311 38.31318 
1 1 1   11   29   45 o  103.442   24.324   9.2112   3.7865   2.1224   5.1670   17.435   5.5651   70.372   29.202  142.030   26.576 -71.65777 39.48470 
1 1 1   11   29   46 o  134.908   23.202   15.467   4.6184  -2.2158   9.9198   20.361   5.2185   78.652   36.118  155.543   22.579 -76.89131 42.59483 
1 1 1   11   29   47 o   52.883   22.955   0.0917   3.4480  -2.2955   4.8617   2.5078   4.8910   55.039   25.278   69.615   28.603 -14.57615 38.17204 
1 1 1   11   29   48 o  267.357   22.083   60.138   8.9562   0.0000   0.0000   60.138   8.9562  ?   ?   267.357   22.083 0.000000 22.08337 
1 1 1   11   30    0 o  287.982   18.237   64.498   7.9648   64.498   7.9648   64.498   7.9648  287.982   18.237  287.982   18.237 0.000000 0.000000 
1 1 1   11   30    1 o  433.175   11.003  144.052   7.2956  143.809   10.486  144.280   10.157  432.087   15.855  432.884   15.329 -0.7972107 22.05387 
1 1 1   11   30    2 o  418.438   11.208  134.434   7.1787  138.445   10.357  130.727   9.9589  423.927   15.962  411.971   15.793 11.95688 22.45465 
1 1 1   11   30    3 o  318.633   12.653   78.024   6.1710   89.467   8.9795   67.782   8.4950  340.156   17.304  295.652   18.870 44.50381 25.60299 
1 1 1   11   30    4 o  142.534   23.467   16.169   4.9415   27.124   7.1532   6.1693   6.8342  184.919   25.990   96.965   35.397 87.95435 43.91358 
1 1 1   11   30    5 o  531.747   9.0047  216.862   7.3290  219.786   9.2562  211.949   11.999  534.989   11.304  524.702   14.941 10.28723 18.73483 
1 1 1   11   30    6 o  300.418   10.977   69.294   5.0474   72.590   6.2649   63.199   8.5204  307.244   13.322  285.233   19.636 22.01077 23.72818 
1 1 1   11   30    7 o  133.305   27.836   14.382   5.4963   10.569   8.0434   17.722   7.5280  117.189   38.645  147.041   34.109 -29.85120 51.54432 
1 1 1   11   30    8 o  238.306   17.052   44.033   6.1788   40.884   9.3605   46.465   8.2255  227.203   27.475  243.740   22.295 -16.53687 35.38231 
1 1 1   11   30    9 o  182.568   20.744   26.141   5.6937   25.468   8.7502   26.635   7.4983  176.926   33.539  182.646   27.690 -5.720108 43.49219 
1 1 1   11   30   10 o  382.763   12.781  112.658   7.4879  112.658   7.4879   0.0000   0.0000  382.763   12.781  ?   ?  0.000000 12.78090 
1 1 1   11   30   11 o  270.982   15.068   56.751   6.2249   56.751   6.2249   0.0000   0.0000  270.982   15.068  ?   ?  0.000000 15.06762 
1 1 1   11   30   12 o  468.809   11.606  168.900   8.3280  168.900   8.3280   0.0000   0.0000  468.809   11.606  ?   ?  0.000000 11.60574 
1 1 1   11   30   13 o  521.547   9.2869  208.744   7.4137  209.653   9.1084  206.961   12.761  522.321   11.393  517.900   16.098 4.421082 19.72182 
1 1 1   11   30   14 o  303.443   11.649   70.782   5.4106   68.918   6.5378   74.832   9.6387  299.089   14.281  309.936   20.432 -10.84695 24.92858 
1 1 1   11   30   15 o  402.676   10.255  124.536   6.3205  124.753   7.5902  124.045   11.415  402.711   12.314  400.250   18.633 2.460968 22.33402 
1 1 1   11   30   16 o  304.934   11.972   71.521   5.5877   64.909   6.5759   88.695   10.598  289.731   14.878  337.318   20.626 -47.58725 25.43258 
1 1 1   11   30   17 o  120.892   25.579   11.863   4.5855   11.740   5.4538   12.160   8.4701  119.628   29.875  123.277   39.588 -3.649033 49.59536 
1 1 1   11   30   18 o   57.194   25.649  -1.9649   4.6513  -3.1419   5.5773   0.7237   8.4293   60.542   27.527   85.886   36.561 -25.34361 45.76538 
1 1 1   11   30   19 o  514.225   10.051  203.183   7.9111  201.735   9.4867  206.490   14.334  511.927   12.107  516.065   18.147 -4.137512 21.81486 
1 1 1   11   30   20 o  421.173   10.794  136.413   6.9583  135.619   8.2614  138.350   12.908  419.522   12.866  421.694   19.998 -2.171570 23.77937 
1 1 1   11   30   21 o  447.676   10.971  154.183   7.5173  143.964   8.9024  179.573   14.033  432.018   13.463  480.608   19.076 -48.58984 23.34820 
1 1 1   11   30   22 o  212.907   32.853   37.110   10.362   0.0000   0.0000   37.110   10.362  ?   ?   212.907   32.853 0.000000 32.85290 
1 1 1   11   30   23 o  386.719   14.326  115.578   8.4798   0.0000   0.0000  115.578   8.4798  ?   ?   386.719   14.326 0.000000 14.32591 
1 1 1   11   30   24 o  160.998   19.905   20.516   4.8006   24.734   6.6757   15.999   6.9083  175.261   25.644  138.260   33.086 37.00102 41.86046 
1 1 1   11   30   25 o  271.759   14.243   57.265   5.9040   51.303   9.5783   60.918   7.4978  253.744   24.986  279.371   17.624 -25.62717 30.57634 
1 1 1   11   30   26 f  430.419   11.246  142.740   7.4090  140.797   12.162  143.887   9.3429  424.973   18.696  431.301   14.152 -6.327423 23.44881 
1 1 1   11   30   27 o  246.612   14.230   47.219   5.3485   45.085   7.5608   49.356   7.5671  238.996   20.878  250.473   19.902 -11.47675 28.84395 
1 1 1   11   30   28 o   55.567   25.317  -2.6932   4.7486   1.3372   6.7755  -6.5840   6.6572   78.710   33.106   59.844   28.178 18.86517 43.47404 
1 1 1   11   30   29 f  197.493   17.978   30.665   5.3751   30.179   7.4306   31.199   7.7849  193.269   25.760  196.220   26.606 -2.951065 37.03318 
1 1 1   11   30   30 o   72.941   30.194   1.6057   5.5043   1.8796   7.3400   1.2536   8.3203   82.672   34.597   85.306   36.320 -2.634262 50.16039 
1 1 1   11   30   31 o  315.586   12.960   77.060   6.2600   88.142   8.7889   65.649   8.9186  335.729   17.160  288.340   20.338 47.38959 26.61063 
1 1 1   11   30   32 o  127.498   28.892   13.619   5.5080   19.132   7.7006   7.8444   7.8816  149.540   34.364  103.411   37.972 46.12868 51.21325 
1 1 1   11   30   33 o  419.466   11.485  135.935   7.3738  127.640   10.266  144.777   10.599  404.411   16.584  430.962   16.067 -26.55078 23.09097 
1 1 1   11   30   34 o  121.715   35.610   12.747   7.0557   4.8632   7.9736   41.195   15.147   93.332   37.171  211.398   47.918 -118.0663 60.64529 
1 1 1   11   30   35 o  353.152   15.762   97.311   8.5200   97.477   9.9228   96.845   16.622  351.742   18.496  340.936   32.234 10.80652 37.16320 
1 1 1   11   30   36 o  139.970   34.765   17.071   7.4145   13.214   8.5331   28.959   14.980  123.198   39.753  172.605   52.232 -49.40726 65.63906 
1 1 1   11   30   37 o  135.920   19.950   14.907   4.0269   16.643   4.1790  -7.6573   15.064  143.919   19.471   93.223   43.401 50.69678 47.56803 
1 1 1   11   30   38 o  144.600   18.955   16.790   4.0943   18.431   4.6539   11.173   8.6117  150.962   20.685  114.604   39.962 36.35740 44.99835 
1 1 1   11   30   39 o   64.787   25.415   2.2777   3.6753   4.5518   4.1209  -6.5640   8.1257   77.890   27.605   66.637   31.299 11.25270 41.73287 
1 1 1   11   30   40 o   75.053   26.402   4.2663   3.7629   6.9047   4.2586  -5.1290   8.0364   90.604   27.934   68.316   31.770 22.28843 42.30426 
1 1 1   11   30   41 o  186.761   15.359   27.599   4.3518   25.819   5.0783   32.519   8.4431  179.149   18.800  195.155   29.160 -16.00607 34.69467 
1 1 1   11   30   42 o   58.141   23.538   1.4680   3.2531  -1.1295   4.7188   3.8207   4.4909   58.255   26.000   74.945   28.430 -16.69014 38.52647 
1 1 1   11   30   43 o   66.161   24.872   2.9478   3.4189   1.3475   5.0649   4.2873   4.6338   67.615   28.541   77.226   28.971 -9.610901 40.66860 
1 1 1   11   30   44 o  206.183   34.594   38.853   10.531   38.853   10.531   0.0000   0.0000  206.183   34.594  ?   ?  0.000000 34.59372 
1 1 1   11   30   45 f  119.650   24.909   12.419   4.4136  -7.2901   9.2385   18.248   5.0240   68.200   32.431  146.752   23.133 -78.55252 39.83542 
1 1 1   11   30   46 o   60.666   24.501   1.8959   3.5159   0.7476   5.1430   2.9034   4.8174   64.875   28.098   70.772   28.646 -5.896309 40.12577 
1 1 1   11   30   47 o  213.405   15.427   36.611   5.0053   37.758   6.0218   34.048   9.0026  214.509   18.522  191.956   31.750 22.55269 36.75807 
1 1 1   11   31    0 o  733.768   15.326  414.016   17.196  414.016   17.196  414.016   17.196  733.768   15.326  733.768   15.326 0.000000 0.000000 
1 1 1   11   31    1 o  461.927   11.164  163.900   7.8931  163.385   11.128  164.420   11.197  460.360   15.792  461.806   15.841 -1.445770 22.36833 
1 1 1   11   31    2 o  177.977   19.246   24.783   5.1594   29.656   7.2134   19.680   7.3825  193.576   24.925  155.335   32.111 38.24132 40.64933 
1 1 1   11   31    3 o  194.145   17.134   29.318   5.0393   28.997   6.9928   29.665   7.2685  191.500   24.412  193.547   25.128 -2.047363 35.03372 
1 1 1   11   31    4 o  226.527   15.373   39.728   5.2987   49.194   7.8617   31.849   7.1726  251.121   20.636  200.973   23.778 50.14796 31.48374 
1 1 1   11   31    5 o  396.953   9.7756  120.941   5.9395  112.626   7.3295  136.844   10.137  382.712   12.512  421.282   15.720 -38.57010 20.09179 
1 1 1   11   31    6 o  150.359   18.590   17.742   4.1873   23.896   5.2527   7.0135   6.9354  174.533   20.025  100.305   35.783 74.22718 41.00540 
1 1 1   11   31    7 o  531.150   17.091  217.878   13.895  217.878   13.895   0.0000   0.0000  531.150   17.091  ?   ?  0.000000 17.09108 
1 1 1   11   31    8 o  395.358   18.600  120.939   11.256  120.939   11.256   0.0000   0.0000  395.358   18.600  ?   ?  0.000000 18.60034 
1 1 1   11   31    9 o  458.081   17.876  162.256   12.534  162.256   12.534   0.0000   0.0000  458.081   17.876  ?   ?  0.000000 17.87583 
1 1 1   11   31   10 o  311.549   14.038   74.768   6.6942   70.088   10.000   78.568   9.0109  299.475   21.969  318.069   18.590 -18.59366 28.77901 
1 1 1   11   31   11 o  176.861   17.151   24.397   4.5845   22.942   5.5725   27.444   8.0644  170.440   21.865  184.560   29.544 -14.11975 36.75482 
1 1 1   11   31   12 o  608.551   9.3616  284.288   8.7200  278.258   10.584  297.030   15.385  601.597   11.494  620.155   16.208 -18.55737 19.87005 
1 1 1   11   31   13 o  280.328   12.655   60.487   5.4301   51.920   6.4807   80.676   9.9481  258.700   16.452  321.692   20.308 -62.99191 26.13564 
1 1 1   11   31   14 o  359.744   11.055   99.493   6.0870   96.661   7.4018  105.410   10.699  354.167   13.654  368.181   19.050 -14.01416 23.43797 
1 1 1   11   31   15 o   93.062   29.292   6.8016   4.6555   6.9215   5.5004   6.4987   8.7415   95.535   31.974  103.597   39.578 -8.062210 50.87959 
1 1 1   11   31   16 o  210.531   15.692   34.437   5.0203   27.786   5.8253   53.637   9.8974  187.902   20.592  260.366   25.148 -72.46396 32.50303 
1 1 1   11   31   17 o   88.607   29.702   5.9201   4.7467   3.8034   5.6014   11.313   8.9405   82.256   31.620  120.356   40.762 -38.09964 51.58866 
1 1 1   11   31   18 o  383.425   13.271  113.363   7.7885  104.186   10.182  126.303   12.091  366.382   18.157  402.934   19.605 -36.55255 26.72132 
1 1 1   11   31   19 o  337.989   14.264   88.224   7.3793   85.580   9.6836   91.885   11.396  331.152   19.187  342.201   21.871 -11.04871 29.09454 
1 1 1   11   31   20 o  447.450   13.614  154.548   9.3237  134.680   12.520  179.291   13.971  415.765   19.673  479.986   19.016 -64.22086 27.36142 
1 1 1   11   31   21 o  391.502   15.168  118.612   9.0895  110.963   12.877  126.209   12.832  375.564   22.504  401.323   20.963 -25.75974 30.75506 
1 1 1   11   31   22 o  514.749   10.669  203.939   8.4063  200.852   9.9800  211.478   15.597  510.211   12.779  520.701   19.569 -10.49042 23.37238 
1 1 1   11   31   23 o  236.640   13.839   43.423   4.9906   46.776   6.9559   39.866   7.1643  244.342   18.742  224.756   21.071 19.58545 28.20012 
1 1 1   11   31   24 o   97.603   28.637   7.7668   4.5572   9.4501   6.3161   5.9389   6.5819  107.938   34.136   93.714   34.651 14.22312 48.64114 
1 1 1   11   31   25 o  117.105   27.107   11.329   4.7628   9.5208   6.5731   13.327   6.9110  108.458   34.879  125.753   34.749 -17.29438 49.23470 
1 1 1   11   31   26 o  135.531   27.562   15.145   5.5229   21.807   9.1220   11.290   6.9393  159.444   37.929  116.477   35.616 42.96774 52.03037 
1 1 1   11   31   27 o  167.592   22.593   22.505   5.6480   16.028   9.0060   26.704   7.2511  136.489   40.317  181.210   26.964 -44.72092 48.50318 
1 1 1   11   31   28 o  137.173   27.691   15.560   5.6137   16.302   7.2585   14.456   8.8555  138.381   34.413  130.091   40.311 8.290558 53.00197 
1 1 1   11   31   29 o   72.602   30.027   1.6258   5.4369  -2.0695   6.9274   7.5528   8.7734   70.371   31.448  104.979   39.758 -34.60779 50.69226 
1 1 1   11   31   30 o  382.910   11.602  113.225   6.7997  114.072   9.4692  112.323   9.7705  382.729   16.164  379.512   16.820 3.216339 23.32771 
1 1 1   11   31   31 o  127.030   28.798   13.532   5.4703   9.3482   7.6488   17.912   7.8266  108.389   37.669  144.027   35.685 -35.63707 51.88864 
1 1 1   11   31   32 o  518.719   12.821  208.398   10.180  213.161   12.119  196.984   18.761  523.396   15.128  496.392   24.692 27.00385 28.95758 
1 1 1   11   31   33 o   87.571   34.911   4.1181   7.0399   0.8319   8.0114   15.256   14.749   82.154   35.324  135.746   51.516 -53.59271 62.46382 
1 1 1   11   31   34 o  260.010   16.143   53.004   6.3926   58.080   9.0339   47.912   9.0472  269.487   22.096  243.331   24.630 26.15540 33.08883 
1 1 1   11   31   35 o  229.191   18.246   41.571   6.3477   46.202   8.9676   36.921   8.9863  238.411   24.944  210.969   28.563 27.44145 37.92144 
1 1 1   11   31   36 o  150.575   27.634   19.006   6.1341   19.142   8.7651   18.876   8.5876  145.975   38.628  145.168   38.149 0.8069305 54.29108 
1 1 1   11   31   37 o  171.238   38.703   26.425   9.9055   32.686   15.313   21.920   12.989  180.205   52.386  150.410   49.085 29.79472 71.78861 
1 1 1   11   31   38 o   87.013   26.354   6.3094   3.8122   6.2648   3.9696   6.8385   13.676   86.895   26.999  110.989   46.877 -24.09399 54.09650 
1 1 1   11   31   39 o  246.686   12.582   47.512   4.7349   48.094   5.5984   46.051   8.8741  247.236   14.863  236.205   24.921 11.03073 29.01678 
1 1 1   11   31   40 o  110.510   25.145   10.391   4.1575   11.050   4.8416   8.5396   8.1128  112.911   28.120  102.665   38.369 10.24540 47.57074 
1 1 1   11   31   41 o  135.379   21.056   15.096   4.2213   14.404   4.9146   17.041   8.2428  130.096   25.592  134.735   38.209 -4.638809 45.98825 
1 1 1   11   31   42 o  196.861   14.884   30.724   4.4516   30.188   5.2359   32.121   8.4560  193.669   17.864  192.038   29.728 1.631943 34.68303 
1 1 1   11   31   43 o  167.527   15.387   22.421   3.9015   23.752   5.3398   20.897   5.7142  169.501   21.034  156.766   24.626 12.73495 32.38602 
1 1 1   11   31   44 o  185.234   14.066   27.267   3.9582   29.254   5.7881   25.521   5.4249  188.189   20.422  175.564   20.578 12.62506 28.99169 
1 1 1   11   31   45 o  141.447   29.736   18.187   6.2335   17.644   9.2262   18.643   8.4552  129.803   41.279  135.712   38.772 -5.908279 56.63241 
1 1 1   11   31   46 o  192.271   22.204   31.254   6.4144   28.215   9.4091   33.893   8.7676  168.745   37.410  192.478   30.798 -23.73264 48.45694 
1 1 1   11   32    0 o  120.699   43.541   15.077   7.3720   15.077   7.3720   15.077   7.3720  120.699   43.541  120.699   43.541 0.000000 0.000000 
1 1 1   11   32    1 o  714.996   11.028  392.837   12.069  426.439   17.910  364.887   16.335  743.385   15.741  687.726   15.518 55.65979 22.10349 
1 1 1   11   32    2 o  197.770   24.980   31.011   7.3931   31.011   7.3931   0.0000   0.0000  197.770   24.980  ?   ?  0.000000 24.97987 
1 1 1   11   32    3 o  459.132   16.005  162.726   11.247  162.726   11.247   0.0000   0.0000  459.132   16.005  ?   ?  0.000000 16.00466 
1 1 1   11   32    4 o  505.797   15.790  197.455   12.224  197.455   12.224   0.0000   0.0000  505.797   15.790  ?   ?  0.000000 15.79010 
1 1 1   11   32    5 o  514.203   11.585  203.288   9.1178  203.288   9.1178   0.0000   0.0000  514.203   11.585  ?   ?  0.000000 11.58475 
1 1 1   11   32    6 f  269.556   12.180   55.896   5.0254   56.732   6.3252   54.465   8.2755  270.736   15.327  264.044   20.640 6.691162 25.70835 
1 1 1   11   32    7 o  208.445   18.948   33.942   5.9794   24.461   8.9637   41.543   8.0261  172.206   35.195  229.719   23.142 -57.51236 42.12180 
1 1 1   11   32    8 o  469.601   12.107  169.665   8.7025  171.762   13.074  167.997   11.661  470.953   18.137  466.280   16.339 4.673309 24.41141 
1 1 1   11   32    9 o  292.621   15.824   66.324   7.0610   79.509   10.934   56.893   9.2478  318.588   22.569  269.219   22.653 49.36972 31.97669 
1 1 1   11   32   10 o  475.539   12.312  174.056   8.9615  176.091   13.425  172.420   12.035  476.641   18.402  472.187   16.652 4.454041 24.81782 
1 1 1   11   32   11 o   54.480   25.695  -5.9907   5.5791   4.6371   8.3658 -14.5033   7.4871   96.475   38.184   53.992   26.488 42.48311 46.47209 
1 1 1   11   32   12 o  208.560   16.396   33.844   5.1920   32.468   6.3246   36.686   9.0920  203.282   20.612  213.845   28.486 -10.56285 35.16087 
1 1 1   11   32   13 o  334.635   14.122   86.395   7.2334   87.208   9.7117   85.382   10.840  334.590   19.042  330.243   21.564 4.347443 28.76778 
1 1 1   11   32   14 o  511.270   11.827  201.226   9.2557  198.396   12.544  204.608   13.714  506.375   16.184  513.792   17.438 -7.416473 23.79060 
1 1 1   11   32   15 o  184.937   21.510   27.036   5.9752   28.159   7.9655   25.590   9.0356  186.546   28.826  175.593   34.848 10.95293 45.22582 
1 1 1   11   32   16 o  308.523   14.623   73.547   6.9056   70.446   9.1849   77.580   10.473  300.043   20.116  314.303   21.907 -14.26056 29.74201 
1 1 1   11   32   17 o  307.343   12.776   72.839   6.0104   72.974   7.2238   72.535   10.835  306.725   15.436  303.148   23.535 3.576355 28.14525 
1 1 1   11   32   18 o  232.575   20.727   42.560   7.3011   40.300   10.046   45.091   10.630  222.894   30.224  236.009   30.112 -13.11450 42.66392 
1 1 1   11   32   19 o  206.090   23.726   33.804   7.3476   43.105   10.400   24.536   10.382  230.519   30.202  169.231   40.601 61.28864 50.60228 
1 1 1   11   32   20 o  371.499   12.196  106.416   6.9348  105.609   8.2696  108.327   12.730  369.486   14.622  370.870   22.532 -1.383545 26.86103 
1 1 1   11   32   21 o  131.324   27.911   14.205   5.4374   13.367   6.2541   16.800   11.005  126.431   32.223  140.730   45.116 -14.29920 55.44217 
1 1 1   11   32   22 o  238.405   16.956   44.379   6.1471   48.997   7.2503   32.574   11.593  249.910   19.099  195.139   40.152 54.77060 44.46254 
1 1 1   11   32   23 o  343.880   13.278   91.389   6.9889   90.002   8.1762   95.151   13.467  340.608   15.683  345.490   25.649 -4.882446 30.06342 
1 1 1   11   32   24 o  167.467   20.124   22.252   5.0552   25.484   6.8169   18.303   7.5352  177.476   25.854  147.144   34.120 30.33141 42.80904 
1 1 1   11   32   25 f  243.815   14.693   46.237   5.4577   50.654   7.6901   41.755   7.7469  253.555   19.977  229.214   22.366 24.34134 29.98839 
1 1 1   11   32   26 o  266.798   13.780   55.254   5.6079   48.055   7.5221   64.263   8.4143  246.777   20.089  285.892   19.342 -39.11427 27.88680 
1 1 1   11   32   27 o  135.502   27.527   15.198   5.5144   19.986   7.0465   7.6328   8.8578  154.629   30.854  105.511   39.952 49.11790 50.47849 
1 1 1   11   32   28 o  280.551   15.864   61.428   6.7842   68.733   10.898   56.806   8.6688  292.984   24.527  267.654   21.337 25.32996 32.50907 
1 1 1   11   32   29 o   80.048   31.854   3.2257   5.8511   5.3712   9.5293   1.9273   7.4131  100.281   40.394   82.815   34.720 17.46613 53.26507 
1 1 1   11   32   30 o  440.535   13.136  150.366   8.8574  152.881   10.631  144.656   16.017  443.056   15.676  424.897   24.735 18.15918 29.28446 
1 1 1   11   32   31 f  133.929   32.827   15.368   6.6773   21.657   7.8063  -1.7797   12.890  159.376   33.083   95.800   42.849 63.57626 54.13408 
1 1 1   11   32   32 o  275.014   15.426   59.130   6.4674   56.170   8.9960   62.296   9.3044  264.957   22.392  279.353   21.937 -14.39578 31.34673 
1 1 1   11   32   33 o  129.253   30.791   14.273   6.0047   21.291   8.5491   7.4392   8.4358  155.784   36.493  102.354   38.933 53.42957 53.36187 
1 1 1   11   32   34 o  105.596   32.525   9.4534   5.7749   2.2402   8.0053   17.280   8.3388   85.200   35.918  139.220   38.047 -54.02032 52.32346 
1 1 1   11   32   35 o  158.063   26.569   20.809   6.1999   24.596   8.8836   17.214   8.6569  167.148   35.801  138.042   39.161 29.10657 53.05945 
1 1 1   11   32   36 o   78.713   33.336   1.6965   6.9465   23.924   14.116  -5.4063   7.9795  155.067   51.197   67.918   31.609 87.14911 60.16873 
1 1 1   11   32   37 o   84.908   32.549   4.8804   5.9251  -1.5290   8.9864   9.8096   7.8807   79.440   35.636  107.747   38.175 -28.30760 52.22376 
1 1 1   11   32   38 o  204.205   23.747   34.315   7.2839   36.282   12.520   33.310   8.9553  195.691   42.976  196.729   30.747 -1.038086 52.84209 
1 1 1   11   32   39 f  148.016   21.384   17.985   4.7043   21.978   5.0210 -10.7010   13.458  164.336   20.400   81.756   38.952 82.57970 43.97034 
1 1 1   11   32   40 o  204.318   27.269   35.442   8.3150   39.515   10.341   27.990   13.987  211.293   33.057  161.601   50.758 49.69223 60.57319 
1 1 1   11   32   41 o   60.966   25.344   1.2960   3.9017   1.3595   4.4199   1.0718   8.3043   64.084   26.835   80.446   35.258 -16.36162 44.30820 
1 1 1   11   32   42 o  199.025   15.964   31.703   4.8223   30.965   5.2554   35.632   12.130  195.691   17.738  187.829   43.104 7.862518 46.61156 
1 1 1   11   32   43 o   66.283   26.477   2.5287   4.0570   4.1492   4.7402  -1.9095   7.8446   75.845   29.104   71.083   32.445 4.762581 43.58631 
1 1 1   11   32   44 o  113.171   33.468   12.224   6.2028   12.130   9.4405   12.295   8.2281  110.276   41.356  111.124   39.044 -0.8482895 56.87475 
1 1 1   11   33    0 o  100.798   45.799   11.652   7.6445   11.652   7.6445   11.652   7.6445  100.798   45.799  100.798   45.799 0.000000 0.000000 
1 1 1   11   33    1 o  456.384   16.346  161.032   11.418   0.0000   0.0000  161.032   11.418  ?   ?   456.384   16.346 0.000000 16.34587 
1 1 1   11   33    2 f  478.608   15.578  176.938   11.412   0.0000   0.0000  176.938   11.412  ?   ?   478.608   15.578 0.000000 15.57753 
1 1 1   11   33    3 o  591.278   15.437  270.018   13.971   0.0000   0.0000  270.018   13.971  ?   ?   591.278   15.437 0.000000 15.43717 
1 1 1   11   33    4 o  186.467   29.763   28.131   8.2092   0.0000   0.0000   28.131   8.2092  ?   ?   186.467   29.763 0.000000 29.76326 
1 1 1   11   33    5 o  438.443   16.574  148.703   11.123   0.0000   0.0000  148.703   11.123  ?   ?   438.443   16.574 0.000000 16.57415 
1 1 1   11   33    6 o  102.458   37.775   7.0502   7.8112   0.0000   0.0000   7.0502   7.8112  ?   ?   102.458   37.775 0.000000 37.77515 
1 1 1   11   33    7 o  306.830   20.126   73.523   9.3994   0.0000   0.0000   73.523   9.3994  ?   ?   306.830   20.126 0.000000 20.12552 
1 1 1   11   33    8 o  224.184   25.254   39.924   8.5148   0.0000   0.0000   39.924   8.5148  ?   ?   224.184   25.254 0.000000 25.25402 
1 1 1   11   33    9 o  477.974   16.924  176.938   12.381   0.0000   0.0000  176.938   12.381  ?   ?   477.974   16.924 0.000000 16.92382 
1 1 1   11   33   10 o  307.351   20.847   73.956   9.7494   0.0000   0.0000   73.956   9.7494  ?   ?   307.351   20.847 0.000000 20.84720 
1 1 1   11   33   11 o  403.836   13.438  125.797   8.3065  127.904   12.326  124.045   11.242  405.322   19.869  399.652   18.379 5.670532 27.06539 
1 1 1   11   33   12 o  161.218   19.879   20.531   4.8016   20.550   5.7990   20.489   8.5633  160.057   24.446  156.152   36.486 3.904892 43.91817 
1 1 1   11   33   13 o  305.694   12.385   72.021   5.7952   67.914   6.9829   81.109   10.388  295.880   15.473  321.583   21.223 -25.70273 26.26395 
1 1 1   11   33   14 o  122.611   26.832   12.326   4.8957   20.224   5.8984  -5.1670   8.7777  158.444   25.162   74.471   34.116 83.97285 42.39149 
1 1 1   11   33   15 o  357.488   11.558   98.433   6.3245   98.781   7.6666   97.692   11.189  357.585   14.007  353.056   20.798 4.529236 25.07499 
1 1 1   11   33   16 o  748.701   12.376  432.225   14.183  420.604   20.224  443.474   19.897  735.536   17.963  755.759   17.200 -20.22272 24.86992 
1 1 1   11   33   17 o   65.963   29.685  -2.6045   6.2903  -4.4009   8.8903  -0.8037   8.9014   76.308   34.718   83.738   36.607 -7.429787 50.45163 
1 1 1   11   33   18 o  248.595   15.526   48.059   5.8783   47.135   6.9719   50.333   10.932  245.304   18.710  249.602   29.165 -4.298065 34.65073 
1 1 1   11   33   19 o  122.453   29.218   12.443   5.4001   10.868   6.4013   16.329   10.056  114.554   34.028  138.525   42.962 -23.97119 54.80541 
1 1 1   11   33   20 o  151.467   24.897   18.575   5.5715   15.569   6.4866   27.030   10.880  136.424   31.673  176.912   40.983 -40.48720 51.79538 
1 1 1   11   33   21 o  190.395   20.436   28.692   5.8624   27.723   6.8575   31.322   11.300  185.711   24.740  191.046   39.928 -5.335236 46.97099 
1 1 1   11   33   22 o  139.431   28.248   16.058   5.8221   20.082   6.7248   4.0150   11.634  155.983   29.241  104.638   43.652 51.34505 52.54087 
1 1 1   11   33   23 o  196.549   20.931   30.650   6.2002   28.418   7.1360   37.524   12.524  187.580   25.517  208.639   40.678 -21.05988 48.01907 
1 1 1   11   33   24 o  463.858   11.836  166.089   8.4031  156.044   9.6589  197.361   17.043  448.823   14.060  500.247   22.258 -51.42383 26.32655 
1 1 1   11   33   25 o  130.643   28.040   14.182   5.4393   16.230   6.7654   10.437   9.1473  138.518   32.474  115.483   41.106 23.03394 52.38578 
1 1 1   11   33   26 o  344.118   11.945   91.482   6.2915   91.924   8.5339   90.956   9.3121  343.592   16.227  340.701   17.920 2.890839 24.17496 
1 1 1   11   33   27 o   83.289   33.031   3.6282   6.2718   2.2002   7.2292   7.9735   12.611   82.824   34.470  115.394   46.473 -32.57014 57.86116 
1 1 1   11   33   28 o  281.905   17.485   62.363   7.5073   69.797   8.8864   43.830   14.030  297.353   19.635  222.758   42.703 74.59410 47.00139 
1 1 1   11   33   29 o  431.087   13.179  144.048   8.6962  154.444   14.594  138.324   10.828  441.689   21.587  420.767   16.813 20.92172 27.36247 
1 1 1   11   33   30 o  206.925   22.105   34.333   6.8927   30.296   11.008   36.938   8.8404  185.168   40.007  211.958   27.929 -26.79059 48.79124 
1 1 1   11   33   31 o  187.132   21.538   28.124   6.0566   26.367   8.3019   30.123   8.8555  176.374   31.927  188.877   31.758 -12.50311 45.03274 
1 1 1   11   33   32 o  320.246   14.256   79.847   6.9880   85.024   9.8331   74.565   9.9326  327.402   19.714  305.592   21.370 21.80997 29.07391 
1 1 1   11   33   33 f  199.098   20.236   31.741   6.0811   39.973   8.6068   23.535   8.5932  220.686   25.977  163.911   35.295 56.77472 43.82405 
1 1 1   11   33   34 o  266.950   19.967   56.907   8.0994   44.470   14.701   62.327   9.7052  217.795   45.563  277.555   23.053 -59.75999 51.06340 
1 1 1   11   33   35 o  140.234   30.182   16.965   6.2865   12.969   9.1938   20.474   8.6154  120.585   41.333  150.311   37.555 -29.72593 55.84579 
1 1 1   11   33   36 o  148.999   31.274   19.346   6.9051   34.832   12.341   12.287   8.3313  192.090   43.040  117.148   39.350 74.94108 58.31708 
1 1 1   11   33   37 o  177.025   27.722   26.564   7.2650   24.555   12.307   27.638   9.0004  156.424   47.346  176.106   34.624 -19.68137 58.65599 
1 1 1   11   33   38 o   65.373   29.377  -1.5542   6.1352   4.8069   9.4935  -6.1161   8.0395   94.443   39.419   66.151   31.090 28.29294 50.20430 
1 1 1   11   33   39 o  198.776   21.736   32.466   6.5053   40.621   9.8066   26.057   8.6935  215.899   30.526  169.226   34.727 46.67358 46.23662 
1 1 1   11   33   40 o  145.623   24.334   17.995   5.2324   17.995   5.2324   0.0000   0.0000  145.623   24.334  ?   ?  0.000000 24.33357 
1 1 1   11   33   41 o  293.825   15.608   68.830   6.9942   68.830   6.9942   0.0000   0.0000  293.825   15.608  ?   ?  0.000000 15.60777 
1 1 1   11   33   42 o  114.067   23.902   11.256   4.0396   7.6721   4.6847   21.648   7.9768   92.625   29.410  150.567   35.236 -57.94198 45.89693 
1 1 1   11   33   43 o  125.866   30.444   14.633   5.8011   24.772   9.0909   7.6678   7.5345  157.746   38.084   94.439   36.571 63.30729 52.79944 
1 1 1   11   34    0 o  516.929   15.927  206.208   12.575  206.208   12.575  206.208   12.575  516.929   15.927  516.929   15.927 0.000000 0.000000 
1 1 1   11   34    1 o  224.420   16.102   39.172   5.4943   47.830   8.0316   31.557   7.5326  246.651   21.489  198.846   25.324 47.80457 33.21220 
1 1 1   11   34    2 o  343.691   12.934   91.061   6.8042   96.281   9.8435   86.285   9.4158  351.659   18.351  332.790   18.559 18.86868 26.09978 
1 1 1   11   34    3 o  516.435   11.187  205.233   8.8432  204.608   12.644  205.831   12.373  514.161   16.066  515.836   15.670 -1.675476 22.44302 
1 1 1   11   34    4 o   72.684   27.998   2.8877   4.3981   7.2007   5.3870  -5.7345   7.6166   96.344   31.619   67.365   31.189 28.97906 44.41306 
1 1 1   11   34    5 o  199.993   16.179   31.162   4.9102   36.033   6.2270   23.153   7.9842  214.426   19.175  167.582   32.298 46.84337 37.56122 
1 1 1   11   34    6 o  332.421   11.421   85.066   5.8111   89.049   7.3561   78.455   9.4774  339.583   14.152  316.862   19.638 22.72083 24.20606 
1 1 1   11   34    7 o  529.849   9.6869  215.773   7.8561  211.130   9.6943  224.655   13.408  523.494   12.099  538.562   16.266 -15.06750 20.27197 
1 1 1   11   34    8 o  343.532   14.673   91.215   7.7152   89.259   11.735   92.704   10.239  336.739   22.903  344.510   19.498 -7.770447 30.07848 
1 1 1   11   34    9 o  358.808   14.237   99.462   7.8192  102.680   11.795   96.939   10.444  361.848   21.392  352.295   19.443 9.553192 28.90747 
1 1 1   11   34   10 o  140.486   29.335   16.250   6.1044   20.235   9.5399   13.487   7.9434  154.014   40.082  127.200   37.933 26.81426 55.18583 
1 1 1   11   34   11 o   98.644   34.037   7.3173   6.2395   3.6705   9.5988   9.9857   8.2108   97.645   40.089  113.540   39.053 -15.89545 55.96651 
1 1 1   11   34   12 o  312.279   15.777   75.723   7.5169   73.636   11.077   77.504   10.234  305.107   23.911  314.058   21.417 -8.950653 32.10016 
1 1 1   11   34   13 o  622.197   12.533  298.581   11.936  307.759   17.576  290.724   16.261  628.971   18.256  611.789   17.365 17.18182 25.19595 
1 1 1   11   34   14 o  535.173   12.998  221.061   10.647  208.278   15.279  233.125   14.844  516.839   19.314  547.605   17.710 -30.76544 26.20471 
1 1 1   11   34   15 o  220.219   17.347   37.913   5.7997   27.815   7.0145   59.735   10.311  186.066   25.284  274.027   24.854 -87.96107 35.45468 
1 1 1   11   34   16 o  305.759   13.404   72.229   6.2730   67.177   7.5168   83.820   11.385  293.627   16.795  325.673   22.987 -32.04639 28.46885 
1 1 1   11   34   17 o  120.141   29.603   12.006   5.4084   10.594   6.4088   15.501   10.081  113.201   34.144  135.369   43.160 -22.16833 55.03237 
1 1 1   11   34   18 o  237.715   16.961   44.148   6.1309   44.251   7.2786   43.896   11.375  236.971   20.262  230.645   33.176 6.326218 38.87435 
1 1 1   11   34   19 o  106.823   31.973   9.4020   5.6355   9.4658   6.7064   9.2488   10.396  108.297   35.266  114.891   43.335 -6.594139 55.87152 
1 1 1   11   34   20 f  282.688   15.019   62.134   6.4755   63.023   7.6584   59.905   12.128  283.844   17.716  271.504   29.667 12.34042 34.55449 
1 1 1   11   34   21 o   47.165   23.060 -10.0627   5.5288 -12.1081   6.3570  -3.7110   11.203   49.763   24.412   87.350   39.433 -37.58784 46.37808 
1 1 1   11   34   22 o  151.632   26.137   18.792   5.8471   17.334   6.5875   24.207   12.694  143.884   30.839  163.933   47.708 -20.04922 56.80709 
1 1 1   11   34   23 o  207.628   22.677   34.440   7.0896   34.440   7.0896   0.0000   0.0000  207.628   22.677  ?   ?  0.000000 22.67698 
1 1 1   11   34   24 o  131.448   30.755   14.560   6.0780   13.599   6.8095   18.324   13.480  126.254   34.332  144.692   50.024 -18.43808 60.67168 
1 1 1   11   34   25 o  283.740   16.440   62.953   7.1095   67.065   8.4007   52.573   13.346  291.906   18.903  249.388   36.006 42.51865 40.66671 
1 1 1   11   34   26 o  212.683   17.229   35.562   5.5604   33.321   7.4961   38.303   8.2912  203.057   24.622  217.542   25.377 -14.48529 35.35876 
1 1 1   11   34   27 o  220.651   17.508   38.320   5.8646   47.649   8.2894   28.971   8.2982  244.140   22.434  186.579   30.080 57.56104 37.52401 
1 1 1   11   34   29 o   63.285   28.199  -1.4917   5.5269   3.9653   7.5483  -7.7982   8.1147   88.769   35.883   65.329   30.866 23.43961 47.33205 
1 1 1   11   34   30 o  169.134   24.137   23.350   6.0713   32.476   8.8084   15.089   8.3799  196.844   30.199  130.493   38.972 66.35107 49.30352 
1 1 1   11   34   31 o  110.495   34.349   10.467   6.4239   5.6733   10.310   13.509   8.2129  101.697   41.626  123.729   38.900 -22.03257 56.97316 
1 1 1   11   34   32 o  106.337   34.376   9.6249   6.3787   13.148   10.187   7.3527   8.1809  122.713   43.412  100.563   38.319 22.14994 57.90436 
1 1 1   11   34   33 o  239.284   21.942   46.268   7.9470   39.999   15.122   48.660   9.3409  201.963   49.340  243.268   25.463 -41.30579 55.52297 
1 1 1   11   34   34 o  120.885   35.336   13.064   6.9503   24.997   11.638   6.4485   8.6653  160.631   45.348   97.979   38.835 62.65260 59.70490 
1 1 1   11   34   35 o  201.694   24.502   33.618   7.4090   28.367   12.300   36.609   9.2819  169.816   46.125  206.827   30.211 -37.01118 55.13845 
1 1 1   11   34   36 o  118.669   33.069   12.598   6.2306   20.929   9.4055   6.0824   8.3173  148.706   40.311   95.126   37.939 53.58000 55.35703 
1 1 1   11   34   37 o  117.255   32.812   12.393   6.1208   11.096   9.0805   13.473   8.2861  111.611   40.792  120.045   39.206 -8.434456 56.57820 
1 1 1   11   34   38 o  123.892   32.409   13.964   6.2162   13.120   9.2063   14.670   8.4272  117.393   41.297  123.518   39.469 -6.125229 57.12481 
1 1 1   11   34   39 o   85.048   34.551   4.5861   7.0362   1.3612   9.0464   9.5245   11.195   83.070   36.593  107.010   43.539 -23.93949 56.87415 
1 1 1   11   34   40 o  103.942   33.281   9.9894   5.9897   8.9390   8.6194   10.970   8.3296  101.176   39.133  107.726   39.115 -6.549347 55.32997 
1 1 1   11   34   41 o  147.985   31.543   20.164   6.9264   8.9066   8.7424   39.143   11.352  100.385   39.248  200.254   38.432 -99.86929 54.93106 
1 1 1   11   35    0 o  187.658   30.634   29.524   8.0950   29.524   8.0950   29.524   8.0950  187.658   30.634  187.658   30.634 0.000000 0.000000 
1 1 1   11   35    1 o   94.425   31.266   6.8915   5.2633   9.4869   7.8009   4.7227   7.1309  110.896   38.070   91.531   35.541 19.36462 52.08144 
1 1 1   11   35    2 o  458.261   11.829  161.791   8.2972  171.762   11.787  151.997   11.682  470.749   16.358  442.527   17.247 28.22256 23.77057 
1 1 1   11   35    3 o  328.078   13.602   83.104   6.8305   91.603   9.8304   75.170   9.4976  342.587   18.819  309.797   20.139 32.79013 27.56320 
1 1 1   11   35    4 o   79.285   28.998   4.1667   4.5899  -1.1567   5.7336   13.666   7.6589   66.321   29.176  127.804   37.018 -61.48296 47.13359 
1 1 1   11   35    5 o  387.141   10.873  115.359   6.4428  116.441   8.1059  113.504   10.617  388.320   13.638  382.080   18.154 6.240540 22.70624 
1 1 1   11   35    6 o  448.033   10.430  154.437   7.1524  146.816   8.8145  169.126   12.238  436.148   13.204  466.776   17.129 -30.62802 21.62733 
1 1 1   11   35    7 o  222.471   15.311   38.488   5.1820   34.919   6.3973   45.298   8.8371  210.632   20.086  238.641   24.543 -28.00885 31.71459 
1 1 1   11   35    8 o  243.141   19.819   46.410   7.3116   52.291   11.078   41.872   9.7323  254.737   28.925  227.801   28.538 26.93610 40.63374 
1 1 1   11   35    9 f  177.400   24.509   25.232   6.4772   31.529   9.9327   20.574   8.5437  194.778   34.583  155.986   36.442 38.79265 50.23951 
1 1 1   11   35   10 o  407.626   13.978  128.433   8.7215  124.892   13.051  131.292   11.724  398.767   21.461  410.555   18.657 -11.78860 28.43637 
1 1 1   11   35   11 o  274.863   17.851   59.011   7.4696   59.528   11.345   58.615   9.9243  272.329   27.598  271.701   24.114 0.6283264 36.64886 
1 1 1   11   35   12 o  308.392   16.329   74.009   7.6803   55.566   11.339   89.645   10.440  262.449   28.693  338.029   20.272 -75.57986 35.13163 
1 1 1   11   35   13 o  425.505   14.264  140.078   9.2901  147.950   13.910  133.739   12.482  434.607   20.910  413.736   19.711 20.87091 28.73565 
1 1 1   11   35   14 o  193.127   19.086   29.377   5.5681   25.599   6.7842   37.176   9.7465  178.106   25.623  213.115   30.770 -35.00970 40.04192 
1 1 1   11   35   15 o  177.686   21.225   25.092   5.6583   21.068   6.8553   33.693   10.023  160.028   29.058  201.314   33.719 -41.28624 44.51207 
1 1 1   11   35   16 o  236.038   16.612   43.514   5.9633   51.014   7.3327   28.865   10.248  254.926   18.927  184.146   37.628 70.78033 42.12027 
1 1 1   11   35   17 o  190.765   19.968   28.786   5.7440   28.349   6.8195   29.854   10.656  187.861   24.285  186.756   38.557 1.105286 45.56756 
1 1 1   11   35   18 o  115.040   30.889   11.076   5.5538   5.3276   6.4882   26.832   10.742   90.715   34.230  175.689   40.739 -84.97475 53.21062 
1 1 1   11   35   19 o  182.665   21.810   26.617   5.9772   27.599   7.0029   23.981   11.472  184.752   25.438  164.313   44.511 20.43895 51.26719 
1 1 1   11   35   20 o  231.024   17.899   41.907   6.2799   42.424   7.3216   40.470   12.215  231.403   20.897  217.858   38.014 13.54504 43.37875 
1 1 1   11   35   21 o  178.166   26.880   25.913   7.1024   25.913   7.1024   0.0000   0.0000  178.166   26.880  ?   ?  0.000000 26.88020 
1 1 1   11   35   22 o   83.708   32.705   3.9568   6.0673   0.1716   6.9617   15.915   12.374   76.005   32.805  136.689   47.889 -60.68417 58.04727 
1 1 1   11   35   23 o  423.853   12.669  139.012   8.2191  135.345   9.7171  148.232   15.408  417.215   15.216  431.449   23.419 -14.23407 27.92818 
1 1 1   11   35   24 o  163.911   26.447   22.041   6.4094   24.501   7.5247   15.539   12.234  171.591   29.727  134.818   47.586 36.77284 56.10831 
1 1 1   11   35   25 o  134.680   31.592   15.426   6.4000   14.552   7.4668   17.844   12.424  129.618   36.230  141.624   48.052 -12.00549 60.17928 
1 1 1   11   35   26 o  473.772   12.663  173.892   9.1831  188.062   11.132  143.715   16.246  491.610   14.794  422.513   25.236 69.09659 29.25267 
1 1 1   11   35   27 o   57.278   26.571  -4.1375   5.5674  -9.8194   7.5720   2.5490   8.2142   59.433   28.557   87.234   36.559 -27.80147 46.39013 
1 1 1   11   35   28 o  115.937   31.539   11.523   5.7455   7.6583   7.7178   16.328   8.6051  101.285   37.508  135.387   39.245 -34.10122 54.28654 
1 1 1   11   35   29 o  116.999   31.935   11.810   5.8790   20.280   7.9518   1.5986   8.7311  152.229   34.875   86.329   36.991 65.89945 50.83944 
1 1 1   11   35   30 o   58.403   26.938  -3.5830   5.6029   1.6856   7.9298  -8.8354   7.9177   83.082   35.417   62.316   29.741 20.76592 46.24810 
1 1 1   11   35   31 o  191.652   26.412   30.493   7.5422   15.915   14.060   36.383   8.9367  132.830   50.326  208.121   28.828 -75.29118 57.99762 
1 1 1   11   35   32 o  251.034   19.498   50.423   7.4331   44.432   13.151   53.235   9.0105  220.764   40.407  255.666   23.281 -34.90129 46.63355 
1 1 1   11   35   33 o  241.715   19.963   46.957   7.3196   59.462   12.451   40.353   9.0483  263.397   31.509  219.316   27.563 44.08095 41.86329 
1 1 1   11   35   34 o  140.384   29.690   17.114   6.1804   9.3778   9.0809   23.789   8.4357  107.101   40.476  162.844   34.894 -55.74298 53.44040 
1 1 1   11   35   35 o  145.283   28.569   18.257   6.1266   24.989   9.0030   12.450   8.3612  165.035   36.599  116.441   39.419 48.59438 53.79015 
1 1 1   11   35   36 o  192.603   21.364   30.454   6.1921   40.306   9.1411   22.099   8.4174  216.776   28.219  154.195   36.272 62.58092 45.95552 
1 1 1   11   35   37 o   71.695   30.624   1.4459   5.9503   8.2210   8.5249  -4.9909   8.3093  100.067   38.858   68.357   31.960 31.71031 50.31331 
1 1 1   11   35   38 o   97.858   36.589   8.2649   7.3791   1.8025   9.0132   21.402   12.851   83.614   36.687  138.611   48.788 -54.99748 61.04234 
1 1 1   11   35   39 o  101.727   33.557   9.5652   6.0647   1.7984   8.5170   17.554   8.6379   81.425   35.696  131.900   39.607 -50.47482 53.31919 
1 1 1   11   35   40 o   90.439   32.768   7.1111   5.8409   12.670   8.7317   2.6095   7.8579  112.547   40.151   80.776   34.858 31.77079 53.17117 
1 1 1   11   36    0 f  672.140   16.231  348.699   16.676  348.699   16.676  348.699   16.676  672.140   16.231  672.140   16.231 0.000000 0.000000 
1 1 1   11   36    1 o   40.545   20.202 -12.6240   5.0078 -15.5479   7.1612  -9.8257   7.0057   50.727   25.081   56.906   27.374 -6.178513 37.12678 
1 1 1   11   36    2 o  132.168   28.375   14.410   5.5687   13.214   7.7753   15.670   7.9792  125.615   37.546  135.974   37.242 -10.35907 52.88319 
1 1 1   11   36    3 o  254.466   16.377   50.446   6.3449   59.246   9.3662   42.983   8.6255  273.783   22.551  232.171   24.649 41.61215 33.40849 
1 1 1   11   36    4 o  235.799   15.260   43.242   5.4780   43.168   6.9134   43.369   8.9796  234.437   19.442  232.836   25.620 1.601151 32.16165 
1 1 1   11   36    5 o  287.398   13.515   63.819   5.9452   62.110   7.3522   67.048   10.105  282.227   17.100  291.198   22.855 -8.971069 28.54459 
1 1 1   11   36    6 o  417.543   11.007  134.282   7.0349  125.902   8.5754  151.527   12.302  403.547   13.883  441.107   18.221 -37.56042 22.90701 
1 1 1   11   36    7 o   81.548   29.350   4.6148   4.6756   4.7161   5.6924   4.4046   8.1970   85.785   32.125   94.132   37.624 -8.347679 49.47248 
1 1 1   11   36    8 o  326.406   15.824   82.636   7.9057   73.373   11.787   90.210   10.659  303.354   25.625  338.876   20.647 -35.52188 32.90871 
1 1 1   11   36    9 o  406.357   14.670  127.855   9.1244  137.315   13.636  120.186   12.278  417.898   21.390  391.292   20.573 26.60547 29.67747 
1 1 1   11   36   10 o  304.715   17.021   72.411   7.9069   97.598   12.432   55.302   10.246  351.195   23.259  262.903   25.795 88.29236 34.73254 
1 1 1   11   36   11 o  205.820   22.736   33.727   7.0430   17.129   10.472   47.434   9.5169  141.106   43.855  243.174   25.970 -102.0681 50.96761 
1 1 1   11   36   12 o  371.442   15.265  106.995   8.6790  110.963   13.231  103.998   11.499  374.410   23.201  363.642   20.745 10.76886 31.12310 
1 1 1   11   36   13 o  328.060   16.193   83.620   8.1313   95.810   12.486   74.643   10.715  347.515   23.614  306.852   22.980 40.66360 32.95002 
1 1 1   11   36   14 o   69.476   30.856  -1.6760   6.5621  -8.5664   9.6471   4.2578   8.9524   72.627   34.109   96.040   38.988 -23.41211 51.80281 
1 1 1   11   36   15 o  161.490   23.142   20.975   5.5568   18.041   6.7882   26.936   9.6747  146.838   31.167  177.788   36.766 -30.94992 48.19852 
1 1 1   11   36   16 o  395.903   12.218  121.062   7.4040  129.080   9.1144  105.504   12.696  408.008   14.595  364.801   22.853 43.20682 27.11543 
1 1 1   11   36   17 o  243.047   16.813   46.224   6.2162   44.121   7.4227   51.161   11.375  236.076   20.753  249.864   30.366 -13.78761 36.77985 
1 1 1   11   36   18 f  489.860   13.630  185.859   10.219  185.859   10.219   0.0000   0.0000  489.860   13.630  ?   ?  0.000000 13.62972 
1 1 1   11   36   19 o  175.706   27.999   25.364   7.2773   25.364   7.2773   0.0000   0.0000  175.706   27.999  ?   ?  0.000000 27.99889 
1 1 1   11   36   20 o  318.214   14.638   78.627   7.1299   76.378   8.4155   84.347   13.422  312.134   17.687  322.838   27.421 -10.70331 32.63019 
1 1 1   11   36   21 o  283.385   16.165   62.775   6.9825   60.751   8.2104   68.065   13.273  277.469   19.455  287.639   30.619 -10.17078 36.27715 
1 1 1   11   36   22 f  316.272   15.219   77.827   7.3674   84.776   8.8563   62.211   13.276  328.717   17.667  273.562   32.330 55.15503 36.84214 
1 1 1   11   36   23 o  231.223   19.316   42.322   6.7735   48.471   8.1445   28.527   12.198  246.465   21.815  176.979   44.946 69.48599 49.96058 
1 1 1   11   36   24 o  347.437   14.479   93.887   7.6997   91.533   9.0721   99.951   14.559  341.421   17.418  350.463   27.358 -9.041565 32.43200 
1 1 1   11   36   25 o   82.793   32.928   3.6700   6.2489  -2.8756   7.3267   21.138   11.969   70.104   31.747  151.109   46.871 -81.00443 56.61079 
1 1 1   11   36   26 f  139.818   32.629   16.867   6.8556   17.955   7.9602   13.741   13.489  142.771   36.335  129.101   49.202 13.66988 61.16444 
1 1 1   11   36   27 o   75.855   32.489   0.8723   6.7297   1.3077   7.8531  -0.3314   13.057   82.027   35.113   97.469   43.394 -15.44202 55.82100 
1 1 1   11   36   28 o  300.783   14.541   70.613   6.6945   76.895   9.4108   64.177   9.5252  310.692   19.894  282.357   22.219 28.33517 29.82361 
1 1 1   11   36   29 o   88.579   36.675   3.5878   8.1236   0.0000   0.0000   3.5878   8.1236  ?   ?    88.579   36.675 0.000000 36.67489 
1 1 1   11   36   30 o   77.933   34.439  -0.4750   8.0757   0.0000   0.0000  -0.4750   8.0757  ?   ?    77.933   34.439 0.000000 34.43904 
1 1 1   11   36   31 o  248.908   17.231   49.163   6.5244   45.558   9.0847   53.004   9.3760  234.548   25.727  254.079   24.409 -19.53107 35.46438 
1 1 1   11   36   32 f  153.829   26.175   19.947   5.9424   14.225   8.4903   25.441   8.3199  124.132   39.611  169.808   33.200 -45.67561 51.68477 
1 1 1   11   36   33 o   57.364   27.342  -7.0767   6.6470 -15.4632   11.798  -3.1768   8.0455   70.530   34.307   71.358   32.680 -0.8281555 47.38054 
1 1 1   11   36   34 o  190.675   24.819   30.486   7.0717   25.778   11.697   33.197   8.8778  159.049   45.656  194.762   30.805 -35.71336 55.07617 
1 1 1   11   36   35 o  291.053   17.293   67.845   7.6693   84.704   13.695   60.142   9.2571  313.439   28.870  269.760   22.629 43.67862 36.68155 
1 1 1   11   36   36 o  166.627   29.523   24.548   7.2541   29.838   9.1028   15.341   12.008  180.069   34.279  122.617   46.495 57.45217 57.76563 
1 1 1   11   36   37 o  142.662   28.870   18.137   6.0877   21.131   8.8477   15.446   8.3892  146.136   38.876  124.497   39.337 21.63853 55.30641 
1 1 1   11   36   38 o  100.852   32.767   9.3979   5.7909  -1.9836   8.3091   20.147   8.0750   72.674   33.256  143.874   36.585 -71.19937 49.44130 
1 1 1   11   37    0 o  141.403   45.755   20.131   8.7525   20.131   8.7525   20.131   8.7525  141.403   45.755  141.403   45.755 0.000000 0.000000 
1 1 1   11   37    1 f  297.761   15.843   68.993   7.1947   66.578   10.100   71.481   10.251  289.879   22.952  300.644   22.438 -10.76489 32.09761 
1 1 1   11   37    2 o  253.001   17.016   49.995   6.5511   51.274   9.3669   48.771   9.1657  253.576   24.436  247.208   24.548 6.367661 34.63674 
1 1 1   11   37    3 o  336.608   12.114   87.430   6.2414   87.513   7.8058   87.283   10.393  335.985   15.179  333.220   20.476 2.765137 25.48825 
1 1 1   11   37    4 o  105.697   29.239   9.2455   4.8899   12.950   6.0047   1.9520   8.4250  124.308   31.516   87.929   36.947 36.37853 48.56227 
1 1 1   11   37    5 o  320.583   12.413   79.343   6.0911   84.933   7.6069   69.354   10.169  331.020   15.014  295.972   22.617 35.04785 27.14676 
1 1 1   11   37    6 o  263.198   14.006   53.757   5.6221   51.410   6.7931   58.860   10.016  256.405   17.412  271.781   24.335 -15.37622 29.92278 
1 1 1   11   37    7 o  352.736   12.101   96.028   6.5337   94.611   8.0676   98.728   11.138  349.313   15.089  354.285   20.628 -4.972504 25.55792 
1 1 1   11   37    8 o  102.389   30.368   8.6180   5.1013   12.421   6.3197   1.5049   8.6425  121.498   33.089   87.580   37.143 33.91840 49.74351 
1 1 1   11   37    9 o  233.633   20.636   43.130   7.3035   41.562   11.073   44.338   9.7166  223.855   33.335  234.067   27.655 -10.21194 43.31320 
1 1 1   11   37   10 o  344.279   15.622   92.039   8.2323   86.050   12.146   97.128   11.196  328.736   24.312  351.089   20.929 -22.35281 32.07973 
1 1 1   11   37   11 o  178.321   25.864   25.780   6.8534   24.075   10.262   27.152   9.2081  166.169   40.675  179.349   34.798 -13.18063 53.52880 
1 1 1   11   37   12 o   93.828   34.560   6.1285   6.5359   20.028   9.8022  -4.9976   8.7700  151.309   41.210   74.064   33.992 77.24535 53.42019 
1 1 1   11   37   13 o  241.502   21.066   46.198   7.7090   45.006   11.167   47.284   10.655  233.297   32.125  240.536   29.562 -7.238922 43.65740 
1 1 1   11   37   14 o  308.853   18.086   74.771   8.5127   65.599   12.208   83.453   11.877  284.305   28.434  323.420   24.166 -39.11520 37.31645 
1 1 1   11   37   15 o  275.199   15.757   59.082   6.6098   62.992   7.9455   50.296   11.911  283.214   18.429  246.415   32.362 36.79918 37.24126 
1 1 1   11   37   16 o  265.836   19.199   55.677   7.7595   55.677   7.7595   0.0000   0.0000  265.836   19.199  ?   ?  0.000000 19.19908 
1 1 1   11   37   17 o  211.764   24.064   36.070   7.6615   36.070   7.6615   0.0000   0.0000  211.764   24.064  ?   ?  0.000000 24.06439 
1 1 1   11   37   18 o  457.097   12.064  161.524   8.4406  162.725   10.229  158.962   14.943  457.727   14.599  448.407   21.772 9.320282 26.21410 
1 1 1   11   37   19 f   61.673   28.198  -3.3311   5.9565   0.5316   6.9832 -13.6468   11.412   76.874   33.015   73.395   35.210 3.479294 48.26702 
1 1 1   11   37   20 o  313.403   15.316   76.475   7.3470   76.295   8.7392   76.911   13.568  311.347   18.420  306.299   29.298 5.047913 34.60699 
1 1 1   11   37   21 o  273.318   16.925   58.634   7.0457   59.449   8.3282   56.582   13.215  273.877   20.005  258.941   34.177 14.93515 39.60115 
1 1 1   11   37   22 o  253.942   18.103   50.870   6.9906   47.177   8.1545   61.109   13.577  242.687   22.198  269.195   33.689 -26.50806 40.34477 
1 1 1   11   37   23 o  102.295   34.347   8.5610   6.3475   8.7381   7.3363   8.0337   12.660  104.602   36.858  113.904   46.317 -9.302490 59.19276 
1 1 1   11   37   24 o   66.376   30.018  -2.5233   6.5250  -4.2267   7.5780   2.3604   12.831   68.481   31.492  101.909   44.259 -33.42830 54.31973 
1 1 1   11   37   25 o  291.175   17.523   66.909   7.7734   69.155   9.2214   61.392   14.450  294.364   20.596  266.125   36.431 28.23892 41.84999 
1 1 1   11   37   26 o  256.871   23.457   53.516   9.1211   57.580   12.196   48.357   13.740  261.154   31.124  232.247   40.101 28.90732 50.76189 
1 1 1   11   37   27 o  231.560   37.626   47.529   12.878   0.0000   0.0000   47.529   12.878  ?   ?   231.560   37.626 0.000000 37.62632 
1 1 1   11   37   28 f  131.662   42.047   16.067   9.5653   11.303   13.550   20.800   13.505  120.307   48.271  145.294   50.078 -24.98690 69.55549 
1 1 1   11   37   29 o  146.049   28.049   18.178   6.0424   18.599   8.7765   17.798   8.3314  141.825   39.147  139.316   38.013 2.509247 54.56596 
1 1 1   11   37   30 o  199.727   20.589   32.302   6.2041   27.538   8.6947   37.243   8.8553  176.727   33.366  209.785   28.300 -33.05759 43.75120 
1 1 1   11   37   31 o  113.234   32.374   11.439   5.8926   12.595   8.3291   10.281   8.3377  117.146   39.345  108.637   39.182 8.509178 55.52709 
1 1 1   11   37   32 o  173.839   24.428   25.322   6.3206   32.639   9.1608   18.673   8.7320  191.993   32.321  139.770   39.218 52.22348 50.82053 
1 1 1   11   37   33 o   91.394   32.968   6.9176   5.9031   8.6460   8.7003   5.4432   8.0356  102.072   39.362   90.972   36.936 11.10078 53.97795 
1 1 1   11   37   34 o  166.999   26.545   24.012   6.5581   33.536   9.4428   15.136   9.1151  192.256   33.294  123.589   41.157 68.66687 52.93782 
1 1 1   11   37   35 o  202.889   29.653   36.381   8.9367   22.597   12.474   50.917   12.810  142.507   48.148  232.086   37.324 -89.57962 60.92107 
1 1 1   11   37   36 o   87.414   34.263   5.8227   6.6754  -0.1877   11.943   8.5539   8.0505   87.752   40.046   98.975   37.941 -11.22256 55.16508 
1 1 1   11   38    0 o   45.086   31.417  -6.8366   7.8131  -6.8366   7.8131  -6.8366   7.8131   45.086   31.417   45.086   31.417 0.000000 0.000000 
1 1 1   11   38    1 o  323.845   15.372   81.416   7.6199   73.279   10.663   89.909   10.893  303.749   23.108  337.565   21.190 -33.81561 31.35269 
1 1 1   11   38    2 o  275.632   16.449   59.301   6.9083   60.093   9.8100   58.521   9.7300  274.703   23.559  271.003   23.695 3.699646 33.41378 
1 1 1   11   38    3 o  251.434   15.373   49.256   5.8878   54.033   7.4002   41.016   9.7192  262.353   18.548  224.249   28.995 38.10332 34.41991 
1 1 1   11   38    4 o  135.298   26.210   15.040   5.2317   9.3537   6.6128   24.555   8.5538  107.395   35.022  170.678   33.938 -63.28336 48.76761 
1 1 1   11   38    5 o  619.150   10.207  295.270   9.6735  286.578   11.765  313.406   16.995  608.939   12.623  633.950   17.515 -25.01117 21.58934 
1 1 1   11   38    6 o   71.941   29.031   2.1599   4.9319   4.2991   6.0416  -2.1129   8.5385   85.089   32.804   78.544   35.021 6.544670 47.98510 
1 1 1   11   38    7 o  148.535   25.024   17.967   5.4870   12.202   6.7562   29.138   9.4042  120.142   34.759  186.011   34.294 -65.86958 48.82912 
1 1 1   11   38    8 o  226.933   16.981   40.343   5.8555   36.999   6.9567   48.470   10.845  215.825   21.338  243.454   29.720 -27.62840 36.58682 
1 1 1   11   38    9 o  172.335   28.668   24.455   7.2963   21.383   10.926   26.927   9.8021  155.169   43.987  177.101   37.337 -21.93138 57.69617 
1 1 1   11   38   10 o  152.296   31.627   19.493   7.1314   13.882   10.330   24.602   9.8575  128.664   43.814  168.262   39.031 -39.59741 58.67731 
1 1 1   11   38   11 o   97.505   35.341   6.9391   6.7955  -9.9763   9.6057   23.887   9.6149   70.110   33.260  165.842   38.601 -95.73139 50.95356 
1 1 1   11   38   12 o  166.921   42.867   24.781   11.009   24.781   11.009   0.0000   0.0000  166.921   42.867  ?   ?  0.000000 42.86724 
1 1 1   11   38   13 o  186.665   41.277   30.644   11.480   30.644   11.480   0.0000   0.0000  186.665   41.277  ?   ?  0.000000 41.27727 
1 1 1   11   38   14 o  382.884   23.353  116.798   13.620  116.798   13.620   0.0000   0.0000  382.884   23.353  ?   ?  0.000000 23.35266 
1 1 1   11   38   15 o  164.503   31.417   22.751   7.6222   18.437   10.918   26.851   10.646  143.802   44.793  174.444   40.627 -30.64207 60.47289 
1 1 1   11   38   16 o   98.868   32.541   7.8966   5.7042   0.5121   6.7200   26.936   10.790   75.481   32.401  174.221   41.124 -98.74023 52.35452 
1 1 1   11   38   17 o  248.589   17.719   48.630   6.6978   45.129   8.0095   56.771   12.214  237.533   22.291  261.626   31.109 -24.09390 38.27097 
1 1 1   11   38   18 o  301.249   15.423   70.898   7.0876   69.108   8.4084   75.293   13.173  296.023   18.653  303.075   28.741 -7.052002 34.26308 
1 1 1   11   38   19 o  185.675   23.521   27.916   6.5347   29.228   7.7146   24.583   12.295  188.189   27.603  162.594   46.846 25.59520 54.37337 
1 1 1   11   38   20 o  339.161   14.670   89.597   7.6154   93.931   9.1002   79.471   13.910  346.148   17.176  310.072   29.672 36.07602 34.28456 
1 1 1   11   38   21 o  499.824   12.314  193.681   9.4204  185.658   11.162  213.549   17.565  487.882   14.946  517.434   22.177 -29.55212 26.74388 
1 1 1   11   38   22 o  156.033   35.674   21.408   8.3343   23.661   11.066   18.456   12.668  159.596   43.919  141.036   48.509 18.55954 65.43759 
1 1 1   11   38   23 o  401.658   16.898  126.768   10.389  118.774   13.696  137.597   15.942  383.603   23.438  411.082   25.461 -27.47897 34.60692 
1 1 1   11   38   24 o  132.339   38.816   15.857   8.3739   21.543   11.031   8.1231   12.865  150.890   44.634  112.712   46.358 38.17798 64.35225 
1 1 1   11   38   25 o  300.947   22.556   73.229   10.315   87.387   14.866   60.084   14.324  322.002   30.526  261.295   36.837 60.70682 47.84175 
1 1 1   11   38   26 o  182.556   33.887   29.193   9.1202   32.846   13.218   25.872   12.600  183.737   46.855  162.059   47.636 21.67760 66.81792 
1 1 1   11   38   27 o  195.883   24.566   31.694   7.2036   27.672   8.5453   41.571   13.391  178.117   32.543  210.382   43.036 -32.26505 53.95532 
1 1 1   11   38   28 o  115.405   35.940   11.981   7.0294   14.155   8.6136   7.6469   12.163  123.683   39.943  108.074   44.822 15.60907 60.03704 
1 1 1   11   38   29 o   64.333   29.638  -3.5045   6.7535  -2.2701   8.1504  -6.2088   12.064   73.522   33.370   82.295   38.487 -8.773521 50.93932 
1 1 1   11   38   30 o   83.508   32.195   4.9075   5.8194   15.332   8.7273  -3.4384   7.8089  126.492   40.139   69.371   31.926 57.12073 51.28727 
1 1 1   11   38   31 o  129.634   30.866   15.080   6.0364   15.931   8.6497   14.271   8.4282  128.079   39.865  121.849   39.528 6.230072 56.13935 
1 1 1   11   38   32 o  121.275   31.710   13.418   5.9526   2.1862   8.8132   22.841   8.0721   84.297   36.646  157.067   34.518 -72.76962 50.34278 
1 1 1   11   38   33 o  134.441   33.915   16.908   6.9785   22.411   8.7755   7.4408   11.510  152.085   37.849  102.037   43.045 50.04786 57.31854 
1 1 1   11   38   34 o  125.955   30.706   14.501   5.8661   20.092   8.4582   9.3185   8.1426  143.003   37.996  101.823   38.364 41.18100 53.99517 
1 1 1   11   39    0 o  596.844   17.707  276.136   16.144  276.136   16.144  276.136   16.144  596.844   17.707  596.844   17.707 0.000000 0.000000 
1 1 1   11   39    1 o  177.447   25.140   25.524   6.6373   34.446   9.9071   18.258   8.9402  202.952   33.028  144.700   39.334 58.25153 51.36137 
1 1 1   11   39    2 o  522.007   12.832  210.801   10.253  216.372   14.403  205.079   14.598  526.209   17.882  511.840   18.633 14.36935 25.82552 
1 1 1   11   39    3 o  106.058   31.467   9.3609   5.4764   8.3238   6.9655   11.040   8.8624  103.378   35.946  116.917   40.553 -13.53927 54.19083 
1 1 1   11   39    4 o  254.653   15.528   50.601   6.0236   58.961   7.5966   36.442   9.8861  273.999   18.217  209.391   31.850 64.60756 36.69164 
1 1 1   11   39    5 o  465.569   11.207  167.275   7.9865  167.040   9.8975  167.714   13.521  464.191   13.930  462.535   19.099 1.656036 23.63939 
1 1 1   11   39    6 o  469.255   11.076  169.911   7.9552  161.154   9.4540  191.149   14.723  456.082   13.543  493.510   19.491 -37.42813 23.73417 
1 1 1   11   39    7 o  129.666   29.805   14.129   5.7916   15.526   7.0001   11.096   10.311  134.758   33.953  119.226   43.485 15.53198 55.16994 
1 1 1   11   39    8 o  456.491   11.759  160.994   8.2164  180.643   9.9785  119.621   14.479  482.823   13.502  386.718   24.590 96.10522 28.05281 
1 1 1   11   39    9 f  339.138   26.702   92.874   13.749   92.874   13.749   0.0000   0.0000  339.138   26.702  ?   ?  0.000000 26.70224 
1 1 1   11   39   10 o   77.752   36.209  -7.3730   10.498  -7.3730   10.498   0.0000   0.0000   77.752   36.209  ?   ?  0.000000 36.20889 
1 1 1   11   39   11 o  249.260   22.955   49.722   8.6594   59.980   12.732   40.893   11.812  269.042   31.516  218.707   36.577 50.33464 48.28139 
1 1 1   11   39   12 o  165.256   31.279   22.991   7.6221   29.646   11.519   17.807   10.166  182.298   42.128  141.383   43.084 40.91524 60.25746 
1 1 1   11   39   13 o  186.707   28.693   28.847   7.9375   37.797   11.999   21.882   10.584  208.206   39.086  155.790   42.985 52.41553 58.09885 
1 1 1   11   39   14 o   60.780   29.009  -8.8148   7.5346   0.6884   10.702 -18.1549   10.610   92.510   40.298   64.829   31.749 27.68093 51.30211 
1 1 1   11   39   15 o  229.985   24.740   42.843   8.5721   55.359   12.535   31.849   11.749  256.864   32.618  188.568   41.803 68.29657 53.02250 
1 1 1   11   39   16 o  175.635   31.722   26.132   8.2140   13.044   11.161   41.599   12.133  124.858   45.286  218.818   37.579 -93.95970 58.84742 
1 1 1   11   39   17 o  113.568   33.934   11.072   6.3523   14.411   7.6281   3.5181   11.473  128.067   36.900  100.476   42.711 27.59095 56.44322 
1 1 1   11   39   18 o  315.086   19.294   78.691   9.2603   66.502   12.247   94.963   14.150  283.783   28.584  340.486   27.383 -56.70328 39.58400 
1 1 1   11   39   19 o  103.512   37.600   8.4066   7.6976   1.9218   9.6597   19.689   12.741   90.457   38.838  144.670   48.663 -54.21234 62.26158 
1 1 1   11   39   20 o  316.807   19.569   79.837   9.4430   83.490   12.475   74.935   14.451  319.692   25.711  297.514   32.250 22.17810 41.24440 
1 1 1   11   39   21 o  282.020   17.602   62.915   7.5602   72.331   9.0302   40.846   13.824  301.251   19.692  209.264   44.528 91.98708 48.68787 
1 1 1   11   39   22 o  353.156   15.190   97.653   8.2108   96.437   9.8496  100.422   14.865  348.601   18.526  347.829   28.163 0.7721252 33.71013 
1 1 1   11   39   23 o  174.557   35.109   26.930   9.0555   32.790   12.655   20.781   12.964  185.455   45.030  145.716   49.085 39.73885 66.61168 
1 1 1   11   39   24 o   74.773   34.162  -3.3429   8.7224   3.8136   12.396 -10.3622   12.276  101.409   43.771   78.798   37.445 22.61072 57.60249 
1 1 1   11   39   25 o  176.432   28.023   26.389   7.3147   24.404   8.8576   30.644   12.971  164.433   36.175  175.728   47.215 -11.29445 59.48046 
1 1 1   11   39   26 o  116.565   35.260   12.283   6.8274   1.2152   8.4603   32.950   11.561   82.548   35.895  186.550   41.554 -104.0023 54.91065 
1 1 1   11   39   27 o  114.983   35.647   12.060   6.9239   12.041   8.6052   12.094   11.661  114.716   39.950  116.956   45.438 -2.239815 60.50309 
1 1 1   11   39   28 o   89.903   34.379   6.0896   6.5999   19.011   8.5570 -12.8845   10.369  141.232   38.519   67.051   32.510 74.18026 50.40460 
1 1 1   11   39   29 o  164.132   28.453   23.442   6.8892   32.644   8.8590   9.3626   10.958  192.058   31.207  107.299   43.283 84.75975 53.35983 
1 1 1   11   39   30 o   99.148   32.680   8.7906   5.7525   11.884   8.3233   5.9616   7.9595  112.131   39.277   91.819   36.941 20.31234 53.91972 
1 1 1   11   39   31 o  116.758   35.134   12.894   6.7917   6.9540   8.4091   24.037   11.518   95.266   38.097  149.825   45.899 -54.55872 59.64949 
1 1 1   11   40    0 o   45.989   32.423  -9.8069   9.0678  -9.8069   9.0678  -9.8069   9.0678   45.989   32.423   45.989   32.423 0.000000 0.000000 
1 1 1   11   40    1 o  134.687   31.787   15.432   6.4475   16.696   8.9393   14.061   9.3081  137.774   40.018  127.687   41.546 10.08756 57.68447 
1 1 1   11   40    2 o   64.994   29.426  -2.7306   6.2910   0.2409   8.7598  -5.8954   9.0403   84.167   36.562   73.321   33.959 10.84551 49.89940 
1 1 1   11   40    3 o  189.600   26.076   29.327   7.3673   29.327   7.3673   0.0000   0.0000  189.600   26.076  ?   ?  0.000000 26.07635 
1 1 1   11   40    4 o  197.035   25.699   31.592   7.5659   31.592   7.5659   0.0000   0.0000  197.035   25.699  ?   ?  0.000000 25.69872 
1 1 1   11   40    5 o  524.769   13.476  213.589   10.824  213.589   10.824   0.0000   0.0000  524.769   13.476  ?   ?  0.000000 13.47570 
1 1 1   11   40    6 o  305.630   17.498   73.345   8.1517   73.345   8.1517   0.0000   0.0000  305.630   17.498  ?   ?  0.000000 17.49810 
1 1 1   11   40    7 o  101.602   32.112   8.5355   5.5900   0.9505   6.6530   26.748   10.309   76.254   32.472  174.062   39.588 -97.80872 51.20213 
1 1 1   11   40    8 o  335.197   13.791   87.244   7.0756   83.393   8.6282   95.151   12.364  325.920   17.358  344.620   23.581 -18.69977 29.28069 
1 1 1   11   40    9 o  203.167   19.776   32.830   6.0719   27.845   7.2139   44.940   11.245  184.285   26.323  231.184   32.690 -46.89861 41.97058 
1 1 1   11   40   10 o  448.864   15.593  157.176   10.713  138.539   15.133  175.903   15.169  415.541   23.893  471.203   21.032 -55.66159 31.83118 
1 1 1   11   40   11 o  303.554   19.978   73.084   9.2305   58.982   13.117   86.916   12.991  264.602   33.113  327.168   26.162 -62.56564 42.20056 
1 1 1   11   40   12 o  243.653   34.640   50.616   12.555   0.0000   0.0000   50.616   12.555  ?   ?   243.653   34.640 0.000000 34.64023 
1 1 1   11   40   13 f  316.432   27.715   82.107   13.288   0.0000   0.0000   82.107   13.288  ?   ?   316.432   27.715 0.000000 27.71510 
1 1 1   11   40   14 o  136.816   46.614   17.026   11.692   0.0000   0.0000   17.026   11.692  ?   ?   136.816   46.614 0.000000 46.61384 
1 1 1   11   40   15 o   97.011   42.209   1.7534   11.713   0.0000   0.0000   1.7534   11.713  ?   ?    97.011   42.209 0.000000 42.20919 
1 1 1   11   40   16 o  366.001   18.623  106.059   10.398   90.859   14.302  123.104   15.145  331.387   28.472  388.744   25.596 -57.35727 38.28640 
1 1 1   11   40   17 o  146.876   37.057   19.307   8.3304   18.315   11.257   20.508   12.386  139.973   45.695  146.578   47.937 -6.605087 66.22692 
1 1 1   11   40   18 o   78.262   32.548   2.2664   6.4391  -2.1571   7.6404   13.110   11.963   72.562   32.679  123.877   46.534 -51.31499 56.86239 
1 1 1   11   40   19 o  257.679   18.907   52.884   7.4052   48.244   8.7616   64.488   13.855  243.283   23.835  273.704   33.790 -30.42108 41.35054 
1 1 1   11   40   20 o  305.442   16.621   73.631   7.7413   79.095   9.2345   60.714   14.199  314.997   19.245  262.958   36.241 52.03931 41.03407 
1 1 1   11   40   21 o  214.916   28.448   38.893   9.1280   42.710   12.321   34.249   13.590  217.797   38.360  186.889   47.429 30.90761 61.00027 
1 1 1   11   40   22 f  190.160   32.905   31.606   9.2309   39.877   13.009   23.218   13.100  205.889   42.682  151.516   49.287 54.37335 65.19949 
1 1 1   11   40   23 o  265.383   19.096   56.489   7.7048   55.338   9.3026   59.001   13.750  259.514   23.680  257.291   35.891 2.222961 42.99905 
1 1 1   11   40   24 o  109.681   35.865   10.795   6.9334   17.974   8.4437  -4.0649   12.148  138.241   38.487   85.587   39.543 52.65378 55.18022 
1 1 1   11   40   25 o  147.574   31.805   19.422   6.9725   20.864   8.6521   16.753   11.776  148.871   37.878  129.638   46.588 19.23293 60.04280 
1 1 1   11   40   26 o  290.831   17.588   67.733   7.7926   73.254   9.8666   58.578   12.705  299.096   21.700  256.606   33.119 42.49002 39.59488 
1 1 1   11   40   27 o  208.929   23.001   36.312   7.2338   45.973   9.1845   20.527   11.740  232.628   26.254  139.516   46.712 93.11258 53.58443 
1 1 1   11   40   28 o  138.866   32.364   17.628   6.7519   13.875   8.7319   23.209   10.648  119.219   40.284  150.099   43.697 -30.88059 59.43275 
1 1 1   11   40   29 o  149.181   37.361   21.453   8.5124   21.453   8.5124   0.0000   0.0000  149.181   37.361  ?   ?  0.000000 37.36089 
1 1 1   11   41    1 o  224.825   30.581   42.220   10.251   0.0000   0.0000   42.220   10.251  ?   ?   224.825   30.581 0.000000 30.58093 
1 1 1   11   41    2 o  305.911   24.803   75.660   11.514   0.0000   0.0000   75.660   11.514  ?   ?   305.911   24.803 0.000000 24.80269 
1 1 1   11   41    3 o  124.680   42.213   13.477   9.5882   0.0000   0.0000   13.477   9.5882  ?   ?   124.680   42.213 0.000000 42.21263 
1 1 1   11   41    4 o  305.763   25.267   75.782   11.719   0.0000   0.0000   75.782   11.719  ?   ?   305.763   25.267 0.000000 25.26702 
1 1 1   11   41    5 o  100.283   41.174   5.1632   10.126   0.0000   0.0000   5.1632   10.126  ?   ?   100.283   41.174 0.000000 41.17414 
1 1 1   11   41    6 o  194.733   39.277   33.628   11.303   0.0000   0.0000   33.628   11.303  ?   ?   194.733   39.277 0.000000 39.27744 
1 1 1   11   41    7 o  325.122   25.656   85.928   12.663   0.0000   0.0000   85.928   12.663  ?   ?   325.122   25.656 0.000000 25.65550 
1 1 1   11   41    8 o  321.290   25.699   84.008   12.532   0.0000   0.0000   84.008   12.532  ?   ?   321.290   25.699 0.000000 25.69918 
1 1 1   11   41    9 o  327.493   19.133   85.021   9.5493   86.210   13.844   83.942   13.189  323.333   28.257  319.866   27.197 3.467621 39.21920 
1 1 1   11   41   10 o  177.564   31.449   26.864   8.2345   13.910   11.636   39.858   11.654  126.738   46.199  213.299   37.041 -86.56042 59.21481 
1 1 1   11   41   11 o  171.838   33.009   25.473   8.3666   20.056   11.603   31.341   12.075  146.011   46.276  183.965   43.558 -37.95401 63.55148 
1 1 1   11   41   12 o  397.723   16.741  124.243   10.191  125.080   14.324  123.386   14.503  393.252   23.911  390.132   24.410 3.120758 34.17002 
1 1 1   11   41   13 o  338.175   18.631   90.671   9.6067   92.855   13.617   88.507   13.555  336.232   26.679  327.732   27.268 8.500427 38.14870 
1 1 1   11   41   14 o   69.167   31.698  -3.6913   7.5869 -11.2469   10.022   6.4535   11.612   69.042   33.088  106.138   43.889 -37.09576 54.96434 
1 1 1   11   41   15 o  209.082   26.740   36.277   8.3614   43.811   11.026   26.080   12.827  225.848   32.858  163.363   48.077 62.48477 58.23300 
1 1 1   11   41   16 o  290.518   20.736   67.728   9.1600   70.709   12.094   63.716   14.028  291.977   27.382  271.034   34.605 20.94272 44.12822 
1 1 1   11   41   17 f  107.518   38.757   9.6325   8.1561   13.562   10.717   4.2239   12.573  123.114   44.419  102.862   44.241 20.25247 62.69244 
1 1 1   11   41   18 o  300.092   20.976   72.551   9.5742   66.502   12.828   80.158   14.385  279.715   30.454  306.685   31.074 -26.97046 43.50901 
1 1 1   11   41   19 o  203.372   29.417   35.288   8.8912   39.679   12.307   30.494   12.860  207.164   40.261  175.118   46.997 32.04620 61.88422 
1 1 1   11   41   20 o  300.199   17.414   71.704   7.9671   69.218   9.6212   77.128   14.212  291.900   21.689  298.965   31.532 -7.065460 38.27117 
1 1 1   11   41   21 o  287.534   17.765   66.016   7.7802   66.600   9.5393   64.855   13.446  285.705   21.982  271.838   32.992 13.86737 39.64458 
1 1 1   11   41   22 o  215.411   22.649   38.240   7.3559   30.092   9.0983   53.618   12.499  183.264   33.676  245.114   34.252 -61.84985 48.03378 
1 1 1   11   41   23 o  219.812   22.203   39.799   7.3679   43.844   8.9564   31.331   12.958  227.788   26.163  173.536   47.432 54.25232 54.16891 
1 1 1   11   41   24 o   68.356   30.674  -1.1598   6.6630   3.2524   8.1126 -10.3057   11.680   85.088   36.030   74.690   35.776 10.39793 50.77472 
1 1 1   11   41   25 o   45.601   22.808 -16.3763   6.6538 -15.5263   8.1542 -18.0702   11.511   54.053   26.732   65.911   32.437 -11.85823 42.03278 
1 1 1   11   41   26 o  209.766   22.568   36.630   7.1320   37.176   8.9821   35.698   11.732  205.926   29.325  190.160   41.476 15.76575 50.79594 
1 1 1   11   42    0 o   58.125   38.866  -2.1035   9.5435  -2.1035   9.5435  -2.1035   9.5435   58.125   38.866   58.125   38.866 0.000000 0.000000 
1 1 1   11   42    1 o  235.031   21.336   44.376   7.5920   58.738   10.737   30.014   10.737  267.328   26.593  182.596   39.559 84.73264 47.66674 
1 1 1   11   42    2 o  261.196   16.834   53.794   6.6945   51.842   8.1350   57.891   11.783  254.283   21.092  263.114   29.782 -8.831528 36.49411 
1 1 1   11   42    3 o  115.320   32.290   11.531   5.9256   6.2621   7.5077   20.235   9.6502   95.254   36.610  148.535   41.070 -53.28102 55.01829 
1 1 1   11   42    4 o   57.240   26.723  -4.6464   5.7755   1.4610   7.3032 -14.8421   9.4361   79.839   34.011   62.285   30.381 17.55436 45.60414 
1 1 1   11   42    5 o  111.737   32.588   10.807   5.9172   9.4166   7.1474   13.835   10.549  106.191   36.442  125.170   44.188 -18.97959 57.27636 
1 1 1   11   42    6 o  200.455   21.405   32.407   6.4660   24.030   7.5833   54.719   12.376  167.835   30.649  253.355   32.676 -85.52017 44.80046 
1 1 1   11   42    7 o  338.470   14.195   89.378   7.3539   89.147   8.9945   89.843   12.772  335.929   17.554  331.724   25.346 4.205383 30.83077 
1 1 1   11   42    8 o  162.274   25.187   21.797   6.0533   21.778   7.2105   21.844   11.141  159.471   30.654  151.864   44.836 7.606537 54.31358 
1 1 1   11   42    9 o  178.078   22.780   25.856   6.0668   25.015   7.1898   27.934   11.305  172.411   28.221  172.966   42.908 -0.5544128 51.35677 
1 1 1   11   42   10 o  213.988   20.638   36.837   6.6758   35.698   7.7113   40.244   13.338  208.519   24.637  208.116   43.281 0.4033813 49.80162 
1 1 1   11   42   11 o  112.598   38.321   11.005   7.9022   7.4041   10.523   15.661   11.966  105.424   42.454  130.495   46.955 -25.07145 63.30229 
1 1 1   11   42   12 o  205.655   27.630   35.422   8.4774   32.649   11.374   38.889   12.715  188.336   40.649  204.947   41.946 -16.61179 58.41035 
1 1 1   11   42   13 o  141.692   36.974   18.263   8.1038   13.383   11.024   24.000   11.953  122.434   44.916  156.380   46.510 -33.94546 64.65765 
1 1 1   11   42   14 o  168.158   33.053   24.870   8.2041   26.230   10.856   23.058   12.528  166.035   42.527  151.783   48.083 14.25218 64.19155 
1 1 1   11   42   15 o   69.141   31.935  -4.1887   7.9154 -10.7386   10.414   4.7707   12.180   70.567   33.796  101.926   43.683 -31.35896 55.23007 
1 1 1   11   42   16 o  160.034   35.504   23.202   8.4694   21.185   11.220   25.872   12.913  146.166   45.388  158.827   48.588 -12.66170 66.48952 
1 1 1   11   42   17 o  286.704   22.113   67.072   9.6290   66.163   12.999   68.178   14.333  276.496   31.265  277.349   34.510 -0.8529358 46.56651 
1 1 1   11   42   18 o   95.519   38.156   6.3563   8.4253   0.4894   11.368   13.506   12.549   90.287   40.322  121.230   47.127 -30.94266 62.02250 
1 1 1   11   42   19 o  128.419   40.128   15.839   8.7549   4.0197   12.207   28.357   12.563   98.780   43.034  165.495   47.255 -66.71517 63.91328 
1 1 1   11   42   20 o  107.102   44.694   8.2634   12.201   0.0000   0.0000   8.2634   12.201  ?   ?   107.102   44.694 0.000000 44.69423 
1 1 1   11   42   21 o  178.258   26.710   27.198   7.0632   32.889   8.7650   16.659   11.928  193.247   30.656  127.868   46.750 65.37836 55.90534 
1 1 1   11   42   22 o  248.531   19.715   50.244   7.4382   50.829   9.0257   49.006   13.132  246.335   24.252  227.292   39.160 19.04329 46.06123 
1 1 1   11   42   23 o  282.209   17.476   63.989   7.5118   60.161   9.1731   71.782   13.088  269.523   22.440  285.916   30.372 -16.39307 37.76227 
1 1 1   11   43    0 o   83.152   47.198   8.3622   9.3126   8.3622   9.3126   8.3622   9.3126   83.152   47.198   83.152   47.198 0.000000 0.000000 
1 1 1   11   43    1 o  363.468   15.802  103.782   8.7910   99.480   12.145  108.516   12.741  350.415   22.767  365.952   22.861 -15.53738 32.26401 
1 1 1   11   43    2 o  250.318   17.350   49.702   6.6066   50.511   8.5840   48.526   10.347  249.269   22.749  240.245   28.707 9.024414 36.62830 
1 1 1   11   43    3 o  158.682   25.863   21.059   6.0653   22.739   7.5434   17.986   10.202  161.869   31.580  137.893   43.355 23.97595 53.63698 
1 1 1   11   43    4 o  312.895   14.593   76.650   6.9889   74.625   8.6872   80.366   11.767  306.075   18.632  313.070   24.758 -6.994568 30.98536 
1 1 1   11   43    5 o  156.746   27.557   20.808   6.3701   18.983   7.9283   24.131   10.700  145.044   35.904  159.205   42.928 -14.16080 55.96363 
1 1 1   11   43    6 o  234.612   19.084   44.074   6.7937   41.070   8.3848   49.816   11.591  222.971   24.999  240.200   32.350 -17.22902 40.88355 
1 1 1   11   43    7 o  193.386   21.903   30.480   6.3691   23.768   7.6772   45.298   11.407  165.258   31.501  227.613   33.766 -62.35593 46.17833 
1 1 1   11   43    8 o  209.674   21.266   35.686   6.7304   35.305   8.3848   36.376   11.285  204.809   27.437  199.904   38.276 4.904556 47.09352 
1 1 1   11   43    9 o  155.131   28.815   20.669   6.5902   24.803   7.8883   11.115   11.991  168.436   31.762  116.139   45.795 52.29662 55.73147 
1 1 1   11   43   10 o  116.257   33.094   12.075   6.1715   13.216   7.3149   9.2582   11.496  120.384   36.516  110.411   44.405 9.972244 57.49124 
1 1 1   11   43   11 o  162.863   34.646   23.872   8.3711   23.642   11.605   24.122   12.087  153.727   45.851  154.420   46.961 -0.6926727 65.63270 
1 1 1   11   43   12 o  105.879   38.806   9.5615   8.2262  -0.4821   11.155   21.534   12.179   88.208   39.628  145.336   47.535 -57.12875 61.88663 
1 1 1   11   43   13 o   88.090   36.663   3.9553   8.1790   22.183   11.622 -13.9291   11.512  147.852   46.241   70.811   34.314 77.04123 57.58193 
1 1 1   11   43   14 o  101.957   38.409   8.5831   8.1612  -0.9760   11.260   19.162   11.846   87.244   39.446  137.234   46.917 -49.98994 61.29601 
1 1 1   11   43   15 o  256.589   23.800   54.574   9.2409   52.027   12.632   57.505   13.553  239.932   35.467  251.556   36.246 -11.62439 50.71180 
1 1 1   11   43   16 o   94.747   38.203   6.2069   8.5328   0.8001   11.990   11.755   12.146   91.958   41.214  115.355   45.897 -23.39735 61.68603 
1 1 1   11   43   17 o   92.949   38.173   5.5095   8.7066   6.9655   12.060   3.9246   12.582  103.716   43.925   98.746   43.336 4.969643 61.70390 
1 1 1   11   43   18 o   56.698   27.841 -13.8668   8.3300 -10.2492   11.653 -17.6467   11.912   74.579   35.726   67.944   33.349 6.635124 48.87196 
1 1 1   11   43   19 o  154.193   38.062   22.786   8.9288   25.129   12.856   20.602   12.410  151.753   48.777  138.509   47.991 13.24469 68.42729 
1 1 1   11   44    0 o  163.903   45.992   26.889   9.9866   26.889   9.9866   26.889   9.9866  163.903   45.992  163.903   45.992 0.000000 0.000000 
1 1 1   11   44    1 o  144.304   27.116   17.822   5.7693   13.318   7.2402   25.656   9.5489  120.448   36.283  165.953   38.360 -45.50494 52.80101 
1 1 1   11   44    2 o  146.623   27.981   18.507   6.0504   20.201   7.6003   15.576   9.9976  149.671   33.955  127.376   43.105 22.29553 54.87230 
1 1 1   11   44    3 o  120.125   31.162   12.831   5.7785   19.121   7.4513   3.3392   9.1529  145.402   34.075   89.650   38.130 55.75221 51.13692 
1 1 1   11   44    4 o  108.648   33.593   10.556   6.1539   16.371   7.5636  -0.8338   10.585  133.115   36.176   85.560   38.505 47.55451 52.83322 
1 1 1   11   44    5 o  122.404   31.840   13.408   6.0219   15.349   7.3298   9.3768   10.563  128.997   35.839  108.331   42.897 20.66558 55.89783 
1 1 1   11   44    6 o  197.855   21.837   32.110   6.5030   29.608   7.9656   37.110   11.260  185.359   29.029  200.385   38.105 -15.02611 47.90289 
1 1 1   11   44    7 o   92.051   33.683   6.8026   6.1939   12.364   7.5567  -4.5834   10.812  115.784   37.415   79.876   37.045 35.90855 52.65145 
1 1 1   11   44    8 o   60.401   28.002  -3.7850   6.1694  -6.2074   7.5633   1.0315   10.665   63.383   29.902   88.927   39.423 -25.54387 49.48012 
1 1 1   11   44    9 o  116.107   32.801   12.207   6.0866   6.6556   7.2157   25.901   11.332   93.413   35.894  160.417   44.561 -67.00472 57.21902 
1 1 1   11   44   10 o  253.126   18.585   51.578   7.1504   53.167   8.7502   48.385   12.405  253.959   22.752  230.122   36.432 23.83641 42.95254 
1 1 1   11   44   11 o  191.344   31.156   32.261   8.8109   22.324   12.340   42.597   12.585  145.485   47.860  211.637   40.322 -66.15143 62.58154 
1 1 1   11   44   12 o  324.591   19.810   85.346   9.7952   94.775   14.097   76.544   13.621  333.342   27.885  296.549   30.439 36.79288 41.28070 
1 1 1   11   44   13 o  177.306   32.262   28.136   8.4331   22.861   12.041   33.213   11.814  147.044   47.200  183.088   42.907 -36.04427 63.78703 
1 1 1   11   45    0 o  162.587   46.036   26.776   9.9227   26.776   9.9227   26.776   9.9227  162.587   46.036  162.587   46.036 0.000000 0.000000 
1 1 1   11   45    1 o   71.838   29.783   2.2196   5.3678   6.2171   6.8797  -4.0009   8.5820   90.806   35.007   71.566   33.125 19.24059 48.19448 
1 1 1   11   45    2 o   80.076   31.316   4.2836   5.5672   1.2122   7.1954   8.8648   8.7876   76.648   33.216  103.099   39.612 -26.45134 51.69528 
1 1 1   11   45    3 o  126.361   31.482   14.394   6.0666   23.684   7.6505  -1.3440   9.9574  162.822   31.839   81.609   36.978 81.21348 48.79636 
1 1 1   11   45    4 o  185.536   22.648   28.567   6.2983   28.249   7.7137   29.204   10.909  180.294   28.930  172.591   41.750 7.702759 50.79425 
1 1 1   12    0    1 o  641.395   10.767  315.288   10.564  315.288   10.564  315.288   10.564  641.395   10.767  641.395   10.767 0.000000 0.000000 
1 1 1   12    0    2 o  193.414   9.8484   28.865   2.8983   28.865   2.8983   28.865   2.8983  193.414   9.8484  193.414   9.8484 0.000000 0.000000 
1 1 1   12    0    4 o  1244.57   16.866  1187.74   32.117  1187.74   32.117  1187.74   32.117  1244.57   16.866  1244.57   16.866 0.000000 0.000000 
1 1 1   12    0    7 o   78.316   11.981   5.0149   1.3364   5.0149   1.3364   5.0149   1.3364   78.316   11.981   78.316   11.981 0.000000 0.000000 
1 1 1   12    0    8 o  376.952   4.7462  108.809   2.7375  108.809   2.7375  108.809   2.7375  376.952   4.7462  376.952   4.7462 0.000000 0.000000 
1 1 1   12    0    9 o  875.214   9.0695  586.638   12.147  586.638   12.147  586.638   12.147  875.214   9.0695  875.214   9.0695 0.000000 0.000000 
1 1 1   12    0   10 o  1366.68   10.490  1430.39   21.941  1430.39   21.941  1430.39   21.941  1366.68   10.490  1366.68   10.490 0.000000 0.000000 
1 1 1   12    0   11 o  173.112   6.1816   23.026   1.6332   23.026   1.6332   23.026   1.6332  173.112   6.1816  173.112   6.1816 0.000000 0.000000 
1 1 1   12    0   12 o  140.221   9.2184   15.247   1.9589   15.247   1.9589   15.247   1.9589  140.221   9.2184  140.221   9.2184 0.000000 0.000000 
1 1 1   12    0   13 o  680.471   6.8976  354.543   7.1825  354.543   7.1825  354.543   7.1825  680.471   6.8976  680.471   6.8976 0.000000 0.000000 
1 1 1   12    0   14 o  175.359   7.1802   23.656   1.9199   23.656   1.9199   23.656   1.9199  175.359   7.1802  175.359   7.1802 0.000000 0.000000 
1 1 1   12    0   15 o  869.510   6.7755  578.804   9.0162  578.804   9.0162  578.804   9.0162  869.510   6.7755  869.510   6.7755 0.000000 0.000000 
1 1 1   12    0   16 o  445.941   5.6312  152.280   3.8423  152.280   3.8423  152.280   3.8423  445.941   5.6312  445.941   5.6312 0.000000 0.000000 
1 1 1   12    0   17 o   82.217   19.624   5.9805   2.1428   5.9805   2.1428   5.9805   2.1428   82.217   19.624   82.217   19.624 0.000000 0.000000 
1 1 1   12    0   18 o  196.199   7.9520   29.610   2.3791   29.610   2.3791   29.610   2.3791  196.199   7.9520  196.199   7.9520 0.000000 0.000000 
1 1 1   12    0   19 o  641.957   7.1481  315.554   7.0218  315.554   7.0218  315.554   7.0218  641.957   7.1481  641.957   7.1481 0.000000 0.000000 
1 1 1   12    0   20 o  272.046   7.3184   56.771   3.0424   56.771   3.0424   56.771   3.0424  272.046   7.3184  272.046   7.3184 0.000000 0.000000 
1 1 1   12    0   21 o  1498.48   11.652  1719.41   26.721  1719.41   26.721  1719.41   26.721  1498.48   11.652  1498.48   11.652 0.000000 0.000000 
1 1 1   12    0   22 o  975.939   8.7678  729.263   13.095  729.263   13.095  729.263   13.095  975.939   8.7678  975.939   8.7678 0.000000 0.000000 
1 1 1   12    0   23 o  1035.15   9.1360  820.450   14.473  820.450   14.473  820.450   14.473  1035.15   9.1360  1035.15   9.1360 0.000000 0.000000 
1 1 1   12    0   24 o  1090.85   8.2576  911.038   13.786  911.038   13.786  911.038   13.786  1090.85   8.2576  1090.85   8.2576 0.000000 0.000000 
1 1 1   12    0   25 o  366.478   7.8169  102.947   4.3803  102.947   4.3803  102.947   4.3803  366.478   7.8169  366.478   7.8169 0.000000 0.000000 
1 1 1   12    0   26 o  245.946   11.484   46.617   4.3016   46.617   4.3016   46.617   4.3016  245.946   11.484  245.946   11.484 0.000000 0.000000 
1 1 1   12    0   27 o  512.542   7.3188  201.211   5.7391  201.211   5.7391  201.211   5.7391  512.542   7.3188  512.542   7.3188 0.000000 0.000000 
1 1 1   12    0   28 o  612.166   7.3121  286.983   6.8492  286.983   6.8492  286.983   6.8492  612.166   7.3121  612.166   7.3121 0.000000 0.000000 
1 1 1   12    0   29 o  526.724   7.7577  212.520   6.2513  212.520   6.2513  212.520   6.2513  526.724   7.7577  526.724   7.7577 0.000000 0.000000 
1 1 1   12    0   30 o  138.566   26.692   16.267   5.0549   16.267   5.0549   16.267   5.0549  138.566   26.692  138.566   26.692 0.000000 0.000000 
1 1 1   12    0   31 o  419.175   8.9240  134.708   5.7198  134.708   5.7198  134.708   5.7198  419.175   8.9240  419.175   8.9240 0.000000 0.000000 
1 1 1   12    0   32 o   48.976   30.888   0.7950   4.9113   0.7950   4.9113   0.7950   4.9113   48.976   30.888   48.976   30.888 0.000000 0.000000 
1 1 1   12    0   33 o  658.831   9.3013  332.564   9.3754  332.564   9.3754  332.564   9.3754  658.831   9.3013  658.831   9.3013 0.000000 0.000000 
1 1 1   12    0   34 o  646.107   11.246  320.051   11.114  320.051   11.114  320.051   11.114  646.107   11.246  646.107   11.246 0.000000 0.000000 
1 1 1   12    0   35 o  603.589   11.995  279.463   11.072  279.463   11.072  279.463   11.072  603.589   11.995  603.589   11.995 0.000000 0.000000 
1 1 1   12    0   36 o  478.315   8.9647  175.403   6.5581  175.403   6.5581  175.403   6.5581  478.315   8.9647  478.315   8.9647 0.000000 0.000000 
1 1 1   12    0   37 o   40.613   26.886  -1.0683   4.3781  -1.0683   4.3781  -1.0683   4.3781   40.613   26.886   40.613   26.886 0.000000 0.000000 
1 1 1   12    0   38 o  323.702   10.896   80.574   5.3847   80.574   5.3847   80.574   5.3847  323.702   10.896  323.702   10.896 0.000000 0.000000 
1 1 1   12    0   39 f  331.199   11.636   84.408   5.8824   84.408   5.8824   84.408   5.8824  331.199   11.636  331.199   11.636 0.000000 0.000000 
1 1 1   12    0   40 o  102.711   31.876   10.188   4.3892   10.188   4.3892   10.188   4.3892  102.711   31.876  102.711   31.876 0.000000 0.000000 
1 1 1   12    0   41 o  286.664   11.596   63.335   5.0691   63.335   5.0691   63.335   5.0691  286.664   11.596  286.664   11.596 0.000000 0.000000 
1 1 1   12    0   42 o  121.222   31.065   13.383   4.9824   13.383   4.9824   13.383   4.9824  121.222   31.065  121.222   31.065 0.000000 0.000000 
1 1 1   12    0   43 o   89.171   33.201   8.2914   4.2161   8.2914   4.2161   8.2914   4.2161   89.171   33.201   89.171   33.201 0.000000 0.000000 
1 1 1   12    0   44 o   60.141   34.215   3.7433   4.9088   3.7433   4.9088   3.7433   4.9088   60.141   34.215   60.141   34.215 0.000000 0.000000 
1 1 1   12    0   45 o   73.081   34.463   6.1393   4.3510   6.1393   4.3510   6.1393   4.3510   73.081   34.463   73.081   34.463 0.000000 0.000000 
1 1 1   12    0   46 o  495.132   9.1984  188.249   6.9657  188.249   6.9657  188.249   6.9657  495.132   9.1984  495.132   9.1984 0.000000 0.000000 
1 1 1   12    0   47 o   63.892   37.166   4.0931   5.9864   4.0931   5.9864   4.0931   5.9864   63.892   37.166   63.892   37.166 0.000000 0.000000 
1 1 1   12    0   48 o   30.110   21.512  -6.6454   4.4880  -6.6454   4.4880  -6.6454   4.4880   30.110   21.512   30.110   21.512 0.000000 0.000000 
1 1 1   12    0   49 o  329.227   11.541   83.646   5.7994   83.646   5.7994   83.646   5.7994  329.227   11.541  329.227   11.541 0.000000 0.000000 
1 1 1   12    0   50 o   40.242   27.433  -2.8064   5.2186  -2.8064   5.2186  -2.8064   5.2186   40.242   27.433   40.242   27.433 0.000000 0.000000 
1 1 1   12    0   51 o  141.350   26.733   17.193   5.1807   17.193   5.1807   17.193   5.1807  141.350   26.733  141.350   26.733 0.000000 0.000000 
1 1 1   12    0   52 o   57.599   33.881   3.2524   5.0684   3.2524   5.0684   3.2524   5.0684   57.599   33.881   57.599   33.881 0.000000 0.000000 
1 1 1   12    0   53 o  341.649   13.747   90.557   7.1621   90.557   7.1621   90.557   7.1621  341.649   13.747  341.649   13.747 0.000000 0.000000 
1 1 1   12    0   54 o  238.614   16.044   44.721   5.7989   44.721   5.7989   44.721   5.7989  238.614   16.044  238.614   16.044 0.000000 0.000000 
1 1 1   12    0   55 o   71.888   37.480   6.2628   5.3855   6.2628   5.3855   6.2628   5.3855   71.888   37.480   71.888   37.480 0.000000 0.000000 
1 1 1   12    0   56 o   33.499   24.125 -10.2439   6.1426 -10.2439   6.1426 -10.2439   6.1426   33.499   24.125   33.499   24.125 0.000000 0.000000 
1 1 1   12    0   57 f   67.682   38.853   5.3050   6.4090   5.3050   6.4090   5.3050   6.4090   67.682   38.853   67.682   38.853 0.000000 0.000000 
1 1 1   12    0   58 o   84.677   38.490   8.6824   5.3996   8.6824   5.3996   8.6824   5.3996   84.677   38.490   84.677   38.490 0.000000 0.000000 
1 1 1   12    0   59 o  148.314   26.324   19.128   5.4145   19.128   5.4145   19.128   5.4145  148.314   26.324  148.314   26.324 0.000000 0.000000 
1 1 1   12    0   60 o  184.606   19.549   27.827   5.3820   27.827   5.3820   27.827   5.3820  184.606   19.549  184.606   19.549 0.000000 0.000000 
1 1 1   12    0   61 o   32.754   23.351  -6.6646   5.1792  -6.6646   5.1792  -6.6646   5.1792   32.754   23.351   32.754   23.351 0.000000 0.000000 
1 1 1   12    0   62 o   48.626   30.906   1.4763   5.0244   1.4763   5.0244   1.4763   5.0244   48.626   30.906   48.626   30.906 0.000000 0.000000 
1 1 1   12    1    0 o  639.879   10.550  313.782   10.326  313.782   10.326  313.782   10.326  639.879   10.550  639.879   10.550 0.000000 0.000000 
1 1 1   12    1    1 o  654.337   7.5415  327.860   7.5531  324.888   10.695  330.817   10.669  651.177   10.730  657.101   10.608 -5.923767 15.08817 
1 1 1   12    1    2 o  214.536   9.5433   35.256   3.1338   35.256   3.1338   0.0000   0.0000  214.536   9.5433  ?   ?  0.000000 9.543315 
1 1 1   12    1    3 o  689.798   8.0383  364.385   8.4870  354.911   11.711  374.864   12.316  680.564   11.243  699.412   11.505 -18.84802 16.08599 
1 1 1   12    1    4 o  405.301   9.6601  125.833   5.9928   0.0000   0.0000  125.833   5.9928  ?   ?   405.301   9.6601 0.000000 9.660050 
1 1 1   12    1    5 o  254.321   4.2109   49.508   1.6392   49.465   2.6600   49.535   2.0813  254.173   6.8372  254.376   5.3456 -0.2034912 8.678855 
1 1 1   12    1    6 o  110.547   6.0810   9.3843   1.0250   7.3406   1.7074   10.536   1.2816   97.172   11.716  117.081   7.1863 -19.90976 13.74435 
1 1 1   12    1    7 o  1107.68   6.8884  939.440   11.679  922.036   18.095  951.867   15.290  1097.01   10.776  1114.81   8.9606 -17.79626 14.01510 
1 1 1   12    1    8 o  834.424   5.6400  533.017   7.2033  565.952   11.821  513.563   9.0851  859.620   8.9839  818.975   7.2475 40.64520 11.54286 
1 1 1   12    1    9 o  615.521   4.0930  289.995   3.8562  294.520   5.9244  286.668   5.0796  620.243   6.2404  611.945   5.4230 8.297546 8.267509 
1 1 1   12    1   10 o  320.494   4.0743   78.621   1.9987   79.230   2.4359   77.367   3.4964  321.721   4.9467  317.878   7.1861 3.843872 8.724049 
1 1 1   12    1   11 o  565.368   4.0962  244.660   3.5447  248.047   4.6838  240.120   5.4231  569.239   5.3757  560.043   6.3264 9.196289 8.301874 
1 1 1   12    1   12 o  444.213   3.6572  151.032   2.4866  152.412   3.5205  149.657   3.5128  446.216   5.1545  442.163   5.1904 4.052917 7.314944 
1 1 1   12    1   13 o  440.556   4.3832  148.561   2.9557  145.083   4.1899  152.005   4.1701  435.337   6.2880  445.604   6.1141 -10.26700 8.770423 
1 1 1   12    1   14 o  706.630   4.6137  382.197   4.9902  381.982   7.6992  382.353   6.5529  706.360   7.1212  706.737   6.0577 -0.3770752 9.349142 
1 1 1   12    1   15 o  1091.86   5.5248  912.561   9.2333  908.144   12.985  917.079   13.132  1089.11   7.7891  1094.45   7.8392 -5.341919 11.05093 
1 1 1   12    1   16 o  1159.91   5.8057  1029.86   10.307  1039.80   14.699  1020.24   14.457  1165.38   8.2407  1154.37   8.1823 11.00818 11.61290 
1 1 1   12    1   17 o  886.476   5.6323  601.524   7.6423  601.633   10.823  601.415   10.793  886.476   7.9761  886.315   7.9560 0.1601563 11.26572 
1 1 1   12    1   18 f  571.974   4.4839  250.404   3.9256  243.184   5.9160  256.083   5.2471  563.626   6.8576  578.401   5.9268 -14.77460 9.063872 
1 1 1   12    1   19 o  542.951   4.8861  225.640   4.0607  222.918   6.9628  227.043   4.9987  539.597   8.4304  544.619   5.9965 -5.021912 10.34550 
1 1 1   12    1   20 o  658.743   5.1755  332.149   5.2184  325.498   7.2899  339.139   7.4734  652.068   7.3039  665.590   7.3357 -13.52228 10.35179 
1 1 1   12    1   21 o  480.385   4.7368  176.633   3.4830  179.412   5.3941  174.646   4.5613  484.109   7.2795  477.654   6.2389 6.454987 9.587234 
1 1 1   12    1   22 o  825.747   5.3208  521.918   6.7250  519.687   10.255  523.602   8.9078  823.892   8.1319  827.028   7.0369 -3.135925 10.75387 
1 1 1   12    1   23 f  650.505   5.4394  323.904   5.4159  325.057   7.7511  322.804   7.5706  651.602   7.7716  649.344   7.6170 2.257996 10.88193 
1 1 1   12    1   24 o  1218.22   6.6538  1136.08   12.407  1127.58   16.326  1147.71   19.089  1213.53   8.7892  1224.21   10.187 -10.68237 13.45472 
1 1 1   12    1   25 o  680.345   4.9286  354.298   5.1324  364.585   7.3884  344.705   7.1349  690.095   6.9947  671.018   6.9467 19.07660 9.858173 
1 1 1   12    1   26 o  435.488   5.5494  145.173   3.6991  142.061   4.8868  149.349   5.6606  430.757   7.4118  441.646   8.3737 -10.88870 11.18273 
1 1 1   12    1   27 o  901.941   5.8087  622.739   8.0192  620.831   12.333  624.136   10.555  900.401   8.9484  902.869   7.6380 -2.467651 11.76490 
1 1 1   12    1   28 o  218.607   8.5246   36.595   2.8524   36.697   4.1127   36.500   3.9595  218.494   12.348  217.940   11.915 0.5540466 17.15899 
1 1 1   12    1   29 o  1218.22   6.8870  1136.24   12.842  1149.74   17.251  1119.47   19.232  1225.24   9.1987  1208.88   10.394 16.36047 13.87963 
1 1 1   12    1   30 o  361.870   7.0928  100.265   3.9286  102.732   6.2546   98.657   5.0489  366.170   11.160  358.901   9.1907 7.269257 14.45702 
1 1 1   12    1   31 o  330.157   7.2501   83.466   3.6638   81.187   5.2823   85.578   5.0862  325.522   10.602  334.232   9.9420 -8.709625 14.53400 
1 1 1   12    1   32 f  586.082   7.1370  263.025   6.4024  267.408   8.3416  256.743   9.9880  590.834   9.2239  578.800   11.274 12.03455 14.56653 
1 1 1   12    1   33 o  478.680   7.1489  175.469   5.2379  173.434   6.4135  179.544   9.0768  475.820   8.8060  483.915   12.254 -8.095093 15.09034 
1 1 1   12    1   34 o  516.701   6.0513  204.427   4.7858  201.911   6.7663  206.945   6.7701  513.380   8.6108  519.746   8.5101 -6.366760 12.10651 
1 1 1   12    1   35 o  336.624   9.0856   86.835   4.6813   75.648   6.7563   97.165   6.4923  313.909   14.062  355.918   11.917 -42.00809 18.43241 
1 1 1   12    1   36 o  190.674   12.588   28.024   3.6531   25.742   5.6646   29.649   4.7799  181.543   20.758  195.719   16.098 -14.17627 26.26920 
1 1 1   12    1   37 o  371.900   7.5405  105.974   4.2924  113.707   6.7640  100.760   5.5540  384.934   11.480  362.475   10.010 22.45892 15.23160 
1 1 1   12    1   38 o  794.959   6.1596  484.074   7.4949  471.447   9.8776  501.208   11.507  784.252   8.2286  808.451   9.2987 -24.19867 12.41678 
1 1 1   12    1   39 o  304.734   8.3910   71.200   3.9139   68.043   5.8754   73.719   5.2477  297.528   12.902  309.867   11.064 -12.33890 16.99617 
1 1 1   12    1   40 o  239.262   9.3741   43.925   3.4330   47.106   4.9809   41.046   4.7382  247.114   13.217  230.583   13.484 16.53127 18.88084 
1 1 1   12    1   41 o  536.979   6.4400  220.974   5.2931  222.030   7.1190  219.668   7.9154  537.969   8.6455  534.938   9.6672 3.031616 12.96920 
1 1 1   12    1   42 o   86.386   24.439   5.9908   3.3763   2.6802   5.0942   8.5843   4.5088   75.621   29.839  102.763   27.933 -27.14175 40.87298 
1 1 1   12    1   43 o  127.306   16.825   12.754   3.1981   12.631   4.5683   12.873   4.4787  124.877   24.775  126.258   24.053 -1.381363 34.53072 
1 1 1   12    1   44 o  173.511   14.293   23.403   3.7621   24.553   5.4314   22.343   5.2161  176.353   20.504  168.072   20.714 8.281891 29.14613 
1 1 1   12    1   45 o   41.621   19.796  -4.2578   3.4457  -8.2692   4.5787   0.9806   5.2324   43.264   21.116   69.755   29.203 -26.49091 36.03735 
1 1 1   12    1   46 o  421.372   7.5219  136.306   4.8513  134.161   7.7587  137.683   6.2165  417.006   12.156  423.084   9.5995 -6.078400 15.48899 
1 1 1   12    1   47 o  110.297   23.036   9.9431   3.7636   12.380   5.0021   6.7635   5.7137  122.188   27.420   94.273   32.569 27.91461 42.57431 
1 1 1   12    1   48 o  323.232   8.2134   80.317   4.0636   80.084   5.8505   80.534   5.6483  321.982   11.871  322.997   11.425 -1.014893 16.47577 
1 1 1   12    1   49 o  104.870   21.771   8.9954   3.3803   8.8157   4.7942   9.1732   4.7669  102.774   29.138  104.717   28.828 -1.943611 40.98888 
1 1 1   12    1   50 o  193.576   13.014   29.174   3.8337   28.182   5.2602   30.299   5.5990  188.628   18.455  195.467   18.952 -6.839066 26.45350 
1 1 1   12    1   51 o  167.971   15.283   22.176   3.8864   17.324   5.6463   26.544   5.3576  144.429   26.518  182.486   19.482 -38.05714 32.90539 
1 1 1   12    1   52 o  199.609   12.817   31.054   3.8951   23.332   5.6103   38.240   5.4121  169.759   22.117  220.470   16.150 -50.71059 27.38584 
1 1 1   12    1   53 o  127.290   22.528   13.325   4.2285   13.017   6.0441   13.621   5.9179  122.379   31.930  125.509   30.990 -3.129547 44.49636 
1 1 1   12    1   54 o  191.848   13.766   28.849   4.0155   30.485   5.8334   27.377   5.5358  194.833   19.838  184.507   19.918 10.32547 28.11159 
1 1 1   12    1   55 o  144.352   19.671   16.887   4.2331   16.930   6.5166   16.856   5.5677  139.111   31.355  141.084   26.762 -1.972916 41.22316 
1 1 1   12    1   56 o  233.522   12.804   42.681   4.5592   42.369   6.0162   43.102   6.9876  230.649   17.164  231.088   19.951 -0.4389343 26.31807 
1 1 1   12    1   57 o   63.384   26.619   1.1886   4.3696  -6.7265   6.8301   6.6728   5.6853   58.670   27.895   90.374   32.382 -31.70394 42.73980 
1 1 1   12    1   58 o  135.569   19.000   15.064   3.8343   14.284   5.4191   15.846   5.4259  127.015   28.567  134.741   27.246 -7.725525 39.47627 
1 1 1   12    1   59 o  162.854   15.745   21.292   3.8756   21.808   5.5473   20.801   5.4170  160.631   23.238  156.799   23.277 3.832092 32.89100 
1 1 1   12    1   60 o   52.425   23.061  -0.2632   3.5817   0.8040   5.0664  -1.3295   5.0643   64.502   27.912   58.489   26.449 6.013065 38.45277 
1 1 1   12    1   61 o  169.324   15.818   23.281   4.0522   22.660   5.4199   24.069   6.1018  162.566   22.375  165.648   24.831 -3.081573 33.42464 
1 1 1   12    1   62 o   87.404   25.370   6.9661   3.5939   9.5870   5.4507   4.9504   4.7802   98.858   31.758   77.202   29.321 21.65609 43.22423 
1 1 1   12    2    0 o   30.045   17.974   0.7113   1.4707   0.7113   1.4707   0.7113   1.4707   30.045   17.974   30.045   17.974 0.000000 0.000000 
1 1 1   12    2    1 o  855.235   8.8413  560.204   11.574  568.178   16.701  552.837   16.053  860.950   12.674  849.281   12.349 11.66840 17.69528 
1 1 1   12    2    2 o  276.073   5.9704   58.350   2.5229   62.898   3.9230   55.142   3.2945  286.567   8.9438  268.340   8.0211 18.22684 12.01375 
1 1 1   12    2    3 o  451.883   9.7037  156.421   6.7117  156.421   6.7117   0.0000   0.0000  451.883   9.7037  ?   ?  0.000000 9.703718 
1 1 1   12    2    4 o  591.599   10.407  268.136   9.4235   0.0000   0.0000  268.136   9.4235  ?   ?   591.599   10.407 0.000000 10.40677 
1 1 1   12    2    5 o  1178.91   9.3363  1064.55   16.847  1144.45   31.347  1032.10   19.977  1221.19   16.770  1160.58   11.246 60.61572 20.19183 
1 1 1   12    2    6 o  829.239   6.3573  526.464   8.0690  546.002   11.734  508.938   11.114  844.314   9.0798  815.166   8.9073 29.14850 12.71940 
1 1 1   12    2    7 o  1388.91   9.2494  1477.54   19.663  1478.47   27.745  1476.59   27.872  1388.79   13.052  1387.90   13.120 0.8948975 18.50662 
1 1 1   12    2    8 o  516.571   4.1245  204.252   3.2612  202.046   4.5394  206.605   4.6882  513.735   5.7728  519.495   5.8960 -5.760437 8.251545 
1 1 1   12    2    9 o  574.779   4.3281  252.880   3.8077  255.702   5.3678  250.022   5.4023  577.931   6.0681  571.473   6.1761 6.458008 8.658254 
1 1 1   12    2   10 o  559.772   4.2922  239.845   3.6775  237.042   5.1488  242.765   5.2544  556.448   6.0452  563.123   6.0961 -6.675781 8.585290 
1 1 1   12    2   11 f  251.975   4.0174   48.597   1.5494   48.152   2.2995   48.967   2.0969  250.798   5.9903  252.919   5.4165 -2.121689 8.075996 
1 1 1   12    2   12 o  618.583   3.9867  292.879   3.7746  294.443   5.3651  291.346   5.3116  620.194   5.6517  616.924   5.6251 3.269287 7.973887 
1 1 1   12    2   13 o  692.627   4.2069  367.192   4.4600  377.452   6.4587  357.841   6.1661  702.190   6.0093  683.708   5.8921 18.48157 8.415983 
1 1 1   12    2   14 o  990.141   5.5290  750.453   8.3795  751.326   12.904  749.817   11.019  990.576   8.5109  989.646   7.2740 0.9291992 11.19587 
1 1 1   12    2   15 o  623.015   4.1221  297.086   3.9309  289.394   5.4671  305.319   5.6559  614.864   5.8091  631.553   5.8509 -16.68964 8.244888 
1 1 1   12    2   16 o  322.358   4.3616   79.536   2.1520   78.982   2.8873   80.230   3.2280  321.217   5.8726  323.737   6.5143 -2.520142 8.770564 
1 1 1   12    2   17 o  606.895   5.2348  281.926   4.8627  289.971   10.864  279.910   5.4379  615.309   11.535  604.709   5.8751 10.59985 12.94489 
1 1 1   12    2   18 o  201.191   6.2875   30.985   1.9362   32.380   3.5168   30.378   2.3194  205.315   11.233  199.201   7.6069 6.114044 13.56670 
1 1 1   12    2   19 o  525.166   4.5384  211.096   3.6481  209.101   5.6467  212.526   4.7796  522.637   7.0587  526.920   5.9261 -4.283203 9.216523 
1 1 1   12    2   20 o  860.730   5.3108  567.073   6.9968  560.336   9.1488  576.564   10.860  855.555   6.9863  867.813   8.1755 -12.25818 10.75396 
1 1 1   12    2   21 o  430.009   4.5030  141.528   2.9638  141.660   4.2430  141.403   4.1417  430.184   6.4438  429.796   6.2958 0.3883667 9.008876 
1 1 1   12    2   22 o  825.969   5.3233  522.199   6.7300  524.734   10.421  520.386   8.8145  827.879   8.2240  824.485   6.9847 3.393616 10.78979 
1 1 1   12    2   23 o  1411.54   7.3492  1525.34   15.878  1524.68   21.062  1526.21   24.168  1411.06   9.7517  1411.65   11.185 -0.5849609 14.83916 
1 1 1   12    2   24 o  757.178   4.9463  438.836   5.7325  451.088   8.3109  427.717   7.9174  767.613   7.0735  747.469   6.9202 20.14447 9.895691 
1 1 1   12    2   25 o  570.475   5.6774  249.118   4.9574  252.682   6.1813  242.695   8.2993  574.508   7.0293  562.958   9.6316 11.55005 11.92386 
1 1 1   12    2   26 o  118.605   15.945   10.978   2.8213   9.3771   3.5414   13.761   4.6679  108.554   22.066  131.790   24.025 -23.23656 32.62075 
1 1 1   12    2   27 o  470.043   5.5868  169.129   4.0195  171.671   6.3185  167.401   5.2094  473.483   8.7185  467.597   7.2786 5.885284 11.35740 
1 1 1   12    2   28 o  949.785   5.6220  690.559   8.1731  691.400   11.702  689.758   11.420  950.236   8.0458  949.118   7.8610 1.118103 11.24853 
1 1 1   12    2   29 o  491.219   5.9484  184.724   4.4725  182.996   6.0515  186.803   6.6393  488.853   8.0876  493.887   8.7826 -5.034302 11.93912 
1 1 1   12    2   30 o  1151.86   7.2199  1015.89   12.729  1013.03   18.038  1018.73   17.966  1149.95   10.248  1153.19   10.179 -3.234253 14.44372 
1 1 1   12    2   31 o  388.451   7.4189  115.545   4.4111  123.533   6.3485  108.089   6.1335  401.550   10.329  375.597   10.669 25.95251 14.84964 
1 1 1   12    2   32 o  691.454   5.5979  366.030   5.9246  376.831   8.5940  356.247   8.1786  701.456   8.0044  682.039   7.8343 19.41644 11.20029 
1 1 1   12    2   33 f  603.960   6.1380  279.291   5.6743  268.598   7.4307  294.249   8.7882  592.178   8.1980  619.739   9.2645 -27.56152 12.37087 
1 1 1   12    2   34 o  101.279   21.398   8.1964   3.2133   4.9845   4.6312   11.178   4.4620   84.536   29.316  118.095   25.436 -33.55915 38.81233 
1 1 1   12    2   35 o  433.635   7.8745  144.051   5.2265  146.485   7.9483  142.197   6.9373  437.008   11.883  430.668   10.524 6.340546 15.87300 
1 1 1   12    2   36 o  299.818   8.0776   68.877   3.7069   65.665   5.3627   71.815   5.1297  292.537   11.977  305.995   10.952 -13.45776 16.22947 
1 1 1   12    2   37 o  646.184   5.7755  319.780   5.7124  304.167   8.0878  335.322   8.0693  629.971   8.3877  661.494   7.9697 -31.52283 11.57019 
1 1 1   12    2   38 o  108.847   21.508   9.4784   3.4563   10.251   5.0729   8.8088   4.7219  112.537   29.199  104.615   28.648 7.921936 40.90593 
1 1 1   12    2   39 o  241.977   10.156   44.934   3.7614   37.144   6.2677   49.318   4.7023  218.475   18.930  253.362   12.125 -34.88681 22.48036 
1 1 1   12    2   40 o  209.394   10.466   33.665   3.3545   38.039   4.9165   29.854   4.5885  221.780   14.564  196.227   15.401 25.55263 21.19678 
1 1 1   12    2   41 o  465.457   7.3369  166.098   5.2271  162.274   6.3709  173.975   9.1432  459.856   9.0512  475.556   12.561 -15.70044 15.48243 
1 1 1   12    2   42 o  261.841   9.2536   52.634   3.7087   56.097   5.8076   50.250   4.8193  269.396   14.134  255.534   12.321 13.86191 18.75038 
1 1 1   12    2   43 o  207.734   11.219   33.289   3.5541   40.727   5.6924   28.538   4.5499  228.887   16.356  191.536   15.656 37.35115 22.64165 
1 1 1   12    2   44 f  314.575   8.3689   75.971   4.0296   78.034   6.1374   74.408   5.3424  318.187   12.602  310.935   11.225 7.252228 16.87638 
1 1 1   12    2   45 o   89.944   24.304   6.5878   3.4254   3.1895   4.5577   10.999   5.1926   74.642   28.563  115.265   29.353 -40.62283 40.95668 
1 1 1   12    2   46 o  203.732   12.361   32.148   3.8363   38.346   6.5282   28.878   4.7413  220.728   19.524  192.197   16.270 28.53026 25.41434 
1 1 1   12    2   47 o  181.640   13.623   25.675   3.7599   19.906   4.9507   33.539   5.7797  157.887   21.007  206.417   18.489 -48.53015 27.98476 
1 1 1   12    2   48 o  267.869   9.2213   55.225   3.7808   54.875   5.4192   55.557   5.2773  266.210   13.300  267.960   12.867 -1.749359 18.50513 
1 1 1   12    2   49 o  186.484   12.362   27.017   3.5087   23.915   4.9869   30.058   4.9375  173.581   19.085  195.601   16.650 -22.02007 25.32703 
1 1 1   12    2   50 o  237.515   10.969   43.572   3.9878   38.803   5.4893   48.902   5.8031  222.378   16.239  250.127   15.230 -27.74950 22.26373 
1 1 1   12    2   51 o  101.691   24.420   8.6119   3.7532   5.3320   5.6028   11.282   5.0551   86.772   31.992  115.404   28.730 -28.63198 42.99899 
1 1 1   12    2   52 o  239.086   10.776   44.195   3.9436   43.250   5.5757   45.142   5.5785  234.729   15.608  239.958   15.268 -5.228333 21.83387 
1 1 1   12    2   53 o  132.927   21.536   14.427   4.2319   9.1536   5.8578   20.185   6.1205  103.783   32.879  155.453   26.684 -51.66953 42.34479 
1 1 1   12    2   54 o  288.118   9.6951   64.140   4.2756   65.739   6.1070   62.602   5.9879  290.299   13.744  283.262   13.811 7.037109 19.48419 
1 1 1   12    2   55 o   75.580   27.471   4.1567   4.1100   3.5913   6.3293   4.5689   5.4044   81.522   32.892   81.821   31.153 -0.2990570 45.30266 
1 1 1   12    2   56 f  281.777   11.024   61.662   4.7544   58.365   6.2795   66.091   7.2779  272.005   15.143  288.682   16.540 -16.67679 22.42467 
1 1 1   12    2   57 o  103.547   26.064   9.2795   4.1280   12.777   6.4985   6.9138   5.3449  118.176   34.061   90.872   31.494 27.30357 46.38989 
1 1 1   12    2   58 o   61.839   24.889   1.9214   3.6144   0.8065   5.0378   3.1041   5.1886   65.273   28.037   73.879   29.790 -8.606651 40.90879 
1 1 1   12    2   59 o  116.957   21.253   11.518   3.6645   15.288   5.2709   7.9922   5.0982  131.838   27.028   94.589   30.746 37.24918 40.93680 
1 1 1   12    2   60 o  101.196   23.748   8.9540   3.6151   4.9781   5.0413   13.163   5.1869   79.639   30.144  120.265   28.596 -40.62595 41.54964 
1 1 1   12    2   61 o  137.208   18.800   15.715   3.8445   10.531   5.2759   21.586   5.6138  105.028   30.811  157.289   24.085 -52.26069 39.10753 
1 1 1   12    2   62 o  111.999   22.311   11.010   3.6905   10.677   5.5751   11.269   4.9236  103.896   31.950  108.769   29.032 -4.872208 43.17027 
1 1 1   12    3    0 o  711.327   11.129  387.757   12.110  387.757   12.110  387.757   12.110  711.327   11.129  711.327   11.129 0.000000 0.000000 
1 1 1   12    3    1 o  720.957   6.4681  397.958   7.1376  398.581   12.493  397.656   8.6967  721.217   11.317  720.612   7.8846 0.6047974 13.79310 
1 1 1   12    3    2 o  1227.91   11.666  1155.46   21.926  1167.04   31.406  1144.45   30.624  1233.20   16.638  1221.26   16.382 11.94214 23.34993 
1 1 1   12    3    3 o  515.588   7.0138  203.542   5.5351  204.420   7.9756  202.726   7.6880  516.566   10.087  514.437   9.7637 2.128845 14.03844 
1 1 1   12    3    4 o  854.133   9.0557  558.774   11.839  558.013   16.836  559.519   16.651  853.202   12.892  854.369   12.733 -1.167297 18.12000 
1 1 1   12    3    5 o  1049.00   10.450  843.040   16.778  892.877   25.170  803.185   22.509  1078.92   15.241  1023.42   14.369 55.49683 20.94669 
1 1 1   12    3    6 o  968.020   8.1115  717.597   12.019  707.708   14.503  739.280   21.475  961.183   9.8575  981.890   14.289 -20.70685 17.35923 
1 1 1   12    3    7 o  461.961   5.1330  163.364   3.6295  159.107   5.0460  167.927   5.2244  455.847   7.2320  468.310   7.2884 -12.46234 10.26754 
1 1 1   12    3    8 o  569.951   5.4523  248.674   4.7565  270.054   7.0861  231.142   6.4170  593.864   7.7956  549.421   7.6306 44.44202 10.90859 
1 1 1   12    3    9 o  1235.21   6.3388  1168.07   11.984  1194.29   18.741  1149.94   15.588  1248.69   9.8057  1225.42   8.3106 23.26245 12.85369 
1 1 1   12    3   10 o  606.327   4.1307  281.395   3.8336  282.566   5.8129  280.493   5.0998  607.531   6.2511  605.321   5.5042 2.210388 8.328993 
1 1 1   12    3   11 o  497.166   4.1874  189.192   3.1865  194.686   4.6013  184.128   4.4172  504.297   5.9611  490.434   5.8844 13.86298 8.376184 
1 1 1   12    3   12 o  520.871   4.3724  207.665   3.4860  203.527   4.8304  212.162   5.0359  515.620   6.1204  526.442   6.2496 -10.82214 8.747433 
1 1 1   12    3   13 o  1598.46   7.9022  1956.29   19.334  1945.54   29.304  1964.58   25.729  1593.60   12.014  1601.57   10.495 -7.973633 15.95249 
1 1 1   12    3   14 o  804.952   4.8694  495.961   5.9995  492.797   9.1215  498.374   7.9648  802.297   7.4278  806.860   6.4492 -4.563049 9.836902 
1 1 1   12    3   15 o  234.082   5.6572   41.943   2.0269   43.456   3.5343   41.202   2.4743  238.220   9.6930  231.992   6.9679 6.228546 11.93757 
1 1 1   12    3   16 o  1061.35   6.8494  862.339   11.127  859.174   17.610  864.442   14.356  1059.18   10.862  1062.55   8.8272 -3.367310 13.99650 
1 1 1   12    3   17 o  678.115   5.0051  351.971   5.1950  343.622   8.8593  356.346   6.4133  669.930   8.6397  682.292   6.1411 -12.36163 10.59990 
1 1 1   12    3   18 o  1396.35   7.1655  1492.62   15.315  1464.26   22.889  1515.60   20.607  1382.78   10.815  1406.91   9.5692 -24.13037 14.44034 
1 1 1   12    3   19 o  362.411   4.3749  100.528   2.4268   99.847   3.5388  101.133   3.3344  361.160   6.4016  363.483   5.9933 -2.323364 8.769320 
1 1 1   12    3   20 o  1110.34   5.7386  943.693   9.7528  944.008   13.800  943.379   13.785  1110.43   8.1193  1110.06   8.1132 0.3699951 11.47814 
1 1 1   12    3   21 o  726.435   5.0346  403.919   5.5980  396.648   7.3221  414.148   8.6848  719.830   6.6456  735.507   7.7144 -15.67682 10.18213 
1 1 1   12    3   22 o  1143.49   6.3177  1000.92   11.058  974.922   16.489  1022.17   14.906  1128.37   9.5473  1155.46   8.4281 -27.08582 12.73514 
1 1 1   12    3   23 o  374.415   5.2824  107.305   3.0273  103.761   4.1069  111.521   4.4798  368.153   7.2881  381.665   7.6685 -13.51208 10.57932 
1 1 1   12    3   24 f  239.623   7.0153   43.957   2.5730   42.526   3.5162   45.607   3.7753  235.656   9.7482  244.037   10.107 -8.381790 14.04205 
1 1 1   12    3   25 o  1392.41   6.8781  1484.28   14.659  1493.47   20.898  1475.38   20.569  1396.49   9.7767  1388.02   9.6815 8.474854 13.75913 
1 1 1   12    3   26 o  682.838   5.0387  356.907   5.2663  370.253   7.7118  345.243   7.2091  695.421   7.2450  671.531   7.0136 23.89038 10.08370 
1 1 1   12    3   27 o  1220.08   7.3245  1139.71   13.678  1165.08   19.953  1117.23   18.788  1233.31   10.570  1207.76   10.163 25.55298 14.66328 
1 1 1   12    3   28 o  243.520   9.3636   45.417   3.4902   42.399   4.3795   50.669   5.7778  234.915   12.222  256.656   14.770 -21.74178 19.17101 
1 1 1   12    3   29 o  478.838   6.0509  175.532   4.4348  182.102   6.1372  168.352   6.4156  487.651   8.2223  468.855   8.9399 18.79630 12.14606 
1 1 1   12    3   30 o  122.697   17.629   11.790   3.2157   4.8434   5.3979   15.612   4.0037   87.034   31.506  141.333   18.988 -54.29819 36.78506 
1 1 1   12    3   31 o  368.302   7.0217  103.864   3.9584  107.559   6.2135  101.340   5.1353  374.667   10.835  363.733   9.2239 10.93362 14.22938 
1 1 1   12    3   32 o  479.455   6.0106  175.999   4.4110  170.229   6.4154  181.172   6.0747  471.418   8.8909  486.367   8.1600 -14.94968 12.06787 
1 1 1   12    3   33 o  203.636   11.771   31.896   3.6532   26.051   4.9323   39.000   5.4374  183.282   17.806  224.830   15.903 -41.54779 23.87393 
1 1 1   12    3   34 o  388.644   7.5203  115.689   4.4736  109.465   7.4091  119.259   5.6121  377.758   12.814  394.513   9.2938 -16.75479 15.82948 
1 1 1   12    3   35 o  1285.10   7.9346  1265.19   15.608  1273.51   22.513  1257.50   21.657  1288.61   11.414  1280.57   11.049 8.040405 15.88575 
1 1 1   12    3   36 o  812.245   5.7815  505.222   7.1878  511.370   10.409  499.618   9.9376  816.901   8.3248  807.495   8.0403 9.406250 11.57358 
1 1 1   12    3   37 o  241.510   9.6816   44.727   3.5789   46.050   4.9388   43.263   5.1935  244.492   13.247  236.814   14.396 7.678818 19.56343 
1 1 1   12    3   38 o  406.570   6.6071  126.637   4.1116  127.149   5.9709  126.175   5.6702  407.159   9.5810  405.636   9.1325 1.522339 13.23619 
1 1 1   12    3   39 o  443.798   6.7128  150.916   4.5599  146.239   7.2244  154.012   5.8790  436.448   10.814  448.158   8.5704 -11.70953 13.79861 
1 1 1   12    3   40 o  133.563   17.242   13.996   3.4425   7.6531   5.9123   17.250   4.2343  100.320   33.134  148.135   19.121 -47.81494 38.25566 
1 1 1   12    3   41 o  266.133   9.6667   54.373   3.9377   51.275   5.6220   57.355   5.5170  257.577   14.316  272.970   13.204 -15.39346 19.47600 
1 1 1   12    3   42 o  285.141   8.6888   62.397   3.7922   65.747   6.0023   60.172   4.8922  292.133   13.424  279.728   11.426 12.40485 17.62816 
1 1 1   12    3   43 o  237.301   9.6558   43.261   3.5072   41.748   5.4004   44.364   4.6122  231.962   15.296  239.662   12.617 -7.699966 19.82850 
1 1 1   12    3   44 o  235.854   9.5210   42.747   3.4371   45.950   5.1352   40.147   4.6262  243.596   13.830  227.744   13.329 15.85240 19.20747 
1 1 1   12    3   45 o  336.108   8.1157   86.743   4.1752   78.379   5.5304   97.829   6.3668  318.993   11.327  356.310   11.674 -37.31717 16.26583 
1 1 1   12    3   46 o  332.456   8.6189   84.938   4.3859   84.214   7.2543   85.355   5.5062  329.829   14.369  332.879   10.807 -3.050476 17.97959 
1 1 1   12    3   47 o  546.220   6.7071  228.971   5.6075  230.229   7.4961  227.372   8.4497  547.127   8.9511  543.336   10.160 3.790894 13.54079 
1 1 1   12    3   48 o   87.207   24.226   6.2341   3.3495   4.7533   4.9103   7.5228   4.5807   82.562   30.024   95.772   28.862 -13.21079 41.64640 
1 1 1   12    3   49 o   75.739   25.146   4.4159   3.4035   1.8229   4.7264   7.2086   4.9051   69.298   28.253   94.337   30.108 -25.03973 41.28884 
1 1 1   12    3   50 o   90.943   24.064   6.8461   3.4017   11.708   4.9156   2.3775   4.7124  118.069   27.681   71.214   28.504 46.85533 39.73337 
1 1 1   12    3   51 o   70.235   25.893   3.3056   3.6700   4.9788   5.3838   1.8531   5.0162   84.562   31.325   70.629   28.987 13.93362 42.67876 
1 1 1   12    3   52 o   79.217   26.431   4.9228   3.7587   9.3487   5.0408  -0.6198   5.6410  104.861   29.930   66.072   29.006 38.78943 41.67868 
1 1 1   12    3   53 o  218.397   12.379   37.151   4.1210   43.906   6.2103   31.837   5.5085  235.571   17.345  200.077   18.186 35.49396 25.13144 
1 1 1   12    3   54 o   61.023   24.887   1.4552   3.6686   4.9131   5.2808  -1.7705   5.1003   83.166   30.981   59.384   26.726 23.78181 40.91583 
1 1 1   12    3   55 o  191.879   14.256   28.962   4.1571   29.476   6.3676   28.580   5.4881  189.970   22.325  188.518   19.291 1.452469 29.50492 
1 1 1   12    3   56 o   68.120   26.822   2.6373   4.1082  -2.1636   5.3321   9.6497   6.4442   59.372   26.964  104.825   34.591 -45.45251 43.85915 
1 1 1   12    3   57 o  136.604   22.360   15.562   4.5135   15.841   6.4154   15.289   6.3512  132.648   31.973  130.212   32.076 2.436630 45.28958 
1 1 1   12    3   58 o  188.236   13.243   27.965   3.7913   27.038   5.2713   28.959   5.4569  182.090   19.202  188.517   19.178 -6.426956 27.13940 
1 1 1   12    3   59 o   68.145   25.405   3.3479   3.5522   1.5419   4.9185   5.3170   5.1358   66.695   28.138   82.093   30.558 -15.39804 41.53980 
1 1 1   12    3   60 o  101.550   23.795   9.0284   3.6339   10.267   5.2063   7.8516   5.0744  104.993   30.552   92.864   30.698 12.12959 43.31065 
1 1 1   12    3   61 o  128.908   19.351   13.970   3.7003   15.788   4.9934   11.757   5.5110  133.143   25.430  110.613   31.199 22.52978 40.24949 
1 1 1   12    3   62 o   67.560   25.367   3.5461   3.5541   1.0317   5.2958   5.6067   4.7941   64.785   28.281   80.049   29.578 -15.26405 40.92286 
1 1 1   12    4    0 o  601.915   7.1730  277.462   6.6065  277.462   6.6065  277.462   6.6065  601.915   7.1730  601.915   7.1730 0.000000 0.000000 
1 1 1   12    4    1 o  518.646   4.7581  205.910   3.7773  209.452   5.4001  202.516   5.2855  523.030   6.7454  514.299   6.7143 8.731873 9.517436 
1 1 1   12    4    2 o  380.739   6.5182  110.988   3.7986  116.421   5.6294  106.445   5.1470  389.860   9.4338  372.796   9.0202 17.06403 13.05219 
1 1 1   12    4    3 o  396.264   6.7273  120.226   4.0803  119.245   5.8970  121.127   5.6517  394.548   9.7648  397.667   9.2852 -3.119354 13.47464 
1 1 1   12    4    4 o  1057.09   10.500  856.093   16.990  838.667   23.581  874.901   24.499  1045.73   14.733  1068.05   14.986 -22.31299 21.01503 
1 1 1   12    4    5 o  572.824   10.527  251.383   9.2297   0.0000   0.0000  251.383   9.2297  ?   ?   572.824   10.527 0.000000 10.52679 
1 1 1   12    4    6 o  889.637   7.6893  606.042   10.471  610.463   12.934  597.636   17.836  892.750   9.4651  882.977   13.197 9.773376 16.24040 
1 1 1   12    4    7 o  313.270   6.0335   75.131   2.8931   74.930   3.5518   75.528   4.9870  312.824   7.4179  313.996   10.376 -1.171570 12.75517 
1 1 1   12    4    8 o  399.399   5.9866  122.121   3.6598  117.942   4.4017  131.480   6.5870  392.475   7.3272  414.290   10.388 -21.81583 12.71179 
1 1 1   12    4    9 o  329.392   5.3459   83.056   2.6953   80.076   3.7909   86.102   3.8329  323.388   7.6586  335.339   7.4675 -11.95068 10.69657 
1 1 1   12    4   10 o  144.954   4.8060   16.084   1.0663   17.168   1.6966   15.376   1.3709  149.741   7.4025  141.719   6.3197 8.021957 9.733263 
1 1 1   12    4   11 o  892.650   5.4515  609.959   7.4484  613.471   10.607  606.543   10.461  895.112   7.7422  890.047   7.6790 5.065430 10.90452 
1 1 1   12    4   12 o  654.309   4.3483  327.692   4.3549  335.579   6.7679  322.118   5.6891  662.075   6.6784  648.689   5.7298 13.38641 8.799518 
1 1 1   12    4   13 o  733.136   4.6166  411.407   5.1806  414.332   7.9678  409.265   6.8186  735.666   7.0760  731.185   6.0926 4.480225 9.337538 
1 1 1   12    4   14 o  364.483   4.3693  101.683   2.4376   99.152   4.3384  102.850   2.9467  359.869   7.8761  366.559   5.2519 -6.689545 9.466569 
1 1 1   12    4   15 o  523.903   5.5716  210.098   4.4679  223.149   10.020  206.860   4.9916  539.740   12.128  519.836   6.2734 19.90417 13.65467 
1 1 1   12    4   16 o  1267.73   6.6106  1230.28   12.827  1230.60   19.631  1230.04   16.945  1267.68   10.117  1267.49   8.7344 0.1904297 13.36589 
1 1 1   12    4   17 o  1486.61   8.0912  1691.96   18.411  1674.54   31.395  1701.10   22.730  1478.42   13.874  1490.48   9.9632 -12.05847 17.08043 
1 1 1   12    4   18 o  532.032   4.4228  216.651   3.6017  219.538   5.6131  214.630   4.6959  535.526   6.8478  529.525   5.7937 6.001160 8.969973 
1 1 1   12    4   19 o  1143.51   5.8210  1000.92   10.188  1003.00   14.464  998.872   14.354  1144.60   8.2560  1142.24   8.2099 2.356201 11.64314 
1 1 1   12    4   20 o  617.136   4.4186  291.505   4.1738  287.318   5.9387  295.593   5.8672  612.653   6.3330  621.416   6.1685 -8.763245 8.840627 
1 1 1   12    4   21 o  715.516   5.4249  391.876   5.9413  388.592   8.4121  395.144   8.3926  712.452   7.7140  718.436   7.6320 -5.983643 10.85140 
1 1 1   12    4   22 o  1225.14   6.1896  1148.96   11.607  1122.50   16.064  1177.86   16.789  1210.82   8.6679  1240.31   8.8434 -29.48804 12.38303 
1 1 1   12    4   23 o  460.797   5.4921  162.532   3.8736  160.184   4.8681  166.585   6.3955  457.431   6.9529  466.436   8.9581 -9.005432 11.33977 
1 1 1   12    4   24 o  750.595   5.2987  431.251   6.0876  429.807   8.1201  433.104   9.1989  749.284   7.0802  752.120   7.9906 -2.835449 10.67609 
1 1 1   12    4   25 o  437.776   5.0393  146.697   3.3767  146.457   4.9139  146.910   4.6479  437.377   7.3401  438.061   6.9319 -0.6845093 10.09599 
1 1 1   12    4   26 o  303.983   6.6899   70.742   3.1127   65.076   4.2176   77.521   4.6130  291.507   9.4525  318.162   9.4725 -26.65518 13.38200 
1 1 1   12    4   27 o  119.563   15.981   11.156   2.8514   15.213   4.2327   7.7851   3.8581  139.296   20.462   98.756   25.385 40.54037 32.60490 
1 1 1   12    4   28 o  355.128   7.0810   96.558   3.8490   98.602   5.6419   94.779   5.2644  358.784   10.274  351.775   9.7771 7.008820 14.18231 
1 1 1   12    4   29 o  381.828   6.9780  111.625   4.0782  112.609   5.1947  110.045   6.5842  383.456   8.8506  378.981   11.350 4.475433 14.39324 
1 1 1   12    4   30 o  974.545   7.2079  727.208   10.752  718.013   16.825  733.554   13.978  968.010   11.355  978.624   9.3318 -10.61462 14.69787 
1 1 1   12    4   31 f  146.302   13.593   16.553   3.0091   15.568   4.3754   17.437   4.1450  140.791   20.941  149.554   18.502 -8.763336 27.94405 
1 1 1   12    4   32 o  762.024   5.5581  444.559   6.4828  445.729   9.3507  443.477   8.9958  762.882   8.0079  760.971   7.7233 1.910828 11.12543 
1 1 1   12    4   33 o  724.388   6.0369  401.777   6.6935  400.213   8.8480  403.869   10.235  722.850   7.9970  726.048   9.2095 -3.197815 12.19705 
1 1 1   12    4   34 o  552.462   6.4327  233.725   5.4396  220.577   8.8078  241.833   6.9162  536.411   10.728  561.868   8.0420 -25.45715 13.40727 
1 1 1   12    4   35 o  164.243   13.914   20.858   3.4650   18.543   4.8858   23.202   4.9147  153.638   21.354  172.589   18.914 -18.95148 28.52586 
1 1 1   12    4   36 o  708.739   5.7147  384.663   6.1994  393.059   9.0948  377.377   8.4728  716.187   8.2966  701.798   7.8876 14.38922 11.44762 
1 1 1   12    4   37 o  260.109   9.0538   51.870   3.6046   55.882   5.2209   48.216   4.9828  269.755   12.645  250.205   13.056 19.54977 18.17555 
1 1 1   12    4   38 f  560.779   5.8557  240.871   5.0262  238.513   7.3058  242.990   6.9256  557.765   8.5575  563.034   8.0363 -5.269531 11.73935 
1 1 1   12    4   39 o  327.844   7.3728   82.379   3.6997   83.967   5.4272   81.001   5.0568  330.714   10.721  324.873   10.169 5.841644 14.77712 
1 1 1   12    4   40 o  226.240   10.215   39.297   3.5372   43.593   5.5880   36.425   4.5692  237.307   15.469  217.098   13.822 20.20813 20.74464 
1 1 1   12    4   41 o   98.452   22.767   7.8419   3.3624   1.6614   4.5432   15.328   5.0000   68.650   27.807  138.182   24.539 -69.53190 37.08670 
1 1 1   12    4   42 o  237.753   9.7807   43.415   3.5593   49.817   5.7771   39.498   4.5188  253.648   14.946  226.080   13.115 27.56728 19.88446 
1 1 1   12    4   43 o  282.807   9.0775   61.419   3.9294   59.891   6.4943   62.301   4.9353  277.983   15.322  284.562   11.331 -6.578247 19.05685 
1 1 1   12    4   44 o  236.760   9.6642   43.084   3.5022   40.752   5.2492   44.955   4.7017  229.089   15.054  241.130   12.785 -12.04057 19.75001 
1 1 1   12    4   45 o  284.494   9.3035   62.216   4.0513   61.470   5.5202   63.087   5.9643  282.232   12.778  285.757   13.636 -3.524933 18.68773 
1 1 1   12    4   46 o  183.673   13.467   26.218   3.7598   35.622   6.6857   21.869   4.5469  212.208   20.853  166.576   18.126 45.63152 27.62924 
1 1 1   12    4   47 f  173.060   13.494   23.317   3.5463   19.616   4.7494   27.980   5.3314  156.908   20.248  188.281   18.749 -31.37309 27.59511 
1 1 1   12    4   48 o  263.849   9.4873   53.602   3.8315   51.846   5.5450   55.206   5.3004  258.187   14.084  267.072   12.966 -8.884338 19.14400 
1 1 1   12    4   49 o  299.784   9.0601   69.186   4.1573   68.672   5.7956   69.730   5.9667  297.823   12.714  300.031   12.993 -2.207764 18.17822 
1 1 1   12    4   50 f  166.334   14.035   21.642   3.5398   25.350   5.1587   18.343   4.8661  178.535   19.178  150.715   21.721 27.81943 28.97613 
1 1 1   12    4   51 o   55.109   23.668   0.0371   3.5891   1.8174   5.5699  -1.2269   4.6933   73.302   30.360   58.659   26.071 14.64277 40.01841 
1 1 1   12    4   52 o  149.381   17.274   17.746   3.8768   17.956   5.1963   17.483   5.8222  147.909   23.757  144.412   27.341 3.496689 36.22020 
1 1 1   12    4   53 o  103.904   23.922   9.0319   3.7259   9.2581   5.5380   8.8448   5.0361  104.083   31.816  101.884   30.163 2.198830 43.84155 
1 1 1   12    4   54 o   77.290   26.546   4.6313   3.7930   1.9280   5.7320   6.7370   5.0590   73.764   30.696   90.926   30.663 -17.16209 43.38728 
1 1 1   12    4   55 o  100.730   24.927   8.6114   3.8225   5.2696   5.4310   11.892   5.3810   84.732   31.447  116.742   29.963 -32.00932 43.43633 
1 1 1   12    4   56 o   88.415   27.683   6.6123   4.1641   5.0817   5.3770   8.9056   6.5818   83.335   31.219  101.646   34.965 -18.31062 46.87413 
1 1 1   12    4   57 o  162.180   18.473   21.305   4.5039   22.033   6.3651   20.575   6.3740  160.318   26.891  154.106   28.056 6.212479 38.86230 
1 1 1   12    4   58 o   44.484   20.788  -2.8778   3.5081  -1.5868   4.7738  -4.3934   5.1725   56.775   25.676   52.822   24.861 3.952648 35.73963 
1 1 1   12    4   59 o  226.431   11.516   40.208   3.9782   29.817   5.4097   52.445   5.8707  191.083   18.737  256.579   15.014 -65.49696 24.01035 
1 1 1   12    4   60 o   75.409   26.228   4.7339   3.7083   0.4770   5.0078   9.9022   5.5178   63.056   27.514  102.549   31.827 -39.49303 42.07112 
1 1 1   12    4   61 o   77.060   25.429   5.1853   3.4826   4.6788   4.8229   5.7371   5.0342   76.767   29.381   81.767   30.291 -5.000099 42.19917 
1 1 1   12    4   62 o   69.442   25.617   3.8977   3.5930   8.6327   5.3865   0.1020   4.8227   94.152   31.641   59.831   26.518 34.32088 41.28354 
1 1 1   12    5    0 o  944.803   9.4555  683.657   13.671  683.657   13.671  683.657   13.671  944.803   9.4555  944.803   9.4555 0.000000 0.000000 
1 1 1   12    5    1 o  1393.82   9.1267  1487.98   19.471  1453.99   26.761  1526.22   28.382  1377.30   12.694  1411.01   13.142 -33.71741 18.27156 
1 1 1   12    5    2 o  154.478   8.3264   18.328   1.9615   19.491   2.9631   17.421   2.6170  159.003   12.270  150.345   11.458 8.658173 16.78836 
1 1 1   12    5    3 o  394.410   5.2319  119.083   3.1584  116.242   3.7497  126.021   5.8601  389.655   6.2870  405.621   9.4387 -15.96576 11.34092 
1 1 1   12    5    4 o  420.207   7.0459  135.197   4.5318  133.833   6.5247  136.468   6.2991  417.977   10.199  422.090   9.7500 -4.112549 14.10937 
1 1 1   12    5    5 o  380.442   9.9591  110.868   5.7993   0.0000   0.0000  110.868   5.7993  ?   ?   380.442   9.9591 0.000000 9.959103 
1 1 1   12    5    6 o  255.632   6.5082   50.031   2.5465   45.394   3.0680   60.300   4.5659  243.472   8.2326  280.557   10.633 -37.08511 13.44722 
1 1 1   12    5    7 o  768.954   7.1835  452.725   8.4549  443.882   10.182  472.368   15.174  761.325   8.7375  785.091   12.627 -23.76630 15.35569 
1 1 1   12    5    8 o  1202.84   9.6123  1108.13   17.697  1088.73   21.255  1151.98   31.952  1192.04   11.649  1225.38   17.036 -33.33691 20.63786 
1 1 1   12    5    9 o  661.200   6.8061  334.710   6.8881  332.199   8.3781  339.947   12.100  658.654   8.3104  666.098   11.868 -7.443054 14.48818 
1 1 1   12    5   10 o  631.032   5.6040  304.823   5.4128  310.853   6.3325  288.465   10.429  637.217   6.4926  613.651   11.103 23.56683 12.86225 
1 1 1   12    5   11 o  730.386   4.8769  408.338   5.4522  412.811   7.8347  404.138   7.5921  734.309   6.9707  726.560   6.8269 7.748901 9.756861 
1 1 1   12    5   12 o  318.846   4.2795   77.814   2.0885   74.556   3.7103   79.325   2.5269  312.054   7.7679  321.919   5.1283 -9.864349 9.308092 
1 1 1   12    5   13 o  950.993   5.7777  692.291   8.4101  695.845   14.621  690.533   10.281  953.223   10.021  949.733   7.0725 3.489502 12.26532 
1 1 1   12    5   14 o   85.912   9.8854   5.7268   1.2762   7.4223   2.1524   4.8075   1.5849   97.293   14.930   78.062   13.767 19.23045 20.30898 
1 1 1   12    5   15 o  459.861   4.5487  161.862   3.2017  164.556   5.9150  160.746   3.8078  463.607   8.3356  458.261   5.4286 5.345673 9.947474 
1 1 1   12    5   16 o  1044.71   5.7706  835.434   9.2276  835.288   14.114  835.544   12.195  1044.49   8.8282  1044.71   7.6264 -0.2175293 11.66613 
1 1 1   12    5   17 o  754.505   5.2089  435.740   6.0155  440.746   10.458  433.264   7.3540  758.716   9.0051  752.331   6.3862 6.385803 11.03973 
1 1 1   12    5   18 o  1051.59   5.8675  846.477   9.4443  827.214   14.161  861.909   12.675  1039.44   8.9006  1061.06   7.8044 -21.62598 11.83762 
1 1 1   12    5   19 o  1686.00   8.3756  2176.29   21.614  2160.47   32.744  2188.51   28.775  1679.45   12.738  1690.49   11.121 -11.03516 16.90900 
1 1 1   12    5   20 o  975.448   5.3179  728.308   7.9399  715.597   11.138  741.441   11.322  966.824   7.5264  984.128   7.5161 -17.30389 10.63667 
1 1 1   12    5   21 o  1014.43   6.3378  787.739   9.8408  773.851   13.664  802.703   14.184  1005.34   8.8799  1023.90   9.0506 -18.56091 12.67930 
1 1 1   12    5   22 o  911.593   5.5780  636.094   7.7830  629.252   10.236  645.471   11.984  906.615   7.3760  918.175   8.5270 -11.56012 11.27452 
1 1 1   12    5   23 o  515.945   5.3630  203.763   4.2353  203.221   5.3381  204.682   6.9581  515.232   6.7689  517.031   8.7923 -1.798401 11.09602 
1 1 1   12    5   24 o  266.788   6.5025   54.487   2.6553   53.542   3.6147   55.594   3.9135  264.433   8.9306  269.443   9.4891 -5.009644 13.03071 
1 1 1   12    5   25 o  475.380   5.2947  172.984   3.8526  172.346   5.2042  173.758   5.7304  474.464   7.1661  476.386   7.8587 -1.922363 10.63546 
1 1 1   12    5   26 o  614.238   5.3418  288.805   5.0222  287.897   6.8064  289.891   7.4409  613.217   7.2516  615.314   7.9005 -2.097656 10.72400 
1 1 1   12    5   27 o  1101.78   6.4279  929.330   10.840  949.078   17.110  916.089   14.011  1113.16   10.042  1093.78   8.3687 19.38428 13.07208 
1 1 1   12    5   28 o  1114.73   7.0243  951.390   11.985  960.178   17.352  943.372   16.574  1119.61   10.125  1109.81   9.7566 9.807129 14.06117 
1 1 1   12    5   29 o  769.299   5.6875  453.062   6.6970  453.305   10.400  452.889   8.7532  769.348   8.8320  769.073   7.4358 0.2745361 11.54542 
1 1 1   12    5   30 o  768.449   6.2696  452.101   7.3744  440.395   10.468  463.635   10.391  758.280   9.0189  778.050   8.7249 -19.77008 12.54848 
1 1 1   12    5   31 o  343.789   7.2851   90.504   3.8335   92.189   5.3635   88.744   5.4812  346.885   10.102  340.326   10.522 6.558746 14.58641 
1 1 1   12    5   32 o  437.784   6.5740  146.751   4.4051  155.925   6.2991  137.969   6.1627  451.156   9.1219  424.368   9.4876 26.78836 13.16145 
1 1 1   12    5   33 o  185.169   12.281   26.408   3.4611   24.197   4.6798   29.077   5.1423  176.594   17.546  193.745   17.530 -17.15100 24.80235 
1 1 1   12    5   34 o  357.184   7.6356   97.724   4.1745   99.648   7.4135   96.831   5.0515  360.352   13.441  355.473   9.2841 4.878418 16.33553 
1 1 1   12    5   35 o  364.019   7.3166  101.505   4.0766  102.085   5.7385  100.914   5.7924  364.896   10.274  362.786   10.431 2.109589 14.64159 
1 1 1   12    5   36 o  252.326   9.3339   48.809   3.6049   48.080   5.0432   49.571   5.1549  249.874   13.233  253.719   13.320 -3.844315 18.77631 
1 1 1   12    5   37 o  135.391   15.180   14.274   3.0917   15.181   4.5912   13.522   4.1820  138.364   22.448  130.559   21.688 7.805252 31.21378 
1 1 1   12    5   38 o  340.910   7.2032   89.060   3.7587   87.335   5.6608   90.420   5.0267  337.307   10.964  343.335   9.5652 -6.028534 14.55021 
1 1 1   12    5   39 o  276.195   8.1979   58.491   3.4657   56.633   5.1809   59.995   4.6624  271.440   12.470  279.523   10.897 -8.082855 16.56048 
1 1 1   12    5   40 o  187.481   12.945   27.167   3.6919   25.167   5.2256   29.160   5.2166  179.295   19.348  193.452   17.818 -14.15706 26.30261 
1 1 1   12    5   41 o  230.962   10.621   40.983   3.7548   37.209   5.2974   44.792   5.3228  218.986   15.913  240.627   14.520 -21.64166 21.54214 
1 1 1   12    5   42 o  626.520   6.4882  300.889   6.2220  290.430   10.558  306.454   7.7015  614.555   11.224  632.032   7.9610 -17.47729 13.76054 
1 1 1   12    5   43 o  145.622   13.976   16.509   3.0769   7.7267   4.5574   23.866   4.1710   97.791   28.622  174.993   15.741 -77.20169 32.66472 
1 1 1   12    5   44 o  514.493   7.0471  203.051   5.5496  205.386   8.0733  200.960   7.6410  516.784   10.206  511.292   9.7637 5.492554 14.12446 
1 1 1   12    5   45 o  148.959   16.303   17.412   3.6564   12.894   5.0417   22.424   5.3106  125.197   27.096  168.015   21.117 -42.81841 34.35237 
1 1 1   12    5   46 o  329.394   9.8758   83.503   4.9792  101.345   8.9998   75.632   5.9773  361.156   16.280  312.966   12.478 48.19022 20.51219 
1 1 1   12    5   47 o  110.914   20.009   9.9275   3.2719   8.6409   4.7924   11.051   4.4779  102.121   29.195  115.600   25.944 -13.47881 39.05729 
1 1 1   12    5   48 o  266.710   9.2545   54.757   3.7780   58.292   5.5937   51.792   5.1230  274.334   13.321  258.347   12.997 15.98694 18.61135 
1 1 1   12    5   49 o  111.308   21.389   10.097   3.5116   9.0738   4.9899   11.101   4.9427  104.096   29.801  114.967   28.283 -10.87096 41.08544 
1 1 1   12    5   50 o  160.673   14.673   20.247   3.5688   11.397   5.0655   28.969   5.0287  116.181   28.662  191.593   17.335 -75.41218 33.49708 
1 1 1   12    5   51 o   48.633   22.041  -1.7609   3.5398  -2.2465   5.3008  -1.3701   4.7556   59.852   27.063   58.648   26.144 1.203358 37.62825 
1 1 1   12    5   52 o  200.061   13.423   31.263   4.0866   35.583   5.5154   26.004   6.0851  212.195   17.127  178.975   22.725 33.22031 28.45648 
1 1 1   12    5   53 o  301.549   9.6671   70.223   4.4620   70.938   6.7800   69.676   5.9262  301.310   14.701  299.312   12.935 1.998260 19.58172 
1 1 1   12    5   54 o  117.505   22.515   11.442   3.9021   11.831   5.9530   11.149   5.1669  116.170   32.306  113.576   29.469 2.594048 43.72738 
1 1 1   12    5   55 o  208.576   12.875   34.044   4.0904   36.530   6.0406   31.938   5.5587  213.563   18.667  199.728   18.389 13.83496 26.20345 
1 1 1   12    5   56 o   62.321   25.854   1.3355   4.0486  -1.8582   5.2210   6.1526   6.4121   59.389   26.855   90.231   34.033 -30.84144 43.35291 
1 1 1   12    5   57 o   89.590   29.000   6.8781   4.5383   18.054   6.6349  -2.9486   6.2214  141.986   31.366   62.227   28.586 79.75923 42.43780 
1 1 1   12    5   58 o  183.779   13.886   26.756   3.8773   26.312   5.3502   27.247   5.6268  179.149   19.845  181.896   20.572 -2.746613 28.58338 
1 1 1   12    5   59 o   52.113   23.090  -0.5711   3.6535  -1.7269   4.9531   0.8083   5.4109   57.158   25.970   66.619   28.837 -9.460651 38.80732 
1 1 1   12    5   60 o  188.014   15.376   28.464   4.3861   12.149   6.3463   43.383   6.0686  111.742   34.039  230.890   17.298 -119.1474 38.18151 
1 1 1   12    5   61 o   93.774   23.953   7.8520   3.4503   6.1948   4.7894   9.6400   4.9748   83.451   29.740  100.710   30.017 -17.25939 42.25476 
1 1 1   12    5   62 o  141.581   19.360   16.969   4.0856   15.818   5.6565   18.225   5.9075  128.995   29.314  139.386   28.647 -10.39186 40.98751 
1 1 1   12    6    0 o   29.515   17.155   0.8023   1.2739   0.8023   1.2739   0.8023   1.2739   29.515   17.155   29.515   17.155 0.000000 0.000000 
1 1 1   12    6    1 o  441.281   4.5668  149.057   3.0846  148.243   4.3794  149.859   4.3453  440.031   6.5023  442.426   6.4166 -2.394409 9.135239 
1 1 1   12    6    2 o  423.985   5.2960  137.610   3.4369  135.339   6.1562  138.639   4.1426  420.350   9.5682  425.542   6.3600 -5.192169 11.48916 
1 1 1   12    6    3 o  909.488   9.4226  633.546   13.117  619.000   18.138  649.494   18.992  898.644   13.187  920.481   13.480 -21.83649 18.85728 
1 1 1   12    6    4 o  274.824   5.4715   57.818   2.3016   58.155   2.7154   56.959   4.3373  275.609   6.4369  272.681   10.392 2.928772 12.22397 
1 1 1   12    6    5 o  281.193   10.676   60.573   4.5950   0.0000   0.0000   60.573   4.5950  ?   ?   281.193   10.676 0.000000 10.67612 
1 1 1   12    6    6 o  157.229   8.6627   18.989   2.0767   19.500   2.5814   18.051   3.4964  159.191   10.656  152.683   15.161 6.507706 18.53138 
1 1 1   12    6    7 o  709.445   6.9615  385.348   7.5594  377.329   9.1007  403.192   13.577  701.958   8.4702  725.382   12.228 -23.42407 14.87502 
1 1 1   12    6    8 o  443.451   7.8911  150.573   5.3562  148.797   7.6504  152.279   7.5013  440.712   11.341  445.853   10.992 -5.140961 15.79384 
1 1 1   12    6    9 o  404.169   7.9766  125.077   4.9346  135.245   7.3206  116.610   6.6804  420.171   11.383  390.158   11.186 30.01291 15.95946 
1 1 1   12    6   10 o  515.250   6.0793  203.232   4.7945  212.088   5.9860  187.385   8.0076  526.322   7.4305  494.619   10.577 31.70233 12.92613 
1 1 1   12    6   11 o  322.288   5.3890   79.509   2.6584   83.154   3.6809   75.534   3.8435  329.566   7.2970  314.091   7.9946 15.47485 10.82407 
1 1 1   12    6   12 o  1130.53   7.1585  978.466   12.387  969.832   15.702  992.693   20.157  1125.41   9.1154  1138.41   11.568 -12.99841 14.72792 
1 1 1   12    6   13 o  250.746   5.4516   48.127   2.0923   48.076   2.6662   48.209   3.3756  250.599   6.9510  250.922   8.7892 -0.3232269 11.20565 
1 1 1   12    6   14 o  206.259   4.8945   32.563   1.5452   33.896   2.5453   31.785   1.9446  210.414   7.9030  203.772   6.2347 6.641953 10.06621 
1 1 1   12    6   15 o  455.884   4.6019  159.074   3.2111  155.054   5.8571  160.802   3.8396  450.022   8.5032  458.341   5.4730 -8.319458 10.11225 
1 1 1   12    6   16 o  334.895   4.7720   85.844   2.4461   93.592   3.6548   79.557   3.2923  349.660   6.8289  322.379   6.6720 27.28079 9.547201 
1 1 1   12    6   17 o  164.470   6.5803   20.707   1.6565   18.350   2.9457   21.797   2.0033  154.270   12.585  168.735   7.7566 -14.46487 14.78308 
1 1 1   12    6   18 o  1209.64   6.4496  1120.08   11.942  1121.00   18.302  1119.40   15.758  1209.96   9.8824  1209.17   8.5140 0.7883301 13.04416 
1 1 1   12    6   19 o  596.798   4.6315  272.612   4.2308  275.087   6.6271  270.909   5.4967  599.452   7.2227  594.907   6.0364 4.544678 9.413061 
1 1 1   12    6   20 f  844.542   5.2523  545.944   6.7895  545.579   10.456  546.209   8.9279  844.172   8.0921  844.701   6.9052 -0.5288696 10.63780 
1 1 1   12    6   21 o  915.914   6.6296  642.183   9.2941  647.370   12.047  634.553   14.609  919.529   8.5591  910.285   10.485 9.244019 13.53485 
1 1 1   12    6   22 o  293.324   5.7342   65.860   2.5745   71.655   4.2704   62.551   3.2269  305.910   9.1201  285.843   7.3753 20.06775 11.72913 
1 1 1   12    6   23 o  512.631   5.3338  201.154   4.1851  209.453   5.3994  188.663   6.6239  523.071   6.7439  496.385   8.7182 26.68619 11.02215 
1 1 1   12    6   24 o  946.255   5.7862  685.415   8.3806  679.146   11.070  693.834   12.827  941.836   7.6788  951.907   8.8039 -10.07086 11.68217 
1 1 1   12    6   25 o  507.570   4.9399  197.200   3.8378  200.428   5.6278  194.394   5.2470  511.658   7.1861  503.907   6.8029 7.751465 9.895427 
1 1 1   12    6   26 f  597.392   4.9798  273.175   4.5534  274.303   6.5818  272.139   6.3061  598.564   7.1840  596.207   6.9102 2.356628 9.967969 
1 1 1   12    6   27 o  210.996   9.0237   34.094   2.9143   38.525   4.0976   29.558   4.1457  223.913   11.999  195.878   13.918 28.03517 18.37647 
1 1 1   12    6   28 o  222.747   9.9766   38.005   3.4015   46.070   5.4520   32.865   4.3525  244.690   14.624  206.594   13.844 38.09636 20.13741 
1 1 1   12    6   29 o  527.739   5.6756  213.210   4.5846  211.810   7.1658  214.180   5.9653  525.889   8.9022  528.885   7.3689 -2.995422 11.55638 
1 1 1   12    6   30 o  1118.09   6.5819  957.145   11.264  943.132   17.118  967.847   14.959  1109.55   10.079  1124.14   8.6940 -14.58984 13.31081 
1 1 1   12    6   31 o  305.461   7.1384   71.448   3.3375   72.085   4.9815   70.929   4.4957  306.716   10.611  304.280   9.6529 2.436371 14.34479 
1 1 1   12    6   32 o  118.038   17.717   10.939   3.1022   16.030   4.4564   6.1529   4.3210  142.844   21.010   89.761   28.215 53.08355 35.17801 
1 1 1   12    6   33 o  593.708   7.4111  269.968   6.7348  261.767   9.0532  280.130   10.078  584.431   10.120  604.516   10.892 -20.08527 14.86784 
1 1 1   12    6   34 o  597.762   5.9508  273.612   5.4447  270.425   7.5026  277.158   7.9136  594.119   8.2503  601.443   8.5963 -7.323303 11.91487 
1 1 1   12    6   35 o  478.670   6.7541  175.495   4.9485  178.211   6.5902  171.984   7.4928  482.213   8.9288  473.601   10.336 8.612549 13.65870 
1 1 1   12    6   36 o  168.240   12.946   21.863   3.3081   18.972   4.7406   24.607   4.6184  155.496   20.411  177.972   17.167 -22.47549 26.67031 
1 1 1   12    6   37 o  587.564   5.7270  264.408   5.1506  269.115   7.6556  260.515   6.9618  592.512   8.4413  583.036   7.8011 9.475403 11.49402 
1 1 1   12    6   38 o  559.695   5.8136  239.949   4.9804  242.299   7.4046  238.007   6.7304  562.140   8.6057  557.222   7.8912 4.918213 11.67596 
1 1 1   12    6   39 o  473.309   6.0158  171.625   4.3582  171.676   6.4231  171.581   5.9329  473.091   8.8701  473.039   8.1941 0.5273438E-01 12.07566 
1 1 1   12    6   40 o  194.525   12.083   29.205   3.5799   26.493   5.1683   31.706   4.9633  184.141   18.592  202.067   16.183 -17.92531 24.64851 
1 1 1   12    6   41 o  345.004   7.5379   91.276   3.9806   90.873   6.6833   91.498   4.9554  343.611   12.707  345.234   9.3776 -1.622894 15.79292 
1 1 1   12    6   42 o  281.452   8.1353   60.781   3.5047   59.078   5.4623   61.973   4.5691  276.943   12.886  283.952   10.513 -7.009338 16.63039 
1 1 1   12    6   43 f  127.346   15.493   12.718   2.9578   16.232   4.4549   9.9491   3.9553  142.848   21.002  110.606   24.049 32.24246 31.92838 
1 1 1   12    6   44 o  150.990   13.403   17.732   3.0653   19.250   4.5561   16.477   4.1433  156.040   19.502  144.254   19.245 11.78641 27.39892 
1 1 1   12    6   45 o  225.454   12.703   39.354   4.3657   37.925   7.1805   40.193   5.4987  218.896   21.718  227.113   15.919 -8.216370 26.92699 
1 1 1   12    6   46 o  427.530   8.1293  140.429   5.3197  137.443   8.5832  142.292   6.7787  421.594   13.301  429.852   10.303 -8.257996 16.82462 
1 1 1   12    6   47 o  141.766   15.567   15.799   3.3224   17.892   5.0984   14.255   4.3801  148.782   23.140  132.712   22.357 16.06924 32.17640 
1 1 1   12    6   48 o  428.203   7.3190  140.843   4.7970  140.451   6.7883  141.234   6.7797  426.811   10.391  428.013   10.349 -1.202118 14.66513 
1 1 1   12    6   49 o   96.183   23.020   7.6363   3.3438   8.3086   4.9784   7.0837   4.5135  100.013   30.077   93.051   28.770 6.962395 41.62104 
1 1 1   12    6   50 o  219.211   11.119   37.228   3.7185   36.118   5.4532   38.193   5.0838  214.261   16.761  220.915   15.126 -6.654175 22.57725 
1 1 1   12    6   51 o   57.891   24.204   0.7572   3.5880  -3.7551   5.4013   4.3209   4.8002   56.935   26.327   79.577   29.559 -22.64298 39.58283 
1 1 1   12    6   52 o  108.506   23.389   9.7855   3.7700   15.592   5.1363   3.0030   5.5511  136.877   25.453   77.067   30.905 59.80968 40.03721 
1 1 1   12    6   53 o  129.945   20.400   13.731   3.9239   14.983   6.4734   13.003   4.9335  130.922   32.464  123.987   26.779 6.934761 42.08346 
1 1 1   12    6   54 o  175.397   14.680   24.234   3.9048   27.023   5.7776   21.888   5.2980  182.664   21.050  163.923   21.645 18.74150 30.19250 
1 1 1   12    6   55 o   94.305   25.232   7.5612   3.7136   7.5371   5.4370   7.5823   5.0843   94.772   31.789   94.613   30.702 0.1595459 44.19397 
1 1 1   12    6   56 o  187.852   15.221   27.972   4.3388   28.326   5.5815   27.431   6.8973  186.859   19.818  180.518   25.687 6.340408 32.44331 
1 1 1   12    6   57 o   74.808   28.431   3.9068   4.4964   11.598   6.4515  -3.3587   6.2702  112.310   34.342   61.559   28.430 50.75101 44.58268 
1 1 1   12    6   58 o   65.294   25.283   2.7024   3.6010   0.8193   4.8750   4.9640   5.3423   64.313   27.601   81.460   30.983 -17.14709 41.49453 
1 1 1   12    6   59 o  236.949   12.524   44.251   4.5260   42.607   6.8540   45.521   6.0270  227.587   19.875  237.720   16.669 -10.13342 25.94006 
1 1 1   12    6   60 f  149.722   17.357   18.383   3.9039   16.111   5.1545   21.440   5.9786  134.776   25.928  155.904   25.967 -21.12831 36.69521 
1 1 1   12    6   61 o  194.489   13.623   30.289   4.0297   20.507   5.8481   39.133   5.5606  151.117   26.235  218.797   16.731 -67.68056 31.11551 
1 1 1   12    6   62 o  128.475   21.598   14.343   4.0964   8.6033   5.5954   20.973   6.0136   93.613   32.236  151.230   26.968 -57.61761 42.02930 
1 1 1   12    7    0 o  856.005   8.9000  561.154   11.658  561.154   11.658  561.154   11.658  856.005   8.9000  856.005   8.9000 0.000000 0.000000 
1 1 1   12    7    1 o   65.054   10.273   3.3211   0.9890   5.6887   1.4823   1.4218   1.3277   85.379   11.647   45.409   15.699 39.96978 19.54768 
1 1 1   12    7    2 o  1016.79   7.1144  791.578   11.072  766.303   15.101  820.967   16.283  1000.23   9.8635  1035.25   10.276 -35.02411 14.24383 
1 1 1   12    7    3 o  119.183   8.2501   10.929   1.4958   11.252   1.6842   9.7222   3.2545  120.865   9.1721  110.852   19.913 10.01321 21.92353 
1 1 1   12    7    4 f  492.346   10.596  185.691   7.9853   0.0000   0.0000  185.691   7.9853  ?   ?   492.346   10.596 0.000000 10.59621 
1 1 1   12    7    5 o  765.724   8.7041  449.010   10.202  433.215   13.912  467.379   15.004  751.919   12.088  780.968   12.551 -29.04950 17.42589 
1 1 1   12    7    6 o  288.963   8.1499   63.937   3.6046   57.025   4.8805   72.234   5.3468  272.819   11.688  307.062   11.376 -34.24289 16.30997 
1 1 1   12    7    7 o  366.103   6.3488  102.608   3.5576  100.856   4.2937  106.445   6.3543  362.936   7.7291  372.765   11.137 -9.828827 13.55615 
1 1 1   12    7    8 o  729.047   7.1206  406.925   7.9459  407.047   9.6856  406.675   13.896  729.090   8.6791  728.541   12.461 0.5490112 15.18587 
1 1 1   12    7    9 o  215.480   5.6838   35.543   1.8746   35.281   2.0404   36.959   4.7485  214.681   6.2093  219.138   14.234 -4.457672 15.52934 
1 1 1   12    7   10 o  669.831   6.6495  343.479   6.8175  343.479   6.8175   0.0000   0.0000  669.831   6.6495  ?   ?  0.000000 6.649522 
1 1 1   12    7   11 o  263.613   5.0838   53.192   2.0513   55.130   2.5562   49.688   3.4376  268.361   6.2232  254.739   8.8164 13.62187 10.79149 
1 1 1   12    7   12 o  641.930   5.2415  315.419   5.1501  314.088   6.5457  317.582   8.3438  640.540   6.6764  644.039   8.4641 -3.498718 10.78033 
1 1 1   12    7   13 f  733.726   5.5631  412.084   6.2477  412.497   7.9990  411.439   10.005  734.050   7.1194  733.046   8.9169 1.003784 11.41039 
1 1 1   12    7   14 o  864.593   5.5597  572.188   7.3575  559.928   10.085  586.140   10.758  855.211   7.7040  874.987   8.0328 -19.77637 11.13003 
1 1 1   12    7   15 o  644.328   5.5072  317.779   5.4314  330.216   8.8550  310.278   6.8769  656.731   8.8091  636.645   7.0571 20.08649 11.28731 
1 1 1   12    7   16 o  1661.31   8.2339  2112.99   20.938  2112.54   31.952  2113.32   27.718  1660.74   12.570  1661.21   10.901 -0.4770508 16.63820 
1 1 1   12    7   17 o  1005.20   6.0940  773.446   9.3762  769.857   16.035  775.311   11.558  1002.67   10.448  1006.36   7.5033 -3.685852 12.86344 
1 1 1   12    7   18 o  692.994   4.7738  367.580   5.0636  370.238   7.8347  365.672   6.6358  695.438   7.3603  691.164   6.2725 4.274292 9.670491 
1 1 1   12    7   19 o  642.618   5.1208  316.087   5.0369  312.042   7.1356  320.105   7.1109  638.445   7.3019  646.644   7.1843 -8.199524 10.24367 
1 1 1   12    7   20 o  697.235   5.8049  372.118   6.1951  377.965   8.2090  364.382   9.4422  702.644   7.6328  689.860   8.9422 12.78333 11.75681 
1 1 1   12    7   21 o  1320.35   8.2846  1334.72   16.743  1326.11   21.456  1348.13   26.773  1315.91   10.653  1326.55   13.186 -10.64307 16.95110 
1 1 1   12    7   22 o  599.903   5.3952  275.474   4.9540  286.189   7.3194  266.415   6.7297  611.399   7.8213  589.909   7.4532 21.48920 10.80386 
1 1 1   12    7   23 o  859.770   6.4415  565.877   8.4769  578.955   11.411  549.770   12.663  869.557   8.5731  847.296   9.7644 22.26117 12.99391 
1 1 1   12    7   24 o  741.864   5.2958  421.282   6.0135  416.125   9.2665  425.034   7.9039  737.209   8.2121  745.109   6.9303 -7.900330 10.74561 
1 1 1   12    7   25 o  387.576   5.6690  114.989   3.3630  116.080   5.5277  114.347   4.2375  389.333   9.2759  386.466   7.1635 2.867096 11.71996 
1 1 1   12    7   26 o  751.255   5.1058  432.019   5.8711  448.266   8.6515  418.149   7.9935  765.166   7.3870  739.029   7.0666 26.13757 10.22273 
1 1 1   12    7   27 o  167.446   12.029   21.594   3.0624   23.428   5.2258   20.636   3.7793  173.530   20.044  163.335   15.295 10.19496 25.21277 
1 1 1   12    7   28 o  371.651   6.3937  105.747   3.6371  102.907   6.1574  107.269   4.5075  366.496   10.976  374.281   7.8681 -7.784241 13.50501 
1 1 1   12    7   29 o  666.562   5.5582  340.133   5.6708  340.103   8.7826  340.154   7.4263  666.396   8.6104  666.513   7.2794 -0.1174316 11.27511 
1 1 1   12    7   30 o  226.567   8.6484   39.316   2.9992   37.074   4.4813   41.135   4.0365  219.486   13.403  231.684   11.382 -12.19745 17.58443 
1 1 1   12    7   31 o  492.108   5.6791  185.404   4.2777  183.538   6.3022  186.999   5.8250  489.519   8.4111  494.144   7.7015 -4.625366 11.40440 
1 1 1   12    7   32 o  193.264   10.024   28.698   2.9551   28.792   4.4313   28.623   3.9657  193.095   15.114  192.699   13.531 0.3961945 20.28576 
1 1 1   12    7   33 o  357.465   8.1784   97.886   4.4748  102.592   7.0429   94.701   5.7948  365.716   12.582  351.476   10.771 14.23969 16.56254 
1 1 1   12    7   34 o  656.796   5.9251  330.331   5.9565  340.141   8.3759  320.294   8.4725  666.301   8.2128  646.539   8.5615 19.76160 11.86378 
1 1 1   12    7   35 o  559.466   6.4724  239.732   5.5425  249.173   7.3713  227.451   8.4071  570.221   8.4456  544.646   10.085 25.57428 13.15408 
1 1 1   12    7   36 o  105.734   19.592   8.8953   3.0540   7.0458   4.4345   10.564   4.2121   94.633   28.370  114.604   24.737 -19.97067 37.64022 
1 1 1   12    7   37 o  396.182   6.4244  120.241   3.8958  124.259   5.8880  117.113   5.1958  402.509   9.5571  390.836   8.6853 11.67239 12.91402 
1 1 1   12    7   38 o  273.477   7.9337   57.333   3.3210   57.101   4.9370   57.525   4.4882  272.645   11.830  273.746   10.712 -1.101807 15.95918 
1 1 1   12    7   39 o   59.676   22.308   2.0955   2.7427   1.2415   4.1052   2.7840   3.6861   64.369   26.298   68.846   25.837 -4.477242 36.86617 
1 1 1   12    7   40 o  260.370   9.5814   52.039   3.8185   52.536   5.6041   51.607   5.2169  260.786   14.092  258.607   13.224 2.179138 19.32495 
1 1 1   12    7   41 o  360.393   7.3758   99.597   4.0687  103.303   6.8889   97.613   5.0420  366.396   12.284  356.585   9.2379 9.811798 15.36972 
1 1 1   12    7   42 o  227.271   9.3343   39.668   3.2471   35.472   4.8370   43.110   4.3810  213.841   14.870  236.334   12.152 -22.49274 19.20420 
1 1 1   12    7   43 o  124.972   16.020   12.279   2.9939   8.4270   4.4803   15.387   4.0244  101.567   27.943  139.370   19.390 -37.80347 34.01183 
1 1 1   12    7   44 o  455.451   6.3347  159.067   4.4161  160.968   6.4920  157.430   6.0248  457.651   9.2677  452.707   8.6948 4.943970 12.70784 
1 1 1   12    7   45 o  179.753   14.963   25.195   4.0793   35.353   6.6980   19.205   5.1433  211.456   20.971  154.870   22.344 56.58650 30.64349 
1 1 1   12    7   46 o  173.101   12.579   23.269   3.3102   27.875   4.7114   18.779   4.6517  188.625   16.484  153.524   20.293 35.10114 26.14429 
1 1 1   12    7   47 o  313.588   8.2031   75.590   3.9374   71.207   5.6287   79.790   5.5098  303.576   12.113  321.575   11.194 -17.99927 16.49365 
1 1 1   12    7   48 o  351.496   8.1406   94.990   4.3797   93.699   6.4597   96.089   5.9584  348.125   12.123  352.846   11.032 -4.720520 16.39142 
1 1 1   12    7   49 o   78.708   24.581   4.9559   3.2857   4.6293   4.8216   5.2391   4.4894   81.394   29.728   83.268   28.864 -1.873825 41.43560 
1 1 1   12    7   50 o  228.727   11.099   40.434   3.8857   41.412   5.9771   39.719   5.1138  229.328   17.152  225.342   14.911 3.986267 22.72720 
1 1 1   12    7   51 o  152.119   16.249   18.302   3.7247   18.407   5.6594   18.222   4.9473  149.119   25.725  149.725   22.265 -0.6067810 34.02205 
1 1 1   12    7   52 o  100.747   24.917   8.5204   3.8210   14.905   5.3115   1.6730   5.5008  133.080   26.999   72.154   30.052 60.92576 40.39852 
1 1 1   12    7   53 o  373.278   8.4634  107.396   4.8356  116.254   7.7898  101.843   6.1678  386.428   13.170  362.571   11.114 23.85681 17.23276 
1 1 1   12    7   54 o   93.758   24.852   7.4262   3.6240   5.8726   5.3190   8.7724   4.9511   87.267   31.315  101.029   29.907 -13.76208 43.30207 
1 1 1   12    7   55 o  136.135   18.925   15.022   3.8368   18.240   5.6238   12.220   5.2477  146.977   25.947  118.428   29.147 28.54939 39.02300 
1 1 1   12    7   56 o   90.739   29.782   6.9896   4.7793   1.9606   7.0772   11.206   6.4802   78.589   33.479  111.277   34.484 -32.68806 48.06225 
1 1 1   12    7   57 o  183.444   14.835   26.738   4.1299   23.809   5.2456   31.513   6.6982  170.207   20.551  194.548   22.934 -24.34164 30.79482 
1 1 1   12    7   58 o   54.362   23.498   0.1667   3.5826  -3.2951   4.9067   4.1193   5.2430   53.355   24.816   77.674   30.387 -24.31925 39.23295 
1 1 1   12    7   59 o  128.528   19.737   13.759   3.7587   16.529   4.9777   10.084   5.7333  138.367   24.394  103.909   32.474 34.45838 40.61602 
1 1 1   12    7   60 o  173.310   13.999   24.046   3.6819   28.543   5.0300   18.855   5.4041  186.444   17.844  146.546   24.989 39.89812 30.70553 
1 1 1   12    7   61 o  145.329   16.035   17.287   3.5075   25.096   4.8487   8.7136   5.0800  173.602   18.534   95.435   30.660 78.16681 35.82625 
1 1 1   12    7   62 o  109.475   24.706   10.883   4.0416   13.658   5.5432   7.7339   5.9053  118.367   30.428   89.637   32.876 28.73000 44.79600 
1 1 1   12    8    0 o  165.433   7.8113   21.090   1.9679   21.090   1.9679   21.090   1.9679  165.433   7.8113  165.433   7.8113 0.000000 0.000000 
1 1 1   12    8    1 o  250.706   4.7084   48.111   1.8068   47.676   2.5451   48.553   2.5654  249.547   6.6632  251.833   6.6553 -2.285873 9.417576 
1 1 1   12    8    2 o  772.999   5.9608  457.426   7.0527  440.544   9.5825  477.379   10.418  758.502   8.2538  789.555   8.6203 -31.05383 11.93460 
1 1 1   12    8    3 o  519.820   7.0967  206.880   5.6465  202.255   7.4612  213.078   8.6380  513.897   9.4856  527.417   10.700 -13.52002 14.29933 
1 1 1   12    8    4 o   71.620   14.164   4.0699   1.4977   3.9538   1.6561   4.5910   3.5090   70.425   15.757   78.602   25.506 -8.176987 29.98059 
1 1 1   12    8    5 o  595.272   6.2029  271.267   5.6517  273.579   6.7742  265.971   10.251  597.767   7.4038  589.231   11.367 8.535461 13.56523 
1 1 1   12    8    6 o  636.319   5.6492  309.949   5.5022  312.050   6.2946  303.147   11.328  638.449   6.4413  629.052   11.765 9.397156 13.41259 
1 1 1   12    8    7 o  734.809   7.1475  413.378   8.0389  411.148   9.7658  418.063   14.158  732.761   8.7071  738.684   12.522 -5.923035 15.25193 
1 1 1   12    8    8 o  661.646   6.8978  335.146   6.9857  329.627   8.3662  347.852   12.695  656.127   8.3305  673.832   12.309 -17.70447 14.86281 
1 1 1   12    8    9 o  463.062   5.8854  164.141   4.1714  164.141   4.1714   0.0000   0.0000  463.062   5.8854  ?   ?  0.000000 5.885415 
1 1 1   12    8   10 o  523.644   6.1404  209.901   4.9216  209.901   4.9216   0.0000   0.0000  523.644   6.1404  ?   ?  0.000000 6.140411 
1 1 1   12    8   11 o  472.111   4.8522  170.604   3.5063  169.460   4.3773  172.652   5.8572  470.506   6.0781  474.876   8.0583 -4.370239 10.09352 
1 1 1   12    8   12 o  725.290   5.5303  402.662   6.1395  400.448   7.7784  406.319   9.9991  723.255   7.0263  728.472   8.9677 -5.216919 11.39246 
1 1 1   12    8   13 o  506.389   5.0225  196.277   3.8929  194.154   4.8891  199.956   6.4347  503.621   6.3424  511.052   8.2261 -7.430695 10.38724 
1 1 1   12    8   14 o  777.246   6.6144  462.444   7.8690  455.375   11.030  469.772   11.230  771.191   9.3438  783.287   9.3668 -12.09576 13.23040 
1 1 1   12    8   15 o  710.634   5.6147  386.549   6.1072  388.266   7.8145  383.855   9.7890  712.173   7.1688  708.059   9.0323 4.113708 11.53145 
1 1 1   12    8   16 o  298.879   5.1349   68.374   2.3491   69.046   3.2454   67.634   3.4045  300.325   7.0600  297.235   7.4830 3.090179 10.28782 
1 1 1   12    8   17 o  1130.76   7.2903  978.813   12.618  982.694   19.709  976.117   16.425  1132.77   11.367  1129.09   9.5041 3.681396 14.81686 
1 1 1   12    8   18 o  504.488   5.5306  194.811   4.2706  194.389   5.3798  195.530   7.0223  503.918   6.9749  505.347   9.0787 -1.429810 11.44864 
1 1 1   12    8   19 f  1008.61   6.8263  778.754   10.539  771.945   13.539  789.224   16.788  1004.11   8.8089  1015.17   10.804 -11.06598 13.93989 
1 1 1   12    8   20 o  1036.39   7.0377  822.258   11.164  819.608   14.318  826.368   17.830  1034.62   9.0415  1038.74   11.214 -4.125977 14.40516 
1 1 1   12    8   21 o  980.683   6.2321  736.206   9.3547  755.720   13.650  718.923   12.846  993.470   8.9764  968.998   8.6611 24.47186 12.47354 
1 1 1   12    8   22 o  1962.02   10.370  2948.11   31.142  2982.93   44.752  2915.43   43.364  1972.86   14.820  1950.47   14.525 22.39612 20.75120 
1 1 1   12    8   23 f  319.340   5.6588   78.062   2.7660   82.931   4.5758   75.259   3.4721  329.093   9.0840  313.532   7.2351 15.56094 11.61315 
1 1 1   12    8   24 o  428.712   5.3029  140.688   3.4798  143.470   5.6674  139.005   4.4086  432.860   8.5539  426.112   6.7595 6.748322 10.90228 
1 1 1   12    8   25 o  952.759   5.8741  694.895   8.5663  703.287   13.399  689.093   11.141  958.318   9.1345  948.686   7.6722 9.631958 11.92898 
1 1 1   12    8   26 o  371.097   6.9982  105.435   3.9751  102.760   6.6513  106.921   4.9579  366.224   11.866  373.664   8.6685 -7.439423 14.69471 
1 1 1   12    8   27 o  1182.39   7.2764  1070.43   13.169  1108.21   24.296  1054.71   15.670  1202.45   13.201  1173.56   8.7238 28.89075 15.82293 
1 1 1   12    8   28 o  811.949   5.7439  504.695   7.1384  519.443   11.545  495.567   9.0826  823.536   9.1592  804.495   7.3759 19.04089 11.75988 
1 1 1   12    8   29 o  1069.10   6.3865  875.083   10.451  887.878   16.263  866.083   13.640  1076.59   9.8693  1063.43   8.3798 13.15320 12.94694 
1 1 1   12    8   30 o  677.617   5.3931  351.515   5.5936  347.385   8.1012  355.279   7.7328  673.507   7.8585  681.140   7.4171 -7.633362 10.80595 
1 1 1   12    8   31 o  609.944   5.4288  284.821   5.0683  287.390   7.3942  282.544   6.9609  612.570   7.8862  607.405   7.4871 5.164917 10.87422 
1 1 1   12    8   32 o  858.737   6.0784  564.643   7.9895  553.716   12.533  572.122   10.370  850.071   9.6325  864.265   7.8387 -14.19354 12.41891 
1 1 1   12    8   33 o  183.231   11.593   25.849   3.2346   24.682   4.3097   27.354   4.8947  178.542   15.938  187.857   17.214 -9.315094 23.45918 
1 1 1   12    8   34 o  152.508   13.473   17.994   3.1128   16.072   4.2545   20.208   4.5662  143.071   19.973  160.918   18.899 -17.84711 27.49683 
1 1 1   12    8   35 o  265.797   7.7325   54.131   3.1459   63.919   4.7985   46.753   4.1661  288.666   10.860  246.872   11.025 41.79425 15.47582 
1 1 1   12    8   36 o  328.419   7.2054   82.640   3.6221   86.745   5.2296   78.855   5.0215  336.288   10.160  320.624   10.232 15.66336 14.41939 
1 1 1   12    8   37 o  299.466   7.6003   68.731   3.4838   76.917   5.1069   61.606   4.7645  316.589   10.539  283.300   10.988 33.28931 15.22474 
1 1 1   12    8   38 o  238.899   8.8379   43.773   3.2317   47.189   4.6389   40.551   4.5047  247.803   12.230  229.304   12.887 18.49925 17.76667 
1 1 1   12    8   39 o  234.685   9.3709   42.265   3.3662   39.813   4.5256   45.300   5.0361  227.119   13.074  242.226   13.639 -15.10677 18.89273 
1 1 1   12    8   40 o  214.220   9.9838   35.239   3.2736   38.996   5.6064   33.295   4.0325  224.119   16.458  207.624   12.751 16.49475 20.81937 
1 1 1   12    8   41 f  359.129   6.9150   98.882   3.8011   98.628   5.9419   99.058   4.9454  358.202   10.837  359.227   8.9943 -1.024597 14.08362 
1 1 1   12    8   42 o  225.271   8.9886   38.967   3.0993   42.725   4.6875   36.049   4.1312  235.090   13.079  215.971   12.551 19.11858 18.12691 
1 1 1   12    8   43 o  123.269   15.404   11.932   2.8430   12.081   4.1640   11.801   3.8912  122.277   23.095  121.135   21.788 1.141617 31.75013 
1 1 1   12    8   44 o  364.655   6.9617  102.017   3.8857  103.379   5.8138  100.916   5.2238  366.537   10.363  362.315   9.4196 4.222626 14.00409 
1 1 1   12    8   45 o  110.694   24.115   10.033   3.9702   17.776   6.8158   6.0564   4.8844  145.915   31.445   89.092   30.129 56.82301 43.54890 
1 1 1   12    8   46 o  352.052   7.6496   95.196   4.1221   94.966   5.8832   95.418   5.7772  350.963   10.952  351.850   10.727 -0.8864441 15.33024 
1 1 1   12    8   47 o  157.225   13.872   19.303   3.3040   18.770   4.7777   19.791   4.5741  153.105   20.936  157.771   19.347 -4.665771 28.50639 
1 1 1   12    8   48 o  181.139   12.194   25.486   3.3611   28.624   5.0181   22.934   4.5264  190.622   17.390  170.399   17.609 20.22360 24.74844 
1 1 1   12    8   49 o  140.716   15.668   15.616   3.3174   15.673   4.9842   15.571   4.4450  138.199   24.457  138.714   21.642 -0.5153198 32.65773 
1 1 1   12    8   50 o  129.964   17.850   13.489   3.4570   17.551   5.2757   10.432   4.5764  146.224   24.434  111.361   27.104 34.86298 36.49201 
1 1 1   12    8   51 o  128.617   21.634   13.492   4.1078   15.660   5.9830   11.558   5.6500  135.645   29.645  115.976   31.162 19.66902 43.01043 
1 1 1   12    8   52 o   71.011   25.395   3.6326   3.4950   11.606   5.5471  -1.6160   4.5006  115.974   30.749   56.035   25.173 59.93909 39.73893 
1 1 1   12    8   53 o   52.643   22.879  -0.2451   3.4333  -3.5832   5.3051   2.1604   4.5035   56.363   26.073   68.627   27.725 -12.26378 38.05864 
1 1 1   12    8   54 o  113.429   21.508   10.638   3.5976   9.9938   5.4079   11.150   4.8185  107.125   31.128  113.855   27.874 -6.729927 41.78416 
1 1 1   12    8   55 o  178.930   14.034   25.224   3.8127   22.751   5.6657   27.272   5.1545  166.003   22.908  184.193   18.535 -18.18932 29.46722 
1 1 1   12    8   56 o  210.229   15.216   35.032   4.8632   34.290   6.9475   35.745   6.8097  203.817   22.653  208.796   21.621 -4.978287 31.31503 
1 1 1   12    8   57 f   89.982   26.307   7.0228   3.8520   7.7606   5.1123   6.0537   5.8589   94.117   30.798   87.479   32.624 6.637573 44.86465 
1 1 1   12    8   58 o  184.007   13.694   26.833   3.8293   25.338   5.3446   28.409   5.4892  175.267   20.298  186.155   19.557 -10.88771 28.18664 
1 1 1   12    8   59 o   44.801   21.028  -3.0916   3.6575  -6.2839   4.8004   1.3260   5.6471   46.470   22.431   68.835   29.628 -22.36431 37.16150 
1 1 1   12    8   60 o   91.485   24.615   7.4756   3.5224   11.651   4.7746   2.4892   5.2177  112.558   27.862   69.927   29.208 42.63087 40.36619 
1 1 1   12    8   61 o   79.640   24.881   5.6715   3.3658   7.2287   4.5757   3.8355   4.9685   88.066   29.152   73.209   29.281 14.85683 41.31861 
1 1 1   12    9    0 o  472.423   6.8458  170.943   4.9479  170.943   4.9479  170.943   4.9479  472.423   6.8458  472.423   6.8458 0.000000 0.000000 
1 1 1   12    9    1 o  231.944   4.9601   41.180   1.7609   39.149   2.4404   43.386   2.5435  226.131   7.0507  238.056   6.9805 -11.92503 9.921632 
1 1 1   12    9    2 o  147.799   9.2900   16.794   2.0909   18.710   2.6331   13.524   3.4401  155.894   11.108  131.639   17.508 24.25555 20.73409 
1 1 1   12    9    3 o  363.137   6.7686  100.954   3.7622   96.939   4.8366  107.104   5.9865  355.801   8.8811  373.949   10.459 -18.14780 13.72097 
1 1 1   12    9    4 o  986.741   8.1681  745.506   12.337  752.615   15.108  731.280   21.371  991.322   9.9569  976.807   14.294 14.51453 17.41975 
1 1 1   12    9    5 o  471.451   5.8602  170.144   4.2288  167.843   4.9484  176.373   8.1428  468.231   6.9046  479.857   11.087 -11.62537 13.06076 
1 1 1   12    9    6 o  420.932   5.1271  135.626   3.3033  134.857   3.7016  138.633   7.3206  419.728   5.7617  425.430   11.242 -5.701782 12.63262 
1 1 1   12    9    7 o  220.456   7.7662   37.209   2.6206   36.517   3.0638   39.096   5.0584  218.379   9.1659  225.378   14.745 -6.999237 17.36133 
1 1 1   12    9    8 o  487.774   6.5039  182.135   4.8558  184.125   5.8430  177.691   8.7305  490.404   7.7842  481.637   11.843 8.766174 14.17184 
1 1 1   12    9    9 o  782.261   9.1024  468.557   10.899  468.557   10.899   0.0000   0.0000  782.261   9.1024  ?   ?  0.000000 9.102406 
1 1 1   12    9   10 o  921.747   8.2110  650.481   11.584  643.223   13.935  666.717   20.842  916.506   9.9337  932.781   14.598 -16.27466 17.65742 
1 1 1   12    9   11 o  787.527   5.7603  474.737   6.9435  461.889   8.5990  498.811   11.771  776.756   7.2326  807.117   9.5281 -30.36108 11.96218 
1 1 1   12    9   12 o  984.385   6.5542  741.776   9.8754  728.327   12.382  765.288   16.371  975.351   8.2938  999.668   10.699 -24.31671 13.53741 
1 1 1   12    9   13 o  456.822   5.9292  159.740   4.1458  163.050   5.8205  156.332   5.9066  461.490   8.2401  451.876   8.5398 9.613251 11.86707 
1 1 1   12    9   14 o  1381.14   9.4364  1460.55   19.949  1455.26   28.077  1465.94   28.348  1378.31   13.309  1383.36   13.388 -5.043701 18.87765 
1 1 1   12    9   15 o  1069.47   6.9969  875.571   11.454  875.066   14.651  876.366   18.368  1069.08   8.9534  1069.74   11.218 -0.6661377 14.35297 
1 1 1   12    9   16 o  874.302   8.0036  585.206   10.711  589.140   12.896  576.460   19.229  877.172   9.6054  867.413   14.483 9.758301 17.37910 
1 1 1   12    9   17 o  1069.09   7.9068  875.006   12.938  867.256   14.690  901.818   27.325  1064.29   9.0174  1084.74   16.457 -20.44958 18.76590 
1 1 1   12    9   18 o  774.339   6.0502  458.975   7.1708  455.262   9.0893  465.095   11.670  771.152   7.7005  779.358   9.7826 -8.205872 12.44982 
1 1 1   12    9   19 f  625.196   5.2769  299.186   5.0497  301.232   7.0405  297.019   7.2466  627.284   7.3328  622.875   7.6008 4.408997 10.56141 
1 1 1   12    9   20 o  543.259   5.2407  225.904   4.3578  228.133   6.1311  223.628   6.1950  545.890   7.3378  540.469   7.4886 5.420288 10.48437 
1 1 1   12    9   21 o  1063.36   6.5909  865.611   10.728  862.587   15.037  868.744   15.308  1061.36   9.2564  1065.14   9.3896 -3.773071 13.18502 
1 1 1   12    9   22 o  911.120   6.0121  635.470   8.3844  647.939   12.242  624.453   11.507  919.896   8.6944  903.089   8.3245 16.80695 12.03701 
1 1 1   12    9   23 o  1286.16   6.9210  1266.41   13.625  1291.89   21.318  1248.81   17.715  1298.73   10.724  1277.04   9.0631 21.69153 14.04087 
1 1 1   12    9   24 o  651.904   5.2121  325.308   5.2008  314.463   8.0332  333.133   6.8239  640.852   8.1895  659.653   6.7584 -18.80127 10.61815 
1 1 1   12    9   25 o  1050.85   7.2802  845.474   11.710  859.955   18.941  836.514   14.899  1059.46   11.680  1045.13   9.3133 14.33643 14.93838 
1 1 1   12    9   26 o  369.041   6.5809  104.267   3.7173  105.710   5.7358  103.222   4.8812  371.496   10.087  367.138   8.6861 4.357574 13.31167 
1 1 1   12    9   27 o  454.913   6.2630  158.434   4.3609  160.283   9.2468  157.905   4.9455  457.285   13.211  454.130   7.1147 3.155060 15.00498 
1 1 1   12    9   28 o  885.849   5.9120  600.763   8.0161  605.723   12.691  597.471   10.340  889.278   9.3240  883.319   7.6475 5.959106 12.05909 
1 1 1   12    9   29 o  1026.92   6.7585  807.456   10.623  835.999   19.218  794.896   12.748  1044.39   12.022  1018.79   8.1749 25.59125 14.53816 
1 1 1   12    9   30 o  757.736   5.7934  439.582   6.7193  446.737   10.846  435.124   8.5600  763.653   9.2788  753.793   7.4191 9.859192 11.88018 
1 1 1   12    9   31 o  452.401   6.1506  156.709   4.2590  159.614   7.1792  155.131   5.2906  456.382   10.277  450.058   7.6801 6.324188 12.82983 
1 1 1   12    9   32 o  312.643   7.4731   74.865   3.5762   67.937   6.2239   78.280   4.3695  297.551   13.666  319.639   8.9311 -22.08856 16.32533 
1 1 1   12    9   33 o  331.764   8.0150   84.323   4.0701   88.012   5.1156   77.960   6.7186  338.853   9.8631  318.681   13.774 20.17245 16.94111 
1 1 1   12    9   34 o  404.263   6.3428  125.166   3.9248  127.152   5.6156  123.269   5.4876  407.306   9.0076  401.044   8.9396 6.262756 12.69065 
1 1 1   12    9   35 o   68.546   22.025   3.5394   2.6215   5.3936   3.9244   2.0453   3.5227   84.217   26.937   64.428   24.990 19.78857 36.74353 
1 1 1   12    9   36 f  322.793   6.9893   79.832   3.4533   82.947   5.2173   77.404   4.6068  328.808   10.366  317.697   9.4736 11.11093 14.04330 
1 1 1   12    9   37 o  384.977   6.3202  113.542   3.7242  120.243   5.5866  108.182   4.9964  395.943   9.2182  375.608   8.6907 20.33514 12.66898 
1 1 1   12    9   38 o   89.855   20.602   6.5003   2.7730   7.2626   4.0118   5.8029   3.8373   95.072   26.550   86.153   26.509 8.919151 37.51822 
1 1 1   12    9   39 o  364.628   8.4924  101.984   4.7397   99.095   6.8374  104.657   6.5761  358.955   12.445  369.003   11.643 -10.04849 17.04198 
1 1 1   12    9   40 o  216.028   9.5708   35.831   3.1647   37.643   4.5484   34.130   4.4060  220.664   13.532  210.036   13.782 10.62778 19.31437 
1 1 1   12    9   41 o  206.188   9.6118   32.653   3.0335   39.096   4.6609   27.919   3.9955  224.808   13.609  189.797   13.849 35.01166 19.41675 
1 1 1   12    9   42 o  167.663   11.151   21.722   2.8455   20.903   4.1777   22.431   3.8863  163.419   16.948  169.721   15.118 -6.301788 22.71137 
1 1 1   12    9   43 o   61.935   21.941   2.6313   2.6030   4.2359   3.8197   1.2401   3.5567   76.662   26.621   60.392   24.553 16.26925 36.21519 
1 1 1   12    9   44 o  156.114   14.257   19.002   3.3692   21.355   6.6382   18.185   3.9103  161.782   27.809  152.078   17.095 9.704620 32.64352 
1 1 1   12    9   45 o  394.781   7.4449  119.659   4.4987  124.438   6.0297  113.659   6.7563  402.117   9.7966  383.906   11.498 18.21094 15.10540 
1 1 1   12    9   46 o  214.501   10.691   35.468   3.5100   38.634   4.8357   31.943   5.1027  222.810   14.254  201.878   16.663 20.93266 21.92754 
1 1 1   12    9   47 o  227.057   9.7748   39.710   3.3971   35.076   4.9920   43.708   4.6362  211.830   15.504  237.333   12.810 -25.50249 20.11143 
1 1 1   12    9   48 o  417.976   7.0554  134.186   4.5138  126.518   6.7303  140.456   6.0854  404.861   10.861  427.060   9.3095 -22.19934 14.30466 
1 1 1   12    9   49 o  291.351   8.6106   65.337   3.8399   73.322   5.7248   58.807   5.1773  307.769   12.152  275.597   12.273 32.17194 17.27169 
1 1 1   12    9   50 o  271.086   9.0435   56.624   3.7524   53.743   5.5551   59.042   5.0889  262.552   13.873  276.092   12.042 -13.54041 18.37004 
1 1 1   12    9   51 o  279.803   10.576   60.516   4.5292   54.572   6.4755   66.210   6.3373  263.521   16.132  291.510   14.203 -27.98984 21.49338 
1 1 1   12    9   52 o   97.158   23.493   7.8893   3.4554   5.2078   5.3746   9.7785   4.5113   84.975   31.334  107.252   27.385 -22.27685 41.61436 
1 1 1   12    9   53 o  260.422   10.389   52.479   4.1413   49.374   6.3754   54.744   5.4468  249.903   16.764  264.668   13.490 -14.76483 21.51816 
1 1 1   12    9   54 o   75.785   25.871   4.4946   3.6017   4.8473   5.5158   4.2324   4.7554   83.247   31.525   78.114   29.340 5.132935 43.06621 
1 1 1   12    9   55 o  180.102   13.859   25.552   3.7912   36.015   5.6820   17.156   5.0898  212.236   17.651  143.131   24.088 69.10507 29.86277 
1 1 1   12    9   56 o  179.529   17.759   25.951   4.8161   21.000   6.8836   30.698   6.7405  154.359   30.217  192.077   23.411 -37.71849 38.22483 
1 1 1   12    9   57 o   68.681   26.154   3.1939   3.8095  -2.3910   5.1455   9.9686   5.6671   57.061   26.133  104.747   32.213 -47.68640 41.47997 
1 1 1   12    9   58 o   94.752   25.711   7.8909   3.8239   3.9557   5.1258   12.830   5.7423   76.393   29.999  118.007   31.284 -41.61349 43.34312 
1 1 1   12    9   59 o  294.844   10.177   67.846   4.5929   50.276   6.9060   81.780   6.1501  247.937   18.327  322.145   12.473 -74.20831 22.16906 
1 1 1   12    9   60 o  146.988   16.208   17.646   3.5860   20.858   5.0077   14.265   5.1376  156.450   21.478  124.834   27.619 31.61642 34.98793 
1 1 1   12    9   61 o   62.169   24.792   2.4357   3.5515   2.9103   4.6132   1.7451   5.5646   68.349   27.895   68.033   29.346 0.3163376 40.48884 
1 1 1   12   10    0 o  508.739   7.0888  198.224   5.5176  198.224   5.5176  198.224   5.5176  508.739   7.0888  508.739   7.0888 0.000000 0.000000 
1 1 1   12   10    1 o  615.616   6.1983  290.115   5.8405  284.136   9.8780  293.329   7.2420  609.089   10.595  618.975   7.6439 -9.885925 13.06496 
1 1 1   12   10    2 o  188.156   6.6630   27.102   1.9189   26.328   2.2140   29.439   3.8470  185.438   7.8004  195.596   12.923 -10.15790 15.09434 
1 1 1   12   10    3 o  641.301   6.4043  314.833   6.2864  312.126   7.5182  321.123   11.461  638.501   7.6928  647.480   11.565 -8.979065 13.88978 
1 1 1   12   10    4 o  524.466   6.0133  210.560   4.8272  215.574   5.8296  199.620   8.6102  530.648   7.1773  510.520   11.019 20.12866 13.15015 
1 1 1   12   10    5 o  471.885   5.9301  170.454   4.2832  173.093   5.0888  164.044   7.9323  475.502   6.9919  462.795   11.198 12.70706 13.20164 
1 1 1   12   10    6 o  590.962   5.5689  267.327   5.0373  269.315   5.7730  260.983   10.312  593.138   6.3588  583.725   11.541 9.413086 13.17701 
1 1 1   12   10    7 o  559.225   6.6052  239.401   5.6539  237.957   6.8328  242.537   10.069  557.502   8.0072  562.719   11.690 -5.216736 14.16942 
1 1 1   12   10    8 o  503.053   7.8179  193.741   6.0197  193.741   6.0197   0.0000   0.0000  503.053   7.8179  ?   ?  0.000000 7.817863 
1 1 1   12   10    9 o   77.528   18.986   4.7936   2.2350   3.5618   2.5335   9.1161   4.7459   68.627   21.610  107.030   28.473 -38.40215 35.74492 
1 1 1   12   10   10 o  1939.51   14.398  2882.16   42.743  2867.49   51.957  2912.89   75.181  1934.03   17.552  1947.52   25.221 -13.48962 30.72681 
1 1 1   12   10   11 o  200.595   9.2215   30.809   2.8313   29.708   3.2088   34.682   6.0167  196.670   10.700  211.853   18.748 -15.18237 21.58675 
1 1 1   12   10   12 o  1074.75   7.8932  884.300   12.985  890.285   18.400  878.362   18.327  1078.21   11.149  1070.96   11.180 7.246338 15.78908 
1 1 1   12   10   13 o  241.290   6.4355   44.567   2.3768   45.460   2.5318   37.938   6.8988  243.693   6.7876  221.454   20.588 22.23897 21.67837 
1 1 1   12   10   14 o  890.458   7.0094  606.984   9.5535  607.998   10.878  603.565   19.976  891.168   7.9750  887.561   14.704 3.606567 16.72749 
1 1 1   12   10   15 o  832.239   6.8149  530.202   8.6811  507.040   11.521  560.631   13.205  813.774   9.2492  855.664   10.082 -41.88965 13.68218 
1 1 1   12   10   16 o  575.491   5.9972  253.513   5.2827  248.525   7.0019  260.104   8.0489  569.758   8.0289  582.854   9.0221 -13.09515 12.07732 
1 1 1   12   10   17 o  815.908   6.1477  509.579   7.6775  514.552   9.8339  501.815   12.286  819.826   7.8367  809.534   9.9156 10.29211 12.63858 
1 1 1   12   10   18 o  247.330   6.8268   46.828   2.5844   46.542   3.2019   47.364   4.3780  246.554   8.4845  248.681   11.502 -2.126526 14.29242 
1 1 1   12   10   19 o  796.690   5.6462  485.848   6.8852  478.715   9.4853  493.790   10.010  790.751   7.8369  803.094   8.1433 -12.34247 11.30179 
1 1 1   12   10   20 o  1068.60   6.5820  874.153   10.766  888.892   15.354  859.898   15.100  1077.43   9.3100  1059.71   9.3091 17.71704 13.16570 
1 1 1   12   10   21 o  704.957   5.9762  380.423   6.4485  383.687   8.3730  375.665   10.110  707.920   7.7273  700.413   9.4301 7.506714 12.19170 
1 1 1   12   10   22 o  340.849   8.5827   88.958   4.4777   88.958   4.4777   0.0000   0.0000  340.849   8.5827  ?   ?  0.000000 8.582677 
1 1 1   12   10   23 o  240.998   8.3011   44.472   3.0621   42.972   4.7121   45.568   4.0287  236.452   13.071  243.908   10.791 -7.455460 16.94956 
1 1 1   12   10   24 o  667.531   6.3295  341.127   6.4671  362.830   10.381  327.361   8.2675  688.288   9.8534  653.853   8.2609 34.43463 12.85814 
1 1 1   12   10   25 o  546.750   5.7267  228.840   4.7925  231.820   7.0361  226.261   6.5457  550.215   8.3546  543.595   7.8670 6.619690 11.47563 
1 1 1   12   10   26 o  1395.26   8.0684  1490.70   17.231  1556.70   31.906  1463.53   20.474  1424.89   14.629  1382.31   9.6765 42.57947 17.53988 
1 1 1   12   10   27 o   45.645   20.050  -0.7293   2.6986   7.9810   7.3094  -2.1039   2.9037  106.623   36.837   42.744   19.596 63.87943 41.72528 
1 1 1   12   10   28 o  560.171   6.4775  240.249   5.5539  243.745   9.1851  238.234   6.9731  564.032   10.639  557.748   8.1681 6.284119 13.41305 
1 1 1   12   10   29 o  816.215   5.8555  510.046   7.3154  510.772   11.626  509.570   9.4122  816.565   9.3017  815.734   7.5383 0.8301392 11.97283 
1 1 1   12   10   30 o  224.996   8.9020   38.779   3.0657   40.065   5.4607   38.188   3.7046  227.927   15.749  223.221   10.843 4.705856 19.12065 
1 1 1   12   10   31 o  309.293   7.2899   73.263   3.4511   70.887   5.9807   74.450   4.2256  304.007   12.853  311.734   8.8559 -7.726898 15.60836 
1 1 1   12   10   32 o  176.240   11.853   23.929   3.1789   25.373   5.4385   23.179   3.9179  180.444   20.029  173.105   14.933 7.339203 24.98295 
1 1 1   12   10   33 o  161.301   14.271   20.136   3.4869   21.304   5.4586   19.332   4.5321  164.696   22.221  157.286   19.225 7.410309 29.38327 
1 1 1   12   10   34 o  124.773   16.173   12.172   3.0161   10.308   5.3708   13.031   3.6452  113.118   30.378  128.669   19.087 -15.55055 35.87652 
1 1 1   12   10   35 o  177.601   11.139   24.299   3.0126   26.913   5.5481   23.207   3.5875  185.705   19.825  173.254   13.639 12.45105 24.06328 
1 1 1   12   10   36 o  251.454   8.6662   48.479   3.3355   54.669   5.9506   45.643   4.0277  266.175   14.662  243.867   10.790 22.30879 18.20468 
1 1 1   12   10   37 o  343.411   6.5809   90.361   3.4592   85.965   5.1198   94.053   4.6921  334.696   9.9939  350.198   8.7535 -15.50180 13.28542 
1 1 1   12   10   38 f  216.477   10.000   35.973   3.3135   39.191   4.6647   32.694   4.7077  225.266   13.592  205.444   15.076 19.82143 20.29887 
1 1 1   12   10   39 o  523.093   6.4041  209.695   5.1275  224.993   9.3172  203.048   6.1412  541.074   11.250  514.568   7.7972 26.50574 13.68800 
1 1 1   12   10   40 o  248.272   8.4086   47.295   3.1954   47.457   4.9989   47.183   4.1551  247.881   13.223  247.755   10.957 0.1257019 17.17265 
1 1 1   12   10   41 o  192.350   10.079   28.509   2.9571   27.856   4.2785   29.105   4.0917  189.370   14.881  193.774   13.888 -4.403870 20.35424 
1 1 1   12   10   42 o   78.458   21.878   4.9521   2.7261   2.2757   3.8377   7.6783   3.8732   66.893   26.045   97.022   25.680 -30.12852 36.57614 
1 1 1   12   10   43 o  233.823   8.5500   41.993   3.0600   45.229   4.5494   39.319   4.1352  241.891   12.328  225.548   12.021 16.34372 17.21930 
1 1 1   12   10   44 o  167.883   13.042   21.897   3.3250   24.192   6.2955   21.009   3.9157  173.493   24.380  163.847   15.810 9.645737 29.05751 
1 1 1   12   10   45 o  169.449   14.684   22.418   3.7709   22.291   4.5382   22.701   6.7772  168.164   17.907  166.575   27.543 1.588455 32.85259 
1 1 1   12   10   46 o  221.902   9.7417   37.916   3.3088   37.588   4.7576   38.224   4.6048  219.742   14.221  221.749   13.633 -2.007996 19.70032 
1 1 1   12   10   47 o  325.971   7.4426   81.630   3.7134   88.456   5.5094   75.948   5.0268  338.659   10.629  313.839   10.464 24.81970 14.91544 
1 1 1   12   10   48 o  110.853   18.441   9.8786   3.0191   7.7691   4.4135   11.734   4.1391   96.750   28.123  119.539   23.459 -22.78941 36.62313 
1 1 1   12   10   49 o  121.757   17.095   11.817   3.0982   16.673   4.5271   7.5401   4.2490  143.681   21.224   95.203   27.572 48.47861 34.79435 
1 1 1   12   10   50 o  100.060   23.307   8.3124   3.5033   7.5092   4.6719   9.3442   5.2952   95.104   29.248  105.012   30.885 -9.908707 42.53610 
1 1 1   12   10   51 o  108.292   22.260   9.6867   3.5663   8.4312   5.9027   10.408   4.4756  100.662   33.101  111.001   26.674 -10.33848 42.51062 
1 1 1   12   10   52 o  115.401   19.841   10.847   3.3783   8.5524   4.9391   12.864   4.6311  100.272   29.914  123.897   25.277 -23.62538 39.16285 
1 1 1   12   10   53 o   35.762   17.591  -6.7430   3.3724 -10.9521   5.0891  -3.4474   4.5032   42.544   21.054   51.184   23.796 -8.639755 31.77292 
1 1 1   12   10   54 o  209.025   12.184   34.118   3.8813   30.294   5.9274   36.989   5.1355  193.505   20.316  216.315   15.615 -22.80942 25.62347 
1 1 1   12   10   55 o  132.322   21.820   14.512   4.2653   6.2965   8.4568   17.315   4.9396   95.565   38.209  144.128   23.176 -48.56320 44.68819 
1 1 1   12   10   56 o   96.888   28.581   8.2391   4.5286   11.568   5.6113   2.0199   7.6692  113.236   31.321   80.443   34.574 32.79277 46.65172 
1 1 1   12   10   57 o   42.264   20.166  -4.2475   3.6352  -3.9034   5.0832  -4.6076   5.2006   53.228   24.922   52.539   24.789 0.6887779 35.15099 
1 1 1   12   10   58 o   53.353   23.236  -0.0088   3.5566   2.5169   4.9515  -2.7010   5.1120   70.102   28.788   55.732   25.715 14.37044 38.60049 
1 1 1   12   10   59 o   56.742   23.719   1.1560   3.4447   6.4540   4.6687  -5.1742   5.1032   85.456   29.445   50.159   23.922 35.29721 37.93772 
1 1 1   12   10   60 o   60.402   24.049   2.1990   3.3368   6.4999   4.4920  -3.0960   4.9841   84.732   28.892   53.153   24.819 31.57887 38.08833 
1 1 1   12   10   61 o   32.997   16.504  -8.7241   3.4823  -9.2229   4.4263  -7.9138   5.6414   39.039   19.375   48.231   23.518 -9.191936 30.47127 
1 1 1   12   11    0 o  520.103   10.372  207.337   8.2496  207.337   8.2496  207.337   8.2496  520.103   10.372  520.103   10.372 0.000000 0.000000 
1 1 1   12   11    1 o  254.331   6.0318   49.515   2.3481   47.463   2.7732   54.710   4.4133  248.995   7.2764  267.276   10.788 -18.28113 13.01254 
1 1 1   12   11    2 o  381.836   5.7083  111.604   3.3362  111.009   3.9700  113.033   6.1547  380.801   6.8112  384.185   10.466 -3.384033 12.48758 
1 1 1   12   11    3 o  467.581   5.8702  167.357   4.2013  162.527   4.9521  179.761   7.9362  460.764   7.0216  484.486   10.702 -23.72110 12.79981 
1 1 1   12   11    4 o  634.120   6.4707  307.814   6.2804  306.242   7.5233  311.429   11.407  632.464   7.7715  637.656   11.688 -5.192444 14.03565 
1 1 1   12   11    5 o  473.289   6.0104  171.468   4.3541  170.892   5.1604  172.891   8.1126  472.473   7.1357  475.128   11.155 -2.654785 13.24228 
1 1 1   12   11    6 o  635.531   5.7663  309.168   5.6092  306.703   6.3734  317.641   11.814  632.974   6.5783  643.979   11.985 -11.00568 13.67208 
1 1 1   12   11    7 o  881.557   9.6936  595.069   13.080  595.069   13.080   0.0000   0.0000  881.557   9.6936  ?   ?  0.000000 9.693556 
1 1 1   12   11    8 o  1207.25   9.7654  1115.99   18.045  1152.92   22.801  1054.10   29.521  1226.89   12.142  1172.74   16.446 54.15125 20.44223 
1 1 1   12   11    9 o  904.237   8.1555  625.977   11.288  613.446   13.464  655.611   20.705  895.069   9.8279  925.030   14.623 -29.96149 17.61907 
1 1 1   12   11   10 o  1459.16   11.345  1630.56   25.339  1609.80   30.465  1677.15   45.643  1449.61   13.730  1478.78   20.165 -29.16602 24.39585 
1 1 1   12   11   11 o  274.423   7.8868   57.653   3.3128   58.112   3.8024   56.206   6.7488  275.500   9.0171  270.318   16.388 5.182037 18.70532 
1 1 1   12   11   12 o  413.447   6.0650  130.846   3.8381  129.993   5.2416  131.833   5.6356  412.062   8.3106  414.957   8.8729 -2.895782 12.15708 
1 1 1   12   11   13 o  1225.33   8.6786  1149.52   16.277  1115.74   22.155  1189.14   23.993  1206.98   11.992  1246.01   12.580 -39.02271 17.38041 
1 1 1   12   11   14 o  397.444   5.2736  120.908   3.2082  117.122   3.8790  129.105   5.7072  391.157   6.4789  410.636   9.0801 -19.47937 11.15463 
1 1 1   12   11   15 o  894.930   10.302  613.287   14.112   0.0000   0.0000  613.287   14.112  ?   ?   894.930   10.302 0.000000 10.30242 
1 1 1   12   11   16 o  881.876   6.3598  595.321   8.5846  587.491   10.791  608.816   14.167  875.999   8.0483  891.651   10.381 -15.65240 13.13523 
1 1 1   12   11   17 o  187.045   7.7634   26.784   2.2226   26.534   2.6279   27.415   4.1660  186.154   9.2229  188.593   14.544 -2.438110 17.22199 
1 1 1   12   11   18 o  220.999   8.0679   37.393   2.7291   38.992   3.5002   34.914   4.3585  225.650   10.134  213.053   13.434 12.59702 16.82795 
1 1 1   12   11   19 o  542.636   5.7391  225.396   4.7668  225.999   5.9942  224.358   7.8619  543.330   7.2078  541.290   9.4892 2.040466 11.91621 
1 1 1   12   11   20 o  961.512   6.2306  707.716   9.1697  699.187   12.668  717.102   13.290  955.589   8.6612  967.736   8.9721 -12.14734 12.47061 
1 1 1   12   11   21 o  181.540   9.6409   25.309   2.6693   23.352   3.8028   27.211   3.7478  173.961   14.412  187.994   13.106 -14.03259 19.48005 
1 1 1   12   11   22 f  853.599   6.5623  557.805   8.5739  562.172   13.384  554.765   11.166  856.746   10.207  851.177   8.5703 5.568665 13.32754 
1 1 1   12   11   23 o  204.008   8.5571   31.870   2.6720   33.387   3.8137   30.407   3.7450  208.406   12.006  198.829   12.367 9.577393 17.23615 
1 1 1   12   11   24 o  375.857   7.1408  108.159   4.1081  112.484   5.1906  100.907   6.7209  383.256   8.8483  362.899   12.100 20.35739 14.98972 
1 1 1   12   11   25 o  585.727   5.8862  262.639   5.2771  264.333   7.4846  260.964   7.4416  587.527   8.3228  583.771   8.3282 3.756165 11.77404 
1 1 1   12   11   26 o  1058.24   7.6231  857.503   12.348  859.900   19.952  856.015   15.720  1059.27   12.306  1057.15   9.7149 2.122803 15.67849 
1 1 1   12   11   27 o  142.107   13.680   15.626   2.9388   16.360   4.3523   15.010   3.9842  144.536   20.227  138.472   19.325 6.063705 27.97453 
1 1 1   12   11   28 o  624.602   6.6863  298.710   6.3923  301.643   10.058  296.723   8.2798  627.447   10.472  622.420   8.6910 5.026855 13.60895 
1 1 1   12   11   29 o  487.644   5.7793  182.059   4.3137  190.021   7.0567  177.309   5.4506  498.043   9.2569  481.181   7.4006 16.86166 11.85159 
1 1 1   12   11   30 o  666.254   6.1509  339.884   6.2726  327.435   9.0498  351.394   8.7020  653.755   9.0439  677.300   8.3940 -23.54523 12.33901 
1 1 1   12   11   31 o  199.252   10.330   30.512   3.1397   25.004   5.1727   33.725   3.9508  179.275   19.147  209.326   12.386 -30.05075 22.80369 
1 1 1   12   11   32 o  177.565   12.591   24.313   3.3999   30.233   5.2506   20.039   4.4616  197.490   17.553  160.316   18.523 37.17427 25.51847 
1 1 1   12   11   33 o  465.760   6.3740  166.146   4.5440  164.299   7.2474  167.342   5.8330  462.893   10.229  467.323   8.1546 -4.430023 13.08159 
1 1 1   12   11   34 o  110.520   16.769   9.6119   2.7477   12.771   5.0068   8.2505   3.2869  125.928   26.798  101.424   21.820 24.50333 34.55802 
1 1 1   12   11   35 o  419.630   6.3555  134.890   4.0821  144.674   7.1372  130.133   4.9765  434.208   10.739  412.061   7.8902 22.14752 13.32587 
1 1 1   12   11   36 o  297.181   7.7314   67.694   3.5168   68.731   6.1067   67.180   4.3018  298.993   13.344  295.935   9.4969 3.057922 16.37825 
1 1 1   12   11   37 o  384.061   7.0672  113.048   4.1545  119.954   7.8897  110.399   4.8869  394.938   13.052  379.421   8.4148 15.51688 15.52909 
1 1 1   12   11   38 o  176.366   13.491   24.079   3.6143   27.302   6.0441   22.285   4.5094  186.323   21.593  168.913   17.705 17.41000 27.92373 
1 1 1   12   11   39 o  592.565   6.7695  269.155   6.1399  269.346   13.299  269.103   6.9218  591.034   14.700  592.380   7.6339 -1.346619 16.56431 
1 1 1   12   11   40 o  326.475   7.8549   81.765   3.9252   79.137   7.6429   82.706   4.5746  320.077   15.600  328.216   9.1059 -8.138824 18.06339 
1 1 1   12   11   41 o  328.607   6.8482   82.804   3.4445   84.355   5.0565   81.460   4.7049  331.305   9.9713  325.642   9.4393 5.663055 13.73051 
1 1 1   12   11   42 o   45.663   19.664  -0.1763   2.4899  -1.4164   3.6194   0.9378   3.4306   50.846   22.726   58.217   23.941 -7.371162 33.01031 
1 1 1   12   11   43 f   78.455   23.889   4.8840   3.1265   2.4512   5.9656   5.8052   3.6710   78.569   31.851   85.239   25.871 -6.670212 41.03402 
1 1 1   12   11   44 o  386.595   6.9656  114.695   4.1218  129.006   6.0742  102.481   5.6114  409.481   9.6914  364.893   10.047 44.58832 13.95945 
1 1 1   12   11   45 o  259.457   10.820   51.894   4.2970   51.064   5.1456   53.806   7.8114  256.610   13.145  261.348   19.671 -4.737579 23.65899 
1 1 1   12   11   46 o  148.580   13.001   17.210   2.9269   19.447   4.5715   15.656   3.8103  156.325   19.532  140.417   18.153 15.90828 26.66537 
1 1 1   12   11   47 o  113.898   17.081   10.342   2.8860   12.759   4.4171   8.5414   3.8123  124.712   24.011  101.526   24.755 23.18530 34.48725 
1 1 1   12   11   48 o   50.187   21.260   0.2478   2.8261   0.4468   4.0773   0.0637   3.9208   60.144   25.510   57.694   24.757 2.449783 35.54772 
1 1 1   12   11   49 o   35.186   17.018  -4.3925   2.7972  -6.2176   4.0491  -2.7264   3.8687   42.345   20.479   48.564   22.394 -6.219097 30.34628 
1 1 1   12   11   50 o  208.609   11.980   33.828   3.8091   37.032   5.2865   30.368   5.4932  217.005   16.029  195.481   18.583 21.52408 24.54072 
1 1 1   12   11   51 f  204.125   12.051   32.428   3.7486   37.443   6.3119   29.696   4.6594  216.719   19.228  194.130   15.818 22.58881 24.89825 
1 1 1   12   11   52 o  144.364   15.377   16.496   3.3456   14.808   4.9401   17.926   4.5470  133.120   25.167  148.738   20.519 -15.61771 32.47171 
1 1 1   12   11   53 o  136.680   16.593   14.917   3.4002   24.661   5.1189   7.2236   4.5486  175.024   19.436   92.593   28.923 82.43081 34.84675 
1 1 1   12   11   54 o  183.988   12.935   26.543   3.6195   33.191   5.4905   21.434   4.8136  203.775   17.781  162.610   19.745 41.16579 26.57131 
1 1 1   12   11   55 o  157.680   17.129   19.964   4.0676   9.6324   7.0134   25.200   4.9931  104.509   36.085  176.567   18.763 -72.05807 40.67146 
1 1 1   12   11   56 o  173.281   17.159   24.170   4.4913   28.046   5.4480   15.947   7.9348  185.507   19.478  128.962   37.773 56.54436 42.49912 
1 1 1   12   11   57 o   89.777   25.996   7.0314   3.7776   6.3708   5.5228   7.6121   5.1784   87.697   31.849   92.982   31.024 -5.284973 44.46192 
1 1 1   12   11   58 o  120.463   21.118   12.261   3.7518   15.567   5.4786   9.3412   5.1486  131.792   28.021  100.726   30.653 31.06584 41.53098 
1 1 1   12   11   59 o  151.694   15.711   18.670   3.5950   17.229   4.8814   20.378   5.3142  141.004   23.440  153.637   23.332 -12.63344 33.07296 
1 1 1   12   11   60 o  164.367   13.989   21.738   3.4859   22.060   4.7295   21.355   5.1578  162.030   19.459  157.523   21.992 4.507324 29.36518 
1 1 1   12   12    0 o  1564.15   14.443  1873.95   34.571  1873.95   34.571  1873.95   34.571  1564.15   14.443  1564.15   14.443 0.000000 0.000000 
1 1 1   12   12    1 o  859.818   7.5483  565.965   9.9341  568.887   12.186  560.178   17.151  861.967   9.2366  855.139   13.103 6.828247 16.03166 
1 1 1   12   12    2 o  655.242   6.5830  328.660   6.6023  329.662   8.0378  326.582   11.576  656.203   8.0026  653.004   11.582 3.198669 14.07745 
1 1 1   12   12    3 f  860.113   7.5704  566.353   9.9665  578.088   12.352  544.460   16.872  868.909   9.2874  843.063   13.075 25.84631 16.03745 
1 1 1   12   12    4 o  253.390   6.5444   49.150   2.5382   50.465   2.9651   45.543   4.9104  256.748   7.5451  243.469   13.226 13.27873 15.22692 
1 1 1   12   12    5 o  1109.28   9.0289  942.136   15.330  992.917   19.681  863.795   24.445  1138.65   11.293  1061.75   15.042 76.89465 18.80911 
1 1 1   12   12    6 o  955.587   9.9057  699.207   14.489  699.207   14.489   0.0000   0.0000  955.587   9.9057  ?   ?  0.000000 9.905709 
1 1 1   12   12    7 o  1048.90   8.8656  842.337   14.234  852.760   17.620  822.761   24.147  1055.26   10.909  1036.23   15.225 19.03174 18.72937 
1 1 1   12   12    8 o  1335.26   10.564  1365.27   21.590  1370.36   26.522  1355.27   37.174  1337.55   12.955  1329.59   18.267 7.958252 22.39397 
1 1 1   12   12    9 o  1192.49   9.7497  1088.84   17.796  1080.93   21.537  1105.86   31.595  1188.02   11.844  1201.16   17.185 -13.14319 20.87093 
1 1 1   12   12   10 o  576.524   6.9983  254.440   6.1756  260.835   7.5138  241.125   10.842  583.692   8.4101  561.078   12.624 22.61426 15.16891 
1 1 1   12   12   11 o  1097.79   9.2804  922.722   15.594  926.038   19.069  916.030   27.092  1099.64   11.330  1093.31   16.189 6.332031 19.75997 
1 1 1   12   12   12 o  454.458   7.0396  158.103   4.8968  158.679   5.8178  156.703   9.0688  455.262   8.3489  452.299   13.099 2.962646 15.53380 
1 1 1   12   12   13 o  478.521   6.1882  175.279   4.5325  169.234   6.2062  182.188   6.6351  470.152   8.6241  487.809   8.8865 -17.65683 12.38327 
1 1 1   12   12   14 o  949.784   8.6082  690.656   12.514  691.187   21.548  690.386   15.372  949.778   14.822  949.502   10.577 0.2758179 18.20941 
1 1 1   12   12   15 o  471.548   6.4176  170.212   4.6320  170.027   6.4839  170.406   6.6196  471.239   8.9893  471.760   9.1672 -0.5207520 12.83918 
1 1 1   12   12   16 o  700.400   5.8111  375.506   6.2298  377.097   7.8656  372.827   10.205  701.843   7.3219  697.783   9.5544 4.060425 12.03731 
1 1 1   12   12   17 o  449.367   5.6441  154.570   3.8821  157.346   4.8024  149.336   6.5947  453.362   6.9205  441.610   9.7564 11.75208 11.96165 
1 1 1   12   12   18 f  883.659   6.4993  597.755   8.7906  592.227   11.044  607.309   14.521  879.495   8.2042  890.495   10.654 -11.00031 13.44644 
1 1 1   12   12   19 o  1010.77   7.8046  782.197   12.075  777.090   16.643  787.871   17.545  1007.28   10.795  1014.21   11.302 -6.926331 15.62865 
1 1 1   12   12   20 o  713.898   7.6454  390.199   8.3542  391.776   10.211  387.004   14.529  715.270   9.3266  710.680   13.357 4.590942 16.29079 
1 1 1   12   12   21 o  317.226   6.8935   77.041   3.3472   79.148   4.1222   72.964   5.7347  321.508   8.3766  308.606   12.141 12.90201 14.74991 
1 1 1   12   12   22 o  435.286   6.3384  145.051   4.2230  139.919   5.1963  155.033   7.2474  427.480   7.9416  449.895   10.525 -22.41571 13.18468 
1 1 1   12   12   23 o  227.177   9.2822   39.524   3.2276   40.697   4.0070   37.358   5.4466  230.482   11.358  220.107   16.282 10.37468 19.85251 
1 1 1   12   12   24 o  799.756   6.0744  489.654   7.4359  493.731   10.465  485.497   10.568  802.958   8.5148  796.226   8.6710 6.732117 12.15273 
1 1 1   12   12   25 o  888.646   7.1209  604.636   9.6858  617.898   15.892  596.798   12.217  898.006   11.562  882.745   9.0420 15.26099 14.67772 
1 1 1   12   12   26 o  960.766   7.3730  706.805   10.843  732.400   18.061  692.384   13.557  977.581   12.071  950.767   9.3160 26.81458 15.24753 
1 1 1   12   12   27 o   62.681   23.208   2.3386   2.9546   2.3446   4.5487   2.3342   3.8859   72.104   28.277   68.220   26.306 3.883629 38.62165 
1 1 1   12   12   28 o  354.927   7.7065   96.473   4.1867  101.301   6.6371   93.283   5.3956  363.530   11.928  348.925   10.103 14.60464 15.63134 
1 1 1   12   12   29 o  159.277   14.156   19.616   3.4152   19.855   4.6069   19.325   5.0886  159.565   19.252  156.975   21.764 2.589203 29.05696 
1 1 1   12   12   30 o  991.960   7.5140  753.650   11.409  759.849   14.868  744.775   17.790  995.763   9.7552  985.536   11.794 10.22711 15.30528 
1 1 1   12   12   31 o  545.199   6.4451  227.632   5.3784  241.108   7.9657  216.340   7.2914  560.910   9.2781  531.343   8.9654 29.56702 12.90199 
1 1 1   12   12   32 o  407.287   7.1109  127.066   4.4330  134.621   6.6051  120.873   5.9797  419.016   10.299  397.077   9.8387 21.93875 14.24297 
1 1 1   12   12   33 o  160.876   11.814   19.968   2.8887   22.986   4.8509   18.310   3.5958  171.709   18.762  153.539   15.513 18.17067 24.34512 
1 1 1   12   12   34 o  262.227   7.9779   52.699   3.2021   52.392   5.5854   52.849   3.9081  260.703   14.049  262.510   9.7263 -1.807037 17.08732 
1 1 1   12   12   35 o  785.618   5.9631  472.763   7.1706  481.563   11.509  467.179   9.1673  792.365   9.4894  780.742   7.6712 11.62372 12.20234 
1 1 1   12   12   36 o  331.124   7.1491   84.029   3.6234   80.470   6.5994   85.565   4.3353  323.476   13.329  334.042   8.4790 -10.56567 15.79720 
1 1 1   12   12   37 o  191.010   11.794   28.145   3.4312   25.222   5.8062   29.714   4.2533  179.038   21.625  195.929   14.281 -16.89079 25.91531 
1 1 1   12   12   38 o  207.817   9.6339   33.154   3.0645   38.559   5.7780   31.038   3.6147  222.753   17.077  200.578   11.826 22.17540 20.77189 
1 1 1   12   12   39 o  205.092   10.825   32.418   3.3861   38.004   9.4864   31.602   3.6249  217.730   29.201  202.360   11.754 15.36909 31.47770 
1 1 1   12   12   40 o  290.064   8.0531   64.559   3.5754   62.010   6.9708   65.469   4.1650  282.721   16.176  291.973   9.3197 -9.251312 18.66833 
1 1 1   12   12   41 o   46.086   20.318  -0.7585   2.7946  -1.7517   5.2977  -0.3756   3.2896   62.065   27.636   51.820   22.458 10.24502 35.61009 
1 1 1   12   12   42 f  294.352   8.0534   66.519   3.6284   69.531   6.4673   65.135   4.3832  299.970   14.086  291.048   9.8392 8.922668 17.18188 
1 1 1   12   12   43 o  503.378   6.6270  194.379   5.1060  201.304   8.8558  190.930   6.2493  511.117   11.320  498.585   8.1889 12.53278 13.97120 
1 1 1   12   12   44 o  243.008   11.996   45.578   4.4621   44.550   6.1996   46.684   6.4274  238.641   17.086  244.250   17.304 -5.609055 24.31771 
1 1 1   12   12   45 o  249.973   9.8391   48.117   3.7646   51.752   6.7148   46.451   4.5463  257.095   17.162  245.219   12.112 11.87610 21.00593 
1 1 1   12   12   46 f  403.552   6.8862  125.035   4.2536  128.810   6.1551  121.585   5.8849  408.918   9.8339  397.326   9.6766 11.59253 13.79646 
1 1 1   12   12   47 o   64.485   22.796   2.9382   2.8084   4.8627   4.1489   1.3107   3.8155   80.405   27.755   61.897   25.327 18.50789 37.57405 
1 1 1   12   12   48 o  187.321   10.929   27.193   3.1200   32.909   4.7434   22.835   4.1421  204.993   15.226  170.321   16.079 34.67194 22.14412 
1 1 1   12   12   49 o  155.200   14.777   18.928   3.4679   24.694   4.8751   13.022   4.9343  176.312   18.333  124.711   26.657 51.60143 32.35291 
1 1 1   12   12   50 o  216.978   11.649   36.568   3.8545   35.634   5.3311   37.592   5.5796  212.613   16.511  218.284   16.830 -5.671677 23.57654 
1 1 1   12   12   51 o   83.184   24.487   5.7194   3.3273   9.7611   5.5723   3.4799   4.1480  106.618   31.766   72.833   27.394 33.78453 41.94613 
1 1 1   12   12   52 o  288.505   8.7741   64.202   3.8746   61.042   5.7742   66.790   5.2257  279.835   13.481  293.395   11.637 -13.56046 17.80860 
1 1 1   12   12   53 o   68.005   24.452   3.3353   3.2445   2.8200   4.9350   3.7276   4.3059   72.976   29.184   74.186   27.909 -1.209755 40.38054 
1 1 1   12   12   54 o   45.480   20.902  -2.0993   3.3312  -0.9173   4.9109  -3.1067   4.5337   60.068   26.685   51.917   24.046 8.150684 35.92065 
1 1 1   12   12   55 o  159.374   16.738   20.378   4.0221   31.678   6.9263   14.629   4.9405  194.995   23.693  130.731   25.606 64.26358 34.88588 
1 1 1   12   12   56 o   45.800   21.791  -4.5676   4.1823  -8.4042   4.7042   9.9010   9.1354   42.890   21.032  105.943   40.463 -63.05349 45.60293 
1 1 1   12   12   57 o   45.886   21.031  -1.8351   3.3410  -6.1321   4.6774   2.6413   4.7740   46.150   22.242   70.004   28.452 -23.85394 36.11377 
1 1 1   12   12   58 o  123.645   18.929   12.714   3.4684   16.309   4.8613   8.9857   4.9502  137.300   24.006   98.717   30.060 38.58310 38.46945 
1 1 1   12   12   59 o  242.245   10.945   46.060   4.0584   41.976   5.8120   49.947   5.6695  226.897   16.855  249.215   14.932 -22.31738 22.51788 
1 1 1   12   12   60 o   66.690   26.679   2.9199   4.1255   0.9106   4.7246   9.3698   8.4647   61.948   26.880   97.166   38.424 -35.21831 46.89346 
1 1 1   12   13    0 o  1241.84   12.025  1181.02   22.853  1181.02   22.853  1181.02   22.853  1241.84   12.025  1241.84   12.025 0.000000 0.000000 
1 1 1   12   13    1 o  346.070   6.1509   91.676   3.2582   92.722   3.9722   89.523   5.6960  348.025   7.4567  341.912   10.884 6.112579 13.19326 
1 1 1   12   13    2 o  738.357   7.0316  417.333   7.9467  422.348   9.7845  407.616   13.621  742.732   8.6067  729.523   12.198 13.20898 14.92899 
1 1 1   12   13    3 o  1281.58   10.059  1257.64   19.733  1253.25   24.008  1266.80   34.644  1279.18   12.262  1285.55   17.606 -6.369507 21.45550 
1 1 1   12   13    4 o  873.281   9.3926  583.908   12.555  583.908   12.555   0.0000   0.0000  873.281   9.3926  ?   ?  0.000000 9.392645 
1 1 1   12   13    5 f  689.349   8.3064  363.808   8.7644  363.808   8.7644   0.0000   0.0000  689.349   8.3064  ?   ?  0.000000 8.306382 
1 1 1   12   13    6 o  1045.32   10.796  836.745   17.274  854.008   24.772  820.408   24.099  1055.72   15.330  1034.76   15.216 20.96704 21.59932 
1 1 1   12   13    7 o  462.254   6.6766  163.569   4.7240  165.223   5.7388  160.091   8.3196  464.562   8.0706  457.201   11.889 7.360870 14.36914 
1 1 1   12   13    8 o  1035.30   8.8846  820.623   14.079  804.990   16.867  856.549   25.568  1025.29   10.748  1057.26   15.800 -31.96460 19.10847 
1 1 1   12   13    9 o  810.136   7.7858  502.447   9.6545  499.801   11.687  508.132   17.131  807.941   9.4508  814.440   13.742 -6.498474 16.67819 
1 1 1   12   13   10 o  627.387   7.1832  301.319   6.8980  300.625   8.3024  302.865   12.395  626.627   8.6561  628.809   12.879 -2.182129 15.51734 
1 1 1   12   13   11 o  1554.62   12.010  1851.06   28.579  1830.01   34.466  1897.38   51.129  1545.49   14.570  1572.69   21.240 -27.20874 25.75678 
1 1 1   12   13   12 o  883.501   8.2677  597.601   11.180  605.210   13.752  582.766   19.202  889.028   10.106  872.144   14.384 16.88385 17.57948 
1 1 1   12   13   13 o  846.624   8.1788  548.757   10.599  560.366   18.553  543.133   12.913  855.220   14.173  842.198   10.017 13.02228 17.35557 
1 1 1   12   13   14 o  1344.33   10.828  1384.02   22.281  1374.09   38.190  1389.14   27.434  1338.64   18.639  1346.59   13.310 -7.952759 22.90338 
1 1 1   12   13   15 o  552.526   6.4862  233.696   5.4855  233.753   7.6358  233.636   7.8855  552.529   9.0288  552.383   9.3265 0.1462402 12.98089 
1 1 1   12   13   16 o  676.556   6.7656  350.402   7.0061  352.316   9.8236  348.422   9.9950  678.311   9.4618  674.543   9.6806 3.768005 13.53658 
1 1 1   12   13   17 o  351.873   6.6218   94.783   3.5664   90.006   4.5653  102.263   5.7129  342.857   8.6994  365.424   10.214 -22.56760 13.41649 
1 1 1   12   13   18 o  517.306   6.4365  204.858   5.0964  212.403   6.8819  195.696   7.5840  526.691   8.5365  505.514   9.8016 21.17679 12.99782 
1 1 1   12   13   19 o  397.495   6.1434  120.952   3.7377  127.687   4.6099  108.031   6.3857  408.387   7.3749  375.553   11.109 32.83408 13.33392 
1 1 1   12   13   20 o  178.937   9.7926   24.594   2.6719   22.332   3.0310   32.479   5.6588  170.338   11.696  204.959   18.228 -34.62056 21.65811 
1 1 1   12   13   21 o  685.477   6.2278  359.710   6.5342  366.867   8.3087  348.108   10.579  692.204   7.8420  674.164   10.252 18.04022 12.90726 
1 1 1   12   13   22 o  622.123   6.2965  296.298   5.9957  299.841   7.5425  290.215   9.8824  625.776   7.8746  615.531   10.489 10.24506 13.11609 
1 1 1   12   13   23 o  898.265   6.2722  617.720   8.6237  617.555   12.025  617.895   12.374  898.005   8.7489  898.235   8.9998 -0.2300415 12.55150 
1 1 1   12   13   24 o  120.298   14.278   11.251   2.5777   9.5041   3.5541   13.190   3.7441  109.266   22.011  129.637   19.471 -20.37131 29.38731 
1 1 1   12   13   25 o  602.894   6.7418  278.297   6.2214  282.798   10.397  275.786   7.7652  607.522   11.180  600.095   8.4540 7.427124 14.01688 
1 1 1   12   13   26 f   87.077   20.354   6.0612   2.6642   7.4381   3.7983   4.7279   3.7378   96.533   25.373   80.111   26.340 16.42184 36.57335 
1 1 1   12   13   27 o  271.719   8.4012   56.548   3.4941   54.342   5.2671   58.281   4.6694  266.226   12.926  275.773   11.062 -9.547668 17.01302 
1 1 1   12   13   28 o  433.376   7.3666  143.832   4.8866  143.641   6.2381  144.135   7.8615  432.997   9.4123  433.606   11.845 -0.6083374 15.12936 
1 1 1   12   13   29 o  635.924   6.2381  309.656   6.0719  327.951   8.8323  293.262   8.3610  654.267   8.8196  618.698   8.8290 35.56970 12.47943 
1 1 1   12   13   30 o  572.965   6.3629  251.399   5.5802  260.515   8.2111  243.576   7.6068  583.065   9.2005  563.820   8.8144 19.24420 12.74138 
1 1 1   12   13   31 o  358.861   7.4180   98.651   4.0746  101.796   5.9564   95.885   5.5861  364.353   10.680  353.639   10.320 10.71375 14.85183 
1 1 1   12   13   32 o  138.663   15.749   14.973   3.2834   16.122   4.5718   13.748   4.7184  142.954   21.564  131.244   24.386 11.71001 32.55282 
1 1 1   12   13   33 o  184.972   12.038   26.376   3.3896   24.441   4.7767   28.339   4.8107  177.225   17.852  191.159   16.607 -13.93401 24.38180 
1 1 1   12   13   34 o  478.891   6.7174  175.702   4.9239  186.604   7.3525  166.837   6.6302  493.233   9.7389  466.426   9.2870 26.80649 13.45716 
1 1 1   12   13   35 o   61.319   23.726   1.8924   3.1693   0.7420   5.1560   2.5911   4.0179   69.185   28.978   69.791   26.792 -0.6058807 39.46587 
1 1 1   12   13   36 o  411.119   7.3785  129.558   4.6430  131.599   7.5320  128.307   5.8967  413.822   11.891  408.926   9.4209 4.896088 15.17088 
1 1 1   12   13   37 o  256.281   8.0624   50.370   3.1626   48.182   5.3308   51.558   3.9287  249.747   14.002  259.151   9.9045 -9.403000 17.15063 
1 1 1   12   13   38 o  193.263   11.237   28.807   3.3096   18.749   9.1323   30.328   3.5510  149.788   39.330  198.246   11.755 -48.45802 41.04867 
1 1 1   12   13   39 o  335.612   7.4477   86.385   3.8258   92.345   7.1937   84.035   4.5177  346.140   13.578  330.861   8.9208 15.27841 16.24627 
1 1 1   12   13   40 o  112.913   17.034   10.089   2.8524   14.160   5.2870   8.4175   3.3878  131.742   27.123  101.899   22.337 29.84237 35.13641 
1 1 1   12   13   41 o  302.601   7.7656   70.274   3.5968   56.497   6.1985   77.268   4.4164  269.873   15.066  317.137   9.0981 -47.26334 17.59987 
1 1 1   12   13   42 o   86.164   21.113   6.0370   2.7627   11.068   5.4816   4.3238   3.1987  115.462   30.545   75.023   24.352 40.43951 39.06430 
1 1 1   12   13   43 f  364.917   7.6691  102.250   4.2836  103.579   7.2568  101.539   5.3067  366.164   12.948  363.317   9.5427 2.846344 16.08450 
1 1 1   12   13   44 o   93.701   25.953   7.2156   3.8501   6.4933   5.5164   7.9016   5.3760   92.537   32.000   98.929   31.515 -6.392136 44.91304 
1 1 1   12   13   45 o  174.057   12.161   23.521   3.2195   21.602   6.0781   24.269   3.7957  163.000   25.173  176.373   14.180 -13.37308 28.89200 
1 1 1   12   13   46 o  273.138   8.8882   57.411   3.7159   62.114   6.6562   55.282   4.4788  282.135   15.472  267.649   10.933 14.48676 18.94527 
1 1 1   12   13   47 o  289.752   9.3267   64.670   4.1364   74.206   7.5285   60.546   4.9506  308.056   16.022  279.879   11.556 28.17639 19.75465 
1 1 1   12   13   48 o   79.186   24.676   5.0406   3.3130  -0.4240   6.2323   7.1932   3.9115   70.152   30.650   93.036   26.299 -22.88399 40.38654 
1 1 1   12   13   49 o   90.280   27.570   6.7267   4.1596   12.206   7.0502   3.8013   5.1517  118.566   35.823   78.678   30.304 39.88821 46.92127 
1 1 1   12   13   50 o  185.827   14.476   27.088   4.0850   29.539   12.276   26.782   4.3319  177.438   45.102  184.446   15.487 -7.008759 47.68740 
1 1 1   12   13   51 o  166.476   13.409   21.715   3.3879   19.306   5.3417   23.337   4.3821  153.249   23.524  171.474   16.916 -18.22514 28.97501 
1 1 1   12   13   52 o  246.177   9.9357   46.865   3.7438   47.644   5.6954   46.273   4.9679  246.082   15.195  243.243   13.395 2.839355 20.25635 
1 1 1   12   13   53 o   64.934   24.448   2.7430   3.3056  -0.8651   4.9949   5.5546   4.4093   60.899   26.990   83.332   28.621 -22.43356 39.33971 
1 1 1   12   13   54 o  196.899   13.707   30.520   4.1053   16.435   6.9213   38.165   5.0991  134.687   33.665  219.575   15.267 -84.88786 36.96536 
1 1 1   12   13   55 o  101.918   23.608   8.8780   3.6105   9.1244   4.8059   8.5586   5.4706  101.512   29.301   98.409   31.838 3.102219 43.26862 
1 1 1   12   13   56 o   89.093   26.636   6.9064   3.9129   1.9657   4.6629   18.669   7.1947   67.254   27.811  141.973   33.626 -74.71912 43.63674 
1 1 1   12   13   57 o  163.487   16.812   21.645   4.1471   15.656   6.7572   25.263   5.2527  128.420   33.885  174.847   19.986 -46.42761 39.33987 
1 1 1   12   13   58 o   62.870   25.334   2.2095   3.7499   4.1923   4.7983  -0.9014   6.0104   75.307   29.178   64.157   28.931 11.14985 41.08943 
1 1 1   12   13   59 o  119.285   20.760   12.174   3.6527   13.541   4.5517   9.7001   6.1217  123.200   24.992   99.478   33.729 23.72231 41.97962 
1 1 1   12   13   60 o  179.177   14.057   25.879   3.8242   24.464   4.9843   27.904   5.9626  170.345   19.466  179.705   22.146 -9.359848 29.48503 
1 1 1   12   14    0 o  981.015   14.437  737.398   21.667  737.398   21.667  737.398   21.667  981.015   14.437  981.015   14.437 0.000000 0.000000 
1 1 1   12   14    1 o  808.298   7.4417  500.155   9.2070  499.888   11.253  500.697   16.014  808.026   9.0983  808.507   12.940 -0.4802246 15.81872 
1 1 1   12   14    2 o  888.129   9.5899  603.940   13.036  603.940   13.036   0.0000   0.0000  888.129   9.5899  ?   ?  0.000000 9.589895 
1 1 1   12   14    3 o  132.702   12.281   13.603   2.4662   13.603   2.4662   0.0000   0.0000  132.702   12.281  ?   ?  0.000000 12.28097 
1 1 1   12   14    4 o  628.636   6.7089  302.508   6.4553  309.711   7.9225  288.277   11.135  636.042   8.1377  613.524   11.858 22.51874 14.38148 
1 1 1   12   14    5 f  706.135   7.0480  381.702   7.6177  388.599   9.3396  367.993   13.166  712.444   8.5646  693.156   12.410 19.28796 15.07837 
1 1 1   12   14    6 o  1200.87   11.896  1104.45   21.865  1122.80   31.338  1087.04   30.523  1210.36   16.916  1190.95   16.744 19.41479 23.80131 
1 1 1   12   14    7 o  473.651   6.8510  171.736   4.9669  174.871   6.0663  165.362   8.6509  477.928   8.2927  464.657   12.164 13.27057 14.72146 
1 1 1   12   14    8 o  1107.41   9.2888  938.972   15.745  943.469   19.380  930.241   27.005  1109.94   11.407  1101.77   16.013 8.168701 19.66095 
1 1 1   12   14    9 o  219.177   8.9641   36.780   3.0072   37.956   3.5444   33.759   5.6817  222.636   10.401  209.087   17.927 13.54877 20.72554 
1 1 1   12   14   10 o  674.544   7.3671  348.326   7.6063  350.672   9.2508  343.429   13.364  676.766   8.9304  669.579   13.040 7.186646 15.80491 
1 1 1   12   14   11 o  1088.30   9.2974  906.857   15.487  925.926   19.299  872.360   25.957  1099.54   11.467  1066.91   15.895 32.63074 19.59962 
1 1 1   12   14   12 o  319.416   10.085   78.127   4.9307   80.384   6.5256   75.123   7.5271  323.933   13.161  312.690   15.778 11.24286 20.54651 
1 1 1   12   14   13 o  1031.24   15.744  815.044   24.851  815.044   24.851   0.0000   0.0000  1031.24   15.744  ?   ?  0.000000 15.74360 
1 1 1   12   14   14 o  112.180   18.945   9.9167   3.1370   12.649   5.3441   8.4801   3.8749  125.785   28.426  103.026   24.858 22.75884 37.76202 
1 1 1   12   14   15 o  460.528   7.8127  162.373   5.5071  167.620   9.5207  159.735   6.7512  467.743   13.298  456.725   9.6573 11.01730 16.43488 
1 1 1   12   14   16 o  523.599   7.8349  209.898   6.2791  213.737   10.918  208.001   7.6754  528.162   13.506  521.176   9.6216 6.986023 16.58264 
1 1 1   12   14   17 o  387.628   7.2132  115.033   4.2797  118.680   6.0509  111.381   6.0539  393.662   10.042  381.356   10.371 12.30582 14.43633 
1 1 1   12   14   18 o  365.171   7.6870  102.097   4.2966   98.854   5.9879  105.538   6.1687  359.251   10.889  371.200   10.857 -11.94876 15.37724 
1 1 1   12   14   19 o  498.512   7.9741  190.279   6.0845  194.978   7.7586  182.773   9.8062  504.561   10.046  488.389   13.118 16.17249 16.52290 
1 1 1   12   14   20 o  359.990   6.5828   99.212   3.6272  101.709   4.4310   94.140   6.3150  364.466   7.9429  350.541   11.770 13.92490 14.19909 
1 1 1   12   14   21 o  679.228   6.2861  353.189   6.5353  355.881   8.2087  348.530   10.800  681.750   7.8665  674.544   10.460 7.205383 13.08831 
1 1 1   12   14   22 o  703.010   6.4369  378.367   6.9264  376.949   8.6249  380.942   11.624  701.623   8.0312  705.177   10.769 -3.553589 13.43399 
1 1 1   12   14   23 o  369.460   7.1819  104.513   4.0614  109.929   4.9515   93.379   7.1000  378.875   8.5383  349.031   13.290 29.84320 15.79637 
1 1 1   12   14   24 o  830.189   7.0022  527.709   8.8978  545.661   14.622  517.151   11.213  843.878   11.320  821.725   8.9150 22.15308 14.40904 
1 1 1   12   14   25 o  781.280   6.1767  467.327   7.3865  468.743   10.355  465.860   10.540  782.318   8.6472  779.896   8.8294 2.421997 12.35855 
1 1 1   12   14   26 o  968.562   8.0798  718.464   11.978  714.375   16.439  723.092   17.489  965.492   11.124  971.287   11.764 -5.794983 16.19073 
1 1 1   12   14   27 o  427.578   7.1363  140.003   4.6705  143.582   6.0191  134.586   7.4041  432.927   9.0833  419.017   11.544 13.91034 14.68938 
1 1 1   12   14   28 o  581.562   6.2200  258.974   5.5368  269.198   8.0110  249.625   7.6610  592.775   8.8293  570.822   8.7683 21.95233 12.44348 
1 1 1   12   14   29 o  530.419   6.3010  215.444   5.1156  213.446   7.1950  217.487   7.2749  527.797   8.9062  532.769   8.9211 -4.971619 12.60578 
1 1 1   12   14   30 o  1019.86   6.9348  796.655   10.825  785.690   15.135  808.141   15.490  1012.42   9.7665  1026.77   9.8565 -14.34802 13.87570 
1 1 1   12   14   31 o  533.713   6.4630  218.169   5.2798  226.755   7.6963  210.537   7.2565  543.891   9.2449  524.099   9.0457 19.79248 12.93419 
1 1 1   12   14   32 o  121.689   16.627   11.606   3.0158   10.276   4.2255   12.986   4.3057  112.976   25.089  127.697   22.869 -14.72089 33.94766 
1 1 1   12   14   33 o  134.527   14.944   14.091   3.0251   12.804   4.5360   15.121   4.0597  126.430   24.323  138.600   19.690 -12.17001 31.29354 
1 1 1   12   14   34 o  450.921   7.1686  155.816   4.9477  165.689   7.8244  149.238   6.3867  464.576   11.003  441.086   9.4598 23.49002 14.51078 
1 1 1   12   14   35 o  285.797   9.9973   62.687   4.3733   61.454   5.5207   64.765   7.1657  282.722   12.758  289.383   16.243 -6.661346 20.65426 
1 1 1   12   14   36 o  443.789   8.1110  151.033   5.5096  154.471   6.9989  145.432   8.9341  448.548   10.194  434.716   13.427 13.83170 16.85836 
1 1 1   12   14   37 o  414.555   7.3065  131.761   4.6362  143.020   6.9856  122.898   6.1980  431.478   10.577  400.039   10.122 31.43912 14.64039 
1 1 1   12   14   38 o  272.088   11.053   56.915   4.6034   55.183   9.5046   57.445   5.2617  264.786   23.702  273.171   12.584 -8.385132 26.83563 
1 1 1   12   14   39 o  346.293   8.4989   92.045   4.5048   90.327   7.0814   93.214   5.8386  342.278   13.517  348.146   10.957 -5.867462 17.39957 
1 1 1   12   14   40 o  383.295   8.5644  112.804   5.0246  105.149   6.6453  123.023   7.6777  369.529   11.749  399.533   12.555 -30.00314 17.19474 
1 1 1   12   14   41 o  484.269   6.4364  179.844   4.7709  176.081   7.8846  182.018   5.9925  478.302   10.770  486.910   8.0406 -8.607910 13.44020 
1 1 1   12   14   42 o  284.161   8.5938   62.043   3.7378   64.462   6.1118   60.598   4.7244  288.739   13.829  280.476   11.005 8.262939 17.67337 
1 1 1   12   14   43 o  184.013   10.991   26.190   3.0817   25.662   5.4719   26.435   3.7293  179.910   20.221  184.429   13.300 -4.519745 24.20294 
1 1 1   12   14   44 o   70.653   25.838   3.3226   3.6438  -0.5589   5.2499   6.9306   5.0615   64.623   28.185   93.521   30.647 -28.89841 41.63686 
1 1 1   12   14   45 o   64.325   22.864   2.8822   2.8290   6.4428   5.4599   1.5755   3.3076   91.911   31.833   59.938   23.919 31.97301 39.81759 
1 1 1   12   14   46 o  245.287   9.5017   46.346   3.5673   55.035   6.7514   42.981   4.2018  265.002   16.731  235.831   11.640 29.17097 20.38154 
1 1 1   12   14   47 o  123.145   17.321   12.088   3.1746   14.947   6.4440   11.172   3.6479  132.153   32.162  117.205   21.111 14.94849 38.47132 
1 1 1   12   14   48 o  177.484   14.366   24.668   3.8693   24.089   6.8017   24.945   4.7047  170.702   26.924  177.510   17.545 -6.807816 32.13656 
1 1 1   12   14   49 o  217.821   11.753   36.856   3.9039   35.054   7.2078   37.605   4.6441  208.122   23.011  219.386   13.902 -11.26392 26.88463 
1 1 1   12   14   50 o  195.962   14.952   30.170   4.4510 -12.0186   18.850   32.661   4.5805   98.727   46.765  203.998   14.770 -105.2712 49.04193 
1 1 1   12   14   51 o  140.178   17.509   15.717   3.6748   24.747   6.9460   12.207   4.3305  171.841   27.323  120.913   24.243 50.92738 36.52741 
1 1 1   12   14   52 o  150.225   17.012   18.023   3.8427   18.710   7.6082   17.788   4.4523  144.533   34.807  148.008   20.179 -3.475113 40.23303 
1 1 1   12   14   53 o  221.695   12.190   38.399   4.1207   38.880   7.3430   38.178   4.9785  217.995   22.322  219.964   14.874 -1.968933 26.82344 
1 1 1   12   14   54 o  142.012   17.867   16.311   3.7977   7.4234   6.4770   20.967   4.6881   94.863   34.485  160.493   19.484 -65.63017 39.60833 
1 1 1   12   14   55 o   99.391   30.265   8.7866   5.0179   12.803   6.3776   2.2588   8.1302  117.720   33.688   82.423   35.513 35.29758 48.94941 
1 1 1   12   14   56 o   72.187   26.098   4.0022   3.7023  -1.1089   6.7514   6.2001   4.4273   68.302   30.744   85.210   28.685 -16.90789 42.04785 
1 1 1   12   14   57 o   47.765   22.660  -4.3586   4.4584  -8.3407   6.5400  -0.9014   6.0937   53.589   25.943   64.978   29.231 -11.38909 39.08334 
1 1 1   12   14   58 o  129.196   18.458   13.887   3.5462   18.089   5.3682   10.634   4.7236  143.051   25.450  107.261   28.345 35.78954 38.09365 
1 1 1   12   14   59 o   70.946   24.793   4.2250   3.3157  -0.1454   4.1891   11.555   5.4252   55.935   24.757  109.171   31.012 -53.23579 39.68147 
1 1 1   12   15    1 o  1165.97   16.380  1041.86   29.233  1041.86   29.233   0.0000   0.0000  1165.97   16.380  ?   ?  0.000000 16.38009 
1 1 1   12   15    2 o  1408.80   10.929  1519.85   23.566  1527.57   29.021  1504.91   40.380  1412.15   13.426  1401.01   18.830 11.13904 23.12669 
1 1 1   12   15    3 o  201.057   8.3332   30.948   2.5645   31.449   3.0612   29.769   4.6962  202.664   9.8685  196.470   15.749 6.194077 18.58523 
1 1 1   12   15    4 o  799.387   7.5026  489.193   9.1799  505.920   11.509  459.944   15.219  812.877   9.2502  774.904   12.832 37.97314 15.81824 
1 1 1   12   15    5 o  483.210   6.4658  178.733   4.7822  182.415   5.8345  171.197   8.3478  488.137   7.8089  472.800   11.535 15.33640 13.92980 
1 1 1   12   15    6 o  988.588   10.482  748.378   15.861  771.185   23.002  727.704   21.900  1003.24   14.980  974.568   14.681 28.67029 20.97427 
1 1 1   12   15    7 o  504.588   6.8663  194.905   5.3031  193.893   6.4656  196.984   9.2699  503.245   8.3938  507.144   11.942 -3.899170 14.59673 
1 1 1   12   15    8 o  700.530   7.4626  375.685   8.0018  375.130   9.7385  376.840   14.039  699.961   9.0897  701.387   13.077 -1.426270 15.92585 
1 1 1   12   15    9 o  1053.69   11.033  850.268   17.794  864.549   25.443  836.596   24.895  1062.14   15.650  1044.84   15.567 17.30408 22.07376 
1 1 1   12   15   10 o  646.789   9.0317  320.305   8.9413  318.959   12.361  321.782   12.949  645.292   12.515  648.117   13.053 -2.824768 18.08350 
1 1 1   12   15   11 o  189.448   21.586   27.896   6.1477   0.0000   0.0000   27.896   6.1477  ?   ?   189.448   21.586 0.000000 21.58617 
1 1 1   12   15   12 o  819.772   10.042  514.619   12.600  522.531   17.991  507.002   17.652  825.801   14.233  813.442   14.177 12.35968 20.08955 
1 1 1   12   15   13 o  826.167   8.2308  522.583   10.408  521.898   12.625  524.037   18.389  825.544   9.9916  826.953   14.528 -1.409180 17.63197 
1 1 1   12   15   14 o  335.897   7.3637   86.377   3.7859   92.627   5.2940   79.836   5.4162  347.787   9.9450  322.859   10.960 24.92773 14.79951 
1 1 1   12   15   15 o  1014.53   7.9444  788.041   12.337  796.796   17.492  779.377   17.401  1019.94   11.205  1008.73   11.270 11.21515 15.89234 
1 1 1   12   15   16 o  917.879   7.5823  645.030   10.653  658.735   15.255  631.987   14.882  927.396   10.747  908.375   10.704 19.02039 15.16765 
1 1 1   12   15   17 o  545.872   7.0225  228.125   5.8675  232.842   8.2783  223.363   8.3176  551.396   9.8086  540.046   10.062 11.35016 14.05198 
1 1 1   12   15   18 o  1090.33   9.6433  910.441   16.094  918.359   19.931  895.607   27.281  1094.86   11.893  1080.70   16.493 14.16602 20.33362 
1 1 1   12   15   19 o  397.121   7.8857  120.752   4.7933  115.203   6.6287  126.833   6.9393  387.796   11.168  406.902   11.142 -19.10587 15.77513 
1 1 1   12   15   20 o  851.094   6.6567  554.563   8.6718  541.428   10.738  579.192   14.704  840.869   8.3431  869.516   11.048 -28.64655 13.84439 
1 1 1   12   15   21 o  399.910   6.6858  122.441   4.0925  123.974   4.9548  119.151   7.2598  402.371   8.0450  394.333   12.028 8.038147 14.47053 
1 1 1   12   15   22 o  626.772   6.4243  300.759   6.1632  299.415   7.6487  303.247   10.407  625.307   7.9914  629.147   10.807 -3.839966 13.44070 
1 1 1   12   15   23 o  727.774   7.7383  405.583   8.6201  405.067   12.069  406.120   12.316  727.112   10.844  728.041   11.052 -0.9288330 15.48378 
1 1 1   12   15   24 f  390.141   7.1854  116.550   4.2908  121.117   5.1975  106.775   7.6036  397.669   8.5389  373.185   13.311 24.48450 15.81481 
1 1 1   12   15   25 o  623.610   8.5494  297.862   8.1605  294.309   9.2606  310.206   17.262  619.805   9.7615  635.559   17.745 -15.75360 20.25274 
1 1 1   12   15   26 o  183.259   10.667   25.825   2.9791   24.456   4.2794   27.112   4.1498  177.787   15.893  187.415   14.581 -9.627945 21.56854 
1 1 1   12   15   27 o  690.826   6.0967  365.420   6.4466  361.555   8.9954  369.501   9.2435  686.998   8.5545  694.495   8.6955 -7.496826 12.19802 
1 1 1   12   15   28 f  250.420   8.4249   48.043   3.2293   51.189   4.6911   45.210   4.4520  258.355   11.863  242.793   11.980 15.56264 16.85944 
1 1 1   12   15   29 o  184.266   10.585   26.119   2.9728   28.307   4.3035   24.122   4.1115  191.409   14.804  176.529   15.370 14.87964 21.33998 
1 1 1   12   15   30 o  322.713   7.5036   79.785   3.7064   79.954   5.2845   79.622   5.1999  322.881   10.693  322.221   10.543 0.6607666 15.01651 
1 1 1   12   15   31 o  355.280   7.6558   96.717   4.1632   99.971   5.7140   93.034   6.0783  361.030   10.340  348.197   11.405 12.83389 15.39442 
1 1 1   12   15   32 o  279.785   8.3692   60.003   3.5841   66.008   5.2123   54.617   4.9362  293.237   11.613  266.704   12.092 26.53391 16.76524 
1 1 1   12   15   33 o  344.818   7.6778   91.129   4.0522  101.866   6.3000   83.552   5.2923  364.253   11.300  329.963   10.479 34.29016 15.41066 
1 1 1   12   15   34 o  392.471   7.0393  118.045   4.2287  126.422   6.2344  110.906   5.7550  405.873   10.035  380.167   9.8901 25.70691 14.08981 
1 1 1   12   15   35 o   42.431   19.994  -3.6831   3.3634  -1.1496   4.0448  -9.3606   6.0550   55.288   24.405   52.118   25.166 3.169254 35.05645 
1 1 1   12   15   36 o  109.715   18.252   9.5543   2.9575   7.4056   4.4033   11.320   3.9920   96.174   28.129  118.703   22.800 -22.52847 36.20927 
1 1 1   12   15   37 o  276.727   10.475   58.837   4.4369   59.666   8.9137   58.564   5.1156  276.206   21.247  275.901   12.114 0.3055115 24.45778 
1 1 1   12   15   38 o  334.138   8.4381   85.686   4.3156   80.720   6.6551   89.289   5.6692  323.618   13.435  340.777   10.869 -17.15878 17.28126 
1 1 1   12   15   39 o  357.443   7.9214   98.045   4.3339   99.688   6.3745   96.633   5.9099  359.875   11.572  354.434   10.894 5.441040 15.89325 
1 1 1   12   15   40 o  218.508   10.756   36.741   3.5976   39.302   5.4291   34.736   4.8036  224.734   15.885  211.416   14.940 13.31720 21.80727 
1 1 1   12   15   41 o  153.801   16.682   18.570   3.8641   18.214   5.7044   18.871   5.2528  149.794   25.812  153.363   23.093 -3.568802 34.63419 
1 1 1   12   15   42 o   94.812   22.705   7.3545   3.2514   8.7949   4.9100   6.2295   4.3391  103.263   29.561   88.716   28.318 14.54745 40.93658 
1 1 1   12   15   43 o  145.987   16.871   16.804   3.7004   27.902   5.6585   8.5128   4.8911  187.657   20.009  101.556   29.631 86.10067 35.75365 
1 1 1   12   15   44 o  179.693   14.239   25.189   3.8843   34.214   5.9913   18.644   5.1017  208.193   19.011  152.082   22.604 56.11050 29.53580 
1 1 1   12   15   45 o  232.513   12.101   41.908   4.2919   44.374   6.4003   39.893   5.7855  237.580   17.728  225.481   16.886 12.09897 24.48299 
1 1 1   12   15   46 o  131.281   16.238   13.639   3.1933   2.2484   6.0637   18.011   3.7565   77.446   31.837  151.041   16.518 -73.59550 35.86684 
1 1 1   12   15   47 o  360.352   8.1528   99.904   4.4968  100.901   8.6731   99.537   5.2589  359.569   15.759  359.336   9.5614 0.2335510 18.43251 
1 1 1   12   15   48 o   65.163   25.501   2.2668   3.6933   8.8157   6.6444  -0.6613   4.4429  103.671   35.140   58.652   25.745 45.01891 43.56191 
1 1 1   12   15   49 o  107.678   20.724   9.4968   3.2916   1.3292   6.3761   12.464   3.8434   75.413   31.938  123.631   21.065 -48.21850 38.25967 
1 1 1   12   15   50 o  262.888   11.558   53.576   4.6506   44.724   19.200   54.128   4.7934  205.311   58.346  264.150   11.856 -58.83896 59.53838 
1 1 1   12   15   51 o  130.275   18.896   13.719   3.6580   6.1686   6.6451   17.002   4.3816   91.958   34.655  144.716   20.343 -52.75815 40.18472 
1 1 1   12   15   52 o  116.851   22.322   11.355   3.8468   19.478   7.1754   8.0785   4.5570  148.554   32.463   97.027   28.684 51.52766 43.32043 
1 1 1   12   15   53 o   51.556   23.005  -1.0197   3.6916  -6.3803   6.1293   2.0319   4.6245   55.482   26.393   68.068   27.872 -12.58590 38.38495 
1 1 1   12   15   54 o  135.408   19.225   15.002   3.8726   4.2761   5.9539   22.867   5.0984   81.303   32.202  167.048   20.361 -85.74510 38.09948 
1 1 1   12   15   55 o   73.630   28.861   3.4978   4.7367   2.5052   6.6495   4.5203   6.7489   77.528   32.713   84.075   33.949 -6.546379 47.14529 
1 1 1   12   15   56 o  172.887   17.950   24.338   4.6808   18.937   6.8977   28.948   6.3728  143.092   32.263  185.349   22.954 -42.25635 39.59577 
1 1 1   12   15   57 o  172.749   15.372   24.047   4.0221   24.834   7.6441   23.745   4.7298  163.349   31.717  169.790   18.499 -6.441452 36.71740 
1 1 1   12   15   58 o   95.332   24.371   8.1256   3.5698   11.176   6.0471   6.4941   4.4227  106.539   33.360   84.872   28.670 21.66677 43.98694 
1 1 1   12   15   59 o   98.324   27.636   9.0500   4.3321   5.6345   7.5277   10.741   5.2971   85.015   35.260  105.020   30.892 -20.00471 46.87833 
1 1 1   12   16    0 o  583.728   11.561  261.172   10.321  261.172   10.321  261.172   10.321  583.728   11.561  583.728   11.561 0.000000 0.000000 
1 1 1   12   16    1 o  541.879   8.0128  224.799   6.6459  225.502   9.3782  224.090   9.4194  542.634   11.291  540.930   11.377 1.704102 16.02872 
1 1 1   12   16    2 o  986.715   8.5044  745.404   12.844  758.633   16.030  721.680   21.466  995.330   10.522  970.531   14.450 24.79926 17.87534 
1 1 1   12   16    3 o  282.475   8.8562   61.092   3.8291   63.001   5.4682   59.255   5.3637  286.796   12.457  278.137   12.599 8.659210 17.71736 
1 1 1   12   16    4 o  472.202   8.1273  170.707   5.8741  178.067   8.4306  163.762   8.1892  482.190   11.423  462.411   11.570 19.77890 16.25883 
1 1 1   12   16    5 o  820.394   9.4931  515.347   11.921  533.261   17.310  499.191   16.440  834.316   13.555  807.239   13.305 27.07709 18.99411 
1 1 1   12   16    6 o  625.310   8.6216  299.371   8.2519  296.089   11.492  302.865   11.856  621.749   12.076  628.813   12.319 -7.064148 17.25022 
1 1 1   12   16    7 o  314.713   7.8102   75.826   3.7622   77.349   4.6149   72.808   6.4965  317.832   9.4862  308.275   13.768 9.557617 16.71970 
1 1 1   12   16    8 f  656.259   7.3876  329.705   7.4207  339.349   9.2756  312.559   12.369  665.732   9.1027  638.773   12.650 26.95978 15.58498 
1 1 1   12   16    9 o  503.777   7.3244  194.291   5.6478  187.112   6.7469  211.102   10.324  494.344   8.9167  524.948   12.849 -30.60327 15.63964 
1 1 1   12   16   10 o  571.768   9.1760  250.322   8.0305  252.795   11.418  247.901   11.297  574.440   12.986  568.853   12.974 5.587097 18.35670 
1 1 1   12   16   11 o  1774.36   13.493  2412.19   36.647  2465.15   46.066  2320.90   60.481  1793.18   16.784  1738.67   22.726 54.51245 28.25202 
1 1 1   12   16   12 o  812.341   8.2222  505.246   10.223  497.086   12.281  523.661   18.449  805.674   9.9591  826.633   14.581 -20.95886 17.65781 
1 1 1   12   16   13 o  763.671   8.1040  446.518   9.4728  446.402   11.455  446.768   16.846  763.496   9.8024  763.531   14.415 -0.3436279E-01 17.43190 
1 1 1   12   16   14 f  837.383   10.206  537.023   13.081  537.023   13.081   0.0000   0.0000  837.383   10.206  ?   ?  0.000000 10.20602 
1 1 1   12   16   15 o  526.623   6.8926  212.317   5.5559  212.910   7.7129  211.677   8.0100  527.277   9.5567  525.735   9.9540 1.542236 13.79900 
1 1 1   12   16   16 o  444.885   7.1975  151.530   4.9012  151.568   6.8598  151.490   7.0052  444.861   10.074  444.740   10.291 0.1211853 14.40103 
1 1 1   12   16   17 o  552.938   8.0085  234.101   6.7780  235.038   8.3416  232.278   11.628  553.977   9.8375  550.520   13.800 3.456848 16.94732 
1 1 1   12   16   18 o  438.231   7.5877  147.042   5.0896  150.135   7.1445  143.855   7.2523  442.723   10.543  433.350   10.934 9.372284 15.18895 
1 1 1   12   16   19 o  1265.87   9.2897  1227.22   18.000  1267.24   26.228  1191.59   24.747  1285.86   13.326  1246.94   12.966 38.92297 18.59304 
1 1 1   12   16   20 o  812.094   7.6598  504.977   9.5212  501.865   13.296  508.252   13.641  809.391   10.732  814.509   10.942 -5.117981 15.32626 
1 1 1   12   16   21 o  891.045   7.9662  607.979   10.865  616.115   15.356  599.823   15.374  896.736   11.188  884.785   11.353 11.95081 15.93874 
1 1 1   12   16   22 o  379.418   8.7957  110.255   5.1081  109.388   7.1459  111.162   7.3046  377.786   12.358  380.829   12.531 -3.043030 17.59967 
1 1 1   12   16   23 o  456.792   7.5901  159.785   5.3069  161.500   5.7899  150.774   13.271  459.213   8.2374  442.985   19.572 16.22839 21.23491 
1 1 1   12   16   24 o  617.924   7.4785  292.402   7.0733  301.065   7.9046  257.595   15.845  626.969   8.2369  579.133   17.875 47.83569 19.68111 
1 1 1   12   16   25 o  618.225   7.3870  292.699   6.9901  302.151   9.3475  280.707   10.529  627.976   9.7249  605.154   11.367 22.82141 14.95909 
1 1 1   12   16   26 o  229.678   9.7364   40.423   3.4228   35.848   4.0125   52.649   6.5590  215.869   12.194  261.296   16.484 -45.42686 20.50406 
1 1 1   12   16   27 o  378.058   6.6995  109.458   3.8768  105.181   5.3288  114.266   5.6505  370.479   9.3972  386.139   9.5604 -15.65964 13.40554 
1 1 1   12   16   28 o  222.124   8.9458   37.810   3.0415   42.866   4.2067   32.273   4.4025  236.402   11.626  204.529   14.150 31.87289 18.31347 
1 1 1   12   16   29 o  121.226   14.863   11.460   2.7000   9.5968   3.7437   13.479   3.8978  109.429   23.078  130.742   20.123 -21.31294 30.61865 
1 1 1   12   16   30 o  465.969   6.4843  166.312   4.6248  167.615   6.4941  164.970   6.5878  467.601   9.0734  463.879   9.2783 3.721558 12.97743 
1 1 1   12   16   31 o   63.322   23.003   2.5535   2.8812   2.7337   4.2196   2.3961   3.9438   71.654   27.468   68.566   26.484 3.087761 38.15666 
1 1 1   12   16   32 o  468.128   7.0051  167.917   5.0194  182.361   7.9045  158.157   6.4974  487.469   10.594  454.106   9.3479 33.36313 14.12856 
1 1 1   12   16   33 o  292.627   8.1818   65.653   3.6647   69.471   5.3694   62.324   5.0141  300.734   11.665  284.861   11.500 15.87372 16.38016 
1 1 1   12   16   34 o  190.848   15.682   28.262   4.5405   28.262   4.5405   0.0000   0.0000  190.848   15.682  ?   ?  0.000000 15.68215 
1 1 1   12   16   35 o  162.982   12.319   20.543   3.0504   17.651   4.4295   23.152   4.2070  149.669   19.823  172.477   16.123 -22.80780 25.55179 
1 1 1   12   16   36 o   75.381   22.916   4.4559   2.8785   11.530   4.3562  -1.0274   3.8352  119.380   24.656   53.985   23.801 65.39430 34.26978 
1 1 1   12   16   37 o  181.308   14.032   25.496   3.8637   27.275   8.3098   25.006   4.3641  183.273   30.709  179.171   16.085 4.101685 34.66629 
1 1 1   12   16   38 o  164.134   13.242   20.901   3.2984   22.888   5.1385   19.508   4.3015  170.384   20.089  157.570   18.168 12.81377 27.08624 
1 1 1   12   16   39 o  252.439   9.3887   48.968   3.6277   48.051   5.1352   49.880   5.1255  249.170   13.515  253.939   13.233 -4.768463 18.91455 
1 1 1   12   16   40 o  164.582   14.344   21.098   3.5774   19.812   4.8749   22.600   5.2661  157.957   20.658  168.825   20.820 -10.86743 29.32980 
1 1 1   12   16   41 o  143.111   15.559   16.063   3.3532   10.671   5.0279   20.382   4.5002  113.368   28.891  160.645   18.649 -47.27670 34.38719 
1 1 1   12   16   42 o  134.430   16.824   14.272   3.3859   11.795   4.8612   16.605   4.7188  119.310   27.221  143.672   22.172 -24.36208 35.10785 
1 1 1   12   16   43 o   61.511   24.483   1.6930   3.4574  -3.2985   5.0951   5.9530   4.7069   56.379   25.888   87.844   29.577 -31.46452 39.30646 
1 1 1   12   16   44 o  231.729   11.219   41.446   3.9794   46.462   6.0357   37.589   5.2927  243.704   16.274  219.212   15.882 24.49211 22.73923 
1 1 1   12   16   45 o   72.705   25.965   3.7384   3.6524  -1.5863   5.6190   7.6342   4.8063   63.805   28.432   96.389   29.669 -32.58356 41.09324 
1 1 1   12   16   46 o  227.913   12.311   40.331   4.2787   43.797   6.7127   37.960   5.5529  235.350   18.791  219.792   16.629 15.55800 25.09234 
1 1 1   12   16   47 o  138.398   23.855   15.715   4.8708   12.313   5.8919   23.060   8.6571  119.823   31.653  162.669   35.745 -42.84604 47.74535 
1 1 1   12   16   48 o  130.577   21.051   13.856   4.0642   16.529   6.1090   11.734   5.4438  139.473   29.536  117.050   30.188 22.42274 42.23365 
1 1 1   12   16   49 o   66.079   28.104   0.6977   4.9724   14.353   18.940  -0.3132   5.1531  135.272   56.003   63.975   27.913 71.29702 62.57327 
1 1 1   12   16   50 o  135.835   21.819   15.108   4.3829   18.201   7.1844   13.275   5.5314  143.988   33.267  124.139   29.539 19.84937 44.48903 
1 1 1   12   16   51 o  147.555   17.021   17.394   3.7738   9.3077   7.2334   20.418   4.4235  104.877   36.622  159.447   18.467 -54.57014 41.01447 
1 1 1   12   16   52 o  174.419   14.398   24.012   3.8096   29.673   6.6669   21.268   4.6421  189.570   23.479  162.232   19.057 27.33842 30.23960 
1 1 1   12   16   53 o  150.608   18.429   18.374   4.1597   10.532   6.4465   23.968   5.4449  108.076   34.519  170.809   21.288 -62.73322 40.55536 
1 1 1   12   16   54 o  287.989   14.648   65.610   6.4354   43.252   9.8103   82.499   8.5263  222.838   29.486  320.889   17.425 -98.05067 34.25014 
1 1 1   12   16   55 o  105.620   28.783   10.001   4.7802   2.7173   6.5453   18.328   6.9978   77.463   32.558  140.756   33.046 -63.29257 46.39049 
1 1 1   12   16   56 o   98.659   24.624   8.5583   3.7066   10.106   6.4194   7.7844   4.5399  103.324   34.542   92.955   28.873 10.36973 45.01988 
1 1 1   12   16   57 o   46.831   21.582  -2.0048   3.5851  -1.5635   6.1957  -2.2270   4.3958   63.336   28.880   51.838   23.893 11.49826 37.48251 
1 1 1   12   16   58 o   50.784   23.055  -1.2729   3.8937  -0.1688   5.9144  -2.1174   5.1728   64.710   28.978   56.343   25.950 8.367050 38.89928 
1 1 1   12   17    0 o  693.305   12.289  368.370   13.032  368.370   13.032  368.370   13.032  693.305   12.289  693.305   12.289 0.000000 0.000000 
1 1 1   12   17    1 o  586.036   8.2704  262.941   7.4186  276.230   10.808  251.101   10.201  600.543   11.758  572.581   11.640 27.96277 16.54485 
1 1 1   12   17    2 o  783.998   7.5163  470.555   9.0196  474.722   11.130  462.580   15.395  787.397   9.2346  777.079   12.944 10.31860 15.90009 
1 1 1   12   17    3 o  796.773   7.5937  486.019   9.2609  486.207   11.314  485.638   16.122  796.862   9.2759  796.192   13.229 0.6705933 16.15713 
1 1 1   12   17    4 o  646.276   7.0139  319.742   6.9382  318.685   8.4248  321.970   12.231  645.163   8.5314  648.331   12.325 -3.167847 14.98986 
1 1 1   12   17    5 o  1052.30   8.9322  847.862   14.387  847.300   17.538  849.019   25.157  1051.83   10.893  1052.51   15.616 -0.6798096 19.03999 
1 1 1   12   17    6 o  1394.09   13.462  1489.00   28.726  1513.38   41.386  1466.32   39.904  1404.67   19.249  1382.72   18.854 21.94934 26.94453 
1 1 1   12   17    7 o  634.564   7.4398  308.274   7.2261  321.952   9.1457  285.548   11.789  648.431   9.2148  610.534   12.615 37.89673 15.62215 
1 1 1   12   17    8 o  559.508   9.1112  239.704   7.8029  244.137   11.302  235.666   10.786  564.505   13.080  554.642   12.705 9.862793 18.23489 
1 1 1   12   17    9 o  928.699   10.573  660.534   15.029  675.752   21.926  647.047   20.641  938.979   15.256  918.869   14.676 20.10980 21.16924 
1 1 1   12   17   10 o  671.530   7.7333  345.253   7.9488  355.318   9.8269  326.206   13.519  681.184   9.4251  652.483   13.536 28.70020 16.49445 
1 1 1   12   17   11 o  704.798   7.8707  380.318   8.4908  376.063   10.215  389.828   15.271  700.778   9.5237  713.241   13.988 -12.46295 16.92257 
1 1 1   12   17   12 o  609.825   7.8223  284.729   7.3015  288.983   8.8962  275.948   12.780  614.306   9.4613  600.079   13.914 14.22699 16.82645 
1 1 1   12   17   13 o  642.557   14.038  316.418   13.807   0.0000   0.0000  316.418   13.807  ?   ?   642.557   14.038 0.000000 14.03827 
1 1 1   12   17   14 o  558.693   8.0133  238.994   6.8526  240.168   8.2234  236.325   12.396  560.007   9.5937  555.267   14.585 4.740112 17.45750 
1 1 1   12   17   15 o  1043.98   8.1708  834.527   13.056  840.806   18.496  828.291   18.434  1047.64   11.534  1039.81   11.582 7.830688 16.34580 
1 1 1   12   17   16 o  900.052   8.8360  620.351   12.173  617.043   14.795  627.282   21.416  897.516   10.770  904.500   15.469 -6.983948 18.84865 
1 1 1   12   17   17 o  913.563   7.8249  639.045   10.942  633.296   15.199  645.231   15.764  909.232   10.921  917.734   11.222 -8.502686 15.65943 
1 1 1   12   17   18 o  410.028   7.9906  128.736   5.0149  129.525   6.8963  127.851   7.3058  411.185   10.957  408.491   11.685 2.694092 16.01859 
1 1 1   12   17   19 o  419.520   8.0820  134.770   5.1897  134.336   7.1303  135.260   7.5678  418.735   11.125  420.145   11.768 -1.409943 16.19417 
1 1 1   12   17   20 o  889.223   9.2301  605.626   12.563  615.436   15.298  585.307   22.016  896.234   11.152  873.427   16.468 22.80719 19.88856 
1 1 1   12   17   21 o  831.407   9.1508  529.450   11.645  527.675   13.944  533.543   21.170  829.862   10.978  833.829   16.587 -3.967834 19.89078 
1 1 1   12   17   22 o  591.714   7.7908  268.127   7.0561  284.325   10.115  252.772   9.8480  609.142   10.849  574.326   11.203 34.81653 15.59458 
1 1 1   12   17   23 o  923.807   7.1388  653.513   10.094  655.283   12.813  650.616   16.390  924.894   9.0508  921.317   11.622 3.577759 14.73074 
1 1 1   12   17   24 o  569.222   11.262  248.363   9.8124   0.0000   0.0000  248.363   9.8124  ?   ?   569.222   11.262 0.000000 11.26221 
1 1 1   12   17   25 o  162.885   12.266   20.461   3.0356   20.013   3.5360   21.719   5.9192  160.827   14.521  166.141   23.970 -5.314377 28.02514 
1 1 1   12   17   26 o  413.886   7.2695  131.204   4.6052  129.238   5.5460  135.571   8.2650  410.695   8.8224  420.362   12.845 -9.667328 15.58332 
1 1 1   12   17   27 o  444.802   7.2141  151.548   4.9116  150.766   5.9548  153.212   8.6868  443.561   8.7709  446.831   12.701 -3.270386 15.43535 
1 1 1   12   17   28 f  414.056   7.1280  131.330   4.5175  128.308   5.6458  136.708   7.5316  409.151   9.0151  422.118   11.657 -12.96771 14.73622 
1 1 1   12   17   29 o  629.096   7.2084  303.201   6.9411  291.938   9.6775  315.133   9.9610  616.970   10.248  641.023   10.152 -24.05365 14.42509 
1 1 1   12   17   30 o  572.887   7.0584  251.455   6.1894  252.363   8.7780  250.557   8.7284  573.601   9.9981  571.548   9.9772 2.053467 14.12468 
1 1 1   12   17   31 o  444.112   6.4985  151.103   4.4175  148.664   6.1595  153.686   6.3389  440.291   9.1398  447.654   9.2513 -7.362854 13.00469 
1 1 1   12   17   32 o  586.679   6.3226  263.698   5.6776  267.574   8.1123  259.976   7.9489  590.655   8.9730  582.216   8.9198 8.439636 12.65218 
1 1 1   12   17   33 o  127.151   18.127   12.735   3.4280   14.701   3.9894   7.1874   6.7020  136.478   19.665  100.407   35.240 36.07143 40.35577 
1 1 1   12   17   34 o  430.001   6.9396  141.723   4.5674  142.783   6.5930  140.745   6.3334  431.254   9.9880  428.208   9.6631 3.046204 13.89733 
1 1 1   12   17   35 o  328.041   7.6077   82.521   3.8199   78.056   5.4002   86.992   5.4041  318.688   11.071  336.507   10.492 -17.81891 15.25257 
1 1 1   12   17   36 o  246.145   10.969   46.579   4.1325   43.028   8.3151   47.744   4.7623  233.564   23.582  248.719   12.550 -15.15526 26.71347 
1 1 1   12   17   37 o  231.433   9.9650   41.158   3.5300   41.982   5.3270   40.514   4.7134  232.662   15.039  228.833   13.517 3.828552 20.22067 
1 1 1   12   17   38 o  126.280   17.086   12.579   3.2176   14.090   4.3942   10.833   4.7246  132.481   22.473  114.859   27.279 17.62154 35.34399 
1 1 1   12   17   39 o  109.261   20.662   9.6173   3.3289   12.999   4.4902   5.4900   4.9603  126.601   24.051   86.826   30.326 39.77590 38.70568 
1 1 1   12   17   40 o  200.423   11.821   31.078   3.6103   28.475   5.2681   33.383   4.9575  190.356   18.306  206.901   15.773 -16.54482 24.16421 
1 1 1   12   17   41 o  561.634   7.1604  242.128   6.1555  243.818   9.0401  240.668   8.4049  562.626   10.497  559.203   9.8196 3.422668 14.37430 
1 1 1   12   17   42 o  219.039   11.371   37.111   3.7992   41.449   5.5808   33.364   5.1866  230.387   15.924  206.411   16.556 23.97598 22.97079 
1 1 1   12   17   43 o   75.585   24.861   4.4043   3.3298   0.8477   4.9153   7.4208   4.5267   67.005   28.191   95.204   28.691 -28.19836 40.22337 
1 1 1   12   17   44 o  188.095   12.780   27.510   3.6577   30.364   5.3665   25.034   4.9987  196.165   18.076  177.795   18.646 18.36975 25.96954 
1 1 1   12   17   45 o   82.321   25.823   5.4398   3.6216   2.0310   5.7055   7.7401   4.6869   74.982   30.860   96.741   29.203 -21.75865 42.48748 
1 1 1   12   17   46 o  167.074   20.427   22.364   5.1150   25.571   6.2639   15.947   8.8616  177.534   23.639  134.129   40.081 43.40456 46.53239 
1 1 1   12   17   47 o  117.079   22.785   11.286   3.9362   7.0326   5.9023   14.693   5.2824   94.698   33.080  132.431   26.976 -37.73282 42.68501 
1 1 1   12   17   48 o  173.452   15.816   23.729   4.1529   22.207   6.1762   24.985   5.6107  164.008   25.426  175.991   21.259 -11.98213 33.14270 
1 1 1   12   17   49 o   90.546   31.419   6.4960   5.3202 -12.4798   18.893   8.1304   5.5446   98.081   46.563   98.581   32.065 -0.5003891 56.53556 
1 1 1   12   17   50 f  150.687   19.633   18.344   4.4207   17.975   6.5705   18.649   5.9755  144.050   30.737  148.539   27.288 -4.488800 41.10182 
1 1 1   12   17   51 o  103.748   27.054   9.2487   4.3406   12.719   6.8104   6.8746   5.6329  118.915   35.041   92.065   32.308 26.85065 47.66197 
1 1 1   12   17   52 o  218.922   15.399   37.949   5.1272   29.101   6.9691   48.388   7.5698  186.471   25.051  244.354   20.427 -57.88339 32.32339 
1 1 1   12   17   53 o  209.824   14.638   34.856   4.6717   23.602   6.4946   46.923   6.7250  166.236   26.407  241.399   18.338 -75.16356 32.15001 
1 1 1   12   17   54 o  120.477   26.726   12.688   4.7994   13.127   6.3951   12.122   7.2621  118.946   33.629  113.396   36.682 5.550316 49.76398 
1 1 1   12   17   55 o  137.787   22.530   16.079   4.5874   11.876   6.7243   19.737   6.2742  111.552   35.215  148.937   28.562 -37.38491 45.34184 
1 1 1   12   17   56 o   86.554   29.179   6.6521   4.5812  -2.0764   6.2770   16.600   6.7013   62.917   28.833  131.547   33.262 -68.63031 44.01921 
1 1 1   12   17   57 o  162.568   18.939   22.005   4.6243   18.749   6.1561   26.221   7.0055  142.363   29.230  170.276   27.842 -27.91354 40.36780 
1 1 1   12   17   58 f  121.773   30.738   14.302   5.7298   15.593   7.7340   12.731   8.5307  120.662   37.718  108.216   39.540 12.44639 54.64505 
1 1 1   12   18    0 o   54.105   31.317   2.7491   4.2183   2.7491   4.2183   2.7491   4.2183   54.105   31.317   54.105   31.317 0.000000 0.000000 
1 1 1   12   18    1 o  1563.59   14.680  1873.53   35.133  1858.79   49.176  1888.91   50.211  1556.42   20.642  1568.93   20.909 -12.50500 29.38131 
1 1 1   12   18    2 o  423.847   8.3702  137.545   5.4302  139.103   7.5806  135.903   7.7824  426.155   11.622  421.211   12.071 4.944031 16.75616 
1 1 1   12   18    3 o  1158.32   9.5401  1027.41   16.914  1015.94   20.453  1052.22   30.085  1151.68   11.602  1171.53   16.778 -19.84644 20.39858 
1 1 1   12   18    4 f  453.951   6.8799  157.756   4.7804  155.390   5.7417  163.103   8.6302  450.502   8.3267  461.432   12.219 -10.92972 14.78657 
1 1 1   12   18    5 o  709.676   7.3735  385.576   8.0095  380.205   9.6286  397.640   14.431  704.660   8.9272  720.426   13.087 -15.76587 15.84185 
1 1 1   12   18    6 o  979.181   15.117  734.857   22.657   0.0000   0.0000  734.857   22.657  ?   ?   979.181   15.117 0.000000 15.11692 
1 1 1   12   18    7 o  769.439   9.8788  453.382   11.634  480.932   17.664  432.274   15.462  792.176   14.568  751.111   13.449 41.06567 19.82702 
1 1 1   12   18    8 o  986.345   8.9513  744.952   13.514  742.134   16.558  750.574   23.388  984.345   10.990  989.541   15.442 -5.195618 18.95311 
1 1 1   12   18    9 o  991.748   9.0161  753.150   13.686  743.456   16.588  773.821   24.223  985.213   11.000  1004.70   15.751 -19.48615 19.21226 
1 1 1   12   18   10 o  540.296   7.7194  223.503   6.3839  232.596   7.9553  207.055   10.699  551.122   9.4306  519.818   13.447 31.30450 16.42394 
1 1 1   12   18   11 o  372.999   8.5780  106.532   4.8974  107.769   5.8751  103.716   8.8657  375.117   10.232  367.808   15.748 7.308960 18.78034 
1 1 1   12   18   12 o  558.680   7.9224  238.982   6.7747  251.460   8.3736  215.337   11.527  573.020   9.5471  530.054   14.207 42.96619 17.11709 
1 1 1   12   18   13 o  668.406   8.1369  342.087   8.3247  350.990   10.209  324.417   14.382  676.969   9.8521  650.567   14.443 26.40210 17.48343 
1 1 1   12   18   14 o  1043.49   11.530  834.197   18.416  834.197   18.416   0.0000   0.0000  1043.49   11.530  ?   ?  0.000000 11.53016 
1 1 1   12   18   15 o  1124.72   10.063  968.901   17.324  1058.54   22.574  840.455   27.023  1175.33   12.548  1046.75   16.866 128.5801 21.02198 
1 1 1   12   18   16 o  494.746   10.038  187.486   7.6014  187.486   7.6014   0.0000   0.0000  494.746   10.038  ?   ?  0.000000 10.03784 
1 1 1   12   18   17 o  497.176   8.6651  189.297   6.5941  185.803   7.7144  198.773   12.705  492.504   10.233  509.046   16.306 -16.54230 19.25161 
1 1 1   12   18   18 o  756.117   8.7288  437.843   10.102  446.157   12.267  420.322   17.808  763.144   10.502  740.259   15.717 22.88501 18.90245 
1 1 1   12   18   19 o  808.561   8.9579  500.725   11.086  495.130   13.129  514.626   20.695  803.901   10.670  818.953   16.509 -15.05121 19.65736 
1 1 1   12   18   20 o  310.829   9.7304   74.012   4.6294   73.812   6.4345   74.227   6.6654  310.268   13.549  311.120   13.997 -0.8513184 19.48040 
1 1 1   12   18   21 o  375.832   8.6946  108.189   5.0016  110.148   7.0426  106.196   7.1045  379.070   12.138  372.192   12.471 6.878265 17.40269 
1 1 1   12   18   22 o  508.960   8.0400  198.398   6.2634  213.744   9.0815  184.476   8.6498  528.086   11.235  490.581   11.519 37.50461 16.09117 
1 1 1   12   18   23 o  725.624   9.1008  403.390   10.108  430.674   18.128  391.079   12.177  748.959   15.813  714.277   11.137 34.68237 19.34142 
1 1 1   12   18   24 o  759.146   6.8415  441.343   7.9496  448.029   10.063  430.240   12.966  764.729   8.5967  749.109   11.309 15.62024 14.20512 
1 1 1   12   18   25 o  826.410   8.1524  523.213   10.312  538.864   14.840  508.597   14.340  838.242   11.566  814.370   11.504 23.87268 16.31339 
1 1 1   12   18   26 o  487.737   6.9081  182.206   5.1572  182.049   6.3014  182.525   8.9750  487.429   8.4461  487.763   12.021 -0.3333435 14.69182 
1 1 1   12   18   27 o  433.192   7.2062  143.754   4.7781  146.261   5.8723  138.843   8.2193  436.850   8.7823  425.302   12.626 11.54871 15.38004 
1 1 1   12   18   28 o  369.811   8.1743  104.808   4.6270  103.737   5.8070  106.669   7.6574  367.768   10.316  372.649   13.425 -4.880310 16.93072 
1 1 1   12   18   29 o  402.491   7.1295  124.122   4.3922  127.138   6.1679  121.018   6.2561  407.138   9.8975  397.184   10.291 9.954803 14.27785 
1 1 1   12   18   30 o  356.013   6.9186   97.114   3.7701   99.381   5.2505   94.701   5.4169  359.955   9.5297  351.331   10.073 8.624023 13.86664 
1 1 1   12   18   31 o  405.060   7.7906  125.772   4.8302  133.925   6.0222  111.070   8.0874  417.826   9.4165  379.976   13.905 37.85007 16.79374 
1 1 1   12   18   32 o  385.361   7.9954  113.863   4.7160  120.216   5.8054  101.533   8.0871  395.806   9.5824  363.123   14.550 32.68381 17.42223 
1 1 1   12   18   33 o  343.674   7.1900   90.540   3.7822   87.865   5.2700   93.380   5.4313  338.284   10.178  348.739   10.175 -10.45486 14.39170 
1 1 1   12   18   34 o  224.806   9.0650   38.786   3.1192   36.221   4.3499   41.501   4.4753  216.512   13.189  231.893   12.656 -15.38011 18.27901 
1 1 1   12   18   35 o  155.537   15.984   18.881   3.7512   23.230   7.6099   17.486   4.3114  168.960   30.550  148.920   19.373 20.03992 36.17505 
1 1 1   12   18   36 o  283.153   8.7393   61.549   3.7876   54.884   5.6807   66.885   5.0822  266.384   13.981  294.871   11.260 -28.48648 17.95172 
1 1 1   12   18   37 o  435.280   7.5997  145.373   5.0633  144.973   6.6727  145.916   7.7740  434.269   10.039  435.342   11.667 -1.072662 15.39100 
1 1 1   12   18   38 o  279.349   9.0452   59.957   3.8675   59.256   5.1146   60.895   5.9104  277.288   12.051  280.803   13.751 -3.514679 18.28428 
1 1 1   12   18   39 o   99.880   19.213   8.0319   2.8306   8.8431   4.0513   7.2582   3.9564  103.724   25.659   94.274   26.380 9.449585 36.80076 
1 1 1   12   18   40 o  344.671   8.1236   91.261   4.2857   93.871   6.2662   88.967   5.8746  348.853   11.735  339.716   11.298 9.137238 16.28970 
1 1 1   12   18   41 o  139.941   15.160   15.367   3.1954   14.632   4.6213   16.041   4.4231  134.309   23.326  141.457   21.071 -7.148071 31.43398 
1 1 1   12   18   42 o   57.253   23.465   1.0225   3.2817   0.4211   4.6976   1.5956   4.5863   64.271   27.325   67.839   27.765 -3.568619 38.95590 
1 1 1   12   18   43 o  155.075   15.023   18.857   3.5211   17.500   5.2372   19.976   4.7565  146.587   24.185  158.216   20.094 -11.62955 31.44398 
1 1 1   12   18   44 o  197.504   12.986   30.346   3.9038   32.925   6.0376   28.494   5.1175  203.715   19.605  189.992   17.805 13.72224 26.48367 
1 1 1   12   18   45 o  268.509   10.303   55.633   4.2346   67.249   6.4628   46.894   5.6055  294.081   14.358  244.958   15.023 49.12283 20.78044 
1 1 1   12   18   46 o  151.454   20.337   18.445   4.5954   19.587   5.4486   15.629   8.5534  154.863   23.744  132.673   39.317 22.18994 45.93021 
1 1 1   12   18   47 o  242.256   11.880   45.475   4.4052   39.942   6.5294   50.098   5.9680  224.077   19.223  252.735   15.502 -28.65804 24.69546 
1 1 1   12   18   48 o   64.004   27.574   0.1895   4.9002  -8.1956   19.516   0.7536   5.0624  104.410   48.869   66.756   28.374 37.65344 56.50898 
1 1 1   12   18   49 o  169.369   16.973   22.799   4.3409   19.103   6.3054   26.129   5.9850  149.951   28.514  179.140   22.311 -29.18839 36.20571 
1 1 1   12   18   50 o  190.147   16.036   28.639   4.6235   32.044   6.7119   25.564   6.3781  198.087   22.538  175.770   24.362 22.31702 33.18883 
1 1 1   12   18   51 o  162.884   19.570   21.505   4.7815   24.834   6.6913   18.032   6.8352  171.587   26.317  142.568   32.096 29.01981 41.50624 
1 1 1   12   18   52 o   61.340   25.866   0.9693   4.1530   2.1492   5.6658  -0.4008   6.1053   73.089   30.475   67.758   29.944 5.330750 42.72406 
1 1 1   12   18   53 o   77.958   28.547   4.6398   4.4503   4.6984   5.9973   4.5681   6.6388   82.738   32.462   84.214   33.788 -1.475349 46.85564 
1 1 1   12   18   54 o   68.914   27.348   2.8379   4.3017   7.7608   6.2891  -1.4900   5.8968   94.550   34.039   63.237   28.573 31.31346 44.44129 
1 1 1   12   18   55 o   78.398   27.859   5.0765   4.1997   3.7788   6.2297   6.1576   5.6861   78.718   32.304   86.059   32.130 -7.341026 45.56241 
1 1 1   12   18   56 o  136.503   20.765   15.768   4.2018   13.598   5.9257   17.962   5.9591  119.199   31.865  140.147   28.744 -20.94788 42.91376 
1 1 1   12   18   57 o  172.630   22.860   25.758   5.8918   31.819   7.7804   17.611   9.0212  187.040   28.041  125.685   40.901 61.35473 49.59033 
1 1 1   12   19    0 o  206.461   16.233   33.251   5.0569   33.251   5.0569   33.251   5.0569  206.461   16.233  206.461   16.233 0.000000 0.000000 
1 1 1   12   19    1 o  500.811   8.5015  192.042   6.5168  189.738   9.1227  194.443   9.3126  497.680   11.976  503.810   12.076 -6.129761 17.00759 
1 1 1   12   19    2 o  139.013   16.599   15.027   3.4620   14.334   4.6750   15.868   5.1515  134.666   23.537  141.682   24.650 -7.016342 34.08267 
1 1 1   12   19    3 o  909.739   10.138  633.830   14.117  637.541   19.946  630.106   19.983  912.089   14.287  906.745   14.398 5.343750 20.28374 
1 1 1   12   19    4 o  227.828   11.187   39.758   3.9012   37.308   5.1043   43.199   6.0495  220.092   15.246  236.766   16.802 -16.67383 22.68784 
1 1 1   12   19    5 o  1042.14   11.009  831.868   17.561  819.091   24.192  846.102   25.534  1033.71   15.290  1050.55   15.879 -16.84033 22.04353 
1 1 1   12   19    6 o  568.503   8.9897  247.485   7.8225  251.289   10.986  243.572   11.141  572.706   12.533  563.824   12.910 8.881653 17.99231 
1 1 1   12   19    7 o  914.586   8.6686  640.498   12.135  629.147   14.686  664.929   21.546  906.328   10.586  931.365   15.114 -25.03638 18.45259 
1 1 1   12   19    8 f  1126.71   9.7104  972.197   16.746  987.244   20.860  944.923   28.085  1135.19   12.006  1110.08   16.529 25.10974 20.42887 
1 1 1   12   19    9 o  392.947   8.1849  118.228   4.9229  114.928   5.8630  126.115   9.0638  387.380   9.8882  405.626   14.599 -18.24622 17.63232 
1 1 1   12   19   10 o  338.406   16.427   87.820   8.5087   0.0000   0.0000   87.820   8.5087  ?   ?   338.406   16.427 0.000000 16.42697 
1 1 1   12   19   11 o  918.852   8.8323  646.533   12.422  650.039   15.282  639.706   21.326  921.201   10.838  913.446   15.253 7.754517 18.71158 
1 1 1   12   19   12 o  565.873   8.0526  245.189   6.9747  247.341   8.4698  240.654   12.293  568.284   9.7373  560.306   14.334 7.978149 17.32882 
1 1 1   12   19   13 f  1008.86   11.388  779.758   17.585  779.758   17.585   0.0000   0.0000  1008.86   11.388  ?   ?  0.000000 11.38780 
1 1 1   12   19   14 o  443.811   10.131  150.873   6.8819  150.873   6.8819   0.0000   0.0000  443.811   10.131  ?   ?  0.000000 10.13078 
1 1 1   12   19   15 o  492.466   8.4694  185.722   6.3841  185.584   7.5594  186.067   11.921  492.220   10.034  492.541   15.813 -0.3206787 18.72767 
1 1 1   12   19   16 o  303.889   10.758   70.750   5.0042   73.438   5.8132   63.058   9.8334  309.560   12.269  285.490   22.690 24.06970 25.79481 
1 1 1   12   19   17 o  1219.46   9.1202  1138.98   17.023  1120.06   23.496  1159.90   24.698  1208.84   12.698  1230.08   13.118 -21.24451 18.25718 
1 1 1   12   19   18 o  1075.65   8.5243  886.138   14.035  883.970   19.626  888.406   20.078  1073.96   11.939  1076.62   12.184 -2.659302 17.05835 
1 1 1   12   19   19 o  572.359   7.6095  250.867   6.6665  256.186   9.3243  245.305   9.5349  578.231   10.535  565.787   11.010 12.44427 15.23859 
1 1 1   12   19   20 o  146.551   17.381   16.723   3.8228   16.492   5.4453   16.948   5.3681  144.148   25.618  146.306   24.861 -2.158691 35.69823 
1 1 1   12   19   21 o  447.826   8.3132  153.613   5.6983  159.237   8.0868  148.067   8.0308  455.766   11.592  439.469   11.939 16.29712 16.64064 
1 1 1   12   19   22 o  574.087   9.0603  252.507   7.9614  274.724   14.377  242.681   9.5612  598.151   15.703  562.651   11.102 35.50024 19.23162 
1 1 1   12   19   23 o  483.160   8.2628  178.837   6.1107  183.308   8.7377  174.557   8.5489  488.919   11.676  477.103   11.707 11.81610 16.53395 
1 1 1   12   19   24 o  548.470   8.1462  230.466   6.8388  231.139   9.6449  229.786   9.6983  548.983   11.478  547.363   11.576 1.619629 16.30175 
1 1 1   12   19   25 o  293.698   8.1902   66.092   3.6818   65.047   4.3770   68.621   6.8085  291.292   9.8170  298.860   14.884 -7.567535 17.82978 
1 1 1   12   19   26 o  469.133   7.5857  168.620   5.4470  174.530   7.0709  159.993   8.5428  477.119   9.6822  456.575   12.224 20.54388 15.59404 
1 1 1   12   19   27 o  361.455   8.1937  100.128   4.5332  105.614   5.7506   91.123   7.3674  371.089   10.124  344.360   13.978 26.72931 17.25909 
1 1 1   12   19   28 o  325.835   8.4473   81.384   4.2129   83.019   4.7770   75.660   8.9369  329.023   9.4856  312.624   18.763 16.39896 21.02460 
1 1 1   12   19   29 o  150.948   13.835   17.666   3.1610   18.464   3.6708   15.376   6.2180  154.057   15.790  137.601   30.339 16.45586 34.20213 
1 1 1   12   19   30 o  221.277   10.341   37.581   3.5026   41.132   4.1868   29.300   6.3931  231.090   11.877  193.206   22.011 37.88419 25.01094 
1 1 1   12   19   31 o  378.673   7.8160  109.936   4.5302  110.654   5.4844  108.394   8.0375  379.754   9.4353  375.275   13.993 4.478729 16.87662 
1 1 1   12   19   32 o  305.106   7.4468   71.367   3.4777   69.355   4.8492   73.498   4.9903  300.512   10.542  309.357   10.539 -8.845581 14.90671 
1 1 1   12   19   33 o  272.139   8.0323   56.804   3.3458   55.635   4.6761   58.029   4.7893  269.031   11.356  274.754   11.388 -5.723541 16.08245 
1 1 1   12   19   34 o  345.022   8.7599   91.362   4.6261   91.003   8.6674   91.505   5.4705  343.106   16.504  345.098   10.356 -1.992157 19.48436 
1 1 1   12   19   35 o  285.141   8.1484   62.390   3.5563   53.355   4.9694   71.875   5.0916  263.235   12.334  305.732   10.880 -42.49664 16.44696 
1 1 1   12   19   36 o  124.432   16.673   12.199   3.0957   7.7908   4.0730   18.227   4.7634   97.769   26.538  151.488   21.118 -53.71899 33.91462 
1 1 1   12   19   37 o  578.715   6.7311  256.864   5.9624  250.234   8.3331  263.819   8.5346  570.579   9.5416  585.869   9.5173 -15.28979 13.47668 
1 1 1   12   19   38 o  407.933   7.3726  127.713   4.6034  119.075   6.5342  136.225   6.4864  393.252   10.856  420.797   10.071 -27.54538 14.80751 
1 1 1   12   19   39 o  278.417   8.7212   59.578   3.7166   65.195   5.4594   54.726   5.0738  290.641   12.272  266.252   12.450 24.38956 17.48157 
1 1 1   12   19   40 o  200.596   11.100   31.116   3.3949   31.069   4.9353   31.158   4.6772  199.262   16.325  199.784   15.415 -0.5218811 22.45225 
1 1 1   12   19   41 o   96.023   21.060   7.5215   3.0101   4.7519   4.1282   10.666   4.3983   80.040   27.682  113.555   25.881 -33.51542 37.89648 
1 1 1   12   19   42 o  224.697   10.852   38.947   3.7323   40.381   5.5025   37.726   5.0793  227.234   15.921  219.817   15.190 7.416962 22.00471 
1 1 1   12   19   43 o  309.030   9.3475   73.544   4.4215   69.848   6.5091   76.710   6.0247  299.955   14.177  314.842   12.502 -14.88678 18.90221 
1 1 1   12   19   44 o   37.523   18.168  -5.1097   3.2107  -5.3350   4.5352  -4.8833   4.5462   47.770   22.718   48.766   23.060 -0.9963799 32.37045 
1 1 1   12   19   45 o   75.399   27.657   3.9041   4.1795  -3.4075   4.7412   29.396   8.8527   53.351   24.668  186.265   32.217 -132.9142 40.57643 
1 1 1   12   19   46 o  135.499   18.076   14.678   3.6555   20.839   5.5573   9.9800   4.8531  159.829   23.410  108.424   28.768 51.40506 37.08991 
1 1 1   12   19   47 o  151.150   17.331   18.180   3.9371   18.985   5.9016   17.534   5.2850  150.883   26.522  145.704   24.572 5.179123 36.15530 
1 1 1   12   19   48 o  157.907   37.604   22.434   8.9584  -0.6286   20.256   28.042   9.9884  114.142   52.114  176.752   38.046 -62.61088 64.52411 
1 1 1   12   19   49 o  102.272   27.184   8.9397   4.3284   12.977   6.9305   6.3579   5.5423  120.537   35.300   89.965   32.000 30.57176 47.64539 
1 1 1   12   19   50 o   71.285   27.826   3.0375   4.3890  -2.6818   6.0150   9.5497   6.4184   62.282   28.422  104.688   34.521 -42.40605 44.71560 
1 1 1   12   19   51 o   96.617   27.378   8.0801   4.2337   4.5659   5.7783   12.153   6.2207   82.275   31.980  115.966   33.296 -33.69135 46.16657 
1 1 1   12   19   52 o   58.536   25.318   0.1930   4.1644  -3.8379   5.6653   4.9309   6.1422   57.202   26.626   84.241   32.908 -27.03848 42.33054 
1 1 1   12   19   53 o  174.838   17.886   24.755   4.7191   22.483   6.1648   27.972   7.3343  161.981   25.725  179.658   27.550 -17.67783 37.69306 
1 1 1   12   19   54 o   70.776   27.247   3.4655   4.1634  -0.7552   5.8778   7.7158   5.8983   64.566   28.903   93.308   33.030 -28.74152 43.89032 
1 1 1   12   19   55 o  113.220   24.452   11.273   4.1136   7.4728   5.8059   15.104   5.8292   91.136   32.716  127.440   30.323 -36.30446 44.60763 
1 1 1   12   19   56 o  210.071   19.475   36.767   6.1908   0.0000   0.0000   36.767   6.1908  ?   ?   210.071   19.475 0.000000 19.47505 
1 1 1   12   20    0 o  687.681   13.066  362.534   13.741  362.534   13.741  362.534   13.741  687.681   13.066  687.681   13.066 0.000000 0.000000 
1 1 1   12   20    1 o  986.441   10.697  745.314   16.152  726.481   22.181  766.574   23.566  973.523   14.885  999.970   15.397 -26.44739 21.41586 
1 1 1   12   20    2 o  839.959   9.8630  540.333   12.681  528.743   17.448  553.307   18.461  830.629   13.724  849.665   14.195 -19.03528 19.74419 
1 1 1   12   20    3 o  1216.55   12.264  1133.89   22.837  1105.86   31.231  1166.10   33.479  1200.81   16.992  1232.97   17.740 -32.15332 24.56461 
1 1 1   12   20    4 o  1158.59   9.7033  1028.02   17.208  1020.22   20.844  1044.69   30.491  1154.00   11.801  1167.10   17.068 -13.10400 20.75044 
1 1 1   12   20    5 o  922.070   8.5102  651.029   12.011  649.393   14.580  654.482   21.187  920.793   10.345  923.992   14.981 -3.198975 18.20534 
1 1 1   12   20    6 o  963.330   8.7860  710.627   12.955  712.041   15.822  707.751   22.565  964.151   10.722  960.808   15.344 3.342773 18.71849 
1 1 1   12   20    7 o  424.133   8.1250  137.741   5.2747  129.732   6.3444  155.668   9.4920  411.562   10.071  450.677   13.760 -39.11502 17.05206 
1 1 1   12   20    8 o  1238.30   10.393  1174.51   19.699  1174.00   24.168  1175.51   34.001  1237.77   12.757  1237.80   17.946 -0.3002930E-01 22.01815 
1 1 1   12   20    9 o  519.753   7.9673  206.849   6.3384  209.073   7.7221  202.255   11.096  522.479   9.6560  513.674   14.113 8.805359 17.10040 
1 1 1   12   20   10 o  306.072   9.6530   71.749   4.5222   73.510   5.4610   67.905   8.0670  309.757   11.518  296.959   17.830 12.79797 21.22711 
1 1 1   12   20   11 o  535.367   9.7826  219.527   8.0163  219.527   8.0163   0.0000   0.0000  535.367   9.7826  ?   ?  0.000000 9.782603 
1 1 1   12   20   12 o  821.749   10.501  517.283   13.208  517.283   13.208   0.0000   0.0000  821.749   10.501  ?   ?  0.000000 10.50126 
1 1 1   12   20   13 o  744.071   8.4144  423.975   9.5831  426.701   11.675  418.345   16.779  746.348   10.219  738.627   14.841 7.721375 18.01953 
1 1 1   12   20   14 o  831.500   8.7426  529.504   11.127  534.810   13.581  518.673   19.405  835.516   10.620  822.344   15.417 13.17291 18.72057 
1 1 1   12   20   15 o  137.934   20.743   14.943   4.2438   14.032   4.9132   17.618   8.4216  132.860   25.080  147.901   37.228 -15.04092 44.88765 
1 1 1   12   20   16 o  663.304   8.6096  336.968   8.7411  343.569   10.631  323.194   15.357  669.657   10.372  649.069   15.458 20.58826 18.61535 
1 1 1   12   20   17 o  569.989   7.6372  248.795   6.6630  246.006   9.1121  252.000   9.7679  566.629   10.506  573.449   11.129 -6.820496 15.30446 
1 1 1   12   20   18 o  830.171   7.8721  527.812   10.003  538.180   14.169  517.511   14.124  838.000   11.047  821.732   11.229 16.26801 15.75189 
1 1 1   12   20   19 o  803.414   7.8390  494.359   9.6398  486.900   13.339  502.515   13.947  797.049   10.933  809.694   11.254 -12.64465 15.69034 
1 1 1   12   20   20 o  576.056   7.7752  254.163   6.8556  249.887   9.4646  258.884   9.9439  570.977   10.830  581.135   11.179 -10.15894 15.56451 
1 1 1   12   20   21 o  105.294   28.809   8.8575   4.7777   5.2771   7.9803   10.858   5.9648   98.733   37.793  116.511   32.316 -17.77766 49.72520 
1 1 1   12   20   22 o  153.567   18.587   18.405   4.2801   18.600   5.8659   18.184   6.2590  153.046   25.969  150.868   28.139 2.177383 38.29107 
1 1 1   12   20   23 o  962.692   8.5018  710.131   12.528  714.196   17.647  706.002   17.787  964.875   11.949  959.292   12.114 5.582458 17.01539 
1 1 1   12   20   24 o  454.610   10.025  158.457   6.9760  164.326   11.536  155.073   8.7590  462.261   16.304  449.479   12.731 12.78195 20.68608 
1 1 1   12   20   25 o   75.150   29.370   2.6893   4.8940  -4.1289   7.9980   6.7701   6.1876   73.545   33.249   97.688   33.885 -24.14302 47.47283 
1 1 1   12   20   26 o  413.987   9.2496  131.404   5.8611  127.038   8.1411  136.102   8.4450  406.681   13.079  420.935   13.107 -14.25388 18.51625 
1 1 1   12   20   27 o  339.644   11.469   88.555   5.9622   88.063   7.5616   89.363   9.6937  338.380   14.600  339.828   18.708 -1.447998 23.73079 
1 1 1   12   20   28 o  425.197   7.4062  138.554   4.8201  138.957   5.7373  137.588   8.8868  425.693   8.8053  422.999   13.726 2.693512 16.30735 
1 1 1   12   20   29 o  204.945   10.595   32.329   3.3121   33.499   3.8345   28.890   6.5730  208.458   12.069  191.631   22.861 16.82687 25.85106 
1 1 1   12   20   30 o  369.014   7.9659  104.408   4.4993  106.526   5.3319   99.169   8.3852  372.608   9.3489  358.746   15.271 13.86273 17.90521 
1 1 1   12   20   31 o  275.919   9.0556   58.416   3.8244   58.644   4.4670   57.788   7.4012  276.329   10.561  272.854   17.819 3.475067 20.71406 
1 1 1   12   20   32 o  516.950   6.3757  204.806   5.0448  209.396   7.0379  199.955   7.2351  522.382   8.8021  510.398   9.2612 11.98462 12.77680 
1 1 1   12   20   33 o  261.831   9.9410   52.659   3.9840   51.405   7.4788   53.155   4.7076  256.740   19.169  262.878   11.700 -6.138123 22.45774 
1 1 1   12   20   34 o  101.352   24.760   8.3668   3.8083   6.4197   7.3423   9.0834   4.4543   98.722   36.579  105.427   27.364 -6.705002 45.68217 
1 1 1   12   20   35 o  492.437   7.8748  186.085   5.9356  184.237   8.0984  188.231   8.7249  489.402   10.811  494.508   11.527 -5.105927 15.80342 
1 1 1   12   20   36 o  393.450   7.1715  118.760   4.3189  116.467   5.9813  121.258   6.2427  389.180   10.041  397.061   10.272 -7.880371 14.36415 
1 1 1   12   20   37 o  175.025   11.192   23.689   2.9825   22.637   4.1261   24.841   4.3163  170.143   16.033  178.311   15.984 -8.167374 22.63941 
1 1 1   12   20   38 o  206.580   10.168   32.848   3.2149   32.474   4.5714   33.213   4.5223  204.254   14.721  206.652   14.387 -2.397888 20.58341 
1 1 1   12   20   39 f  166.977   12.357   21.646   3.1357   16.879   4.3756   26.678   4.4959  145.475   20.196  184.630   16.069 -39.15479 25.80854 
1 1 1   12   20   40 o  212.379   11.081   34.876   3.5897   41.984   5.1775   28.298   4.9812  232.227   14.641  189.771   17.341 42.45619 22.69479 
1 1 1   12   20   41 o  344.388   8.5029   91.205   4.4821   94.514   6.7994   88.662   5.9605  349.548   12.709  338.883   11.491 10.66522 17.13337 
1 1 1   12   20   42 o  179.870   12.704   25.162   3.4752   29.270   4.9535   21.180   4.8766  192.929   16.946  162.980   19.966 29.94872 26.18801 
1 1 1   12   20   43 o   93.395   22.697   7.1965   3.2128   9.2524   4.5353   5.1257   4.5519  105.064   27.779   82.888   29.045 22.17525 40.19068 
1 1 1   12   20   44 o  120.325   23.897   11.942   4.2460   11.864   4.8462   12.197   8.8086  118.896   27.217  119.812   40.461 -0.9164734 48.76315 
1 1 1   12   20   45 o   75.119   24.759   4.4087   3.3017  -0.0655   4.6317   9.0314   4.7079   61.776   26.710  103.390   28.722 -41.61427 39.22209 
1 1 1   12   20   46 o  284.358   10.205   62.462   4.4415   58.766   6.3190   66.071   6.2443  273.909   15.131  291.267   14.006 -17.35779 20.61822 
1 1 1   12   20   47 o   69.766   28.396   2.0752   4.7638 -13.0445   18.017   3.2116   4.9396   95.240   45.289   75.049   29.456 20.19103 54.02533 
1 1 1   12   20   48 o  184.833   15.107   26.929   4.2364   36.075   6.4436   19.966   5.6224  211.877   20.110  155.235   24.473 56.64215 31.67588 
1 1 1   12   20   49 o  168.503   17.300   22.676   4.3986   23.374   6.0026   21.866   6.4640  167.995   24.029  160.712   27.251 7.283035 36.33161 
1 1 1   12   20   50 o  200.839   14.538   31.834   4.4388   28.787   6.3415   34.762   6.2154  186.980   22.618  207.294   19.831 -20.31421 30.08020 
1 1 1   12   20   51 o  185.859   15.521   27.475   4.3750   24.145   6.0988   31.006   6.2794  169.703   24.162  194.303   21.473 -24.59952 32.32438 
1 1 1   12   20   52 o  108.363   28.305   10.403   4.7461   6.7848   6.1854   15.584   7.4010   91.110   33.611  128.365   36.137 -37.25515 49.35138 
1 1 1   12   20   53 f   63.978   26.320   1.8377   4.1483  -3.1442   6.0378   6.2921   5.7092   60.174   27.828   87.413   32.282 -27.23929 42.62103 
1 1 1   12   20   54 o  123.235   22.848   13.052   4.1510   14.676   6.0744   11.630   5.6857  124.974   31.705  111.050   31.817 13.92357 44.91703 
1 1 1   12   20   55 o  125.415   24.326   13.826   4.5012   9.8075   7.0727   16.562   5.8355  100.337   36.100  133.861   29.295 -33.52405 46.49041 
1 1 1   12   20   56 o   63.268   27.227   1.1830   4.7671   2.0546   5.9037  -0.4499   8.0810   70.689   30.357   72.589   33.054 -1.899979 44.87928 
1 1 1   12   21    0 o  1026.89   15.681  808.361   24.634  808.361   24.634  808.361   24.634  1026.89   15.681  1026.89   15.681 0.000000 0.000000 
1 1 1   12   21    1 o  247.038   11.692   46.756   4.4210   49.138   6.1767   44.253   6.3305  252.627   16.057  239.556   17.383 13.07089 23.66445 
1 1 1   12   21    2 o  750.552   9.6172  431.437   11.048  416.745   15.004  448.839   16.330  737.418   13.293  765.232   13.942 -27.81451 19.26316 
1 1 1   12   21    3 o  1127.79   11.767  974.472   20.312  957.158   27.946  993.864   29.574  1117.16   16.343  1138.28   16.975 -21.12427 23.56330 
1 1 1   12   21    4 o  1542.54   12.034  1823.11   28.414  1789.26   33.961  1902.08   51.876  1527.75   14.523  1573.59   21.538 -45.84265 25.97722 
1 1 1   12   21    5 o  1415.28   11.272  1534.51   24.418  1523.75   29.559  1557.62   43.329  1409.96   13.697  1424.36   19.874 -14.39233 24.13678 
1 1 1   12   21    6 f  275.133   8.4382   57.967   3.5535   56.753   3.9913   62.606   7.8045  272.215   9.5792  285.076   17.978 -12.86044 20.37096 
1 1 1   12   21    7 o  743.781   8.2866  423.621   9.4338  410.046   11.336  454.203   17.015  731.664   10.122  769.713   14.442 -38.04901 17.63599 
1 1 1   12   21    8 o  861.864   8.6795  568.846   11.450  569.292   14.117  567.989   19.574  862.059   10.699  860.685   14.858 1.374329 18.30954 
1 1 1   12   21    9 o  770.942   10.292  455.284   12.145  455.284   12.145   0.0000   0.0000  770.942   10.292  ?   ?  0.000000 10.29240 
1 1 1   12   21   10 o  963.082   11.236  710.645   16.564  710.645   16.564   0.0000   0.0000  963.082   11.236  ?   ?  0.000000 11.23638 
1 1 1   12   21   11 o  160.029   16.338   19.850   3.9458   24.164   4.6476   8.7142   7.4677  176.594   17.421  109.982   37.253 66.61189 41.12569 
1 1 1   12   21   12 f  1011.33   9.4150  783.413   14.574  787.511   17.889  775.327   25.131  1013.76   11.529  1005.25   16.333 8.509338 19.99228 
1 1 1   12   21   13 o  731.611   8.5063  409.930   9.5255  414.036   11.682  401.781   16.456  735.138   10.382  723.775   14.854 11.36334 18.12242 
1 1 1   12   21   14 o  885.979   9.0482  601.246   12.270  598.890   14.952  606.106   21.474  884.058   11.049  888.789   15.785 -4.730347 19.26793 
1 1 1   12   21   15 o  1137.16   10.173  990.770   17.706  970.681   21.197  1037.16   32.210  1125.29   12.306  1162.07   18.109 -36.78540 21.89445 
1 1 1   12   21   16 o  820.027   9.0497  515.114   11.359  520.612   13.885  503.991   19.750  824.207   11.006  810.329   15.923 13.87793 19.35686 
1 1 1   12   21   17 o  710.587   7.6339  386.709   8.3030  393.265   11.775  380.225   11.710  716.336   10.739  704.348   10.861 11.98785 15.27423 
1 1 1   12   21   18 o  1053.01   8.6064  849.417   13.871  861.362   19.715  837.708   19.520  1059.87   12.153  1045.21   12.201 14.66199 17.22119 
1 1 1   12   21   19 o  429.317   10.032  141.257   6.5924  137.315   11.071  143.422   8.2057  422.715   17.111  432.434   12.397 -9.719177 21.12992 
1 1 1   12   21   20 o  320.774   11.932   78.918   5.8583   72.027   9.4947   83.154   7.4442  305.141   20.447  329.081   14.779 -23.93979 25.22898 
1 1 1   12   21   21 o  428.085   9.9031  140.473   6.4889  132.798   10.381  145.395   8.3128  415.655   16.317  435.315   12.476 -19.65982 20.54049 
1 1 1   12   21   22 f  701.115   9.1444  376.754   9.8133  370.440   16.065  380.513   12.395  694.331   15.116  704.302   11.497 -9.971985 18.99186 
1 1 1   12   21   23 o  655.739   8.0322  329.484   8.0618  326.802   11.233  332.333   11.577  652.681   11.244  658.145   11.492 -5.463867 16.07808 
1 1 1   12   21   24 o  267.776   11.787   55.033   4.8312   45.708   6.4324   67.101   7.3178  243.020   17.408  294.861   16.277 -51.84108 23.83233 
1 1 1   12   21   25 f  506.437   8.4997  196.602   6.5887  188.546   8.9889  205.955   9.6856  495.579   11.850  517.902   12.218 -22.32254 17.02092 
1 1 1   12   21   26 o  533.059   9.5187  217.938   7.7664  224.474   9.7342  206.490   12.883  540.684   11.762  517.795   16.255 22.88898 20.06404 
1 1 1   12   21   27 o  399.726   9.5670  122.572   5.8534  122.882   8.1115  122.236   8.4552  399.797   13.255  398.660   13.856 1.136780 19.17560 
1 1 1   12   21   28 f  327.394   8.0539   82.179   4.0360   80.745   4.6819   86.330   7.9628  324.416   9.4287  334.741   15.541 -10.32523 18.17785 
1 1 1   12   21   29 o  323.117   8.0945   80.058   4.0033   80.392   4.7096   79.190   7.6004  323.670   9.5063  320.529   15.492 3.140442 18.17593 
1 1 1   12   21   30 o  124.207   15.767   12.087   2.9301   15.514   3.3179  -0.0527   6.2451  140.978   15.640   72.935   31.269 68.04313 34.96232 
1 1 1   12   21   31 o   47.862   20.883  -0.5374   2.8847  -0.5018   3.2081  -0.6879   6.5923   50.789   22.094   73.049   31.725 -22.26062 38.66042 
1 1 1   12   21   32 o  185.912   18.023   27.014   5.0644   36.007   7.3871   19.039   6.9565  213.661   22.947  152.512   30.859 61.14919 38.45635 
1 1 1   12   21   33 o  343.393   7.7076   90.461   4.0512   83.111   5.0324  103.994   6.8287  328.879   9.9971  367.536   12.139 -38.65714 15.72542 
1 1 1   12   21   34 o  178.903   10.855   24.710   2.9585   23.039   4.1947   26.364   4.1731  171.798   16.141  184.120   14.936 -12.32202 21.99183 
1 1 1   12   21   35 o  312.399   7.5710   74.891   3.6202   79.208   5.0355   70.273   5.2084  320.915   10.251  302.119   11.263 18.79620 15.22978 
1 1 1   12   21   36 o   49.700   20.214   0.7997   2.4118  -1.6935   3.2370   3.9107   3.6159   46.689   21.126   74.005   25.890 -27.31648 33.41536 
1 1 1   12   21   37 o  242.200   8.8370   45.088   3.2760   50.923   4.5808   38.979   4.6871  256.989   11.646  224.108   13.730 32.88123 18.00369 
1 1 1   12   21   38 o  180.314   11.212   25.161   3.0791   30.341   4.3265   19.845   4.3832  197.400   14.419  158.456   18.416 38.94423 23.38892 
1 1 1   12   21   39 o  269.251   8.8157   55.749   3.6332   54.706   4.9967   56.918   5.2922  266.128   12.267  271.355   12.742 -5.227173 17.68675 
1 1 1   12   21   40 o  143.656   15.252   16.206   3.3023   14.345   4.6794   18.054   4.6611  132.610   23.934  150.156   20.843 -17.54639 31.73756 
1 1 1   12   21   41 o  327.229   10.086   82.527   5.0518   84.322   6.0027   78.171   9.3529  330.321   11.872  314.913   19.500 15.40820 22.82965 
1 1 1   12   21   42 o  139.284   15.241   15.271   3.1962   15.299   4.6116   15.245   4.4340  137.175   22.762  137.230   21.841 -0.5531311E-01 31.54583 
1 1 1   12   21   43 o  108.656   24.421   9.7974   3.9626   9.8466   4.5784   9.6505   7.9107  108.234   27.562  109.365   38.292 -1.130379 47.17982 
1 1 1   12   21   44 o  277.902   9.4187   59.541   4.0064   57.754   5.6455   61.354   5.6865  272.639   13.528  281.104   13.216 -8.464813 18.91243 
1 1 1   12   21   45 o  199.777   13.053   31.129   3.9695   32.468   5.6662   29.838   5.5628  202.169   18.516  193.548   19.023 8.621338 26.54682 
1 1 1   12   21   46 o  138.172   24.409   15.804   4.9735   10.861   18.077   16.209   5.1732  127.892   53.949  139.678   25.120 -11.78632 59.51069 
1 1 1   12   21   47 o  299.859   10.922   69.646   5.0131   65.968   7.9893   72.035   6.4384  288.275   18.200  303.859   13.843 -15.58337 22.86624 
1 1 1   12   21   48 o  169.482   18.151   23.010   4.6355   30.978   6.4219   14.341   6.6979  195.081   21.884  126.771   33.873 68.31084 40.32725 
1 1 1   12   21   49 o  186.171   15.388   27.453   4.3456   33.747   6.5690   22.556   5.7947  203.492   21.411  164.872   23.639 38.61975 31.89413 
1 1 1   12   21   50 o  156.826   18.034   19.856   4.2502   17.752   6.0243   21.942   5.9970  142.847   28.551  161.268   25.113 -18.42084 38.02375 
1 1 1   12   21   51 o   75.814   27.417   4.3987   4.0863   2.2262   5.4533   7.1805   6.1708   72.129   29.971   92.903   33.677 -20.77432 45.08260 
1 1 1   12   21   52 o   65.485   26.398   2.2601   4.0730   7.0487   5.8918  -2.1229   5.6367   91.185   32.930   60.391   27.541 30.79463 42.92867 
1 1 1   12   21   53 o  171.545   16.300   23.776   4.2286   18.872   5.9358   28.830   6.0256  145.758   27.617  185.511   21.627 -39.75241 35.07685 
1 1 1   12   21   54 o  157.403   18.705   20.505   4.4183   23.834   6.7023   17.947   5.8759  162.962   27.872  140.673   28.270 22.28894 39.69946 
1 1 1   12   21   55 o  115.009   27.128   12.108   4.6981   12.298   5.8219   11.755   7.9550  112.356   32.197  106.494   38.288 5.862206 50.02634 
1 1 1   12   22    0 o  149.822   27.968   18.917   5.7583   18.917   5.7583   18.917   5.7583  149.822   27.968  149.822   27.968 0.000000 0.000000 
1 1 1   12   22    1 o  828.388   10.150  525.645   12.870  522.155   17.984  529.308   18.425  825.279   14.237  830.887   14.488 -5.607666 20.31215 
1 1 1   12   22    2 o  551.315   9.3733  232.793   7.9097  228.043   10.928  238.019   11.463  545.465   13.089  557.246   13.439 -11.78125 18.76026 
1 1 1   12   22    3 o  852.526   10.271  556.742   13.402  536.555   18.193  580.695   19.818  836.577   14.208  870.234   14.878 -33.65741 20.57228 
1 1 1   12   22    4 o  447.537   9.6295  153.409   6.5963  139.103   8.7605  172.138   10.024  425.995   13.436  473.865   13.820 -47.86954 19.27454 
1 1 1   12   22    5 o  141.155   15.990   15.478   3.3938   16.746   4.0160   12.310   6.3478  146.578   18.299  124.047   32.895 22.53049 37.64240 
1 1 1   12   22    6 o  424.309   8.0177  137.866   5.2072  139.415   6.2133  134.209   9.5447  426.636   9.5147  418.346   14.906 8.290131 17.68372 
1 1 1   12   22    7 o  555.304   10.069  236.215   8.5582  236.215   8.5582   0.0000   0.0000  555.304   10.069  ?   ?  0.000000 10.06895 
1 1 1   12   22    8 o  690.671   10.142  365.429   10.722  365.429   10.722   0.0000   0.0000  690.671   10.142  ?   ?  0.000000 10.14185 
1 1 1   12   22    9 o  690.966   8.3248  365.631   8.8044  363.744   10.740  369.499   15.375  689.065   10.183  694.140   14.471 -5.074951 17.69435 
1 1 1   12   22   10 o  718.391   8.4188  395.247   9.2572  390.682   11.220  404.981   16.384  714.108   10.265  726.654   14.731 -12.54590 17.95456 
1 1 1   12   22   11 o  144.311   18.235   16.245   3.9379   19.617   4.7358   8.6897   7.0890  158.539   19.958  108.823   36.299 49.71652 41.42356 
1 1 1   12   22   12 o  344.099   9.8817   90.712   5.2046   87.105   6.1830   99.480   9.6406  337.105   11.983  359.943   17.498 -22.83731 21.20817 
1 1 1   12   22   13 o  635.765   8.5467  309.592   8.3170  307.078   10.093  314.912   14.680  633.051   10.416  640.658   14.970 -7.607239 18.23731 
1 1 1   12   22   14 o  711.677   8.6322  387.963   9.4032  386.495   11.421  391.052   16.567  710.179   10.507  713.846   15.163 -3.667786 18.44730 
1 1 1   12   22   15 o  576.508   8.6586  254.600   7.6406  254.214   9.2466  255.430   13.566  575.944   10.489  576.863   15.364 -0.9194946 18.60296 
1 1 1   12   22   16 f  283.402   12.021   61.586   5.2144   56.538   6.0955   75.359   10.069  271.010   14.750  312.153   21.199 -41.14352 25.82564 
1 1 1   12   22   17 o  650.445   8.9460  324.158   8.9065  322.034   10.704  328.935   16.057  648.144   10.790  654.398   16.030 -6.253723 19.32330 
1 1 1   12   22   18 o  113.229   41.338   8.2963   9.3213   0.0000   0.0000   8.2963   9.3213  ?   ?   113.229   41.338 0.000000 41.33781 
1 1 1   12   22   19 o  187.760   21.420   27.526   6.0457   0.0000   0.0000   27.526   6.0457  ?   ?   187.760   21.420 0.000000 21.42004 
1 1 1   12   22   20 o  502.066   9.4491  193.213   7.2614  204.608   11.914  186.478   9.1593  516.038   15.083  492.988   12.138 23.04947 19.36084 
1 1 1   12   22   21 f  316.561   9.9976   76.836   4.8442   84.570   6.7166   68.452   6.9934  331.878   13.222  298.019   15.384 33.85916 20.28485 
1 1 1   12   22   22 o  416.922   8.9581  133.244   5.7166  131.428   7.6838  135.496   8.5554  413.793   12.132  420.023   13.307 -6.229858 18.00745 
1 1 1   12   22   23 o  109.709   24.444   9.6897   3.9998   9.4513   5.4844   9.9606   5.8459  108.720   31.277  111.618   32.344 -2.898308 44.99379 
1 1 1   12   22   24 o  268.340   11.328   55.271   4.6529   58.035   6.4443   52.261   6.7251  274.194   15.418  259.906   16.999 14.28830 22.94888 
1 1 1   12   22   25 o  612.700   9.1031  287.892   8.5371  284.642   10.455  294.395   14.789  608.907   11.218  618.343   15.626 -9.436218 19.23528 
1 1 1   12   22   26 o  569.189   8.4492  248.416   7.3610  252.302   10.099  244.010   10.752  573.157   11.511  563.489   12.467 9.668335 16.96823 
1 1 1   12   22   27 o  243.448   13.161   45.713   4.8858   47.637   6.7567   43.604   7.0733  247.726   17.941  236.598   19.711 11.12843 26.65336 
1 1 1   12   22   28 o  258.058   12.594   51.212   4.9747   48.472   6.9224   54.138   7.1538  249.758   18.234  264.115   17.800 -14.35733 25.48151 
1 1 1   12   22   29 o  307.359   11.498   72.612   5.4091   64.350   7.4317   81.918   7.8878  288.140   16.925  325.836   15.816 -37.69623 23.16434 
1 1 1   12   22   30 o  191.752   11.681   28.378   3.4121   29.874   3.9321   23.818   6.8657  196.543   13.147  172.340   26.907 24.20369 29.94675 
1 1 1   12   22   31 o  251.948   16.561   49.289   6.3511   58.862   7.3896   22.230   12.424  275.171   17.638  161.599   47.246 113.5719 50.43100 
1 1 1   12   22   32 o  535.376   7.3476  219.843   6.0211  218.196   7.1909  223.705   11.013  533.111   8.8124  538.697   13.357 -5.586121 16.00200 
1 1 1   12   22   33 o  329.961   9.3754   83.646   4.7350   90.482   5.7900   69.842   8.2274  342.927   11.031  299.433   18.035 43.49359 21.14127 
1 1 1   12   22   34 o  578.680   6.4809  256.792   5.7404  253.003   7.9228  260.978   8.3287  573.862   9.0199  582.756   9.3373 -8.893982 12.98240 
1 1 1   12   22   35 o  253.402   8.5693   49.328   3.3237   46.784   4.4884   52.418   4.9458  246.351   11.903  260.683   12.395 -14.33163 17.18513 
1 1 1   12   22   36 o  214.543   9.5080   35.402   3.1223   35.958   4.3893   34.833   4.4424  215.292   13.386  211.801   13.778 3.491486 19.20988 
1 1 1   12   22   37 o  237.502   9.1045   43.378   3.3097   37.751   4.5734   49.566   4.7958  220.499   13.617  253.362   12.367 -32.86253 18.39475 
1 1 1   12   22   38 o  129.476   14.441   13.148   2.8132   9.0068   3.9809   17.280   3.9760  104.468   25.189  147.790   17.944 -43.32287 30.92737 
1 1 1   12   22   39 o  252.938   9.5992   49.257   3.7164   46.382   5.0505   52.652   5.4882  244.357   13.556  260.322   13.823 -15.96480 19.36124 
1 1 1   12   22   40 o  130.381   15.026   13.377   2.9438   15.075   4.1140   11.596   4.2142  137.098   20.211  118.823   23.997 18.27533 31.37462 
1 1 1   12   22   41 o  426.234   7.6179  139.627   4.9700  141.961   7.1612  137.459   6.9031  428.831   10.910  422.051   10.686 6.780029 15.27150 
1 1 1   12   22   42 o  286.379   11.189   63.372   4.9048   61.298   5.8118   68.506   9.1432  281.038   13.511  293.833   20.457 -12.79526 24.51600 
1 1 1   12   22   43 o  150.012   14.550   17.676   3.2989   19.305   4.6932   16.086   4.6380  155.058   20.259  140.627   22.291 14.43077 30.12127 
1 1 1   12   22   44 o   86.660   24.056   6.2246   3.3038   7.1684   4.7963   5.3725   4.5575   93.361   29.770   83.729   29.079 9.632057 41.61507 
1 1 1   12   22   45 o   42.253   19.866  -3.2627   3.2876  -3.7308   4.6291  -2.7862   4.6700   51.632   24.045   54.163   24.839 -2.531021 34.57060 
1 1 1   12   22   46 o   74.859   28.583   3.5756   4.5578   27.275   17.701   1.8927   4.7169  161.275   57.205   68.735   28.147 92.53931 63.75512 
1 1 1   12   22   47 o  146.882   18.854   17.388   4.1409   17.623   5.6996   17.125   6.0264  144.429   26.768  141.318   28.837 3.110138 39.34584 
1 1 1   12   22   48 o   71.551   26.526   3.5709   3.8620   6.8778   5.6912   0.7483   5.2579   92.039   32.460   67.149   28.737 24.89032 43.35289 
1 1 1   12   22   49 o  146.271   18.755   17.358   4.1022   24.760   6.0025   10.872   5.6192  172.654   23.309  110.366   31.633 62.28883 39.29351 
1 1 1   12   22   50 o  204.247   23.547   34.739   7.2267   36.833   10.693   32.979   9.8046  200.128   36.243  190.260   34.956 9.868317 50.35329 
1 1 1   12   22   51 o  167.241   18.074   22.694   4.5531   24.616   6.2949   20.586   6.5937  170.163   24.906  152.528   29.308 17.63484 38.46122 
1 1 1   12   22   52 o  116.309   22.994   11.603   3.9485   10.219   5.5793   12.993   5.5889  104.946   31.903  118.844   30.555 -13.89860 44.17485 
1 1 1   12   22   53 o  101.582   26.854   9.3157   4.2388   18.873   6.7201   3.0010   5.4625  141.866   31.741   73.128   30.158 68.73750 43.78371 
1 1 1   12   22   54 o   94.634   33.236   8.4612   5.9619   21.308   9.3760  -0.2586   7.7247  139.912   41.083   72.261   32.672 67.65162 52.49030 
1 1 1   12   23    0 o  331.833   15.416   84.911   7.7913   84.911   7.7913   84.911   7.7913  331.833   15.416  331.833   15.416 0.000000 0.000000 
1 1 1   12   23    1 o  440.349   9.7751  148.537   6.5885  144.750   9.1278  152.656   9.5196  434.504   13.725  446.199   13.939 -11.69504 19.56155 
1 1 1   12   23    2 o  557.839   9.5436  238.365   8.1488  238.772   11.302  237.925   11.760  558.088   13.230  557.055   13.793 1.031921 19.11231 
1 1 1   12   23    3 o  725.202   9.8077  402.872   10.887  399.522   15.113  406.487   15.696  721.859   13.678  728.083   14.085 -6.224365 19.63318 
1 1 1   12   23    4 o  232.863   17.830   41.872   6.3070   41.872   6.3070   0.0000   0.0000  232.863   17.830  ?   ?  0.000000 17.83048 
1 1 1   12   23    5 o  531.804   9.3379  216.633   7.6010  216.633   7.6010   0.0000   0.0000  531.804   9.3379  ?   ?  0.000000 9.337935 
1 1 1   12   23    6 o  683.622   8.2198  357.909   8.6010  357.909   8.6010   0.0000   0.0000  683.622   8.2198  ?   ?  0.000000 8.219848 
1 1 1   12   23    7 o  803.398   10.320  494.524   12.691  476.509   17.237  515.849   18.754  788.224   14.287  820.034   14.941 -31.81018 20.67252 
1 1 1   12   23    8 o  375.631   10.901  108.124   6.2676  119.904   8.7508   95.716   8.9811  395.372   14.460  353.122   16.616 42.25000 22.02712 
1 1 1   12   23    9 o  257.494   11.072   50.812   4.3636   47.895   5.2331   57.467   7.9049  249.525   13.755  272.816   19.050 -23.29105 23.49679 
1 1 1   12   23   10 o  140.215   19.042   15.383   3.9811   13.628   4.7465   19.548   7.3110  130.890   24.595  156.171   31.668 -25.28134 40.09738 
1 1 1   12   23   11 o  533.102   8.5968  217.695   7.0148  212.924   8.5294  227.666   12.331  527.108   10.572  544.700   14.790 -17.59186 18.18005 
1 1 1   12   23   12 o  1021.73   9.6322  799.867   15.064  784.000   18.165  834.808   26.955  1011.26   11.735  1042.54   16.892 -31.28546 20.56852 
1 1 1   12   23   13 o  416.083   16.735  132.986   10.658   0.0000   0.0000  132.986   10.658  ?   ?   416.083   16.735 0.000000 16.73483 
1 1 1   12   23   14 o  704.841   10.495  380.793   11.322  375.522   15.619  386.628   16.435  699.446   14.589  709.634   15.131 -10.18781 21.01925 
1 1 1   12   23   15 o  1067.98   12.054  874.769   19.704  895.607   28.187  854.855   27.556  1079.46   17.060  1054.61   17.071 24.84766 24.13392 
1 1 1   12   23   16 o  476.108   11.389  173.832   8.2999  169.691   11.380  178.538   12.131  469.962   15.821  481.982   16.444 -12.01990 22.81874 
1 1 1   12   23   17 o  312.511   15.068   75.024   7.2076   68.676   10.063   81.711   10.328  297.529   22.258  324.926   20.878 -27.39743 30.51705 
1 1 1   12   23   18 o  577.138   9.0699  255.287   8.0122  251.529   9.5263  264.371   14.811  572.694   10.868  586.339   16.504 -13.64490 19.76045 
1 1 1   12   23   19 o  252.856   13.748   49.248   5.3010   50.528   6.1524   45.562   10.444  255.871   15.786  240.462   28.958 15.40857 32.98151 
1 1 1   12   23   20 o  473.977   8.2971  172.167   6.0194  171.752   8.1796  172.658   8.8901  473.128   11.295  474.269   12.246 -1.140564 16.65991 
1 1 1   12   23   21 o  436.880   8.5654  146.299   5.7277  156.416   7.9657  135.469   8.2417  451.448   11.528  419.993   12.820 31.45496 17.24112 
1 1 1   12   23   22 o  221.961   12.903   37.974   4.3647   38.997   5.9202   36.756   6.4605  224.304   17.379  217.337   19.632 6.966537 26.21969 
1 1 1   12   23   23 o  249.913   11.998   47.966   4.5896   50.999   6.1648   44.195   6.8743  256.894   15.754  238.529   18.986 18.36459 24.67106 
1 1 1   12   23   24 o  321.538   11.372   79.389   5.5966   81.475   6.7836   74.944   9.9040  325.497   13.616  310.481   20.963 15.01630 24.99675 
1 1 1   12   23   25 f  433.146   9.1021  143.913   6.0346  145.831   8.2325  141.685   8.8716  435.606   12.347  429.193   13.505 6.412750 18.29823 
1 1 1   12   23   26 o  160.792   17.782   20.207   4.3031   20.894   5.7799   19.353   6.4454  162.202   24.006  154.964   28.213 7.238022 37.04388 
1 1 1   12   23   27 o  499.159   8.7636  191.146   6.6956  192.217   9.2650  189.976   9.6872  500.008   12.106  496.964   12.735 3.044250 17.57090 
1 1 1   12   23   28 o   98.768   28.260   7.8574   4.4883   12.051   6.1512   3.0830   6.5637  121.240   32.489   84.297   33.676 36.94278 46.79340 
1 1 1   12   23   29 o  239.778   16.447   44.632   5.9999   47.610   6.9713   36.122   11.783  247.220   18.558  209.008   38.242 38.21184 42.50687 
1 1 1   12   23   30 o  103.819   43.510   2.8122   11.635   0.0000   0.0000   2.8122   11.635  ?   ?   103.819   43.510 0.000000 43.51025 
1 1 1   12   23   31 o  406.944   7.6631  127.047   4.7732  121.389   5.6187  141.719   9.0477  397.560   9.2334  428.635   13.790 -31.07468 16.59619 
1 1 1   12   23   32 o  277.548   9.8067   59.208   4.1661   58.840   4.8871   60.184   7.9692  276.457   11.549  277.620   18.866 -1.162872 22.12032 
1 1 1   12   23   33 o  339.339   8.3754   88.423   4.3502   90.054   5.0579   83.789   8.5272  342.264   9.6547  328.182   17.034 14.08221 19.57988 
1 1 1   12   23   34 o  500.745   7.7041  192.490   5.9048  192.010   7.0369  193.631   10.855  499.795   9.1986  500.401   14.173 -0.6064453 16.89629 
1 1 1   12   23   35 o  508.141   6.7139  198.103   5.2219  198.094   7.2478  198.114   7.5300  507.539   9.3297  507.468   9.6944 0.7147217E-01 13.45454 
1 1 1   12   23   36 o  222.112   9.3574   37.949   3.1812   34.036   4.3188   42.589   4.7037  209.346   13.551  234.360   13.166 -25.01492 18.89340 
1 1 1   12   23   37 o  268.137   8.7506   55.282   3.5914   51.211   5.0900   59.317   5.0680  257.042   12.979  277.195   11.945 -20.15326 17.63937 
1 1 1   12   23   38 o  492.702   10.869  187.211   8.1968  187.211   8.1968   0.0000   0.0000  492.702   10.869  ?   ?  0.000000 10.86900 
1 1 1   12   23   39 o   70.978   22.327   3.9628   2.7051  -0.2220   3.8409   8.0817   3.8106   56.240   24.320   98.792   25.138 -42.55172 34.97702 
1 1 1   12   23   40 o  403.504   7.5677  125.121   4.6739  129.562   6.6652  120.825   6.5560  409.780   10.627  395.662   10.825 14.11838 15.16957 
1 1 1   12   23   41 o   34.001   16.837  -7.4242   3.2730  -7.2685   3.5827  -8.2099   8.0480   36.842   18.124   64.461   30.541 -27.61918 35.51364 
1 1 1   12   23   42 o  313.575   10.499   75.927   5.0393   86.709   5.9743   49.338   9.3821  334.754   11.660  246.529   25.219 88.22404 27.78359 
1 1 1   12   23   43 o  201.341   11.527   31.477   3.5377   35.366   4.9431   27.394   5.0653  212.323   15.313  185.816   18.037 26.50665 23.66022 
1 1 1   12   23   44 o  135.826   21.191   14.997   4.2618   21.001   4.9937  -1.1018   8.1766  161.387   20.692   77.637   34.464 83.74954 40.19837 
1 1 1   12   23   45 o   85.669   28.949   5.8526   4.5094   0.5620   16.947   6.2557   4.6780  108.444   48.770   88.059   29.487 20.38486 56.99095 
1 1 1   12   23   46 o  222.595   13.160   38.744   4.4639   30.259   6.0025   49.242   6.6769  193.604   20.571  249.021   17.631 -55.41711 27.09300 
1 1 1   12   23   47 o  167.039   16.065   22.174   4.0567   32.541   6.0141   13.520   5.4949  200.843   19.822  124.674   29.292 76.16896 35.36860 
1 1 1   12   23   48 o  142.879   18.433   16.530   3.9373   6.0470   5.5617   27.061   5.5745   87.743   31.947  182.355   20.317 -94.61192 37.86010 
1 1 1   12   23   49 o  156.237   21.831   20.200   5.0780   2.2348   10.749   25.362   5.7614   91.200   40.039  175.251   21.960 -84.05056 45.66556 
1 1 1   12   23   50 o  218.807   13.819   37.822   4.6044   35.738   6.1534   40.474   6.9405  209.533   19.407  222.229   20.640 -12.69594 28.33085 
1 1 1   12   23   51 o  222.634   13.145   39.162   4.4596   41.476   6.4897   37.092   6.1385  225.390   18.988  213.052   19.024 12.33780 26.87882 
1 1 1   12   23   52 o  130.747   21.593   14.501   4.1705   1.2563   6.3269   24.678   5.5459   71.360   31.035  171.185   21.650 -99.82548 37.84074 
1 1 1   12   23   53 o   46.915   22.347  -4.5223   4.4255  -4.2710   8.5170  -4.6152   5.1796   68.216   32.041   51.528   24.439 16.68809 40.29750 
1 1 1   12   24    1 o  479.130   14.225  176.091   10.432  176.091   10.432   0.0000   0.0000  479.130   14.225  ?   ?  0.000000 14.22538 
1 1 1   12   24    2 o  698.341   13.637  374.017   14.576  374.017   14.576   0.0000   0.0000  698.341   13.637  ?   ?  0.000000 13.63665 
1 1 1   12   24    3 o   88.914   28.204   6.0000   4.3093   7.2817   5.5995   4.1383   6.7485   98.765   32.228   89.911   34.668 8.854034 47.33427 
1 1 1   12   24    4 o  617.600   9.7369  292.235   9.2044  270.677   12.113  321.688   14.159  594.099   13.321  647.565   14.285 -53.46619 19.53208 
1 1 1   12   24    5 o  804.782   10.286  496.294   12.670  479.238   17.168  516.696   18.776  790.386   14.191  820.587   14.949 -30.20099 20.61189 
1 1 1   12   24    6 o  294.468   9.6745   66.437   4.3605   66.542   5.1844   66.182   8.0614  294.633   11.496  292.942   18.067 1.690460 21.41425 
1 1 1   12   24    7 o  772.594   10.298  457.417   12.178  456.274   16.983  458.627   17.473  771.146   14.388  773.079   14.766 -1.933044 20.61698 
1 1 1   12   24    8 o  394.882   10.944  119.519   6.6146  104.469   8.9437  137.691   9.8277  368.875   15.840  423.544   15.159 -54.66867 21.92552 
1 1 1   12   24    9 o  213.297   15.742   35.121   5.1032   30.296   6.8917   40.978   7.5933  196.913   23.319  229.654   21.866 -32.74069 31.96667 
1 1 1   12   24   10 o  291.379   12.874   65.124   5.7418   69.345   7.8693   60.319   8.3967  299.918   17.214  279.307   19.768 20.61072 26.21294 
1 1 1   12   24   11 o  739.327   10.472  418.978   11.851  419.569   16.474  418.345   17.060  739.309   14.558  738.146   15.100 1.163025 20.97460 
1 1 1   12   24   12 o  224.620   15.832   38.948   5.4085   24.000   7.0059   60.996   8.5087  174.126   27.174  280.791   19.927 -106.6647 33.69728 
1 1 1   12   24   13 o  370.687   10.119  105.328   5.7416  100.486   6.9088  116.139   10.323  361.917   12.472  388.646   17.353 -26.72906 21.37014 
1 1 1   12   24   14 o  298.444   11.399   68.310   5.2069   63.908   6.1719   79.180   9.6983  288.514   13.976  320.012   19.898 -31.49826 24.31604 
1 1 1   12   24   15 o  743.232   11.148  423.658   12.682  420.604   18.063  426.627   17.810  739.722   15.954  745.068   15.617 -5.345642 22.32523 
1 1 1   12   24   16 o  690.229   9.0525  365.150   9.5638  361.291   11.685  372.981   16.647  686.313   11.123  696.573   15.613 -10.25940 19.17018 
1 1 1   12   24   17 o  310.137   11.354   73.793   5.3897   75.959   6.4161   68.601   9.9341  314.509   13.328  297.231   21.992 17.27789 25.71531 
1 1 1   12   24   18 o  334.849   10.936   86.017   5.6048   86.336   6.5783   85.175   10.706  335.316   12.817  331.442   21.215 3.874054 24.78595 
1 1 1   12   24   19 o  320.596   10.022   78.830   4.9178   85.175   6.5226   70.471   7.4862  333.023   12.796  302.165   16.246 30.85782 20.68027 
1 1 1   12   24   20 o  456.943   9.6730  160.135   6.7654  159.700   8.0081  161.221   12.644  456.125   11.470  457.281   18.065 -1.156586 21.39926 
1 1 1   12   24   21 o  370.328   10.834  105.255   6.1409  106.760   7.2828  101.551   11.423  372.762   12.764  361.824   20.712 10.93826 24.32919 
1 1 1   12   24   22 o  588.106   8.2604  265.161   7.4358  267.447   10.093  262.447   10.997  590.208   11.172  584.468   12.293 5.739319 16.61090 
1 1 1   12   24   23 o  203.245   15.936   32.023   4.9178   27.365   5.8875   42.776   8.9446  186.858   20.945  233.060   25.490 -46.20227 32.99141 
1 1 1   12   24   24 f  552.260   8.3886  233.886   7.0909  226.648   9.5063  242.965   10.647  543.177   11.434  562.210   12.372 -19.03314 16.84649 
1 1 1   12   24   25 o  413.518   9.1335  131.201   5.7810  127.563   7.7538  135.754   8.6745  407.302   12.437  420.001   13.494 -12.69879 18.35111 
1 1 1   12   24   26 o  240.098   13.341   44.508   4.8835   44.736   6.3556   44.180   7.6305  239.976   17.422  237.633   21.201 2.343750 27.44093 
1 1 1   12   24   27 o  225.487   16.379   39.475   5.6143   35.910   6.3488   52.263   12.024  214.339   19.567  255.259   31.440 -40.91986 37.03185 
1 1 1   12   24   28 o  192.160   16.420   28.743   4.7833   28.404   6.6249   29.112   6.9135  189.411   23.345  191.579   24.111 -2.168274 33.56049 
1 1 1   12   24   29 o  281.920   12.242   61.188   5.2825   60.276   7.3969   62.136   7.5466  278.441   17.444  282.700   17.527 -4.258545 24.72812 
1 1 1   12   24   30 o   91.734   29.433   6.5676   4.6826   4.7932   6.4775   8.5099   6.7772   89.571   34.105  105.255   35.490 -15.68309 49.22091 
1 1 1   12   24   31 o  375.994   8.6709  108.564   4.9902  111.096   6.1565  103.713   8.5205  380.036   10.584  366.205   15.201 13.83069 18.52258 
1 1 1   12   24   32 o  516.025   7.5451  204.357   5.9595  204.053   7.1222  205.066   10.883  515.331   9.0294  515.245   13.799 0.8636475E-01 16.49100 
1 1 1   12   24   33 o  359.006   8.3787   99.001   4.6042  100.829   5.3986   94.125   8.8176  362.071   9.7412  348.207   16.544 13.86432 19.19889 
1 1 1   12   24   34 o   39.976   18.507  -2.1788   2.6809  -3.7384   2.8971   7.1182   7.0734   37.800   18.026   99.550   36.061 -61.75013 40.31544 
1 1 1   12   24   35 o  102.085   21.406   8.4770   3.2379   12.305   3.6398  -6.0397   7.0880  123.944   19.856   63.346   29.584 60.59827 35.63018 
1 1 1   12   24   36 o  360.114   7.9946   99.636   4.4066   90.990   5.9133  110.435   6.6082  343.478   11.248  378.360   11.411 -34.88208 16.02221 
1 1 1   12   24   37 o  227.903   9.6101   39.989   3.3523   40.780   4.4008   38.894   5.1745  229.326   12.586  223.266   15.233 6.060242 19.75922 
1 1 1   12   24   38 o   46.167   19.771  -0.0241   2.4914   2.2001   3.3972  -2.6127   3.6649   63.522   24.568   47.396   21.834 16.12630 32.86832 
1 1 1   12   24   39 o  331.167   7.9523   84.316   4.0310   88.939   5.6648   79.573   5.7372  339.449   10.903  320.876   11.681 18.57281 15.97896 
1 1 1   12   24   40 o  220.647   12.750   37.842   4.2876   40.058   4.9625   31.314   8.5162  226.569   14.384  194.136   29.596 32.43327 32.90625 
1 1 1   12   24   41 o  101.639   19.856   8.4147   2.9783   10.238   4.2222   6.6088   4.2016  110.769   25.439   89.821   27.756 20.94802 37.65028 
1 1 1   12   24   42 o  141.590   14.884   15.793   3.1774   18.009   4.4290   13.443   4.5608  149.755   19.808  127.537   24.250 22.21855 31.31184 
1 1 1   12   24   43 o  320.577   15.383   80.327   7.5481   63.521   11.175   94.426   10.236  278.378   26.549  344.927   19.467 -66.54990 32.92153 
1 1 1   12   24   44 o  140.243   25.824   16.436   5.3391   45.119   19.031   13.986   5.5625  206.799   57.852  127.811   29.087 78.98760 64.75314 
1 1 1   12   24   45 o  116.822   21.284   11.233   3.6656   10.565   5.3693   11.815   5.0166  110.297   30.685  117.292   28.274 -6.994728 41.72498 
1 1 1   12   24   46 o   79.869   25.977   5.1932   3.6391   10.260   5.2687   0.5707   5.0323  108.356   30.485   65.464   28.068 42.89222 41.43841 
1 1 1   12   24   47 o  242.549   14.756   46.411   5.4522   55.134   6.8707   31.573   8.9602  263.086   17.156  189.615   32.013 73.47073 36.31979 
1 1 1   12   24   48 o  140.020   19.258   15.999   4.0181   20.184   5.9158   12.414   5.4746  153.952   26.033  118.146   30.168 35.80516 39.84753 
1 1 1   12   24   49 o  326.914   13.193   83.879   6.6014   45.722   11.253  103.902   8.1515  225.150   33.688  362.774   14.680 -137.6239 36.74751 
1 1 1   12   24   50 o  308.809   15.674   76.108   7.3841   71.307   11.137   79.873   9.8638  289.481   25.392  311.585   20.802 -22.10388 32.82492 
1 1 1   12   24   51 f  143.997   23.831   17.836   5.0687   31.915   13.575   15.556   5.4639  164.569   49.706  131.597   27.987 32.97180 57.04369 
1 1 1   12   24   52 o  106.730   27.696   10.416   4.5635  -6.8191   8.5826   17.209   5.3884   64.855   30.956  139.085   26.274 -74.23017 40.60283 
1 1 1   12   24   53 o   85.170   29.058   6.5416   4.5437   2.3925   5.6351   14.252   7.6818   71.007   30.046  116.672   37.725 -45.66508 48.22832 
1 1 1   12   25    0 o  705.617   14.150  382.016   15.268  382.016   15.268  382.016   15.268  705.617   14.150  705.617   14.150 0.000000 0.000000 
1 1 1   12   25    1 o  386.126   10.586  114.275   6.2567  108.045   8.7957  120.657   8.9019  375.145   15.318  396.487   14.669 -21.34195 21.20866 
1 1 1   12   25    2 o  216.130   14.874   36.025   4.8907   35.124   6.7576   37.016   7.0870  212.574   21.045  218.207   21.498 -5.633575 30.08468 
1 1 1   12   25    3 o  970.214   15.954  722.904   23.692   0.0000   0.0000  722.904   23.692  ?   ?   970.214   15.954 0.000000 15.95394 
1 1 1   12   25    4 o  229.805   21.701   41.035   7.5429   0.0000   0.0000   41.035   7.5429  ?   ?   229.805   21.701 0.000000 21.70118 
1 1 1   12   25    5 f  532.418   14.618  217.596   11.913   0.0000   0.0000  217.596   11.913  ?   ?   532.418   14.618 0.000000 14.61796 
1 1 1   12   25    6 o  609.750   10.619  285.002   9.9103  285.736   14.888  284.418   13.280  609.915   15.947  608.731   14.253 1.184631 21.38854 
1 1 1   12   25    7 o  634.669   8.4876  308.599   8.2452  309.652   10.302  306.724   13.751  635.562   10.590  632.133   14.212 3.429443 17.72433 
1 1 1   12   25    8 o  260.294   11.606   51.958   4.6238   48.734   5.7913   57.627   7.6793  251.461   15.117  273.085   18.481 -21.62398 23.87574 
1 1 1   12   25    9 o  442.547   9.1644  150.081   6.2078  150.604   7.7937  149.174   10.267  443.151   11.490  440.700   15.221 2.451172 19.07066 
1 1 1   12   25   10 o  626.848   10.159  301.223   9.7477  308.229   13.924  294.489   13.651  633.571   14.358  619.282   14.401 14.28943 20.33587 
1 1 1   12   25   11 o  214.407   16.673   35.556   5.4288   35.971   7.1280   34.983   8.3773  214.836   21.986  210.961   26.531 3.875412 34.45679 
1 1 1   12   25   12 o  958.698   9.5523  704.519   14.017  684.691   16.765  750.574   25.551  944.756   11.594  987.870   16.898 -43.11353 20.49303 
1 1 1   12   25   13 o  199.398   20.067   30.953   6.0414   21.016   8.4369   41.411   8.6549  160.907   35.232  230.007   24.986 -69.09978 43.19267 
1 1 1   12   25   14 o  653.488   11.156  327.598   11.158  326.676   16.027  328.464   15.545  651.744   16.066  653.628   15.538 -1.884460 22.35015 
1 1 1   12   25   15 o  481.917   9.3469  178.049   6.8946  176.274   8.3243  181.926   12.304  479.313   11.346  486.240   16.532 -6.927216 20.05130 
1 1 1   12   25   16 o  533.882   9.1246  218.517   7.4564  224.161   9.1217  207.149   12.945  540.518   11.025  518.824   16.300 21.69354 19.67896 
1 1 1   12   25   17 o   78.850   28.552   4.0399   4.4338   2.5698   5.2429   7.7307   8.3074   76.448   30.238  107.688   39.069 -31.23959 49.40352 
1 1 1   12   25   18 o  315.310   11.369   76.316   5.4868   77.921   6.5439   72.516   10.068  318.421   13.427  305.420   21.677 13.00134 25.49865 
1 1 1   12   25   19 o  349.372   11.183   93.700   5.9803   89.186   7.0551  105.221   11.272  340.613   13.532  368.459   20.062 -27.84561 24.19954 
1 1 1   12   25   20 o  521.503   8.3091  208.508   6.6326  216.243   9.3486  200.669   9.4115  530.656   11.510  511.109   12.030 19.54626 16.64932 
1 1 1   12   25   21 o   76.836   30.806   2.3423   5.5140   2.3423   5.5140   0.0000   0.0000   76.836   30.806  ?   ?  0.000000 30.80567 
1 1 1   12   25   22 o  586.661   11.356  264.367   10.197  264.367   10.197   0.0000   0.0000  586.661   11.356  ?   ?  0.000000 11.35575 
1 1 1   12   25   23 o  559.106   8.3726  239.743   7.1652  248.346   9.8584  230.110   10.432  568.550   11.328  547.056   12.459 21.49408 16.83891 
1 1 1   12   25   24 o  243.187   14.824   45.744   5.4914   46.237   6.2957   44.178   11.229  244.103   16.955  234.465   32.133 9.637848 36.33219 
1 1 1   12   25   25 o  451.940   10.515  156.902   7.2739  150.711   8.4016  175.432   14.535  442.610   12.401  475.569   19.968 -32.95956 23.50557 
1 1 1   12   25   26 o  412.896   9.3616  130.886   5.9165  119.872   7.9272  144.736   8.8895  394.542   13.127  433.478   13.398 -38.93658 18.75685 
1 1 1   12   25   27 f  217.730   14.782   36.749   4.8969   41.171   6.7973   31.977   7.0609  229.471   19.539  201.045   23.382 28.42625 30.47104 
1 1 1   12   25   28 o  187.889   17.022   27.553   4.8422   26.304   6.6497   28.963   7.0650  181.645   24.546  190.678   24.794 -9.032486 34.88860 
1 1 1   12   25   29 f  219.074   15.171   37.271   5.0559   44.170   7.2629   30.785   7.0425  237.321   20.186  196.796   23.868 40.52516 31.25957 
1 1 1   12   25   30 o  336.578   13.633   87.451   7.0234   78.427   12.070   92.070   8.6358  314.534   25.285  344.698   16.368 -30.16397 30.12085 
1 1 1   12   25   31 o  197.740   17.512   30.610   5.2455   38.975   7.4038   22.180   7.4328  221.957   22.086  164.070   30.727 57.88705 37.84095 
1 1 1   12   25   32 o  191.250   11.597   28.295   3.3789   29.413   3.8157   24.231   7.2728  194.770   12.872  172.225   28.592 22.54459 31.35564 
1 1 1   12   25   33 f  115.320   17.778   10.585   3.0372   15.171   3.3865  -8.2714   6.8671  138.872   16.238   58.335   27.801 80.53674 32.19616 
1 1 1   12   25   34 o  359.983   8.9576   99.641   4.9356   98.852   5.8585  101.572   9.1614  358.200   10.685  361.419   16.561 -3.218506 19.70891 
1 1 1   12   25   35 o  140.128   15.410   15.423   3.2506   13.955   3.5887   22.132   7.6724  132.536   18.168  162.605   31.966 -30.06946 36.76847 
1 1 1   12   25   36 o  221.255   11.814   37.909   3.9865   41.691   4.4222   21.505   9.2102  231.898   12.505  157.346   38.546 74.55194 40.52380 
1 1 1   12   25   37 o  330.542   7.9052   83.974   3.9996   83.140   5.4961   84.913   5.8312  328.258   10.939  331.602   11.489 -3.343781 15.86344 
1 1 1   12   25   38 o   51.636   22.076   0.0636   3.0968   0.9801   3.3890  -4.5749   7.6243   57.686   23.768   68.586   31.558 -10.89964 39.50706 
1 1 1   12   25   39 o  362.496   9.2521  101.221   5.1335  105.144   6.0618   91.272   9.6528  369.043   10.731  340.418   18.596 28.62479 21.47018 
1 1 1   12   25   40 o  196.512   10.912   29.926   3.2693   33.672   4.6573   26.287   4.5902  207.450   14.764  182.620   16.603 24.82973 22.21779 
1 1 1   12   25   41 o  124.201   16.554   12.276   3.0687   13.315   4.0891   10.936   4.6430  127.820   21.675  113.946   27.030 13.87383 34.64701 
1 1 1   12   25   42 o   75.709   23.712   4.6071   3.0550   0.5774   4.4651   8.1538   4.1890   62.777   26.664   98.396   26.998 -35.61980 37.94581 
1 1 1   12   25   43 o  141.358   25.005   16.606   5.2122   9.9104   17.393   17.267   5.4633  124.629   52.764  143.881   25.753 -19.25211 58.71358 
1 1 1   12   25   44 o   62.048   24.585   1.9472   3.4715   0.3510   4.9309   3.5159   4.8883   64.447   27.712   75.815   29.429 -11.36766 40.42324 
1 1 1   12   25   45 o   81.035   25.356   5.4189   3.4941   1.0344   4.8383   10.198   5.0515   65.949   27.870  108.275   29.622 -42.32639 40.67198 
1 1 1   12   25   46 o  165.611   15.587   21.795   3.9046   15.849   5.6082   27.389   5.4396  135.496   27.969  183.939   19.624 -48.44258 34.16616 
1 1 1   12   25   47 o  168.549   15.387   22.593   3.9257   23.390   5.7047   21.877   5.4107  167.910   22.785  162.557   22.336 5.353073 31.90701 
1 1 1   12   25   48 o   87.902   27.646   6.6404   4.1479   2.9747   5.9073   10.206   5.8256   76.460   31.427  106.171   32.662 -29.71066 45.32586 
1 1 1   12   25   49 o   43.641   21.027  -5.5718   4.1723  -2.9043   6.2139  -7.7619   5.6304   61.688   28.423   49.642   24.042 12.04602 37.22725 
1 1 1   12   25   50 f   65.126   27.538   1.4646   4.7281   4.9486   11.849   0.8047   5.1564   95.570   41.995   65.089   28.163 30.48146 50.56382 
1 1 1   12   25   51 o  170.542   19.064   24.084   4.8912   27.862   6.2635   18.179   7.8303  180.423   23.220  134.252   36.944 46.17064 43.63469 
1 1 1   12   25   52 o   68.449   27.676   2.8672   4.4915  -7.1571   5.5147   22.618   7.7409   49.093   23.780  152.283   34.063 -103.1900 41.54244 
1 1 1   12   26    0 o  298.974   16.679   69.194   7.5781   69.194   7.5781   69.194   7.5781  298.974   16.679  298.974   16.679 0.000000 0.000000 
1 1 1   12   26    1 o  731.843   10.199  410.578   11.424  414.298   16.265  406.957   16.049  734.535   14.467  728.008   14.403 6.526062 20.41438 
1 1 1   12   26    2 o  1000.36   11.446  767.483   17.526  753.492   24.330  782.573   25.268  990.202   16.053  1009.05   16.360 -18.84772 22.92045 
1 1 1   12   26    3 o  693.105   10.076  368.257   10.689  355.852   14.764  381.922   15.496  680.786   14.168  705.252   14.355 -24.46643 20.16959 
1 1 1   12   26    4 o  465.230   10.153  165.924   7.2297  167.244   10.061  164.515   10.396  466.714   14.084  462.826   14.675 3.888275 20.33977 
1 1 1   12   26    5 o  274.252   12.646   57.716   5.3085   46.427   6.9781   73.222   8.1787  244.880   18.760  308.054   17.417 -63.17424 25.59840 
1 1 1   12   26    6 o   58.089   24.486   0.2740   3.7196  -3.9300   4.6470   7.7702   6.2052   52.522   24.333  102.258   33.953 -49.73624 41.77219 
1 1 1   12   26    7 o  362.560   9.4841  100.757   5.2632  103.406   6.6144   96.186   8.6899  367.140   11.770  353.728   16.050 13.41125 19.90329 
1 1 1   12   26    8 o  205.963   13.989   32.727   4.3838   30.435   5.4760   36.818   7.3152  198.003   18.275  217.264   22.314 -19.26109 28.84247 
1 1 1   12   26    9 o  530.018   8.6783  215.288   7.0403  213.343   8.6881  219.008   12.015  527.424   10.762  533.891   14.703 -6.467102 18.22093 
1 1 1   12   26   10 o  625.605   8.8583  299.973   8.4824  291.835   10.442  315.759   14.544  616.806   11.061  641.003   14.824 -24.19720 18.49526 
1 1 1   12   26   11 f  236.789   23.229   43.764   8.3107   0.0000   0.0000   43.764   8.3107  ?   ?   236.789   23.229 0.000000 23.22925 
1 1 1   12   26   12 o  577.277   15.493  256.277   13.689   0.0000   0.0000  256.277   13.689  ?   ?   577.277   15.493 0.000000 15.49264 
1 1 1   12   26   13 o  653.519   10.644  327.635   10.647  316.888   14.327  340.888   15.911  642.044   14.579  665.696   15.615 -23.65118 21.36307 
1 1 1   12   26   14 o  377.963   10.099  109.574   5.8425  108.304   7.0823  112.280   10.337  375.561   12.320  381.723   17.692 -6.161682 21.55910 
1 1 1   12   26   15 o  840.602   9.2990  541.850   11.965  539.014   14.557  547.754   21.006  837.995   11.349  843.455   16.271 -5.460449 19.83763 
1 1 1   12   26   16 o  496.946   9.3349  189.392   7.1005  193.060   8.5543  181.267   12.732  501.514   11.144  484.974   17.152 16.53922 20.45387 
1 1 1   12   26   17 o  335.390   11.042   86.350   5.6685   91.700   6.8660   74.897   10.046  345.423   12.986  310.377   21.274 35.04562 24.92453 
1 1 1   12   26   18 o  242.820   13.907   45.498   5.1474   44.843   6.1443   47.039   9.4263  240.607   16.789  244.582   25.557 -3.975571 30.57837 
1 1 1   12   26   19 o  287.150   14.852   63.651   6.5056   63.651   6.5056   0.0000   0.0000  287.150   14.852  ?   ?  0.000000 14.85233 
1 1 1   12   26   20 o  609.928   9.2722  285.409   8.6563  290.108   10.491  275.383   15.322  614.592   11.152  597.457   16.755 17.13483 20.12728 
1 1 1   12   26   21 o  247.830   14.038   47.434   5.3033   49.794   6.1784   40.827   10.337  253.604   15.998  225.893   30.692 27.71120 34.61122 
1 1 1   12   26   22 o  232.538   14.920   41.844   5.2825   42.049   6.1782   41.289   10.186  232.633   17.478  227.239   30.021 5.393890 34.73812 
1 1 1   12   26   23 o  104.023   29.536   8.7511   4.9223   9.7757   5.7279   5.8578   9.6253  109.949   32.061  104.961   41.142 4.987846 52.15913 
1 1 1   12   26   24 f  216.396   16.207   36.369   5.3293   38.269   6.1828   30.879   10.512  221.549   18.399  193.432   36.849 28.11690 41.18686 
1 1 1   12   26   25 o  106.713   26.621   9.2904   4.3339   10.422   5.9097   7.9740   6.3748  113.031   32.453  102.384   34.421 10.64687 47.30744 
1 1 1   12   26   26 f  370.377   10.165  105.420   5.7624  103.818   7.8533  107.288   8.4815  366.879   13.985  372.772   14.865 -5.893005 20.40933 
1 1 1   12   26   27 o  176.364   18.269   24.389   4.8602   22.860   6.7567   26.029   6.9964  168.279   27.157  180.114   26.142 -11.83498 37.69440 
1 1 1   12   26   28 o  416.714   10.004  133.498   6.3811  126.528   8.9309  140.768   9.1205  404.708   14.417  427.001   13.955 -22.29276 20.06465 
1 1 1   12   26   29 o  197.605   19.540   30.713   5.8326   40.809   10.982   26.747   6.8836  223.030   33.181  182.574   25.314 40.45656 41.73474 
1 1 1   12   26   30 o  223.740   15.489   38.961   5.2719   41.833   7.5844   36.278   7.3330  230.050   21.799  213.785   22.760 16.26550 31.51527 
1 1 1   12   26   31 o  216.511   16.712   36.624   5.4956   32.012   7.8768   40.999   7.6712  199.230   26.487  227.404   22.327 -28.17334 34.64161 
1 1 1   12   26   32 o  343.858   13.397   91.407   7.0509  102.492   11.531   84.787   8.9110  360.936   20.962  329.479   17.735 31.45676 27.45787 
1 1 1   12   26   33 o  335.002   8.9668   86.296   4.5979   89.724   5.3460   76.558   9.0118  341.346   10.232  312.454   18.933 28.89145 21.52071 
1 1 1   12   26   34 o  460.326   8.1146  162.836   5.7174  166.579   6.7792  153.613   10.641  465.229   9.5202  444.640   15.635 20.58865 18.30503 
1 1 1   12   26   35 o  126.218   17.313   12.647   3.2566   14.634   3.4756  -1.6451   9.3210  135.991   17.074   82.940   36.808 53.05120 40.57533 
1 1 1   12   26   36 o  513.312   10.659  203.227   8.3745  203.325   12.004  203.133   11.689  511.321   15.338  511.289   14.936 0.3201294E-01 21.40886 
1 1 1   12   26   37 o   96.401   21.997   7.6358   3.1740   7.7197   3.4460   7.1667   8.1512   96.671   23.514  101.481   38.349 -4.810677 44.98434 
1 1 1   12   26   38 o  356.216   7.9455   97.579   4.3322   97.327   5.9696   97.858   6.2968  354.982   10.987  355.774   11.563 -0.7915039 15.95032 
1 1 1   12   26   39 o   50.642   21.120   0.5433   2.7221  -1.8429   3.7202   3.2929   3.9935   49.878   22.601   71.667   26.893 -21.78928 35.12933 
1 1 1   12   26   40 o  133.900   15.175   14.156   3.0551   15.106   4.0719   12.931   4.6213  136.904   20.024  124.761   25.070 12.14293 32.08515 
1 1 1   12   26   41 o  184.380   12.658   26.510   3.5507   23.405   4.5617   31.283   5.6557  171.682   17.609  198.225   18.868 -26.54291 25.80833 
1 1 1   12   26   42 o   54.412   24.905  -2.6370   4.6634  -4.2954   16.579  -2.4945   4.8597  101.109   46.527   56.103   25.580 45.00589 53.09559 
1 1 1   12   26   43 o  159.910   14.755   20.170   3.5707   26.930   5.0256   13.279   5.0742  183.679   18.111  124.882   27.307 58.79676 32.76684 
1 1 1   12   26   44 o  120.196   19.528   11.786   3.4693   8.6108   4.7694   15.355   5.0558   99.961   29.287  135.020   25.396 -35.05830 38.76411 
1 1 1   12   26   45 o   89.586   25.233   6.8275   3.6075   7.3589   5.0582   6.2774   5.1466   93.161   30.642   88.083   30.883 5.077377 43.50501 
1 1 1   12   26   46 o  242.990   12.432   46.221   4.6084   43.762   6.2671   49.117   6.7999  233.790   17.643  247.482   18.076 -13.69200 25.25925 
1 1 1   12   26   47 o  164.277   15.315   21.511   3.8066   18.628   5.3070   24.567   5.4632  148.479   24.184  172.713   21.105 -24.23409 32.09791 
1 1 1   12   26   48 o  243.819   17.009   47.804   6.3078   34.315   14.383   51.016   7.0187  173.690   50.851  250.892   18.405 -77.20242 54.07924 
1 1 1   12   26   49 o  243.309   16.084   47.571   5.9562   30.705   9.5632   58.260   7.6131  178.880   36.171  267.138   18.738 -88.25795 40.73622 
1 1 1   12   26   50 o  142.210   28.602   18.336   6.0100   22.299   8.8572   14.955   8.1818  147.691   38.711  120.260   38.939 27.43098 54.90659 
1 1 1   12   26   51 o   71.233   27.890   3.5832   4.4194   1.1154   5.4256   8.4487   7.6183   66.489   28.828   95.532   36.835 -29.04309 46.77509 
1 1 1   12   27    0 o  893.618   15.517  613.071   21.209  613.071   21.209  613.071   21.209  893.618   15.517  893.618   15.517 0.000000 0.000000 
1 1 1   12   27    1 o  862.317   10.797  570.323   14.251  576.177   20.355  564.695   19.958  865.766   15.361  857.132   15.212 8.633789 21.61847 
1 1 1   12   27    2 o  676.873   10.047  351.301   10.409  348.699   14.504  354.064   14.949  673.750   14.064  678.854   14.386 -5.104614 20.11883 
1 1 1   12   27    3 o  648.788   10.025  322.755   9.9550  330.441   14.181  315.288   13.978  655.852   14.127  640.616   14.255 15.23590 20.06930 
1 1 1   12   27    4 o  152.114   19.906   18.140   4.5236   15.699   6.1015   21.120   6.7409  139.518   29.494  162.677   28.087 -23.15956 40.72835 
1 1 1   12   27    5 o  385.041   10.827  113.721   6.3811  119.433   8.8307  107.480   9.2311  394.220   14.635  373.807   16.134 20.41351 21.78247 
1 1 1   12   27    6 o  626.569   8.4743  300.881   8.1272  287.679   9.8194  329.594   14.481  612.440   10.475  654.898   14.447 -42.45886 17.84463 
1 1 1   12   27    7 f  231.622   16.303   41.480   5.7430   38.672   8.8650   43.510   7.5389  221.681   26.661  236.469   21.049 -14.78888 33.96877 
1 1 1   12   27    8 o  304.655   13.794   71.312   6.4322   58.869   9.5709   81.561   8.6863  274.927   22.954  324.957   17.529 -50.02997 28.88143 
1 1 1   12   27    9 o  412.225   11.745  130.430   7.4107  120.845   10.913  138.633   10.095  396.009   18.004  424.525   15.536 -28.51608 23.78070 
1 1 1   12   27   10 o  342.237   10.308   89.847   5.3995   79.958   6.5569  110.680   9.5173  322.608   13.279  379.177   16.398 -56.56885 21.10049 
1 1 1   12   27   11 o  195.200   14.908   29.475   4.4205   28.406   5.4264   31.585   7.6216  190.995   18.806  200.161   25.453 -9.165634 31.64651 
1 1 1   12   27   12 o  602.152   8.9989  278.016   8.2941  275.027   10.199  283.853   14.252  598.607   11.131  607.354   15.331 -8.746155 18.94579 
1 1 1   12   27   13 o  290.693   13.922   64.973   6.1946   74.784   8.6421   54.606   8.8837  310.828   18.245  264.664   22.133 46.16434 28.68321 
1 1 1   12   27   14 o  1039.51   12.131  830.025   19.302  798.856   26.144  867.372   28.617  1018.10   16.777  1060.48   17.630 -42.37604 24.33654 
1 1 1   12   27   15 o   87.127   29.068   5.6349   4.5461   4.2563   5.5407   8.4751   7.9527   84.448   31.680  109.072   38.381 -24.62402 49.76670 
1 1 1   12   27   16 o  250.251   13.141   48.282   5.0158   46.954   5.9487   51.547   9.3290  246.363   15.860  256.467   24.046 -10.10480 28.80481 
1 1 1   12   27   17 o  212.371   15.663   34.939   5.0554   37.908   6.0712   28.225   9.1293  220.824   18.122  186.639   33.172 34.18456 37.79961 
1 1 1   12   27   18 o  469.671   11.652  169.493   8.3764  169.493   8.3764   0.0000   0.0000  469.671   11.652  ?   ?  0.000000 11.65189 
1 1 1   12   27   19 f  144.640   22.136   16.607   4.7448   20.973   5.5715   5.0813   9.0525  162.700   23.015  100.934   39.793 61.76645 45.96891 
1 1 1   12   27   20 o  355.065   11.180   96.873   6.0759   97.519   7.1814   95.245   11.397  355.969   13.180  349.581   21.403 6.387848 25.13621 
1 1 1   12   27   21 o  231.535   13.130   41.397   4.6340   37.187   6.2121   46.678   6.9581  218.359   18.769  244.833   18.709 -26.47403 26.50095 
1 1 1   12   27   22 o  121.633   23.500   11.916   4.2168   9.5103   5.7521   14.712   6.2002  108.568   32.258  133.858   30.889 -25.28990 44.66195 
1 1 1   12   27   23 f  283.375   11.394   61.755   4.9422   57.649   6.7498   66.500   7.2563  272.642   16.248  292.891   16.250 -20.24881 22.97939 
1 1 1   12   27   24 o  184.816   19.305   26.801   5.3804   34.127   6.3132   7.3580   10.285  208.604   20.018  110.827   42.781 97.77655 47.23263 
1 1 1   12   27   25 o  362.874   12.115  101.396   6.7290  100.867   7.8445  102.869   13.091  361.517   14.176  361.629   23.784 -0.1112976 27.68836 
1 1 1   12   27   26 o  136.221   23.064   14.908   4.6373   19.144   6.4064   10.245   6.7210  153.244   28.357  112.548   35.158 40.69582 45.16882 
1 1 1   12   27   27 o  220.906   18.070   38.163   6.0566   44.837   10.664   34.985   7.3586  235.320   30.311  209.948   23.292 25.37247 38.22602 
1 1 1   12   27   28 o  377.987   12.401  110.185   7.1745  118.963   13.025  106.362   8.5961  389.016   21.964  370.675   15.151 18.34189 26.68288 
1 1 1   12   27   29 o  299.064   13.849   69.142   6.3394   70.916   10.323   68.067   8.0327  299.582   22.680  295.241   17.859 4.340302 28.86739 
1 1 1   12   27   30 o  119.522   30.356   11.912   5.5640   7.0352   8.7360   15.241   7.2172  103.976   39.603  134.236   34.827 -30.25978 52.73813 
1 1 1   12   27   31 o  221.450   16.479   38.313   5.5456   27.470   7.7473   49.708   7.9416  183.378   28.529  250.950   20.864 -67.57143 35.34424 
1 1 1   12   27   32 o  491.434   10.141  185.972   7.6281  186.494   10.737  185.439   10.839  490.637   14.298  489.172   14.476 1.464203 20.34651 
1 1 1   12   27   33 o  111.358   30.463   10.376   5.3426   11.458   7.6110   9.3250   7.5013  117.311   37.511  108.573   37.329 8.738693 52.92010 
1 1 1   12   27   34 o  325.349   9.5021   81.492   4.7320   83.883   5.2706   71.556   10.745  329.885   10.438  299.482   23.632 30.40280 25.83487 
1 1 1   12   27   35 o  225.816   10.890   39.346   3.7639   37.441   4.2094   46.942   8.4066  219.639   12.573  242.325   22.938 -22.68628 26.15785 
1 1 1   12   27   36 f  124.805   18.024   12.434   3.3434   14.154   3.6968   4.7086   7.8350  133.126   18.655   92.516   36.847 40.60986 41.29974 
1 1 1   12   27   37 o  326.415   9.4437   82.100   4.7183   84.198   5.5235   76.436   9.0747  330.180   10.929  311.147   19.147 19.03259 22.04722 
1 1 1   12   27   38 o  124.194   18.595   12.375   3.4262   10.861   3.7639   19.698   8.2757  115.122   22.164  149.936   36.421 -34.81363 42.63530 
1 1 1   12   27   39 o  193.224   11.578   28.997   3.4084   27.424   4.6462   30.831   5.0155  186.501   16.444  197.729   16.729 -11.22786 23.45775 
1 1 1   12   27   40 o  176.392   13.680   24.352   3.6645   25.212   4.8029   23.154   5.6689  178.144   17.854  168.849   22.494 9.294708 28.71881 
1 1 1   12   27   41 o   61.087   25.951   0.5521   4.2307   5.4804   15.415   0.1506   4.3997  113.022   48.798   60.759   26.152 52.26307 55.36365 
1 1 1   12   27   42 o  267.969   23.530   58.494   9.5533   0.0000   0.0000   58.494   9.5533  ?   ?   267.969   23.530 0.000000 23.52993 
1 1 1   12   27   43 o  176.433   14.001   24.494   3.7499   27.476   5.3963   21.710   5.2146  184.707   19.376  163.075   21.409 21.63208 28.87484 
1 1 1   12   27   44 o  259.372   11.309   52.295   4.4898   56.543   6.3426   48.027   6.3566  267.453   15.561  245.657   17.010 21.79617 23.05383 
1 1 1   12   27   45 o  266.699   29.468   61.098   11.828   61.098   11.828   0.0000   0.0000  266.699   29.468  ?   ?  0.000000 29.46760 
1 1 1   12   27   46 o   99.249   23.819   8.4379   3.5723   6.2851   5.0972   10.516   5.0079   87.252   30.725  108.726   29.390 -21.47398 42.51818 
1 1 1   12   27   47 o  219.898   18.367   39.224   6.1254   14.362   14.400   44.717   6.7682  120.030   49.170  234.395   19.029 -114.3658 52.72372 
1 1 1   12   27   48 o  184.830   14.440   27.254   4.0528   28.723   5.7701   25.823   5.6936  185.987   20.616  175.570   21.645 10.41658 29.89187 
1 1 1   12   27   49 o   78.195   26.184   5.2372   3.6887   8.5343   5.4644   2.4770   4.9997   95.952   31.862   69.549   28.782 26.40284 42.93716 
1 1 1   12   27   50 o  161.949   19.461   21.870   4.7276   28.341   6.0093   11.361   7.6582  182.666   21.931  106.124   37.629 76.54115 43.55392 
1 1 1   12   28    0 o  512.433   14.309  201.879   11.203  201.879   11.203  201.879   11.203  512.433   14.309  512.433   14.309 0.000000 0.000000 
1 1 1   12   28    1 o  536.873   10.156  221.085   8.3458  213.078   11.551  229.831   12.072  526.475   14.334  546.764   14.425 -20.28906 20.33543 
1 1 1   12   28    2 o  629.537   10.132  303.990   9.7634  307.288   13.816  300.700   13.799  632.244   14.277  625.402   14.415 6.841248 20.28847 
1 1 1   12   28    3 o  735.420   10.462  414.916   11.776  428.510   16.861  401.969   16.455  746.480   14.757  722.966   14.870 23.51361 20.94935 
1 1 1   12   28    4 o  744.673   10.435  425.427   11.894  427.569   16.731  423.239   16.912  745.666   14.659  741.824   14.894 3.841980 20.89782 
1 1 1   12   28    5 o  770.904   10.520  455.958   12.413  456.556   17.358  455.333   17.758  770.489   14.719  769.362   15.080 1.126160 21.07235 
1 1 1   12   28    6 o  347.346   9.8439   92.540   5.2336   93.695   6.5624   90.521   8.6748  349.293   12.274  342.844   16.531 6.449127 20.58950 
1 1 1   12   28    7 o  334.779   13.104   86.118   6.7149   79.340   10.159   91.377   8.9481  319.692   20.876  344.382   16.975 -24.69055 26.90694 
1 1 1   12   28    8 o  314.145   10.626   75.730   5.1094   75.643   6.3832   75.886   8.5241  313.725   13.293  313.202   17.855 0.5232544 22.25964 
1 1 1   12   28    9 o  336.800   10.582   87.050   5.4552   84.299   6.6946   92.488   9.4112  331.183   13.206  345.843   17.839 -14.66000 22.19574 
1 1 1   12   28   10 o  361.564   10.152  100.306   5.6182  107.503   6.9935   87.208   9.4345  374.095   12.214  335.650   18.434 38.44504 22.11332 
1 1 1   12   28   11 o  385.910   10.052  114.271   5.9376  113.192   7.3304  116.327   10.125  383.817   12.478  388.430   17.030 -4.613068 21.11168 
1 1 1   12   28   12 o   76.394   27.895   3.7333   4.2447   1.8016   5.2357   7.4380   7.2507   73.373   29.806  103.166   36.611 -29.79333 47.20937 
1 1 1   12   28   13 o  426.114   9.8837  139.330   6.4464  138.882   7.8870  140.233   11.189  425.144   12.120  426.359   17.145 -1.214508 20.99615 
1 1 1   12   28   14 o  179.217   20.304   25.173   5.4715   26.701   7.4362   23.369   8.0793  182.976   27.394  169.665   32.291 13.31036 42.34528 
1 1 1   12   28   15 o  106.878   30.363   9.2139   5.2003   17.101   7.0472  -0.2153   7.7055  144.531   32.628   80.465   34.622 64.06580 47.57387 
1 1 1   12   28   16 o  281.404   19.819   61.618   8.4821   61.618   8.4821   0.0000   0.0000  281.404   19.819  ?   ?  0.000000 19.81922 
1 1 1   12   28   17 o  214.632   15.475   35.703   5.0497   37.900   5.8372   29.167   10.067  220.813   17.412  188.513   36.205 32.30009 40.17410 
1 1 1   12   28   18 o  153.739   20.484   18.647   4.7002   17.482   5.5124   21.750   8.9961  147.640   25.304  161.943   37.091 -14.30342 44.89977 
1 1 1   12   28   19 o   93.100   29.064   6.8021   4.5938   6.2115   5.3550   8.4478   8.9387   92.000   31.545  110.908   40.482 -18.90804 51.32130 
1 1 1   12   28   20 o  493.790   10.007  187.278   7.5638  188.305   9.0720  184.938   13.699  494.757   11.980  488.637   18.316 6.120453 21.88549 
1 1 1   12   28   21 o  412.138   10.821  130.570   6.8260  124.503   8.0059  146.727   13.064  402.054   13.009  434.702   19.634 -32.64825 23.55261 
1 1 1   12   28   22 o  655.916   11.723  331.060   11.770  331.060   11.770   0.0000   0.0000  655.916   11.723  ?   ?  0.000000 11.72331 
1 1 1   12   28   23 o  326.415   10.781   81.939   5.3863   78.514   7.3199   85.983   7.9544  318.798   15.001  333.494   15.583 -14.69666 21.62995 
1 1 1   12   28   24 o  578.468   8.6765  256.944   7.6824  249.317   10.588  265.423   11.164  568.912   12.159  586.916   12.428 -18.00372 17.38612 
1 1 1   12   28   25 o  348.205   10.675   93.286   5.6894  101.480   7.8464   84.201   8.2617  362.453   14.143  329.637   16.374 32.81616 21.63681 
1 1 1   12   28   26 o  332.507   17.719   86.155   8.9853   82.634   12.316   90.163   13.139  322.721   25.130  336.924   25.670 -14.20239 35.92327 
1 1 1   12   28   27 o  183.820   28.134   27.452   7.6639   25.223   9.5014   31.604   12.966  172.657   37.061  190.048   45.227 -17.39075 58.47219 
1 1 1   12   28   28 o  126.067   29.157   13.189   5.5140   16.875   8.5740   10.589   7.2006  140.549   38.651  113.950   36.491 26.59903 53.15530 
1 1 1   12   28   29 o   59.240   26.112  -1.0419   4.6138   4.9954   6.4426  -7.3979   6.6105   89.519   34.030   58.220   27.611 31.29917 43.82287 
1 1 1   12   28   30 o  100.974   30.215   8.3573   5.0334   11.223   7.0996   5.4615   7.1373  116.235   36.106   93.491   35.751 22.74428 50.81151 
1 1 1   12   28   31 o   65.451   28.030   0.1720   5.0087   4.6907   7.1448  -4.1946   7.0234   90.699   35.475   66.417   30.459 24.28249 46.75764 
1 1 1   12   28   32 o  301.215   13.630   70.260   6.2839   76.392   8.8762   64.099   8.8975  311.966   18.674  284.917   20.540 27.04980 27.76030 
1 1 1   12   28   33 o  167.616   24.055   22.728   5.9945   26.765   7.9302   17.346   9.1566  179.746   29.872  140.818   40.386 38.92847 50.23329 
1 1 1   12   28   34 o  133.245   28.528   14.839   5.6428   13.987   8.1598   15.620   7.8117  127.340   38.554  134.276   36.879 -6.935898 53.35200 
1 1 1   12   28   35 o   90.800   22.540   6.7941   3.1181   6.4927   3.4231   8.2629   7.5566   88.741   24.429  103.842   37.319 -15.10142 44.60364 
1 1 1   12   28   36 o   74.499   24.012   4.3614   3.1141   6.4724   3.4546  -4.7890   7.1926   88.531   24.607   65.675   30.372 22.85602 39.08950 
1 1 1   12   28   37 o  294.271   9.9264   66.802   4.4710   71.086   5.1705   54.102   8.9019  303.249   11.139  259.690   22.621 43.55957 25.21521 
1 1 1   12   28   38 o  251.152   11.888   48.856   4.5698   51.035   4.7665   24.065   16.074  256.630   12.135  157.247   54.611 99.38222 55.94271 
1 1 1   12   28   39 o   92.793   33.463   6.5575   6.0811   10.311   9.0079   3.4146   8.2430  112.306   40.692   89.043   36.911 23.26305 54.93915 
1 1 1   12   28   40 f  171.454   18.535   23.491   4.7869  -3.2997   15.368   26.369   5.0375   98.946   45.259  181.832   18.351 -82.88580 48.83780 
1 1 1   12   28   41 o  146.079   16.347   16.980   3.5925   19.676   5.1830   14.487   4.9840  154.914   22.518  131.191   25.739 23.72258 34.19904 
1 1 1   12   28   42 f  124.104   19.687   12.567   3.6149   17.234   5.1296   7.9631   5.0951  143.760   24.169   96.588   30.671 47.17157 39.04962 
1 1 1   12   28   43 o  233.512   19.730   43.988   6.9857   53.898   10.882   37.042   9.1107  251.769   28.754  207.807   29.469 43.96240 41.17320 
1 1 1   12   28   44 o  220.499   12.144   38.036   4.0828   36.948   5.5832   39.286   5.9858  215.040   17.104  221.387   17.815 -6.346542 24.69675 
1 1 1   12   28   45 o  158.805   19.919   20.655   4.7352   16.602   15.267   21.086   4.9808  127.714   51.240  160.001   20.832 -32.28687 55.31246 
1 1 1   12   28   46 o  102.747   29.120   9.4814   4.7891   0.4678   9.6623   12.417   5.5141   82.869   37.079  116.804   30.509 -33.93570 48.01712 
1 1 1   12   28   47 f  190.453   14.224   28.891   4.1165   37.483   6.1388   21.872   5.5489  213.961   18.940  160.379   23.285 53.58211 30.01547 
1 1 1   12   28   48 o   41.266   19.810  -4.5319   3.6262  -5.3575   5.2611  -3.7848   5.0049   50.895   24.277   52.361   24.584 -1.466034 34.55087 
1 1 1   12   28   49 o  108.836   26.339   10.688   4.3404   11.729   5.2359   8.4025   7.7606  111.831   29.977   95.824   37.113 16.00742 47.70770 
1 1 1   12   29    0 o  310.078   17.386   74.549   8.1921   74.549   8.1921   74.549   8.1921  310.078   17.386  310.078   17.386 0.000000 0.000000 
1 1 1   12   29    1 o  884.546   11.084  600.637   15.007  613.636   21.643  588.601   20.826  892.644   15.841  874.340   15.562 18.30334 22.20568 
1 1 1   12   29    2 o  247.690   14.118   47.338   5.3303   47.641   7.8390   47.077   7.2694  247.296   20.906  246.106   19.456 1.189850 28.55870 
1 1 1   12   29    3 o  408.341   10.964  127.998   6.8526  127.998   9.6504  127.998   9.7323  407.732   15.463  407.711   15.595 0.2099609E-01 21.96190 
1 1 1   12   29    4 o  322.135   12.181   79.717   6.0061   79.471   8.3592   79.980   8.6352  320.608   17.096  321.536   17.613 -0.9274292 24.54551 
1 1 1   12   29    5 o  424.007   10.962  138.015   7.1145  138.727   9.7963  137.221   10.349  424.516   15.076  422.047   16.021 2.468842 21.99920 
1 1 1   12   29    6 o  198.120   14.476   30.363   4.3595   34.206   5.4321   23.407   7.3073  209.942   17.052  170.808   28.986 39.13438 33.62974 
1 1 1   12   29    7 o  207.154   14.128   33.166   4.4530   31.150   5.4261   37.326   7.7929  200.120   17.904  217.992   23.739 -17.87297 29.73368 
1 1 1   12   29    8 o  671.095   11.147  345.831   11.451  347.946   17.038  344.088   15.463  671.787   16.570  668.465   15.113 3.321838 22.42678 
1 1 1   12   29    9 o   83.825   27.823   5.2365   4.1668   4.4521   5.1498   6.7236   7.0907   83.575   30.693   99.847   36.115 -16.27206 47.39561 
1 1 1   12   29   10 o  203.477   14.765   32.046   4.5671   34.257   5.7202   28.159   7.5851  209.863   17.981  188.059   27.136 21.80304 32.55307 
1 1 1   12   29   11 o  445.303   9.4833  152.154   6.4638  151.938   7.9952  152.562   10.982  444.677   11.747  444.803   16.131 -0.1261292 19.95466 
1 1 1   12   29   12 o  419.970   9.7792  135.367   6.2862  135.234   7.7621  135.621   10.716  419.448   12.090  419.220   16.700 0.2275391 20.61728 
1 1 1   12   29   13 o  270.509   15.228   56.577   6.2794   56.577   6.2794   0.0000   0.0000  270.509   15.228  ?   ?  0.000000 15.22789 
1 1 1   12   29   14 o  587.271   11.309  265.022   10.165  265.022   10.165   0.0000   0.0000  587.271   11.309  ?   ?  0.000000 11.30878 
1 1 1   12   29   15 o  339.602   11.289   88.634   5.8680   92.334   7.0725   80.460   10.512  346.331   13.342  321.115   21.512 25.21570 25.31323 
1 1 1   12   29   16 o  216.025   17.892   36.344   5.8630   36.404   7.7426   36.263   8.9766  214.753   23.963  213.103   28.214 1.650467 37.01703 
1 1 1   12   29   17 o  115.162   30.308   10.857   5.4150   13.506   7.0037   6.9194   8.5384  127.970   34.826  104.548   39.306 23.42165 52.51456 
1 1 1   12   29   18 o  305.868   12.473   72.011   5.8393   70.939   6.9640   74.549   10.716  303.195   15.006  308.337   22.869 -5.142365 27.35316 
1 1 1   12   29   19 o   78.870   29.271   3.9063   4.7052   1.5555   5.4253   11.040   9.4508   73.152   30.098  120.547   41.874 -47.39588 51.56833 
1 1 1   12   29   20 o  188.010   17.869   27.639   5.0804   26.804   5.8309   30.268   10.352  184.372   21.039  190.934   36.755 -6.562042 42.35065 
1 1 1   12   29   21 o  493.530   10.211  187.232   7.7135  179.893   9.0468  206.773   14.762  483.301   12.229  515.987   18.691 -32.68698 22.33667 
1 1 1   12   29   22 o  209.902   17.128   34.376   5.4549   35.697   6.3579   30.691   10.619  213.278   19.698  191.520   37.566 21.75826 42.41765 
1 1 1   12   29   23 o  417.085   9.6347  133.713   6.1508  134.877   8.4975  132.431   8.9146  418.084   13.279  414.069   14.066 4.014679 19.34344 
1 1 1   12   29   24 o   80.332   32.793   2.3598   6.3770   0.0000   0.0000   2.3598   6.3770  ?   ?    80.332   32.793 0.000000 32.79271 
1 1 1   12   29   25 o  396.596   14.536  121.679   8.8237   0.0000   0.0000  121.679   8.8237  ?   ?   396.596   14.536 0.000000 14.53568 
1 1 1   12   29   26 o  185.539   17.531   27.001   4.9195   30.583   6.9330   23.369   6.9818  195.738   23.618  169.318   27.912 26.42007 36.56391 
1 1 1   12   29   27 o  379.514   12.767  111.216   7.4164  109.565   8.5119  116.421   15.112  376.117   14.785  382.216   25.985 -6.099884 29.89696 
1 1 1   12   29   28 o  126.759   31.126   13.462   5.9950   10.388   6.7324   25.232   13.174  112.344   35.203  167.813   48.534 -55.46899 59.95695 
1 1 1   12   29   29 o  294.959   13.185   67.276   5.9527   68.382   8.2061   66.048   8.6482  295.460   18.235  289.835   19.609 5.624939 26.77749 
1 1 1   12   29   30 o  332.224   12.176   85.249   6.1916   88.026   8.6724   82.361   8.8426  335.762   16.929  324.379   17.879 11.38394 24.62207 
1 1 1   12   29   31 o  288.161   14.865   64.627   6.5342   67.262   8.4655   60.742   10.278  292.464   19.014  275.366   24.645 17.09769 31.12712 
1 1 1   12   29   32 o   80.389   31.011   3.8103   5.4016   1.1856   6.9737   7.7467   8.5402   78.789   33.386  104.739   39.323 -25.95083 51.58478 
1 1 1   12   29   33 o  170.537   21.709   23.332   5.5383   27.442   7.9372   19.432   7.7315  181.901   29.520  150.539   34.317 31.36272 45.26668 
1 1 1   12   29   34 o  315.787   13.783   77.400   6.6622   84.875   9.5319   70.262   9.3155  328.090   19.063  297.690   20.570 30.40002 28.04529 
1 1 1   12   29   35 o  108.067   32.815   9.8555   5.9050   7.6842   8.4316   11.946   8.2727  103.470   39.027  118.560   39.196 -15.08969 55.31183 
1 1 1   12   29   36 o  365.306   10.235  103.004   5.7227  105.710   6.0711   81.438   17.140  369.919   10.722  307.872   37.122 62.04642 38.63932 
1 1 1   12   29   37 o  118.436   20.760   11.424   3.6262   10.696   3.9796   14.982   8.8028  113.607   23.654  129.691   40.191 -16.08447 46.63527 
1 1 1   12   29   38 o  180.184   23.158   26.431   6.2390   30.555   8.9942   22.606   8.6618  189.033   32.242  159.870   36.235 29.16280 48.50251 
1 1 1   12   29   39 o  102.522   25.586   8.8799   4.0022   12.195   4.6104  -1.2584   8.0619  120.325   25.807   76.393   34.048 43.93137 42.72302 
1 1 1   12   29   40 o  140.028   19.422   15.865   4.0506   15.893   4.6874   15.784   8.0486  138.767   22.865  131.578   37.901 7.188675 44.26394 
1 1 1   12   29   41 o   82.077   24.621   5.6199   3.3392   5.3124   4.6400   5.9502   4.8092   82.658   29.292   86.141   29.873 -3.483360 41.83835 
1 1 1   12   29   42 o  236.926   11.310   43.638   4.1016   40.713   5.7294   46.713   5.8743  226.254   16.661  242.833   15.892 -16.57880 23.02512 
1 1 1   12   29   43 o  144.527   17.499   16.841   3.7922   22.488   5.9740   13.029   4.9078  163.628   24.615  122.780   26.862 40.84782 36.43446 
1 1 1   12   29   44 f  326.935   13.212   83.878   6.6113   74.342   16.782   85.630   7.1929  279.343   40.425  329.662   14.255 -50.31885 42.86503 
1 1 1   12   29   45 o   62.517   24.933   2.1426   3.5920   1.5087   4.9927   2.8227   5.1717   67.061   28.324   72.441   29.547 -5.380142 40.92980 
1 1 1   12   29   46 o  144.105   17.199   16.917   3.7186   21.172   5.4803   13.287   5.0624  157.657   23.422  121.788   27.773 35.86850 36.33080 
1 1 1   12   29   47 o  136.919   21.602   15.895   4.3771   15.404   5.1581   17.158   8.2733  131.648   26.515  129.228   38.753 2.419830 46.95526 
1 1 1   12   30    0 o  459.748   15.195  162.820   10.666  162.820   10.666  162.820   10.666  459.748   15.195  459.748   15.195 0.000000 0.000000 
1 1 1   12   30    1 o  249.947   14.101   48.232   5.3727   52.893   7.6711   43.745   7.5272  260.813   19.354  236.707   20.993 24.10616 28.55325 
1 1 1   12   30    2 o  312.979   12.446   75.298   5.9621   66.672   8.1426   85.269   8.7540  293.217   18.233  331.939   17.289 -38.72195 25.12711 
1 1 1   12   30    3 o  357.869   11.430   98.382   6.2610  101.457   8.9496   95.434   8.7622  362.750   16.119  351.792   16.273 10.95792 22.90430 
1 1 1   12   30    4 o  259.868   14.248   52.140   5.6456   39.519   7.5685   67.970   8.4766  224.569   22.314  295.925   18.812 -71.35608 29.18562 
1 1 1   12   30    5 o  116.995   23.409   11.007   4.0456   10.995   5.0333   11.030   6.7999  116.227   28.509  117.145   35.134 -0.9176254 45.24529 
1 1 1   12   30    6 o  310.529   10.763   74.052   5.1158   71.704   6.3635   78.342   8.6021  305.253   13.620  317.983   17.745 -12.73019 22.36890 
1 1 1   12   30    7 o  363.670   10.024  101.524   5.5796   93.484   6.7386  119.057   9.9507  348.664   12.627  392.798   16.551 -44.13467 20.81735 
1 1 1   12   30    8 o  521.338   11.484  208.850   9.1638  190.867   13.236  225.408   12.700  497.091   17.396  540.753   15.344 -43.66235 23.19588 
1 1 1   12   30    9 o  196.189   19.514   30.091   5.7820   17.091   8.5075   41.251   7.8823  143.642   38.078  229.237   22.766 -85.59564 44.36467 
1 1 1   12   30   10 f  410.492   9.9880  129.371   6.2755  131.779   7.7816  124.892   10.613  413.957   12.281  402.056   17.246 11.90106 21.17222 
1 1 1   12   30   11 o  308.423   14.002   73.270   6.6101   73.270   6.6101   0.0000   0.0000  308.423   14.002  ?   ?  0.000000 14.00196 
1 1 1   12   30   12 o  127.876   29.079   13.358   5.5630   13.358   5.5630   0.0000   0.0000  127.876   29.079  ?   ?  0.000000 29.07925 
1 1 1   12   30   13 o  329.955   11.106   83.677   5.6090   83.695   6.8968   83.641   9.6393  329.629   13.669  327.931   19.289 1.698669 23.64161 
1 1 1   12   30   14 o  234.575   14.132   42.564   5.0503   39.206   6.1025   49.863   8.9971  224.358   17.920  251.701   23.630 -27.34348 29.65613 
1 1 1   12   30   15 o   82.959   28.894   4.9196   4.5013   0.2167   5.3716   16.009   8.2485   68.464   29.167  138.656   37.819 -70.19170 47.75977 
1 1 1   12   30   16 o  362.369   11.164  100.978   6.1920   96.368   7.3649  112.092   11.436  353.591   13.608  379.368   19.763 -25.77664 23.99519 
1 1 1   12   30   17 o  453.406   10.492  158.025   7.2812  146.381   8.7775  183.714   13.038  435.835   13.158  486.976   17.491 -51.14063 21.88777 
1 1 1   12   30   18 o  228.853   18.428   40.899   6.4005   47.557   8.4379   31.877   9.8225  245.684   22.695  197.074   33.779 48.61017 40.69450 
1 1 1   12   30   19 o  150.745   27.377   18.459   6.0842   25.778   7.8421   7.3909   9.6433  177.986   29.842  108.696   41.559 69.29017 51.16336 
1 1 1   12   30   20 o  167.257   20.720   22.138   5.1910   22.007   6.0923   22.484   9.9168  165.610   24.797  162.542   40.106 3.067963 47.15263 
1 1 1   12   30   21 o  223.888   18.787   39.263   6.3787   39.717   8.0981   38.522   10.354  223.584   24.041  217.117   32.125 6.467163 40.12474 
1 1 1   12   30   22 o  254.337   18.105   50.549   7.0020   50.587   9.0858   50.493   10.988  252.569   23.783  250.145   29.250 2.423889 37.69867 
1 1 1   12   30   23 o  114.827   29.815   10.934   5.2865   14.588   9.6561   9.3699   6.3174  132.152   42.251  107.697   34.148 24.45503 54.32492 
1 1 1   12   30   24 o  301.179   11.748   69.926   5.4158   78.010   7.6061   61.613   7.7131  317.221   15.665  280.787   18.042 36.43417 23.89369 
1 1 1   12   30   25 o  140.517   22.960   15.910   4.7677   6.8801   6.4910   26.490   7.0257   97.112   34.621  181.072   26.104 -83.95955 43.35897 
1 1 1   12   30   26 o  381.864   10.777  112.333   6.2989  108.925   8.6474  116.186   9.1937  374.856   15.071  386.998   15.521 -12.14188 21.63421 
1 1 1   12   30   27 o   83.266   29.778   4.9222   4.8058   5.1615   6.6565   4.6616   6.9455   90.729   34.566   89.991   35.038 0.7379837 49.21916 
1 1 1   12   30   28 o  625.255   9.5405  300.861   9.1305  303.060   12.467  298.316   13.410  626.048   13.010  620.566   14.118 5.482605 19.19817 
1 1 1   12   30   29 o  335.320   14.781   87.252   7.5865   85.851   8.5332   92.535   16.572  331.524   16.872  335.193   32.718 -3.668579 36.81214 
1 1 1   12   30   30 o  347.568   16.470   94.118   8.7618   94.118   8.7618   0.0000   0.0000  347.568   16.470  ?   ?  0.000000 16.46965 
1 1 1   12   30   31 o  160.650   23.091   20.848   5.5148   28.875   7.7206   12.486   7.8801  187.613   27.720  121.178   38.105 66.43467 47.12088 
1 1 1   12   30   32 o  218.748   17.432   37.649   5.7882   40.419   8.0219   34.639   8.3603  224.176   23.740  205.802   27.207 18.37378 36.10804 
1 1 1   12   30   33 o  193.051   19.886   29.655   5.7921   24.596   8.1808   34.741   8.2017  170.288   32.574  206.182   26.609 -35.89473 42.06071 
1 1 1   12   30   34 o  357.472   15.869   99.746   8.6826  108.179   10.148   76.714   16.772  371.312   17.856  298.880   37.486 72.43204 41.52141 
1 1 1   12   30   35 f  140.268   35.226   17.199   7.5525   16.776   8.5979   18.626   15.803  137.266   39.057  143.701   53.582 -6.434235 66.30587 
1 1 1   12   30   36 o  131.338   30.995   14.821   6.1306   20.450   8.9809   9.9095   8.3893  151.017   38.682  110.238   39.353 40.77975 55.18074 
1 1 1   12   30   37 o   78.798   31.972   2.9528   6.0168  -5.4716   8.4381   11.666   8.5817   70.241   32.628  116.340   39.931 -46.09878 51.56597 
1 1 1   12   30   38 o  104.632   25.225   9.2428   3.9927   10.501   4.6285   5.5833   7.8939  110.936   27.416   93.661   37.085 17.27510 46.11850 
1 1 1   12   30   39 o  243.980   28.072   49.934   10.292   49.934   10.292   0.0000   0.0000  243.980   28.072  ?   ?  0.000000 28.07205 
1 1 1   12   30   40 o  113.710   24.197   10.912   4.0820   14.688   4.8046   1.1141   7.7395  132.176   24.655   79.671   34.487 52.50526 42.39416 
1 1 1   12   30   41 o  102.412   24.965   8.9601   3.8778   11.679   4.4232  -0.0710   8.0610  116.994   25.427   77.829   34.400 39.16486 42.77679 
1 1 1   12   30   42 o  135.999   22.704   15.448   4.5596   13.204   13.850   15.721   4.8288  120.871   48.694  136.593   23.970 -15.72198 54.27447 
1 1 1   12   30   43 o  247.503   14.376   48.465   5.4225   61.808   6.9415   27.575   8.6857  278.282   16.369  173.801   33.867 104.4811 37.61538 
1 1 1   12   30   44 o   58.382   24.202   1.2694   3.5439   1.9694   4.9210   0.5154   5.1077   68.246   28.424   64.408   27.948 3.838509 39.86270 
1 1 1   12   30   45 o  168.416   14.539   22.669   3.7112   26.195   5.3982   19.509   5.1103  177.788   20.195  151.653   22.715 26.13562 30.39429 
1 1 1   12   30   46 o   77.922   27.797   5.0344   4.1850   6.6425   4.9728   1.1299   7.7484   86.893   30.363   76.282   33.721 10.61102 45.37640 
1 1 1   12   31    0 o  419.893   16.122  136.092   10.327  136.092   10.327  136.092   10.327  419.893   16.122  419.893   16.122 0.000000 0.000000 
1 1 1   12   31    1 o  1029.30   12.057  814.633   18.996  846.102   27.754  786.903   26.054  1046.39   17.329  1009.37   16.863 37.01239 24.17988 
1 1 1   12   31    2 o  212.993   15.794   35.188   5.1125   36.865   7.2979   33.571   7.1643  216.638   22.329  206.451   23.066 10.18764 32.10316 
1 1 1   12   31    3 o  518.086   10.885  206.214   8.6316  206.773   12.138  205.643   12.277  517.811   15.314  516.338   15.535 1.472900 21.81411 
1 1 1   12   31    4 o  383.442   11.940  113.050   7.0079  118.680   9.8163  107.198   10.008  392.073   16.357  372.378   17.558 19.69568 23.99689 
1 1 1   12   31    5 o  406.568   9.7146  126.901   6.0454  123.788   7.4727  132.798   10.285  401.193   12.169  414.754   16.201 -13.56061 20.26185 
1 1 1   12   31    6 o  213.635   14.422   35.330   4.6883   32.728   5.6937   40.809   8.2620  204.844   18.354  227.509   24.092 -22.66516 30.28704 
1 1 1   12   31    7 f   96.964   27.988   7.5577   4.3850   9.2251   5.2818   3.8597   7.8658  106.772   30.688   92.411   36.883 14.36136 47.98007 
1 1 1   12   31    8 o  204.111   28.968   33.402   8.7963   33.402   8.7963   0.0000   0.0000  204.111   28.968  ?   ?  0.000000 28.96836 
1 1 1   12   31    9 o   96.277   37.548   4.9618   7.9864   4.9618   7.9864   0.0000   0.0000   96.277   37.548  ?   ?  0.000000 37.54828 
1 1 1   12   31   10 o  371.856   13.290  106.504   7.5643   98.822   10.994  113.410   10.423  356.147   20.252  382.757   17.792 -26.61008 26.95735 
1 1 1   12   31   11 o  293.357   12.209   66.227   5.4819   63.663   6.7471   71.208   9.4034  286.745   15.429  302.024   20.462 -15.27887 25.62719 
1 1 1   12   31   12 o  108.639   27.416   9.6453   4.5590   12.941   5.6260   3.3430   7.7803  125.513   29.740   90.232   36.446 35.28183 47.04010 
1 1 1   12   31   13 o  480.556   9.7590  177.400   7.1783  172.878   8.7050  187.008   12.689  473.940   12.000  491.578   16.865 -17.63882 20.69812 
1 1 1   12   31   14 o   75.655   28.600   3.3797   4.5347  -0.3212   5.4489   11.717   8.1785   67.186   29.010  120.807   38.912 -53.62089 48.53573 
1 1 1   12   31   15 o  239.102   14.331   44.283   5.2205   47.717   6.2239   36.131   9.5882  247.760   16.507  211.284   30.534 36.47647 34.71014 
1 1 1   12   31   16 o  120.925   29.968   12.068   5.5188   11.068   7.1569   13.534   8.6678  116.697   36.252  128.205   39.907 -11.50745 53.91429 
1 1 1   12   31   17 o  316.342   14.445   77.308   6.9942   71.076   9.0557   86.521   11.011  301.502   19.732  332.030   21.787 -30.52722 29.39442 
1 1 1   12   31   18 o  159.873   24.850   20.555   5.8835   20.385   7.4003   20.847   9.6998  156.984   31.886  156.325   40.286 0.6588135 51.37786 
1 1 1   12   31   19 o  400.783   13.246  123.975   8.1256  115.480   10.354  137.597   13.111  385.584   17.543  419.805   20.404 -34.22092 26.90905 
1 1 1   12   31   20 o  473.790   12.749  173.190   9.2456  190.020   12.578  153.409   13.636  494.892   16.605  443.270   20.098 51.62158 26.07039 
1 1 1   12   31   21 o  149.795   32.121   18.692   7.1438   20.273   10.071   17.091   10.135  153.332   41.776  141.495   42.995 11.83644 59.94841 
1 1 1   12   31   22 o  151.895   42.700   19.971   10.341   0.0000   0.0000   19.971   10.341  ?   ?   151.895   42.700 0.000000 42.70048 
1 1 1   12   31   23 o  260.500   15.968   52.845   6.3363   56.469   7.4559   43.425   12.022  268.620   18.242  228.323   35.559 40.29742 39.96497 
1 1 1   12   31   24 f  140.768   22.736   15.968   4.7319   17.818   6.3799   13.706   7.0547  146.703   29.436  127.320   35.079 19.38297 45.79282 
1 1 1   12   31   25 o  165.746   19.530   21.769   4.8596   17.172   6.5642   27.343   7.2289  143.405   30.822  183.637   26.484 -40.23209 40.63769 
1 1 1   12   31   26 o   76.669   29.188   3.5328   4.7442   1.7227   6.5633   5.5133   6.8654   78.719   32.809   92.636   35.150 -13.91682 48.08271 
1 1 1   12   31   27 o   75.841   29.152   3.3426   4.7609  -1.1510   6.4676   8.6577   7.0340   70.117   30.911  105.049   36.146 -34.93227 47.56036 
1 1 1   12   31   28 o  159.592   24.212   20.638   5.7289   26.963   7.3049   10.532   9.2335  181.694   27.095  115.786   41.290 65.90792 49.38649 
1 1 1   12   31   29 o   61.307   27.634  -2.2600   5.4767   0.6105   6.6722  -8.1881   9.5885   75.698   32.384   72.498   34.035 3.199524 46.97957 
1 1 1   12   31   30 o  118.897   33.622   12.044   6.3918   11.308   7.1992   14.786   13.891  115.751   36.425  134.445   50.215 -18.69387 62.03494 
1 1 1   12   31   31 o  152.720   30.605   19.643   6.9048   20.173   7.9014   17.929   14.203  153.132   34.534  142.657   51.175 10.47495 61.73688 
1 1 1   12   31   32 o   69.824   31.008  -1.4180   6.6251   4.0712   7.5061 -20.7714   14.094   89.110   35.866   76.546   37.292 12.56426 51.74024 
1 1 1   12   31   33 o  215.708   19.085   36.914   6.2362   40.212   8.5081   33.084   9.1674  222.270   25.468  198.441   31.213 23.82889 40.28438 
1 1 1   12   31   34 o   82.265   31.779   4.1842   5.6788   10.444   7.9910  -2.2027   8.0717  111.906   38.525   75.033   33.709 36.87360 51.19036 
1 1 1   12   31   35 o   88.011   32.725   5.5092   5.8864  -8.7734   8.1146   21.373   8.5520   63.523   30.259  155.334   36.575 -91.81088 47.46912 
1 1 1   12   31   36 o  233.742   18.033   43.359   6.4018   48.358   9.2633   38.788   8.8574  242.900   25.286  216.081   27.396 26.81892 37.28167 
1 1 1   12   31   37 o  103.322   35.086   9.0053   6.6240   4.1947   13.742   10.461   7.5603  105.958   45.910  110.159   37.483 -4.200470 59.26818 
1 1 1   12   31   38 o  221.573   14.333   38.586   4.8349   48.554   5.9898   19.946   8.1905  247.944   15.866  148.240   36.371 99.70372 39.68079 
1 1 1   12   31   39 o   72.737   26.652   3.7953   3.8796   10.083   4.5099 -14.1044   7.6091  108.115   27.259   53.444   26.315 54.67077 37.88850 
1 1 1   12   31   40 o   95.512   34.999   7.3812   6.6906   18.870   14.028   3.9983   7.6121  136.062   50.533   86.505   35.629 49.55669 61.83046 
1 1 1   12   31   41 o   78.302   33.155   2.2604   6.8686   0.4292   14.118   2.8283   7.8617   96.944   43.969   83.478   35.415 13.46578 56.45800 
1 1 1   12   31   42 o  263.658   27.646   59.779   10.991   59.779   10.991   0.0000   0.0000  263.658   27.646  ?   ?  0.000000 27.64633 
1 1 1   12   31   43 f   73.706   25.753   4.3639   3.5772   6.8746   4.7065   0.9297   5.5046   88.756   29.575   67.553   29.163 21.20341 41.53540 
1 1 1   12   31   44 f  201.821   12.945   32.228   3.9777   32.806   5.7040   31.681   5.5497  200.046   18.851  196.698   18.656 3.348831 26.52205 
1 1 1   12   31   45 o  305.737   20.864   77.754   9.7054   0.0000   0.0000   77.754   9.7054  ?   ?   305.737   20.864 0.000000 20.86389 
1 1 1   12   32    0 o  179.881   29.303   26.983   7.4254   26.983   7.4254   26.983   7.4254  179.881   29.303  179.881   29.303 0.000000 0.000000 
1 1 1   12   32    1 o  475.447   11.285  173.810   8.2123  172.514   11.729  175.055   11.502  472.500   16.218  476.088   15.784 -3.587494 22.63096 
1 1 1   12   32    2 o  407.225   11.720  127.557   7.3049  133.362   10.574  122.257   10.104  415.327   16.633  397.666   16.600 17.66098 23.49880 
1 1 1   12   32    3 o  241.899   22.065   45.947   8.0797   45.947   8.0797   0.0000   0.0000  241.899   22.065  ?   ?  0.000000 22.06472 
1 1 1   12   32    4 o  223.347   24.820   39.500   8.3414   39.500   8.3414   0.0000   0.0000  223.347   24.820  ?   ?  0.000000 24.81964 
1 1 1   12   32    5 o  272.804   15.573   57.661   6.4759   57.661   6.4759   0.0000   0.0000  272.804   15.573  ?   ?  0.000000 15.57331 
1 1 1   12   32    6 o  488.474   12.017  183.620   8.9850  183.620   8.9850   0.0000   0.0000  488.474   12.017  ?   ?  0.000000 12.01724 
1 1 1   12   32    7 o  167.665   17.962   22.023   4.5379   22.641   5.5261   20.743   7.9517  169.113   21.861  158.400   33.826 10.71259 40.27469 
1 1 1   12   32    8 o  203.874   20.070   32.611   6.1818   35.482   9.2103   30.258   8.3393  209.919   29.477  193.728   29.016 16.19148 41.36250 
1 1 1   12   32    9 o  333.915   14.325   86.036   7.3213   64.451   10.848  104.092   9.9216  285.597   25.070  366.500   17.686 -80.90314 30.68056 
1 1 1   12   32   10 o  226.381   25.441   40.724   8.6628   0.0000   0.0000   40.724   8.6628  ?   ?   226.381   25.441 0.000000 25.44098 
1 1 1   12   32   11 o  464.116   12.003  165.852   8.5268  158.962   11.672  173.738   12.487  453.054   16.831  473.509   17.229 -20.45535 24.08574 
1 1 1   12   32   12 o  187.355   20.706   27.675   5.8387   32.357   8.0422   22.456   8.4902  200.915   26.821  164.253   34.850 36.66212 43.97568 
1 1 1   12   32   13 o   94.215   32.387   6.6158   5.6467   7.8323   7.5463   5.0681   8.5119  104.246   37.312   97.901   38.590 6.344719 53.67799 
1 1 1   12   32   14 o  316.793   14.362   77.530   6.9638   71.980   9.3567   84.422   10.427  303.201   20.278  328.255   20.860 -25.05411 29.09235 
1 1 1   12   32   15 o  177.344   19.087   24.749   5.0995   25.061   6.0246   23.962   9.5773  177.485   22.697  168.320   38.066 9.165024 44.31846 
1 1 1   12   32   16 o  109.402   28.061   9.8613   4.7216   8.5094   5.5058   13.619   9.1790  102.723   31.778  128.477   41.207 -25.75371 52.03662 
1 1 1   12   32   17 o  341.955   11.757   90.103   6.1537   89.682   7.3357   91.104   11.305  340.655   14.069  340.389   21.813 0.2655945 25.95626 
1 1 1   12   32   18 o  306.765   13.063   72.642   6.1336   72.526   7.3408   72.912   11.164  305.536   15.750  303.290   24.251 2.245697 28.91696 
1 1 1   12   32   19 o  174.925   26.708   24.770   6.9243   26.296   9.5866   23.105   10.012  176.518   36.680  163.995   40.197 12.52245 54.41719 
1 1 1   12   32   20 o   96.755   36.299   6.1674   7.2745   7.0408   10.461   5.3495   10.123  109.077   42.849  103.456   41.647 5.621140 59.75380 
1 1 1   12   32   21 o   87.794   34.394   4.2149   6.7241   14.503   8.6024 -11.9433   10.781  130.858   39.578   73.469   34.964 57.38960 52.81020 
1 1 1   12   32   22 o  379.193   15.323  111.514   8.8934  113.315   11.733  109.080   13.635  379.878   20.251  370.711   24.162 9.167297 31.52615 
1 1 1   12   32   23 o  130.012   29.878   14.106   5.8210   14.624   6.7671   12.630   11.415  131.520   33.518  126.816   45.829 4.704033 56.77766 
1 1 1   12   32   24 o  420.384   12.142  136.458   7.8128  133.738   9.0564  144.374   15.448  415.481   14.241  426.497   23.758 -11.01599 27.69921 
1 1 1   12   32   25 o  148.479   23.073   17.802   5.0734   23.303   6.9405   11.489   7.4348  168.522   27.882  117.302   37.029 51.22013 46.35241 
1 1 1   12   32   26 o  310.746   12.819   74.690   6.0974   78.050   8.1741   70.476   9.1552  315.980   16.963  298.927   20.126 17.05270 26.32136 
1 1 1   12   32   27 o  154.536   24.899   19.457   5.6894   28.070   7.2200   5.3477   9.2409  185.719   26.121   99.425   39.874 86.29427 47.66765 
1 1 1   12   32   28 o  274.722   14.274   58.738   5.9814   62.289   8.1498   54.591   8.8063  281.128   19.052  261.748   22.190 19.38016 29.24651 
1 1 1   12   32   29 o  256.794   18.134   51.914   7.0820   47.060   8.2069   66.069   14.015  242.683   22.345  281.276   33.193 -38.59271 40.01285 
1 1 1   12   32   30 o  176.270   26.339   25.481   6.8884   30.458   8.0763   12.197   13.195  192.067   28.322  126.040   48.511 66.02695 56.17355 
1 1 1   12   32   31 o  172.479   23.408   24.120   6.0202   25.460   8.0785   22.447   9.0280  173.570   31.571  159.848   37.539 13.72253 49.05009 
1 1 1   12   32   32 o  156.719   31.522   20.926   7.2993   22.181   8.2558   16.433   15.624  159.871   34.731  138.224   52.886 21.64754 63.27104 
1 1 1   12   32   33 o  141.689   33.662   17.472   7.1922   21.637   8.3386   5.3721   14.214  157.076   35.516  111.219   47.414 45.85742 59.24089 
1 1 1   12   32   34 o  204.838   20.222   33.622   6.2576   26.080   8.8519   41.156   8.8473  172.840   34.666  223.505   26.369 -50.66435 43.55520 
1 1 1   12   32   35 o  141.975   28.789   17.179   6.0420   22.944   8.9380   12.329   8.1991  159.816   37.230  118.131   39.020 41.68477 53.93181 
1 1 1   12   32   36 o  119.746   34.767   12.779   6.7485   14.701   13.455   12.132   7.8006  128.077   49.061  116.642   38.037 11.43604 62.07925 
1 1 1   12   32   37 o  122.318   31.314   13.180   5.8877   18.080   9.0932   9.6434   7.7258  138.736   40.379  106.404   37.788 32.33205 55.30280 
1 1 1   12   32   38 o  104.156   35.543   9.4157   6.7980   15.087   12.993   7.2781   7.9770  126.835   48.300   98.015   37.721 28.82006 61.28407 
1 1 1   12   32   39 o  199.594   24.150   33.145   7.2278   45.778   14.343   28.845   8.3680  216.102   44.831  181.320   31.281 34.78140 54.66539 
1 1 1   12   32   40 o  190.104   15.000   28.703   4.3292   31.153   5.1136   22.502   8.1343  197.034   17.126  156.233   34.896 40.80058 38.87234 
1 1 1   12   32   41 o  189.446   36.424   33.687   10.178   33.687   10.178   0.0000   0.0000  189.446   36.424  ?   ?  0.000000 36.42369 
1 1 1   12   32   42 o  110.362   26.801   10.805   4.4822   11.499   4.9100   7.3382   10.979  113.069   28.407  100.034   42.113 13.03510 50.79776 
1 1 1   12   32   43 o   71.755   27.001   3.8142   4.0308   5.0048   4.7550   0.7738   7.5985   79.287   29.425   75.351   33.347 3.936043 44.47325 
1 1 1   12   33    2 o  115.187   35.353   10.776   6.8298   0.0000   0.0000   10.776   6.8298  ?   ?   115.187   35.353 0.000000 35.35319 
1 1 1   12   33    3 o  164.767   31.192   22.258   7.5785   0.0000   0.0000   22.258   7.5785  ?   ?   164.767   31.192 0.000000 31.19208 
1 1 1   12   33    4 o  458.971   16.595  163.103   11.658   0.0000   0.0000  163.103   11.658  ?   ?   458.971   16.595 0.000000 16.59482 
1 1 1   12   33    5 o   65.832   30.336  -4.9467   7.0807   0.0000   0.0000  -4.9467   7.0807  ?   ?    65.832   30.336 0.000000 30.33574 
1 1 1   12   33    6 o  327.895   14.066   82.990   7.0597   77.006   10.015   88.902   9.9533  313.556   20.988  337.567   19.344 -24.01105 28.54312 
1 1 1   12   33    7 o   69.553   27.596   2.1827   4.3794   5.2634   5.4414  -3.4823   7.3788   87.578   31.643   70.478   31.893 17.10013 44.92670 
1 1 1   12   33    8 o  310.313   15.161   74.453   7.2011   76.479   10.992   72.930   9.5310  311.583   23.215  305.185   20.523 6.397827 30.98598 
1 1 1   12   33    9 o  142.624   28.127   16.636   5.9221   14.682   9.2669   17.986   7.6994  132.850   41.248  146.564   34.834 -13.71387 53.98891 
1 1 1   12   33   10 o  318.491   14.819   78.421   7.2239   83.895   11.033   74.314   9.5572  326.678   22.197  308.024   20.386 18.65466 30.13848 
1 1 1   12   33   11 o  413.087   13.309  131.686   8.4151  140.233   12.694  124.986   11.240  424.250   19.548  400.958   18.314 23.29218 26.78709 
1 1 1   12   33   12 o   88.604   30.025   5.9139   4.8507   5.1853   5.8463   7.5236   8.6900   88.495   32.670  105.995   39.692 -17.49996 51.40812 
1 1 1   12   33   13 o  228.927   15.236   40.736   5.3083   42.388   6.4393   37.232   9.3777  232.786   18.218  214.374   29.350 18.41214 34.54433 
1 1 1   12   33   14 o  212.065   16.794   35.108   5.4066   29.813   6.3965   48.357   10.118  193.918   21.936  245.481   27.394 -51.56316 35.09466 
1 1 1   12   33   15 o  219.570   16.121   37.575   5.3802   34.606   6.3499   45.129   10.130  209.629   20.034  236.501   28.561 -26.87218 34.88688 
1 1 1   12   33   16 o  472.109   13.606  172.211   9.8319  161.691   13.830  182.961   13.980  455.032   19.856  484.514   18.851 -29.48264 27.37973 
1 1 1   12   33   17 o  440.308   14.235  149.969   9.5938  140.044   13.502  160.091   13.635  422.913   20.858  452.734   19.676 -29.82043 28.67381 
1 1 1   12   33   18 o  657.641   10.300  332.914   10.368  315.759   12.408  372.605   18.874  639.523   12.676  691.768   17.825 -52.24481 21.87283 
1 1 1   12   33   19 o  227.372   17.002   40.419   5.8744   33.530   6.9046   58.474   11.178  205.359   22.326  269.555   27.477 -64.19626 35.40428 
1 1 1   12   33   20 o  234.342   16.968   42.934   6.0451   45.981   7.1981   35.642   11.136  241.713   19.625  205.539   36.744 36.17316 41.65665 
1 1 1   12   33   21 o  252.499   16.599   49.792   6.3795   50.821   7.4990   47.096   12.137  254.176   19.422  237.993   34.309 16.18271 39.42486 
1 1 1   12   33   22 o  504.244   13.500  196.758   10.419  176.185   13.329  229.078   16.707  474.949   18.335  540.410   20.198 -65.46075 27.27873 
1 1 1   12   33   23 o  140.528   32.364   16.679   6.8176   13.647   8.3210   22.870   11.891  126.627   39.048  159.844   46.076 -33.21703 60.39697 
1 1 1   12   33   24 o   74.893   30.933   1.8218   5.7591  -0.1407   6.5833   8.2201   11.887   73.308   31.770  114.681   45.476 -41.37289 55.47465 
1 1 1   12   33   25 o  105.460   35.463   8.9384   6.7665   8.9384   6.7665   0.0000   0.0000  105.460   35.463  ?   ?  0.000000 35.46265 
1 1 1   12   33   26 o  228.775   22.295   41.792   7.7078   41.792   7.7078   0.0000   0.0000  228.775   22.295  ?   ?  0.000000 22.29497 
1 1 1   12   33   27 o  114.531   33.597   11.128   6.2730   14.442   7.1919   0.5868   12.826  129.392   35.323  100.013   43.826 29.37822 56.28893 
1 1 1   12   33   28 o  270.303   15.248   57.062   6.2828   50.892   8.6163   64.067   9.1809  252.217   22.557  283.833   21.288 -31.61603 31.01597 
1 1 1   12   33   29 o  243.137   16.697   46.428   6.1762   41.703   8.4832   51.758   9.0094  226.887   24.833  253.724   23.464 -26.83678 34.16505 
1 1 1   12   33   30 f  229.633   18.089   41.674   6.3064   47.818   8.9236   35.544   8.9137  243.101   24.308  206.937   28.933 36.16348 37.78848 
1 1 1   12   33   31 o  133.094   29.352   15.047   5.8188   14.051   8.0121   16.159   8.4647  126.187   38.203  134.570   38.899 -8.383743 54.52132 
1 1 1   12   33   32 o   93.438   32.306   6.9435   5.6224   3.2515   7.6067   11.389   8.3473   86.209   35.575  115.340   39.385 -29.13111 53.07288 
1 1 1   12   33   33 o  159.424   31.303   21.857   7.3658   22.751   8.5792   19.350   14.367  160.148   35.888  142.346   51.419 17.80101 62.70427 
1 1 1   12   33   34 o   84.965   37.638  -0.2677   9.7032 -20.4043   13.750   19.708   13.695   74.107   36.260  142.161   50.329 -68.05370 62.03119 
1 1 1   12   33   35 o  189.813   23.433   29.599   6.6636   40.948   10.484   21.905   8.6315  217.407   32.503  155.328   36.859 62.07861 49.14280 
1 1 1   12   33   36 o   70.143   31.089  -0.7294   6.6285   4.5929   11.921  -3.1114   7.9750  100.890   43.227   71.431   32.647 29.45901 54.16970 
1 1 1   12   33   37 o  103.543   35.730   9.3048   6.8757  -4.8263   12.691   15.177   8.1804   86.369   40.084  127.365   38.612 -40.99595 55.65566 
1 1 1   12   33   38 o  175.968   24.903   26.046   6.5202   26.736   9.5957   25.454   8.8870  168.777   38.053  166.223   35.974 2.554321 52.36540 
1 1 1   12   33   39 o  118.700   32.528   12.910   6.0851   19.967   9.3157   7.6579   8.0365  141.991   40.739   97.503   37.766 44.48820 55.55115 
1 1 1   12   33   40 o  230.251   22.732   44.248   7.9069   39.253   9.8041   53.543   13.373  209.079   31.624  237.239   38.119 -28.15974 49.52906 
1 1 1   12   33   41 o  154.687   21.659   20.073   4.9876   20.073   4.9876   0.0000   0.0000  154.687   21.659  ?   ?  0.000000 21.65908 
1 1 1   12   33   42 o   43.145   20.504  -3.8891   3.6819  -5.3687   4.2724   0.3811   7.2583   44.506   21.401   73.069   32.452 -28.56314 38.87321 
1 1 1   12   34    0 o   83.847   44.052   8.2050   7.4833   8.2050   7.4833   8.2050   7.4833   83.847   44.052   83.847   44.052 0.000000 0.000000 
1 1 1   12   34    1 o  245.416   16.211   46.856   6.0552   41.053   8.5879   52.592   8.5391  227.019   25.136  258.435   21.790 -31.41594 33.26636 
1 1 1   12   34    2 o  272.688   14.845   57.660   6.1727   61.646   8.7348   53.684   8.7242  280.363   20.497  261.032   22.042 19.33160 30.09878 
1 1 1   12   34    3 o  100.938   30.938   8.2104   5.2325   7.9914   7.6235   8.4055   7.1948  104.864   37.505  105.441   36.541 -0.5773621 52.36274 
1 1 1   12   34    4 o   92.371   31.603   6.3993   5.3747  -2.3322   7.4498   15.877   7.7618   73.251   32.683  137.334   36.355 -64.08260 48.88565 
1 1 1   12   34    5 o  390.745   10.734  117.490   6.4197  114.562   7.9186  123.104   10.966  385.254   13.429  398.012   18.000 -12.75876 22.45696 
1 1 1   12   34    6 o  302.786   12.212   70.665   5.6596   70.924   7.0921   70.210   9.3916  302.337   15.376  299.184   20.635 3.153198 25.73345 
1 1 1   12   34    7 o  231.833   14.463   41.705   5.1065   37.986   6.2860   48.921   8.7565  220.145   18.836  248.591   23.284 -28.44644 29.94943 
1 1 1   12   34    8 o  295.313   12.492   67.251   5.6467   58.668   6.9148   84.431   9.7829  274.571   16.530  328.552   19.542 -53.98157 25.59547 
1 1 1   12   34    9 o   95.774   33.198   6.8452   5.9387   9.8539   9.4589   4.8874   7.6300  115.481   41.721   93.827   36.671 21.65484 55.54605 
1 1 1   12   34   10 o  295.986   16.290   68.132   7.3515   69.947   11.111   66.719   9.8042  296.912   24.673  290.925   22.184 5.987366 33.17982 
1 1 1   12   34   11 o   83.796   32.850   3.7043   6.1371   10.494   9.7243  -0.7901   7.9117  118.018   42.343   79.045   34.535 38.97350 54.64035 
1 1 1   12   34   12 o  149.205   29.363   18.340   6.4671   16.668   9.2295   19.953   9.0644  139.808   40.677  152.824   38.708 -13.01526 56.15131 
1 1 1   12   34   13 o  176.023   20.215   24.517   5.3476   19.616   6.4661   35.124   9.5127  154.709   28.351  207.152   30.951 -52.44377 41.97255 
1 1 1   12   34   14 f  345.052   15.619   92.316   8.2493   92.356   12.014   92.281   11.347  341.796   23.099  342.262   21.774 -0.4667664 31.74360 
1 1 1   12   34   15 o  367.115   15.774  104.552   8.8638  103.622   12.797  105.410   12.289  361.971   23.219  365.664   22.061 -3.692291 32.02824 
1 1 1   12   34   16 o   80.887   30.971   3.8632   5.3605   2.6717   6.3383   6.8563   10.046   80.874   32.815  107.123   42.019 -26.24841 53.31433 
1 1 1   12   34   17 o  230.812   16.884   41.646   5.9233   36.624   6.8951   55.792   11.572  215.040   21.225  262.234   29.333 -47.19424 36.20697 
1 1 1   12   34   18 o   59.740   26.942  -2.2995   5.2148  -5.3499   6.1661   5.3618   9.7721   59.095   27.597  101.887   40.953 -42.79131 49.38408 
1 1 1   12   34   19 o  288.314   14.589   64.591   6.4174   59.645   7.5963   76.921   11.993  275.903   18.088  310.089   25.495 -34.18518 31.25925 
1 1 1   12   34   20 o  146.807   26.013   17.630   5.6313   12.020   6.5646   33.261   10.957  119.355   34.185  197.435   37.632 -78.07995 50.84089 
1 1 1   12   34   21 o  214.788   18.938   36.373   6.1624   33.352   7.1621   44.987   12.093  204.051   23.352  231.454   35.248 -27.40276 42.28190 
1 1 1   12   34   22 o  103.542   33.078   8.7573   5.9194   9.0724   6.9046   7.8831   11.499  106.351   35.822  112.786   44.727 -6.434547 57.30368 
1 1 1   12   34   23 o  195.336   26.966   31.122   7.8476   31.122   7.8476   0.0000   0.0000  195.336   26.966  ?   ?  0.000000 26.96643 
1 1 1   12   34   24 f  222.209   29.641   40.667   9.8301   40.667   9.8301   0.0000   0.0000  222.209   29.641  ?   ?  0.000000 29.64101 
1 1 1   12   34   25 o  159.040   32.453   21.444   7.6325   21.995   9.8587   20.621   12.058  157.489   40.629  150.682   47.096 6.806961 62.19937 
1 1 1   12   34   26 f  142.561   30.532   17.172   6.4616   16.003   7.4823   20.602   12.815  135.833   35.568  150.030   48.745 -14.19783 60.34227 
1 1 1   12   34   27 o  428.174   11.306  141.704   7.4094  150.812   10.355  132.149   10.606  439.880   15.380  411.015   16.859 28.86465 22.82047 
1 1 1   12   34   28 o  138.706   28.185   16.153   5.7799   24.451   8.0500   7.3237   8.3040  169.498   32.206  101.703   38.641 67.79530 50.30259 
1 1 1   12   34   29 o  250.409   16.399   49.286   6.2509   53.888   8.6203   44.183   9.0775  259.267   21.928  232.487   25.952 26.78050 33.97573 
1 1 1   12   34   30 o  234.875   17.501   43.608   6.2467   37.961   8.7460   49.490   8.9250  214.243   27.290  247.012   23.905 -32.76814 36.27961 
1 1 1   12   34   31 o  175.221   22.776   25.007   5.9642   20.549   8.5842   29.167   8.2926  151.398   37.289  185.480   30.253 -34.08156 48.01733 
1 1 1   12   34   32 o  235.143   17.896   43.926   6.3926   47.675   9.2718   40.529   8.8256  240.603   25.568  221.024   26.623 19.57866 36.91246 
1 1 1   12   34   33 o  187.549   27.666   29.599   7.7035   22.673   14.695   32.225   9.0462  149.283   52.194  193.248   31.681 -43.96553 61.05646 
1 1 1   12   34   34 o  180.946   27.650   27.681   7.4150   23.501   12.030   30.241   9.4163  153.749   46.872  184.636   34.590 -30.88692 58.25303 
1 1 1   12   34   35 f   74.542   33.058  -0.5509   7.5062  -6.8306   9.0727   13.073   13.363   69.940   32.920  122.062   48.276 -52.12207 58.43206 
1 1 1   12   34   36 o  127.679   37.678   15.280   7.8688   22.585   9.9434   3.0390   12.871  152.560   41.487   98.938   43.612 53.62201 60.19264 
1 1 1   12   34   37 o   56.906   26.815  -5.1274   6.0497  -9.4649   9.2876  -1.9306   7.9732   66.365   31.818   72.714   33.004 -6.348900 45.84338 
1 1 1   12   34   38 o   61.486   28.097  -2.3342   5.9043  -2.1349   8.8074  -2.4970   7.9570   75.210   34.349   71.047   32.523 4.163254 47.30300 
1 1 1   12   34   39 o  124.143   35.236   14.736   7.0067   12.899   8.9002   17.731   11.363  114.464   40.568  128.573   45.809 -14.10913 61.19038 
1 1 1   12   34   40 o  157.293   18.291   20.265   4.3215   20.669   5.1261   19.272   8.0351  156.689   21.978  140.092   36.943 16.59747 42.98640 
1 1 1   12   35    0 o   66.263   40.349   3.4136   7.6864   3.4136   7.6864   3.4136   7.6864   66.263   40.349   66.263   40.349 0.000000 0.000000 
1 1 1   12   35    1 o  175.476   22.010   24.485   5.7816   17.920   7.8492   32.272   8.5483  145.738   35.513  199.433   28.841 -53.69479 45.74871 
1 1 1   12   35    2 o  378.541   13.135  110.618   7.6107  111.339   10.884  109.927   10.647  378.066   18.808  375.765   18.511 2.301453 26.38912 
1 1 1   12   35    3 o  359.422   13.074   99.722   7.1928  116.327   10.436   84.695   9.9274  386.842   17.625  328.853   19.815 57.98898 26.51930 
1 1 1   12   35    4 o  158.433   20.752   19.941   4.9114   22.011   6.3935   16.960   7.6714  164.918   26.205  141.739   35.451 23.17844 44.08455 
1 1 1   12   35    5 o  103.471   28.120   8.8091   4.5698   8.1540   5.6625   10.033   7.7389  101.084   32.359  112.635   37.925 -11.55159 49.85380 
1 1 1   12   35    6 o  215.455   15.828   36.173   5.1834   38.467   6.5869   32.442   8.4002  221.172   19.662  200.098   28.210 21.07449 34.38597 
1 1 1   12   35    7 o  377.319   11.109  109.661   6.4160  119.136   8.1322   94.041   10.442  392.673   13.530  346.484   19.771 46.18860 23.95750 
1 1 1   12   35    8 o  157.003   21.213   19.636   4.9673   15.398   6.1340   27.708   8.4665  136.147   30.223  183.408   31.281 -47.26071 43.49666 
1 1 1   12   35    9 o   70.628   30.836  -0.7203   6.2980  -1.3412   9.4140  -0.2173   8.4735   84.676   37.313   82.923   35.990 1.752762 51.84177 
1 1 1   12   35   10 o   66.280   29.574  -1.9559   6.1008   5.6714   9.4800  -7.3476   7.9705  102.202   40.585   66.166   31.052 36.03622 51.10169 
1 1 1   12   35   11 o  354.740   15.425   97.564   8.3753  104.469   12.608   92.111   11.205  363.681   22.764  341.987   21.515 21.69406 31.32224 
1 1 1   12   35   12 o  379.732   15.057  111.751   8.7518  116.045   12.949  108.139   11.875  383.600   22.148  370.814   21.008 12.78571 30.52639 
1 1 1   12   35   13 o  545.225   13.126  229.732   10.954  209.973   15.364  250.160   15.622  518.303   19.366  566.529   18.015 -48.22614 26.44986 
1 1 1   12   35   14 o  195.482   19.198   30.136   5.6701   34.106   6.9633   22.324   9.7683  207.039   22.326  160.583   39.915 46.45686 45.73478 
1 1 1   12   35   15 o  125.619   28.666   13.124   5.3901   10.829   6.5356   18.004   9.5315  114.056   34.498  144.061   41.169 -30.00484 53.71199 
1 1 1   12   35   16 o  193.910   19.406   29.702   5.6825   28.963   6.7752   31.454   10.435  189.985   23.823  192.478   36.759 -2.492783 43.80326 
1 1 1   12   35   17 o  223.758   17.663   39.283   6.0002   40.268   7.1103   36.846   11.183  225.498   20.836  208.758   36.318 16.73975 41.87023 
1 1 1   12   35   18 f  169.437   23.175   23.092   5.8529   25.091   7.0063   18.475   10.647  175.317   26.974  144.959   44.074 30.35832 51.67337 
1 1 1   12   35   19 o   74.024   30.586   1.7522   5.6334  -1.1370   6.5914   9.5810   10.850   70.760   31.199  115.994   44.146 -45.23383 54.05832 
1 1 1   12   35   20 o   88.297   32.444   5.4189   5.7551   0.4590   6.7452   18.691   11.034   75.700   32.477  145.204   44.997 -69.50380 55.49333 
1 1 1   12   35   21 o  212.217   23.830   36.199   7.6067   36.199   7.6067   0.0000   0.0000  212.217   23.830  ?   ?  0.000000 23.82959 
1 1 1   12   35   22 o  149.296   33.223   18.997   7.3963   18.997   7.3963   0.0000   0.0000  149.296   33.223  ?   ?  0.000000 33.22257 
1 1 1   12   35   23 f  238.657   18.564   44.930   6.7278   45.057   7.9623   44.611   12.579  237.517   22.157  228.069   37.326 9.447510 43.40720 
1 1 1   12   35   24 o   85.553   33.229   4.3843   6.2350   4.6495   7.3714   3.7176   11.688   90.576   35.845  102.398   43.298 -11.82207 56.20996 
1 1 1   12   35   25 o  263.943   21.937   55.663   8.7822   65.251   11.619   42.889   13.413  282.834   27.174  220.040   41.342 62.79369 49.47316 
1 1 1   12   35   26 o  172.435   32.141   25.282   8.1710   18.437   10.359   36.555   13.294  142.540   43.502  199.992   44.568 -57.45181 62.27953 
1 1 1   12   35   27 o  334.121   15.732   87.252   8.0457   83.026   9.3329   99.480   15.877  323.940   18.905  346.173   30.268 -22.23276 35.68655 
1 1 1   12   35   28 o  211.304   18.489   35.469   5.9196   42.458   8.3350   28.356   8.4087  228.487   24.201  182.698   31.189 45.78902 39.47731 
1 1 1   12   35   29 o  174.257   23.288   24.796   6.0561   20.956   8.2479   29.289   8.9210  153.808   35.719  184.402   32.809 -30.59483 48.50026 
1 1 1   12   35   30 o  123.032   31.750   13.222   6.0193   8.9509   8.4010   17.728   8.6289  105.850   39.146  139.295   38.951 -33.44448 55.22353 
1 1 1   12   35   31 o  342.396   19.149   93.485   9.9952   0.0000   0.0000   93.485   9.9952  ?   ?   342.396   19.149 0.000000 19.14854 
1 1 1   12   35   32 o   99.915   38.066   7.6053   8.0725   0.0000   0.0000   7.6053   8.0725  ?   ?    99.915   38.066 0.000000 38.06598 
1 1 1   12   35   33 o  126.031   31.486   14.050   6.0563   4.6677   8.7623   22.632   8.3803   92.408   38.161  158.226   35.479 -65.81857 52.10535 
1 1 1   12   35   34 o   80.633   32.294   3.8322   6.0527   0.1775   8.8180   7.0882   8.3230   81.234   35.938   97.711   38.269 -16.47668 52.49830 
1 1 1   12   35   35 o  216.796   19.693   38.149   6.4636   30.719   9.2518   45.233   9.0338  184.429   34.028  231.577   25.931 -47.14784 42.78216 
1 1 1   12   35   36 o   93.712   35.422   7.1286   6.9555   10.148   8.6167   1.4823   11.784  106.353   39.583   91.694   40.994 14.65883 56.98530 
1 1 1   12   35   37 o  160.880   30.052   23.105   7.1282   33.247   9.3808   9.2488   10.965  190.721   33.349  105.435   43.016 85.28619 54.42881 
1 1 1   12   35   38 o  309.529   17.451   77.325   8.2341   65.184   10.013  102.680   14.471  278.077   23.753  343.792   27.736 -65.71518 36.51697 
1 1 1   12   35   39 o   69.970   29.883   1.6234   5.6641   2.0179   8.3853   1.2925   7.6814   81.019   35.471   76.970   33.817 4.049454 49.00830 
1 1 1   12   36    0 o  309.645   21.356   75.312   10.011   75.312   10.011   75.312   10.011  309.645   21.356  309.645   21.356 0.000000 0.000000 
1 1 1   12   36    1 o  101.131   32.960   8.1306   5.8574  -5.2752   8.2107   22.023   8.3584   71.032   32.708  161.675   34.806 -90.64324 47.76250 
1 1 1   12   36    2 o   79.583   30.847   3.5210   5.3644   6.9853   7.3506  -0.4263   7.8464   99.879   36.672   79.397   34.547 20.48135 50.38127 
1 1 1   12   36    3 o  124.725   30.642   12.986   5.8077   12.395   7.9932   13.647   8.4527  122.104   38.374  127.428   39.366 -5.324310 54.97514 
1 1 1   12   36    4 o  406.746   11.031  127.465   6.8678  121.542   8.4136  139.292   11.889  396.418   13.866  422.706   18.375 -26.28714 23.02012 
1 1 1   12   36    5 o  314.923   12.529   76.562   6.0394   80.481   7.5628   69.665   10.034  322.190   15.336  296.896   22.241 25.29370 27.01570 
1 1 1   12   36    6 o  207.583   16.640   33.693   5.2427   39.182   6.4723   23.218   8.9407  223.226   19.128  165.384   36.313 57.84138 41.04302 
1 1 1   12   36    7 o  233.346   15.314   42.397   5.4392   47.812   6.6473   31.425   9.4622  247.173   17.687  194.549   32.952 52.62474 37.39874 
1 1 1   12   36    8 o  230.806   15.614   41.517   5.4836   46.584   6.8670   32.602   9.1097  243.668   18.551  199.086   30.896 44.58234 36.03768 
1 1 1   12   36    9 o  204.679   21.787   33.278   6.7206   29.223   9.9376   36.696   9.1232  185.880   36.230  212.288   28.822 -26.40771 46.29669 
1 1 1   12   36   10 o  148.999   29.104   18.364   6.3995   19.661   9.6243   17.336   8.5680  150.445   40.776  141.975   38.470 8.470505 56.05896 
1 1 1   12   36   11 o  209.058   22.392   34.796   7.0538   42.013   10.919   29.628   9.2407  225.435   32.591  188.395   33.262 37.04062 46.56725 
1 1 1   12   36   12 o  122.944   35.149   12.784   6.9463   19.002   10.560   8.0413   9.2227  147.286   43.694  108.038   40.800 39.24832 59.78120 
1 1 1   12   36   13 o  108.891   35.909   9.5944   6.9450   1.7016   10.077   16.734   9.5844   93.576   39.909  138.943   41.721 -45.36680 57.73516 
1 1 1   12   36   14 o  108.488   30.998   9.8143   5.4041   12.668   6.5430   3.6903   9.5857  122.311   33.817   96.498   39.887 25.81271 52.29291 
1 1 1   12   36   15 o   65.173   28.536  -0.7419   5.4282  -5.6568   6.6185   9.3570   9.4873   61.137   28.565  112.513   41.602 -51.37614 50.46479 
1 1 1   12   36   16 o  309.866   14.120   74.440   6.6972   78.829   8.1013   64.968   11.902  317.633   16.722  283.135   27.824 34.49850 32.46229 
1 1 1   12   36   17 o  157.887   24.958   20.288   5.8311   20.008   6.9000   20.988   10.906  154.778   30.210  153.397   44.100 1.381073 53.45523 
1 1 1   12   36   18 o  194.739   21.370   30.249   6.2651   24.219   7.3082   46.964   12.168  171.104   28.937  236.341   34.667 -65.23761 45.15664 
1 1 1   12   36   19 o  164.958   29.822   22.673   7.2526   22.673   7.2526   0.0000   0.0000  164.958   29.822  ?   ?  0.000000 29.82215 
1 1 1   12   36   20 o  263.182   20.527   54.909   8.2036   54.909   8.2036   0.0000   0.0000  263.182   20.527  ?   ?  0.000000 20.52701 
1 1 1   12   36   21 o  190.153   23.352   29.162   6.6539   25.441   7.8972   38.268   12.354  174.258   30.731  209.042   40.070 -34.78351 50.49765 
1 1 1   12   36   22 o  430.846   12.821  143.859   8.4549  132.576   9.9110  174.020   16.204  412.320   15.704  467.726   22.634 -55.40570 27.54870 
1 1 1   12   36   23 o  192.582   22.978   29.938   6.6396   29.504   7.6888   31.209   13.166  189.194   27.345  183.262   46.779 5.931107 54.18521 
1 1 1   12   36   24 o  100.765   34.727   8.1552   6.4939   12.018   7.5499  -2.8301   12.731  118.024   37.321   92.789   41.949 25.23545 56.14781 
1 1 1   12   36   25 o   74.117   31.911   0.5216   6.5546   1.7094   7.7733  -2.4009   12.193   82.835   35.183   91.293   41.183 -8.457886 54.16514 
1 1 1   12   36   26 o  246.963   23.556   49.412   8.7963   48.140   11.496   51.208   13.663  238.122   32.380  241.227   38.282 -3.105057 50.13974 
1 1 1   12   36   27 o   61.254   29.347  -9.3520   7.8714 -11.7645   9.9517  -5.3204   12.865   68.133   32.737   88.362   40.778 -20.22903 52.29324 
1 1 1   12   36   28 o  225.150   26.433   41.986   8.9362   50.164   11.836   31.143   13.628  241.623   32.855  177.842   48.656 63.78081 58.71002 
1 1 1   12   36   29 o  144.901   37.316   19.081   8.3266   0.0000   0.0000   19.081   8.3266  ?   ?   144.901   37.316 0.000000 37.31649 
1 1 1   12   36   30 o   96.744   35.493   7.3788   6.8837   1.5670   13.186   9.5562   8.0709   99.019   43.869  106.736   38.542 -7.717049 58.39505 
1 1 1   12   36   31 o  226.924   18.246   41.174   6.2839   49.486   8.9468   33.082   8.8280  245.109   24.162  196.014   30.409 49.09396 38.83972 
1 1 1   12   36   32 o  280.086   15.633   62.053   6.6754   62.679   9.5797   61.462   9.3071  276.511   22.839  274.162   22.374 2.348480 31.97185 
1 1 1   12   36   33 o  109.897   33.283   10.923   6.0805   7.3215   8.6285   14.476   8.5700   98.413   38.834  123.151   39.849 -24.73800 55.64197 
1 1 1   12   36   34 o  160.683   25.241   21.962   6.0033   22.608   8.7744   21.394   8.2316  154.200   37.531  151.005   36.103 3.194962 52.07662 
1 1 1   12   36   35 o  106.934   32.786   10.500   5.8757   9.3332   8.8545   11.419   7.8540  103.401   39.754  110.046   38.176 -6.644615 55.11605 
1 1 1   12   36   36 o  244.643   19.989   49.089   7.4195   48.213   9.0475   50.888   12.965  237.847   25.237  230.638   38.054 7.209320 45.66186 
1 1 1   12   36   37 o   75.710   32.703   1.8004   6.9293   6.4180   8.5947  -6.7754   11.713   93.029   38.034   77.429   36.731 15.60031 52.87432 
1 1 1   12   37    0 o   54.617   36.281  -1.7383   8.0824  -1.7383   8.0824  -1.7383   8.0824   54.617   36.281   54.617   36.281 0.000000 0.000000 
1 1 1   12   37    1 o  454.299   12.494  159.408   8.6879  162.538   12.335  156.327   12.238  456.666   17.647  447.758   17.857 8.907898 25.10585 
1 1 1   12   37    2 o  300.752   14.819   70.124   6.8216   62.869   9.5468   77.693   9.7508  281.685   22.325  314.162   20.388 -32.47754 30.23368 
1 1 1   12   37    3 o  337.388   14.103   88.146   7.2832   94.586   10.448   82.060   10.158  347.031   19.752  322.766   20.669 24.26492 28.58964 
1 1 1   12   37    4 o  353.073   11.895   96.211   6.4282   89.549   7.8902  109.363   11.086  339.737   15.173  373.340   19.467 -33.60352 24.68147 
1 1 1   12   37    5 o   78.431   29.668   3.7986   4.8815   4.4280   6.1449   2.7218   8.0368   86.063   33.111   88.181   36.492 -2.118576 49.27440 
1 1 1   12   37    6 o   53.913   24.917  -3.5862   4.8294  -5.2870   6.0074  -0.4789   8.1200   58.172   27.191   80.279   35.032 -22.10720 44.34653 
1 1 1   12   37    7 o   81.249   29.975   4.4126   4.9199   8.0977   6.1325  -2.2428   8.2413  101.102   33.762   76.885   34.334 24.21674 48.15287 
1 1 1   12   37    8 o  352.156   12.078   95.767   6.5102   99.565   8.0747   88.714   11.005  358.291   14.724  335.037   21.574 23.25430 26.11922 
1 1 1   12   37    9 o   70.964   28.580   2.1319   4.7694  -2.0123   5.6746   12.103   8.8023   63.312   28.366  121.035   40.448 -57.72330 49.40333 
1 1 1   12   37   10 o   81.436   33.072   2.7987   6.4440   1.6169   9.9025   3.6668   8.4869   92.566   39.522   92.394   37.786 0.1724625 54.67900 
1 1 1   12   37   11 o  127.010   33.774   13.717   6.6795   7.7006   9.7534   19.030   9.1664  107.994   41.668  147.713   39.693 -39.71952 57.54753 
1 1 1   12   37   12 o  323.493   16.886   81.787   8.3323   92.761   12.320   72.535   11.312  341.197   23.738  300.998   24.773 40.19833 34.31004 
1 1 1   12   37   13 f   96.695   35.569   6.6511   6.9198   11.981   9.7138   1.1595   9.8601  121.352   42.435   91.141   39.188 30.21124 57.76232 
1 1 1   12   37   14 o   95.064   36.230   5.9014   7.3143   16.451   10.625  -3.6037   10.085  137.305   44.363   82.359   37.275 54.94668 57.94448 
1 1 1   12   37   15 o  196.742   20.637   30.793   6.1220   29.539   7.3712   33.581   10.992  190.599   25.941  197.519   37.733 -6.920074 45.78944 
1 1 1   12   37   16 o  358.727   15.765  100.204   8.6563  100.204   8.6563   0.0000   0.0000  358.727   15.765  ?   ?  0.000000 15.76519 
1 1 1   12   37   17 f  210.372   23.791   35.637   7.5262   35.637   7.5262   0.0000   0.0000  210.372   23.791  ?   ?  0.000000 23.79126 
1 1 1   12   37   18 o  427.632   12.546  141.588   8.2121  142.428   9.8463  139.668   14.884  427.823   15.036  418.247   23.344 9.575348 27.76701 
1 1 1   12   37   19 o  385.223   13.322  115.115   7.8551  110.054   9.3095  127.621   14.636  375.457   16.199  398.960   24.080 -23.50259 29.02192 
1 1 1   12   37   20 o   59.048   27.531  -4.9103   6.0980  -4.9654   7.1435  -4.7623   11.708   65.006   30.135   86.265   39.475 -21.25897 49.66314 
1 1 1   12   37   21 o  316.056   15.229   77.903   7.3674   79.092   8.7555   75.020   13.635  316.752   18.134  301.018   29.993 15.73383 35.04861 
1 1 1   12   37   22 o  179.620   25.364   26.466   6.7792   28.135   7.9351   21.957   13.044  183.364   29.256  152.338   49.149 31.02632 57.19753 
1 1 1   12   37   23 o  101.963   35.473   8.4142   6.7838   10.295   8.0515   3.8126   12.595  111.122   38.647  103.824   44.457 7.298210 58.90633 
1 1 1   12   37   24 o  399.938   13.947  124.637   8.5375  127.368   10.237  118.398   15.471  402.800   16.605  380.058   26.766 22.74146 31.49832 
1 1 1   12   37   25 o  115.168   39.269   11.506   8.2983  -2.6098   10.580   34.070   13.377   84.237   38.148  188.660   46.597 -104.4229 60.22109 
1 1 1   12   37   26 o  169.137   34.002   25.096   8.4975   21.233   10.929   31.002   13.512  149.300   44.488  177.557   48.394 -28.25723 65.73595 
1 1 1   12   37   27 o  157.343   30.401   21.328   7.0565   12.495   8.3101   44.159   13.361  118.228   39.294  219.076   41.360 -100.8474 57.04995 
1 1 1   12   37   28 o  127.363   48.444   14.739   13.061   0.0000   0.0000   14.739   13.061  ?   ?   127.363   48.444 0.000000 48.44398 
1 1 1   12   37   29 o  108.536   38.703   10.178   8.1123   6.9420   10.446   15.096   12.877  102.712   41.954  127.258   48.174 -24.54690 63.88183 
1 1 1   12   37   30 o  151.794   26.691   19.626   5.9750   22.108   8.2797   16.929   8.6310  155.647   35.536  133.661   39.465 21.98535 53.10642 
1 1 1   12   37   31 o   61.202   27.801  -2.1008   5.6717   2.1731   7.8262  -6.8281   8.2309   81.754   35.026   65.533   31.001 16.22098 46.77463 
1 1 1   12   37   32 o  192.928   20.343   30.460   5.9167   37.545   8.6632   24.267   8.1001  208.913   27.781  163.296   33.530 45.61659 43.54349 
1 1 1   12   37   33 o  102.579   32.909   9.5548   5.8543   20.786   8.6560   0.0861   7.9477  146.450   38.212   76.341   33.929 70.10862 51.10115 
1 1 1   12   37   34 o  160.313   25.689   22.136   6.0908   31.188   9.0352   14.596   8.2461  184.483   33.219  121.546   39.064 62.93660 51.27861 
1 1 1   12   37   35 o   89.554   34.410   6.4656   6.6316  -2.9536   8.0621   26.174   11.662   69.995   32.295  154.932   45.907 -84.93692 56.12857 
1 1 1   12   38    0 o   87.248   46.597   9.0775   8.4840   9.0775   8.4840   9.0775   8.4840   87.248   46.597   87.248   46.597 0.000000 0.000000 
1 1 1   12   38    1 o  383.993   13.819  114.226   8.1220  116.892   11.264  111.339   11.722  386.353   19.047  375.906   20.450 10.44699 27.94660 
1 1 1   12   38    2 o  138.026   29.477   15.905   6.0382   11.633   8.8051   19.698   8.2963  119.163   40.452  151.417   36.273 -32.25386 54.33301 
1 1 1   12   38    3 o  587.940   10.247  266.338   9.2218  259.787   11.256  279.712   16.083  579.628   12.687  598.644   17.552 -19.01666 21.65710 
1 1 1   12   38    4 o  409.798   11.537  129.630   7.2364  133.755   9.1462  122.727   11.833  415.282   14.389  395.592   19.542 19.69034 24.26760 
1 1 1   12   38    5 o  115.942   30.746   11.306   5.5453   1.5151   6.6624   33.383   10.004   78.377   32.890  199.296   34.017 -120.9187 47.31705 
1 1 1   12   38    6 o  232.430   16.541   42.287   5.8462   48.836   7.3250   30.795   9.7033  248.864   19.383  190.982   34.462 57.88184 39.53867 
1 1 1   12   38    7 f  141.807   25.123   16.448   5.2534   11.817   6.4350   25.703   9.0967  118.139   33.849  173.612   35.431 -55.47336 49.00132 
1 1 1   12   38    8 o  337.602   12.705   88.168   6.5650   86.665   8.0132   91.236   11.449  333.780   15.685  339.088   22.182 -5.307770 27.16681 
1 1 1   12   38    9 o  167.333   23.160   22.574   5.7727   23.042   7.0350   21.609   10.100  167.010   28.545  156.310   41.516 10.70056 50.38266 
1 1 1   12   38   10 f  389.077   15.777  117.826   9.3959  138.915   14.283  101.739   12.475  418.400   22.385  357.590   22.913 60.81012 32.03213 
1 1 1   12   38   11 o  299.088   18.059   70.243   8.2287   71.745   11.915   68.874   11.378  298.073   26.388  292.412   25.682 5.661041 36.82220 
1 1 1   12   38   12 o  374.182   16.226  109.147   9.2932  119.904   14.103  100.892   12.355  387.427   23.899  355.957   22.796 31.46942 33.02762 
1 1 1   12   38   13 o  165.398   42.335   24.470   10.763   24.470   10.763   0.0000   0.0000  165.398   42.335  ?   ?  0.000000 42.33535 
1 1 1   12   38   14 o   88.893   38.838   0.1097   10.006   0.1097   10.006   0.0000   0.0000   88.893   38.838  ?   ?  0.000000 38.83774 
1 1 1   12   38   15 o  173.956   30.736   25.388   7.8845   26.785   10.740   23.755   11.612  173.362   41.100  161.180   45.225 12.18228 61.11069 
1 1 1   12   38   16 o  111.750   32.377   10.614   5.8582   16.547   6.9921  -3.3609   10.731  138.653   33.353   84.853   38.424 53.80061 50.88013 
1 1 1   12   38   17 f  417.946   12.655  135.397   8.0957  133.564   9.6777  139.668   14.775  413.913   15.276  417.736   23.199 -3.822479 27.77668 
1 1 1   12   38   18 o  170.837   25.387   23.945   6.4365   20.227   7.4897   34.446   12.588  153.431   32.881  194.704   43.352 -41.27312 54.41059 
1 1 1   12   38   19 o   89.711   33.574   5.6328   6.2157   7.3668   7.2278   0.7088   12.180   98.981   36.361   96.871   42.572 2.109413 55.98626 
1 1 1   12   38   20 o  284.986   16.853   63.928   7.3189   61.709   8.6854   69.363   13.593  278.117   20.549  287.479   31.401 -9.361725 37.52721 
1 1 1   12   38   21 o  175.195   33.095   26.482   8.5493   31.510   11.308   19.774   13.062  186.408   40.767  144.416   49.268 41.99196 63.94775 
1 1 1   12   38   22 o  408.727   16.760  131.333   10.485  119.339   14.062  146.350   15.735  383.631   24.069  424.728   24.304 -41.09756 34.20584 
1 1 1   12   38   23 o  107.504   38.574   9.5403   8.0705   7.7100   10.488   12.197   12.637  106.401   42.547  121.853   47.312 -15.45199 63.62952 
1 1 1   12   38   24 o  351.995   15.389   97.155   8.2912  101.391   9.9059   87.245   15.152  357.494   18.163  320.690   31.266 36.80478 36.15884 
1 1 1   12   38   25 o  140.287   32.780   17.350   6.9121   15.633   8.1527   21.741   13.035  130.743   38.286  147.885   49.216 -17.14128 62.35391 
1 1 1   12   38   26 o  137.359   40.745   17.730   9.1829   23.510   13.584   12.866   12.462  151.766   50.229  121.675   47.056 30.09070 68.82768 
1 1 1   12   38   27 o  212.147   22.796   36.923   7.2863   41.987   8.7508   25.477   13.156  224.197   25.982  157.212   49.203 66.98512 55.64189 
1 1 1   12   38   28 o   88.406   34.339   5.5181   6.6587   9.2115   8.0025  -2.7943   12.005  104.115   38.258   86.865   39.832 17.25063 55.22880 
1 1 1   12   38   29 o   73.980   32.956  -0.5605   7.5430  -3.8409   9.8557   4.0780   11.720   77.143   35.633   97.462   42.314 -20.31980 55.31841 
1 1 1   12   38   30 f   68.755   30.582  -0.5808   6.4701  -2.7971   10.526   0.7651   8.2026   80.840   37.153   79.254   34.880 1.585915 50.96067 
1 1 1   12   38   31 o   56.543   26.461  -4.1846   5.7185 -12.1047   8.3649   2.7646   7.8355   58.613   28.593   82.390   35.166 -23.77731 45.32343 
1 1 1   12   38   32 o  161.086   25.314   22.259   6.0355   28.891   8.8801   16.565   8.2282  176.813   34.047  129.634   38.596 47.17906 51.46694 
1 1 1   12   38   33 o  110.992   36.026   11.778   7.0007   13.683   8.7016   8.2803   11.787  117.139   40.208  103.487   43.604 13.65195 59.31291 
1 1 1   12   39    0 o  301.873   24.472   72.516   11.137   72.516   11.137   72.516   11.137  301.873   24.472  301.873   24.472 0.000000 0.000000 
1 1 1   12   39    1 o  221.475   20.115   38.885   6.7447   34.748   9.5072   43.077   9.5700  204.305   31.407  229.764   27.776 -25.45880 41.92754 
1 1 1   12   39    2 o  348.039   15.009   94.162   7.9955   88.328   11.424   99.763   11.194  333.188   22.533  355.234   20.677 -22.04608 30.58228 
1 1 1   12   39    3 o  120.685   29.731   12.274   5.4561   13.143   6.7173   10.588   9.3537  123.951   34.262  115.723   41.527 8.228096 53.83693 
1 1 1   12   39    4 o  336.773   13.312   87.885   6.8618   95.208   8.6657   75.575   11.235  349.487   16.200  307.192   24.088 42.29565 29.02816 
1 1 1   12   39    5 o  442.685   11.432  151.372   7.7465  149.699   9.5297  154.632   13.300  439.144   14.178  443.487   19.593 -4.342621 24.18476 
1 1 1   12   39    6 o  458.111   11.417  162.116   8.0056  155.209   9.8424  175.620   13.762  447.029   14.384  472.938   19.010 -25.90866 23.83928 
1 1 1   12   39    7 o  588.232   10.488  266.929   9.4434  268.859   11.656  263.242   16.109  589.145   12.926  579.585   18.159 9.560059 22.28982 
1 1 1   12   39    8 o   89.660   31.635   6.0395   5.4063  -0.4003   6.5870   19.331   9.4634   72.323   31.557  147.589   40.614 -75.26587 51.43257 
1 1 1   12   39    9 o  371.962   12.775  107.174   7.2734  114.103   8.8920   93.165   12.644  382.854   15.174  340.664   24.410 42.18954 28.74151 
1 1 1   12   39   10 o   95.410   40.702   2.3472   10.487   2.3472   10.487   0.0000   0.0000   95.410   40.702  ?   ?  0.000000 40.70182 
1 1 1   12   39   11 o  256.247   30.215   54.352   11.623   54.352   11.623   0.0000   0.0000  256.247   30.215  ?   ?  0.000000 30.21513 
1 1 1   12   39   12 o  213.197   25.549   37.004   8.1714   41.402   11.661   32.762   11.453  219.689   35.921  192.363   40.195 27.32619 53.90721 
1 1 1   12   39   13 f  489.860   15.161  187.053   11.367  182.303   16.322  191.526   15.840  478.571   22.283  491.545   21.053 -12.97382 30.65569 
1 1 1   12   39   14 o  158.681   34.472   21.814   8.1332   13.515   11.123   31.350   11.923  126.068   45.280  185.856   42.797 -59.78852 62.30440 
1 1 1   12   39   15 o  388.354   17.036  118.275   10.127  109.927   13.775  128.092   14.938  368.974   24.531  398.318   24.623 -29.34460 34.75727 
1 1 1   12   39   16 o  141.776   47.726   18.607   12.256   0.0000   0.0000   18.607   12.256  ?   ?   141.776   47.726 0.000000 47.72594 
1 1 1   12   39   17 o  261.880   22.329   55.197   8.8647   57.411   11.851   52.385   13.357  262.055   30.092  245.373   36.690 16.68231 47.45179 
1 1 1   12   39   18 o  102.325   38.194   7.9616   8.0340   9.1951   10.443   6.1731   12.575  111.014   43.037  108.192   45.281 2.822632 62.46986 
1 1 1   12   39   19 o  115.047   38.269   11.514   7.8815   20.630   10.316  -1.2687   12.216  148.679   42.932   92.474   41.512 56.20530 59.71927 
1 1 1   12   39   20 o  180.340   25.406   26.896   6.8186   27.332   8.0368   25.778   12.882  179.075   30.409  162.261   48.288 16.81387 57.06483 
1 1 1   12   39   21 o  217.642   21.389   38.263   7.0333   23.624   8.0986   83.189   14.187  164.331   33.337  314.604   29.818 -150.2722 44.72650 
1 1 1   12   39   22 o  222.737   21.835   40.208   7.3484   41.940   8.8417   36.338   13.214  224.879   26.177  195.011   45.158 29.86783 52.19698 
1 1 1   12   39   23 o  111.505   35.644   10.992   6.8725   12.025   8.1634   8.4780   12.734  115.995   38.952  111.651   46.046 4.343933 60.31131 
1 1 1   12   39   24 o  136.190   40.122   17.455   8.9296   21.534   12.716   13.487   12.543  145.933   48.612  122.802   47.288 23.13077 67.81784 
1 1 1   12   39   25 o  105.613   35.671   9.8161   6.8465   16.901   8.5309  -3.0051   11.476  133.850   39.155   85.060   38.982 48.78939 55.25162 
1 1 1   12   39   26 o   63.641   29.374  -3.5566   6.6794  -1.1972   8.2698  -7.9839   11.328   75.898   34.107   76.893   36.373 -0.9942474 49.86257 
1 1 1   12   39   27 o  195.107   24.463   31.916   7.1451   39.179   9.0552   19.934   11.631  213.324   28.441  138.736   46.494 74.58867 54.50345 
1 1 1   12   39   28 o   58.382   27.632  -5.8228   6.5542  -4.8303   8.0873  -7.7222   11.188   67.698   31.612   75.936   35.986 -8.237991 47.89912 
1 1 1   12   39   29 o  131.346   33.654   16.030   6.7965   23.265   8.5326   3.4729   11.241  156.916   36.255   93.651   41.034 63.26517 54.75570 
1 1 1   12   39   30 o  275.546   18.282   61.446   7.6666   67.463   10.124   53.354   11.739  283.854   23.513  243.365   32.314 40.48874 39.96303 
1 1 1   12   40    0 o  305.399   23.470   74.126   10.822   74.126   10.822   74.126   10.822  305.399   23.470  305.399   23.470 0.000000 0.000000 
1 1 1   12   40    1 o  110.116   34.498   10.230   6.4656   12.649   9.5789   8.2050   8.7629  122.288   42.175  105.970   39.824 16.31782 58.00527 
1 1 1   12   40    2 o  211.488   21.374   35.770   6.8239   42.522   10.184   30.268   9.1930  226.258   30.157  188.903   32.995 37.35585 44.70052 
1 1 1   12   40    3 o  436.266   11.746  147.240   7.8435  147.778   9.6061  146.162   13.586  435.890   14.398  429.876   20.647 6.014221 25.17179 
1 1 1   12   40    4 o  228.733   18.110   41.313   6.2886   42.145   7.6885   39.632   10.930  229.304   22.183  215.868   34.223 13.43607 40.78324 
1 1 1   12   40    5 o  353.612   16.737   97.836   9.0591   97.836   9.0591   0.0000   0.0000  353.612   16.737  ?   ?  0.000000 16.73738 
1 1 1   12   40    6 o  148.961   30.951   18.846   6.8264   18.846   6.8264   0.0000   0.0000  148.961   30.951  ?   ?  0.000000 30.95065 
1 1 1   12   40    7 o  350.113   16.325   95.852   8.7484   95.852   8.7484   0.0000   0.0000  350.113   16.325  ?   ?  0.000000 16.32496 
1 1 1   12   40    8 o  234.751   18.889   43.673   6.7297   43.347   8.1267   44.385   12.005  231.875   23.209  227.263   35.687 4.612137 42.57052 
1 1 1   12   40    9 o  180.098   25.577   26.611   6.8526   20.658   8.7066   36.300   11.108  152.771   37.509  204.236   36.892 -51.46497 52.61163 
1 1 1   12   40   10 o  245.665   19.707   47.996   7.3479   47.820   9.3927   48.272   11.796  242.068   25.745  238.516   33.213 3.551773 42.02298 
1 1 1   12   40   11 o   61.753   30.606 -22.5878   10.903   0.0000   0.0000 -22.5878   10.903  ?   ?    61.753   30.606 0.000000 30.60640 
1 1 1   12   40   12 o   74.066   35.337 -11.4351   11.158   0.0000   0.0000 -11.4351   11.158  ?   ?    74.066   35.337 0.000000 35.33706 
1 1 1   12   40   13 o  268.928   32.806   61.429   13.224   0.0000   0.0000   61.429   13.224  ?   ?   268.928   32.806 0.000000 32.80593 
1 1 1   12   40   14 o  100.500   38.757   7.1383   8.4347  -8.1297   11.592   24.320   12.297   79.881   37.475  159.294   47.126 -79.41296 60.21045 
1 1 1   12   40   15 o  322.587   19.652   82.863   9.6569   75.359   12.726   93.052   14.828  301.743   27.868  334.235   29.280 -32.49130 40.42187 
1 1 1   12   40   16 o  238.478   24.220   46.417   8.7180   50.427   11.745   41.496   13.010  243.008   32.383  213.429   41.318 29.57901 52.49559 
1 1 1   12   40   17 o   79.071   34.683  -0.0062   8.0500   0.6485   10.777  -0.8326   12.108   90.861   39.985   92.550   41.452 -1.689384 57.59428 
1 1 1   12   40   18 o  314.978   16.154   78.164   7.7621   75.111   9.1989   85.711   14.464  306.625   19.704  319.152   29.960 -12.52722 35.85881 
1 1 1   12   40   19 o  104.989   35.456   9.4210   6.7643   16.483   8.0491  -7.5584   12.481  134.437   37.629   83.123   38.961 51.31387 54.16584 
1 1 1   12   40   20 o  313.432   16.549   77.678   7.9113   77.835   9.3967   77.297   14.661  311.608   19.804  299.485   32.505 12.12296 38.06303 
1 1 1   12   40   21 o  220.732   28.250   41.239   9.3256   44.037   13.054   38.324   13.326  217.817   40.651  198.950   44.836 18.86710 60.52090 
1 1 1   12   40   22 o  239.318   25.947   47.886   9.3525   56.159   13.540   40.338   12.934  249.740   36.498  205.656   42.493 44.08345 56.01582 
1 1 1   12   40   23 o  144.307   31.643   18.531   6.7969   22.032   8.3845   11.821   11.608  154.629   36.084  115.929   45.253 38.70000 57.87846 
1 1 1   12   40   24 o   64.918   29.776  -2.9501   6.7143  -4.1765   8.1381  -0.3353   11.883   69.431   32.179   89.827   40.576 -20.39607 51.78722 
1 1 1   12   40   25 o  184.376   25.372   28.775   6.9705   37.166   8.8389   14.974   11.336  207.321   28.617  123.110   45.484 84.21033 53.73783 
1 1 1   12   40   26 o  166.100   27.821   23.961   6.8229   20.567   8.7090   29.355   10.978  145.856   38.460  171.732   42.092 -25.87540 57.01733 
1 1 1   12   40   27 o  156.387   28.857   21.562   6.6531   25.450   8.4931   15.388   10.703  165.637   34.615  123.006   44.389 42.63101 56.29044 
1 1 1   12   40   28 o  135.941   33.015   17.140   6.8013   13.514   8.5890   23.237   11.137  117.246   39.951  147.766   45.109 -30.52088 60.25732 
1 1 1   12   41    2 o  333.917   27.253   91.471   13.808   91.471   13.808   0.0000   0.0000  333.917   27.253  ?   ?  0.000000 27.25350 
1 1 1   12   41    3 o  126.470   37.241   14.159   7.6947   18.701   11.305   10.240   10.503  141.955   45.752  114.567   43.474 27.38801 63.11276 
1 1 1   12   41    4 o  328.966   14.070   84.305   7.0844   74.681   8.8174  101.833   11.899  306.956   18.858  356.523   21.912 -49.56741 28.90930 
1 1 1   12   41    5 o  133.644   29.195   15.209   5.8050   12.594   7.0635   20.649   10.189  119.877   35.775  149.643   42.497 -29.76627 55.55095 
1 1 1   12   41    6 o  275.401   15.827   59.562   6.6437   59.025   8.0992   60.667   11.616  272.344   19.559  270.499   28.484 1.844452 34.55320 
1 1 1   12   41    7 o  136.657   28.989   15.885   5.8758   15.746   7.1003   16.188   10.466  133.793   34.461  133.228   44.089 0.5650330 55.95887 
1 1 1   12   41    8 o  100.689   33.060   8.4673   5.8889   11.277   6.8624   0.6191   11.470  113.910   35.517   93.677   41.237 20.23270 54.42352 
1 1 1   12   41    9 o  367.834   13.208  105.264   7.4363  103.832   8.8860  108.610   13.584  363.967   15.951  365.839   24.398 -1.872101 29.14969 
1 1 1   12   41   10 o  165.172   25.122   22.548   6.1511   30.100   7.3455   4.8234   11.254  190.907   25.799  101.577   42.692 89.33012 49.88174 
1 1 1   12   41   11 o  102.077   37.360   8.2032   7.6207  -2.3915   10.243   21.336   11.405   83.358   37.662  149.699   45.636 -66.34154 59.17014 
1 1 1   12   41   12 o  324.480   19.079   83.751   9.4342   87.311   13.401   80.253   13.284  325.139   27.176  310.752   28.237 14.38736 39.18984 
1 1 1   12   41   13 o  141.812   35.915   18.010   7.8040   14.691   10.477   22.145   11.697  127.131   44.092  151.568   46.220 -24.43665 63.87802 
1 1 1   12   41   14 f  141.250   37.201   18.085   8.1543   12.273   10.604   26.494   12.755  119.211   44.003  164.025   47.847 -44.81412 65.00436 
1 1 1   12   41   15 o  104.257   38.476   8.7653   8.1073  -5.6310   10.493   30.089   12.770   78.379   36.400  175.410   46.726 -97.03157 59.23092 
1 1 1   12   41   16 o  182.442   31.974   28.918   8.6034   31.999   11.409   24.856   13.099  185.095   41.318  156.870   49.096 28.22514 64.16805 
1 1 1   12   41   17 o  210.052   28.771   37.475   9.0070   28.319   12.025   49.176   13.594  169.829   45.391  231.456   39.807 -61.62711 60.37307 
1 1 1   12   41   18 o  136.551   39.253   17.529   8.6411   18.174   11.822   16.790   12.661  135.610   46.849  131.322   48.143 4.287659 67.17544 
1 1 1   12   41   19 o  297.129   21.313   71.736   9.6286   62.079   13.419   81.984   13.824  265.090   33.844  309.775   29.512 -44.68472 44.90386 
1 1 1   12   41   20 o  143.297   38.935   19.522   8.7621   12.376   12.597   26.221   12.196  118.152   46.826  159.712   46.843 -41.55984 66.23434 
1 1 1   12   41   21 o  309.106   16.724   76.110   7.8831   75.333   9.6255   77.693   13.738  304.303   20.790  299.312   30.409 4.991547 36.83646 
1 1 1   12   41   22 o   99.766   35.256   8.6816   6.7172   10.938   8.1885   4.0395   11.745  109.411   38.898   96.982   42.232 12.42813 57.41622 
1 1 1   12   41   23 o  147.128   31.338   19.456   6.8411   22.803   8.4147   12.932   11.749  156.070   35.964  116.966   45.563 39.10339 58.04649 
1 1 1   12   41   24 o   64.594   29.435  -2.1813   6.4234  -5.8377   7.8874   5.0192   11.069   64.915   30.598   96.522   41.512 -31.60694 51.56999 
1 1 1   12   42    0 o  218.835   31.004   40.338   9.7836   40.338   9.7836   40.338   9.7836  218.835   31.004  218.835   31.004 0.000000 0.000000 
1 1 1   12   42    1 o  172.585   26.444   24.800   6.7629   24.404   9.5687   25.195   9.5596  164.127   38.716  167.166   38.197 -3.038589 54.38679 
1 1 1   12   42    2 o  269.857   16.013   57.331   6.5847   52.604   8.2709   65.514   10.881  255.710   21.326  282.756   25.414 -27.04582 33.17622 
1 1 1   12   42    3 f  277.604   15.832   60.630   6.6991   65.565   8.3598   51.773   11.199  286.939   19.144  247.811   30.145 39.12807 35.71037 
1 1 1   12   42    4 o  287.057   15.449   64.744   6.7628   67.287   8.4548   60.225   11.268  290.686   19.109  269.242   27.740 21.44431 33.68480 
1 1 1   12   42    5 o  161.057   25.465   21.557   6.0690   20.633   7.4011   23.454   10.603  153.933   32.436  158.022   42.787 -4.089462 53.69184 
1 1 1   12   42    6 o  137.466   29.020   16.181   5.9144   14.575   6.9398   20.442   11.306  128.056   34.591  146.111   45.592 -18.05553 57.22894 
1 1 1   12   42    7 o   88.011   32.185   5.8102   5.6539   7.1100   6.8482   3.0277   10.020   96.074   35.378   93.237   39.781 2.837105 53.23618 
1 1 1   12   42    8 o   88.631   32.647   5.8650   5.8323   6.1316   6.9087   5.2037   10.881   92.513   35.222  100.637   42.119 -8.124374 54.90602 
1 1 1   12   42    9 o  139.857   28.845   16.773   5.9698   17.138   7.0204   15.821   11.345  139.126   33.392  130.227   45.840 8.898911 56.71246 
1 1 1   12   42   10 o  242.901   17.970   46.981   6.6338   46.135   7.7995   49.194   12.614  238.669   21.584  235.642   36.125 3.027679 42.08170 
1 1 1   12   42   12 o  135.589   37.101   16.891   7.9234   0.5278   10.407   39.453   12.221   88.282   39.050  206.611   40.089 -118.3285 55.96467 
1 1 1   12   42   13 o   67.617   31.299  -4.2963   7.6636   0.4308   10.312 -10.1269   11.453   87.537   38.789   75.327   35.901 12.21033 52.85271 
1 1 1   12   42   14 o   64.444   30.426  -6.6441   7.8591  -3.0955   10.576 -11.0210   11.745   81.842   37.476   75.164   35.969 6.678490 51.94408 
1 1 1   12   42   15 o  247.851   24.168   50.861   9.0519   52.394   12.321   49.063   13.342  243.053   34.055  230.142   39.286 12.91124 51.99104 
1 1 1   12   42   16 o  263.439   23.479   57.286   9.3683   46.860   12.507   70.615   14.141  226.116   37.447  282.830   33.303 -56.71346 50.11314 
1 1 1   12   42   17 o  155.188   36.627   22.405   8.5602   13.572   11.262   34.493   13.174  119.991   45.136  183.783   46.727 -63.79224 64.96624 
1 1 1   12   42   18 o  202.354   28.979   35.434   8.7195   41.298   11.827   28.451   12.906  210.417   38.126  163.940   48.217 46.47717 61.46933 
1 1 1   12   42   19 o  209.821   28.190   37.949   8.8243   48.752   12.399   26.861   12.562  230.181   36.402  158.906   47.774 71.27496 60.06208 
1 1 1   12   42   20 o  144.191   31.928   18.812   6.8607   20.110   8.2599   15.924   12.320  145.462   37.009  125.135   47.181 20.32691 59.96420 
1 1 1   12   42   21 o  151.779   36.308   21.772   8.3216   12.856   11.241   32.583   12.378  116.015   44.741  177.365   45.403 -61.34991 63.74288 
1 1 1   12   43    0 o   50.778   35.071  -5.7260   9.1899  -5.7260   9.1899  -5.7260   9.1899   50.778   35.071   50.778   35.071 0.000000 0.000000 
1 1 1   12   43    1 o   61.204   28.511  -4.5740   6.5168   4.0413   8.9789 -14.1644   9.4733   91.509   38.277   62.483   30.470 29.02638 48.92389 
1 1 1   12   43    2 o  288.725   15.455   65.749   6.8054   64.216   8.7890   68.046   10.754  282.193   20.488  287.281   24.697 -5.088531 32.08908 
1 1 1   12   43    3 o  389.388   13.067  118.368   7.7881  125.737   9.8771  106.257   12.663  399.249   16.163  360.923   23.042 38.32593 28.14531 
1 1 1   12   43    4 f  194.734   21.046   30.837   6.1733   30.303   7.7766   31.745   10.151  189.148   27.680  187.199   36.739 1.949524 45.99915 
1 1 1   12   43    5 o   85.599   32.509   5.2424   5.8761   4.4098   7.2017   6.9006   10.163   86.778   35.060  101.777   41.456 -14.99896 54.29322 
1 1 1   12   43    6 o  134.633   31.095   15.992   6.2786   12.644   7.9274   21.628   10.284  117.567   38.345  149.298   42.796 -31.73140 57.46179 
1 1 1   12   43    7 o  146.476   28.469   18.507   6.1527   17.910   7.6434   19.604   10.370  139.934   35.600  141.553   43.583 -1.618835 56.27444 
1 1 1   12   43    8 o  265.724   16.826   56.144   6.8082   57.083   8.3741   54.314   11.693  265.369   20.783  250.433   31.180 14.93579 37.47120 
1 1 1   12   43    9 o  233.681   19.771   44.124   7.0052   44.337   8.4682   43.660   12.468  231.218   24.291  217.244   38.924 13.97357 45.88197 
1 1 1   12   43   10 o  206.230   21.971   34.886   6.8285   27.344   8.2330   51.510   12.223  176.180   31.696  240.653   34.141 -64.47266 46.58547 
1 1 1   12   43   11 o  108.780   33.520   10.640   6.1329   6.9815   7.3026   19.397   11.297   94.906   36.194  138.485   45.806 -43.57979 58.37946 
1 1 1   12   43   12 o  186.911   31.723   30.844   8.7511   34.541   12.643   27.444   12.125  185.937   44.925  163.576   46.326 22.36078 64.53173 
1 1 1   12   43   13 o   99.418   38.540   7.8336   8.3750   5.3335   11.705   10.456   11.988   99.971   42.833  112.077   45.251 -12.10569 62.30808 
1 1 1   12   43   14 o  247.294   24.619   51.142   9.1949   32.856   12.015   76.987   14.284  181.536   43.755  295.539   32.093 -114.0028 54.26300 
1 1 1   12   43   15 o   79.327   34.696   1.0767   8.0049   2.1148   10.902  -0.1379   11.792   90.923   40.105   89.378   40.393 1.544685 56.92087 
1 1 1   12   43   16 o  197.238   29.844   34.089   8.7284   36.809   11.568   30.494   13.300  195.783   39.954  168.110   48.808 27.67316 63.07577 
1 1 1   12   43   17 o  105.688   39.045   10.016   8.3534   12.979   11.432   6.6220   12.236  116.719   45.089  102.568   43.866 14.15087 62.90665 
1 1 1   12   44    0 o  262.929   28.736   57.533   11.214   57.533   11.214   57.533   11.214  262.929   28.736  262.929   28.736 0.000000 0.000000 
1 1 1   12   44    1 o  268.654   15.648   57.225   6.4065   56.881   8.1297   57.787   10.407  264.815   20.209  261.933   26.313 2.882141 33.17794 
1 1 1   12   44    2 o   67.130   29.644  -0.3874   5.9729   4.4718   7.7519  -7.4869   9.3701   87.846   36.041   69.691   33.000 18.15513 48.86699 
1 1 1   12   44    3 o  242.849   17.631   47.244   6.5089   40.116   8.2784   58.785   10.534  218.697   25.191  264.029   26.420 -45.33185 36.50500 
1 1 1   12   44    4 f  176.228   25.287   26.204   6.6255   28.719   8.5907   22.513   10.409  179.569   32.450  150.384   43.037 29.18524 53.90006 
1 1 1   12   44    5 o  290.217   16.120   66.934   7.1327   70.934   9.1242   60.648   11.438  295.650   20.285  266.057   28.531 29.59238 35.00735 
1 1 1   12   44    6 o  141.037   29.215   17.469   6.0993   4.3360   7.5615   41.929   10.319   86.680   35.583  217.951   31.875 -131.2701 47.77261 
1 1 1   12   44    7 o  148.488   28.995   19.298   6.3536   26.663   7.9254   6.0526   10.629  173.755   30.934   98.992   41.542 74.76350 51.79403 
1 1 1   12   44    8 o   92.161   33.191   7.0457   5.9801   6.8291   7.3280   7.4775   10.347   93.860   36.145  101.771   41.683 -7.910660 55.17186 
1 1 1   12   44    9 o   65.896   29.562  -1.2140   6.1846  -7.7381   7.6694   10.917   10.458   61.244   29.241  111.025   43.060 -49.78140 52.04992 
1 1 1   12   44   10 o  145.846   29.578   18.786   6.3771   16.952   7.7191   22.729   11.318  133.874   36.615  147.939   45.527 -14.06538 58.42398 
1 1 1   13    0    1 f  252.265   9.1289   48.912   3.5144   48.912   3.5144   48.912   3.5144  252.265   9.1289  252.265   9.1289 0.000000 0.000000 
1 1 1   13    0    4 o  435.041   9.8194  145.127   6.5311  145.127   6.5311  145.127   6.5311  435.041   9.8194  435.041   9.8194 0.000000 0.000000 
1 1 1   13    0    8 o   62.927   16.611   3.5986   1.3823   3.5986   1.3823   3.5986   1.3823   62.927   16.611   62.927   16.611 0.000000 0.000000 
1 1 1   13    0    9 o  126.803   7.8003   12.447   1.5008   12.447   1.5008   12.447   1.5008  126.803   7.8003  126.803   7.8003 0.000000 0.000000 
1 1 1   13    0   10 o  1182.14   8.1386  1069.89   14.724  1069.89   14.724  1069.89   14.724  1182.14   8.1386  1182.14   8.1386 0.000000 0.000000 
1 1 1   13    0   11 o  922.271   6.8523  651.176   9.6718  651.176   9.6718  651.176   9.6718  922.271   6.8523  922.271   6.8523 0.000000 0.000000 
1 1 1   13    0   12 o  1396.18   10.820  1492.67   23.119  1492.67   23.119  1492.67   23.119  1396.18   10.820  1396.18   10.820 0.000000 0.000000 
1 1 1   13    0   13 o  1414.55   10.951  1532.19   23.707  1532.19   23.707  1532.19   23.707  1414.55   10.951  1414.55   10.951 0.000000 0.000000 
1 1 1   13    0   14 o  1147.31   8.0719  1007.73   14.174  1007.73   14.174  1007.73   14.174  1147.31   8.0719  1147.31   8.0719 0.000000 0.000000 
1 1 1   13    0   15 o   18.038   12.885  -2.4460   1.6070  -2.4460   1.6070  -2.4460   1.6070   18.038   12.885   18.038   12.885 0.000000 0.000000 
1 1 1   13    0   16 o  650.139   8.2753  323.701   8.2319  323.701   8.2319  323.701   8.2319  650.139   8.2753  650.139   8.2753 0.000000 0.000000 
1 1 1   13    0   17 o  714.691   6.3698  391.046   6.9669  391.046   6.9669  391.046   6.9669  714.691   6.3698  714.691   6.3698 0.000000 0.000000 
1 1 1   13    0   18 f  187.235   8.3068   26.993   2.3700   26.993   2.3700   26.993   2.3700  187.235   8.3068  187.235   8.3068 0.000000 0.000000 
1 1 1   13    0   19 o  1391.05   10.978  1481.67   23.370  1481.67   23.370  1481.67   23.370  1391.05   10.978  1391.05   10.978 0.000000 0.000000 
1 1 1   13    0   20 o  175.392   9.8523   23.771   2.6259   23.771   2.6259   23.771   2.6259  175.392   9.8523  175.392   9.8523 0.000000 0.000000 
1 1 1   13    0   21 o  400.488   6.5953  122.865   4.0404  122.865   4.0404  122.865   4.0404  400.488   6.5953  400.488   6.5953 0.000000 0.000000 
1 1 1   13    0   22 o  604.742   7.5915  280.067   7.0244  280.067   7.0244  280.067   7.0244  604.742   7.5915  604.742   7.5915 0.000000 0.000000 
1 1 1   13    0   23 o  614.166   6.6749  288.821   6.2731  288.821   6.2731  288.821   6.2731  614.166   6.6749  614.166   6.6749 0.000000 0.000000 
1 1 1   13    0   24 o  1575.80   10.645  1901.40   25.673  1901.40   25.673  1901.40   25.673  1575.80   10.645  1575.80   10.645 0.000000 0.000000 
1 1 1   13    0   25 o  1010.55   7.9979  781.880   12.369  781.880   12.369  781.880   12.369  1010.55   7.9979  1010.55   7.9979 0.000000 0.000000 
1 1 1   13    0   26 o  806.041   8.5621  497.536   10.561  497.536   10.561  497.536   10.561  806.041   8.5621  806.041   8.5621 0.000000 0.000000 
1 1 1   13    0   27 o  1119.12   9.9041  959.124   16.962  959.124   16.962  959.124   16.962  1119.12   9.9041  1119.12   9.9041 0.000000 0.000000 
1 1 1   13    0   28 o  261.092   10.929   52.472   4.3502   52.472   4.3502   52.472   4.3502  261.092   10.929  261.092   10.929 0.000000 0.000000 
1 1 1   13    0   29 o  636.323   11.090  310.344   10.794  310.344   10.794  310.344   10.794  636.323   11.090  636.323   11.090 0.000000 0.000000 
1 1 1   13    0   30 o  248.301   15.043   47.756   5.6692   47.756   5.6692   47.756   5.6692  248.301   15.043  248.301   15.043 0.000000 0.000000 
1 1 1   13    0   31 o  668.449   9.1457  342.313   9.3534  342.313   9.3534  342.313   9.3534  668.449   9.1457  668.449   9.1457 0.000000 0.000000 
1 1 1   13    0   32 o  679.871   8.9612  354.109   9.3216  354.109   9.3216  354.109   9.3216  679.871   8.9612  679.871   8.9612 0.000000 0.000000 
1 1 1   13    0   33 o  632.894   8.0437  306.839   7.7893  306.839   7.7893  306.839   7.7893  632.894   8.0437  632.894   8.0437 0.000000 0.000000 
1 1 1   13    0   34 o  319.631   13.006   78.681   6.3390   78.681   6.3390   78.681   6.3390  319.631   13.006  319.631   13.006 0.000000 0.000000 
1 1 1   13    0   35 o   41.483   28.358  -3.5444   5.6625  -3.5444   5.6625  -3.5444   5.6625   41.483   28.358   41.483   28.358 0.000000 0.000000 
1 1 1   13    0   36 o  536.124   8.4598  220.301   6.9383  220.301   6.9383  220.301   6.9383  536.124   8.4598  536.124   8.4598 0.000000 0.000000 
1 1 1   13    0   37 o  478.489   8.7103  175.550   6.3746  175.550   6.3746  175.550   6.3746  478.489   8.7103  478.489   8.7103 0.000000 0.000000 
1 1 1   13    0   38 o  402.089   9.3659  124.077   5.7572  124.077   5.7572  124.077   5.7572  402.089   9.3659  402.089   9.3659 0.000000 0.000000 
1 1 1   13    0   39 f  341.570   11.377   89.756   5.9332   89.756   5.9332   89.756   5.9332  341.570   11.377  341.570   11.377 0.000000 0.000000 
1 1 1   13    0   40 o  292.326   11.339   65.831   5.0564   65.831   5.0564   65.831   5.0564  292.326   11.339  292.326   11.339 0.000000 0.000000 
1 1 1   13    0   41 o  343.918   11.509   91.041   6.0432   91.041   6.0432   91.041   6.0432  343.918   11.509  343.918   11.509 0.000000 0.000000 
1 1 1   13    0   42 o  202.258   15.179   31.975   4.6384   31.975   4.6384   31.975   4.6384  202.258   15.179  202.258   15.179 0.000000 0.000000 
1 1 1   13    0   43 o  289.823   12.922   64.903   5.7064   64.903   5.7064   64.903   5.7064  289.823   12.922  289.823   12.922 0.000000 0.000000 
1 1 1   13    0   44 o  311.877   15.314   75.401   7.2701   75.401   7.2701   75.401   7.2701  311.877   15.314  311.877   15.314 0.000000 0.000000 
1 1 1   13    0   45 o  188.584   18.992   28.291   5.3545   28.291   5.3545   28.291   5.3545  188.584   18.992  188.584   18.992 0.000000 0.000000 
1 1 1   13    0   46 o  136.952   32.353   16.882   5.8894   16.882   5.8894   16.882   5.8894  136.952   32.353  136.952   32.353 0.000000 0.000000 
1 1 1   13    0   47 o   50.233   30.705   1.8231   4.4899   1.8231   4.4899   1.8231   4.4899   50.233   30.705   50.233   30.705 0.000000 0.000000 
1 1 1   13    0   48 o  251.831   14.068   49.320   5.3838   49.320   5.3838   49.320   5.3838  251.831   14.068  251.831   14.068 0.000000 0.000000 
1 1 1   13    0   49 o  177.491   19.462   25.293   5.1255   25.293   5.1255   25.293   5.1255  177.491   19.462  177.491   19.462 0.000000 0.000000 
1 1 1   13    0   50 o  364.651   11.411  102.597   6.3549  102.597   6.3549  102.597   6.3549  364.651   11.411  364.651   11.411 0.000000 0.000000 
1 1 1   13    0   51 o  221.304   17.837   38.710   5.9517   38.710   5.9517   38.710   5.9517  221.304   17.837  221.304   17.837 0.000000 0.000000 
1 1 1   13    0   52 o   59.176   35.256   3.3112   5.6132   3.3112   5.6132   3.3112   5.6132   59.176   35.256   59.176   35.256 0.000000 0.000000 
1 1 1   13    0   53 o   54.949   33.441   2.4836   5.2727   2.4836   5.2727   2.4836   5.2727   54.949   33.441   54.949   33.441 0.000000 0.000000 
1 1 1   13    0   54 o   51.304   32.504   1.1989   5.5080   1.1989   5.5080   1.1989   5.5080   51.304   32.504   51.304   32.504 0.000000 0.000000 
1 1 1   13    0   55 o  161.319   25.617   22.026   5.8477   22.026   5.8477   22.026   5.8477  161.319   25.617  161.319   25.617 0.000000 0.000000 
1 1 1   13    0   56 o   48.672   32.004  -0.3693   6.0380  -0.3693   6.0380  -0.3693   6.0380   48.672   32.004   48.672   32.004 0.000000 0.000000 
1 1 1   13    0   57 o   63.325   37.392   4.3389   6.2157   4.3389   6.2157   4.3389   6.2157   63.325   37.392   63.325   37.392 0.000000 0.000000 
1 1 1   13    0   58 o  350.553   13.792   95.909   7.3742   95.909   7.3742   95.909   7.3742  350.553   13.792  350.553   13.792 0.000000 0.000000 
1 1 1   13    0   59 o   67.748   35.915   5.7786   5.0073   5.7786   5.0073   5.7786   5.0073   67.748   35.915   67.748   35.915 0.000000 0.000000 
1 1 1   13    0   60 o   78.982   37.345   7.8723   5.1127   7.8723   5.1127   7.8723   5.1127   78.982   37.345   78.982   37.345 0.000000 0.000000 
1 1 1   13    0   61 o   84.171   36.944   8.7187   4.9742   8.7187   4.9742   8.7187   4.9742   84.171   36.944   84.171   36.944 0.000000 0.000000 
1 1 1   13    0   62 o   58.360   34.872   3.9614   5.5229   3.9614   5.5229   3.9614   5.5229   58.360   34.872   58.360   34.872 0.000000 0.000000 
1 1 1   13    1    0 o  626.403   10.541  300.700   10.100  300.700   10.100  300.700   10.100  626.403   10.541  626.403   10.541 0.000000 0.000000 
1 1 1   13    1    1 o  418.177   6.4069  133.882   4.1009  130.915   5.8488  136.750   5.7516  413.436   9.2425  422.561   8.8926 -9.125488 12.82579 
1 1 1   13    1    2 o  275.952   9.3237   58.324   3.9381   58.324   3.9381   0.0000   0.0000  275.952   9.3237  ?   ?  0.000000 9.323695 
1 1 1   13    1    3 o  180.639   10.521   25.082   2.8964   0.0000   0.0000   25.082   2.8964  ?   ?   180.639   10.521 0.000000 10.52123 
1 1 1   13    1    4 o  736.121   8.4492  414.964   9.5199  386.628   12.709  451.191   14.370  710.341   11.689  767.319   12.235 -56.97772 16.92124 
1 1 1   13    1    5 o  246.827   4.8002   46.635   1.8135   45.094   2.6277   48.036   2.5060  242.686   7.0740  250.487   6.5362 -7.800232 9.631364 
1 1 1   13    1    6 o  824.628   5.6172  520.562   7.0901  526.343   11.351  516.863   9.0787  829.025   8.9457  821.622   7.2191 7.402466 11.49529 
1 1 1   13    1    7 o  190.391   4.8421   27.747   1.4111   28.719   2.3311   27.185   1.7728  193.665   7.8638  188.443   6.1462 5.222427 9.980741 
1 1 1   13    1    8 o  530.433   4.6297  215.365   3.7588  215.279   5.9579  215.421   4.8446  530.261   7.3406  530.473   5.9666 -0.2127075 9.459668 
1 1 1   13    1    9 o  821.940   5.6062  517.157   7.0531  515.158   9.0452  520.258   11.265  820.287   7.2041  824.252   8.9294 -3.964661 11.47313 
1 1 1   13    1   10 o  520.971   4.2529  207.741   3.3913  209.433   4.1655  204.416   5.8405  523.071   5.2028  516.717   7.3846 6.353577 9.033360 
1 1 1   13    1   11 o  943.762   5.2786  681.784   7.6251  695.846   10.256  664.406   11.402  953.375   7.0284  931.542   7.9963 21.83307 10.64614 
1 1 1   13    1   12 o  879.401   4.7310  591.939   6.3681  595.029   9.0290  588.880   8.9828  881.630   6.6909  877.063   6.6913 4.566772 9.462667 
1 1 1   13    1   13 o  406.047   4.0795  126.193   2.5355  126.032   3.9241  126.309   3.3220  405.758   6.3184  406.218   5.3428 -0.4601746 8.274494 
1 1 1   13    1   14 o  688.957   4.5793  363.310   4.8291  366.122   7.4875  361.308   6.3190  691.559   7.0735  687.026   6.0090 4.533081 9.281327 
1 1 1   13    1   15 o  858.087   4.7640  563.583   6.2571  557.068   8.7531  570.391   8.9477  853.059   6.7037  863.198   6.7722 -10.13928 9.529048 
1 1 1   13    1   16 o  1001.54   5.5935  767.799   8.5747  767.206   11.370  768.579   13.057  1001.09   7.4203  1001.93   8.5140 -0.8479004 11.29379 
1 1 1   13    1   17 o  371.812   4.3836  105.811   2.4948  101.033   3.7255  109.696   3.3591  363.295   6.6998  378.561   5.7971 -15.26599 8.859688 
1 1 1   13    1   18 o  925.745   5.4253  655.981   7.6875  649.625   11.673  660.848   10.216  921.153   8.2790  929.118   7.1834 -7.964844 10.96098 
1 1 1   13    1   19 o  1234.67   6.5671  1166.93   12.411  1159.83   18.877  1172.33   16.470  1230.72   10.021  1237.41   8.6960 -6.693848 13.26807 
1 1 1   13    1   20 o  385.841   4.8253  113.950   2.8497  111.038   3.7985  117.699   4.3101  380.859   6.5159  392.105   7.1816 -11.24612 9.696984 
1 1 1   13    1   21 o  551.147   4.5157  232.502   3.8095  233.478   5.4073  231.540   5.3677  552.270   6.3967  549.972   6.3764 2.297363 9.032019 
1 1 1   13    1   22 o  505.118   5.3397  195.300   4.1284  188.205   5.8106  202.532   5.8666  495.811   7.6566  514.343   7.4519 -18.53149 10.68433 
1 1 1   13    1   23 o  457.058   4.8049  159.900   3.3614  160.389   4.8416  159.444   4.6705  457.720   6.9107  456.374   6.6861 1.345917 9.615725 
1 1 1   13    1   24 o  718.852   4.9213  395.541   5.4149  402.962   7.8074  388.662   7.5165  725.501   7.0307  712.516   6.8921 12.98450 9.845401 
1 1 1   13    1   25 o  612.832   4.9100  287.475   4.6056  283.834   6.4863  291.177   6.5408  608.885   6.9597  616.711   6.9292 -7.826294 9.820917 
1 1 1   13    1   26 o  139.879   12.307   15.108   2.6082   12.995   3.5580   17.562   3.8347  128.817   18.583  150.366   16.958 -21.54871 25.15688 
1 1 1   13    1   27 o  346.017   6.4486   91.661   3.4153   81.182   5.2257   99.475   4.5124  325.545   10.487  360.425   8.1794 -34.88074 13.29989 
1 1 1   13    1   28 o  445.599   6.1314  152.010   4.1819  147.753   6.6188  154.839   5.3953  439.199   9.8457  449.679   7.8386 -10.47964 12.58502 
1 1 1   13    1   29 o  342.044   8.7661   89.603   4.5894   77.151   7.5996   96.751   5.7580  317.135   15.656  355.367   10.586 -38.23166 18.89876 
1 1 1   13    1   30 o  811.065   5.9302  503.626   7.3619  509.719   11.517  499.416   9.5732  815.747   9.2238  807.565   7.7448 8.181702 12.04411 
1 1 1   13    1   31 o  374.354   7.1027  107.313   4.0698  113.277   5.4541   99.819   6.1133  384.540   9.2664  360.900   11.067 23.63965 14.43401 
1 1 1   13    1   32 o  314.975   8.6189   75.997   4.1553   82.827   5.9225   69.376   5.8314  328.692   11.772  300.778   12.667 27.91354 17.29210 
1 1 1   13    1   33 o  549.484   6.7657  231.224   5.6903  234.553   7.0050  224.764   9.7568  553.337   8.2709  541.397   11.774 11.94000 14.38858 
1 1 1   13    1   34 o  385.043   7.4113  113.565   4.3679  107.815   6.7973  117.609   5.7007  374.910   11.845  391.726   9.5078 -16.81650 15.18894 
1 1 1   13    1   35 o  550.304   6.3126  231.934   5.3171  231.606   7.0334  232.370   8.1228  549.763   8.3584  550.552   9.6392 -0.7893066 12.75836 
1 1 1   13    1   36 o  204.042   10.597   32.023   3.2982   36.307   4.7446   28.016   4.5880  216.871   14.375  190.174   15.908 26.69670 21.44024 
1 1 1   13    1   37 o  540.382   5.8114  223.660   4.8067  223.297   6.8551  224.011   6.7419  539.721   8.2980  540.599   8.1477 -0.8778687 11.62936 
1 1 1   13    1   38 o  351.731   7.0367   94.805   3.7884   93.533   5.4009   96.036   5.3153  349.122   10.107  353.788   9.8155 -4.666870 14.08876 
1 1 1   13    1   39 o   61.906   23.992   1.9232   3.2448   3.0193   4.5757   0.8145   4.6022   74.585   28.601   65.918   27.474 8.666939 39.65901 
1 1 1   13    1   40 o  140.472   14.700   15.371   3.1138   15.970   4.4738   14.807   4.3367  141.917   21.249  136.494   21.466 5.422943 30.20476 
1 1 1   13    1   41 o  235.897   10.471   42.757   3.7809   44.095   5.3981   41.469   5.2973  238.632   14.853  231.352   15.041 7.279221 21.13840 
1 1 1   13    1   42 o  120.436   18.451   11.501   3.2930   10.577   4.4400   12.630   4.9094  113.846   26.044  124.474   26.576 -10.62781 37.21040 
1 1 1   13    1   43 o  303.050   7.9713   70.484   3.6975   74.284   5.3318   66.964   5.1321  310.685   11.212  294.956   11.367 15.72870 15.96656 
1 1 1   13    1   44 o  344.039   7.9629   90.868   4.1932   87.282   6.4971   93.428   5.4896  336.392   12.618  348.488   10.292 -12.09662 16.28319 
1 1 1   13    1   45 o  298.835   9.3657   68.671   4.2839   67.693   6.0615   69.647   6.0553  295.967   13.380  300.253   13.176 -4.285645 18.77863 
1 1 1   13    1   46 o  252.413   12.611   49.229   4.8723   53.478   8.3253   47.016   6.0088  260.081   21.095  245.443   16.083 14.63776 26.52687 
1 1 1   13    1   47 o   94.393   22.170   7.3088   3.1485   3.9381   4.5279   10.464   4.3811   77.399   28.716  112.353   25.992 -34.95387 38.73276 
1 1 1   13    1   48 f  173.283   13.113   23.385   3.4523   19.720   4.9800   26.776   4.7901  156.747   21.309  184.402   17.168 -27.65427 27.36457 
1 1 1   13    1   49 o  201.496   11.912   31.513   3.6574   27.019   5.2677   35.695   5.0820  184.522   18.919  213.444   15.665 -28.92236 24.56219 
1 1 1   13    1   50 o  184.753   13.851   26.670   3.8884   24.521   5.4544   28.891   5.5447  174.870   20.785  190.563   19.274 -15.69383 28.34652 
1 1 1   13    1   51 o   58.287   24.487   0.6754   3.6997   8.9538   5.6393  -5.5797   4.9020  103.111   32.204   49.776   23.656 53.33467 39.95893 
1 1 1   13    1   52 o  376.723   9.2600  109.487   5.3396  114.861   7.6745  104.445   7.4338  384.352   13.045  366.418   13.255 17.93430 18.59731 
1 1 1   13    1   53 o  101.343   24.155   8.6256   3.6939   7.1128   5.3595   9.9945   5.0982   93.343   31.560  107.728   29.875 -14.38511 43.45768 
1 1 1   13    1   54 o  133.992   19.251   14.541   3.8348   8.4877   5.5594   20.036   5.2965   99.770   32.076  156.109   22.842 -56.33839 39.37804 
1 1 1   13    1   55 o  145.000   18.301   16.957   3.9712   11.635   5.7022   21.969   5.5338  114.690   31.512  163.222   22.770 -48.53135 38.87783 
1 1 1   13    1   56 o  167.978   17.231   22.640   4.3675   29.523   6.2486   16.065   6.1071  189.489   21.951  134.818   30.329 54.67023 37.43888 
1 1 1   13    1   57 o  228.965   13.677   41.357   4.7712   35.479   6.6464   47.607   6.8533  207.701   21.204  242.726   18.588 -35.02553 28.19747 
1 1 1   13    1   58 o  184.594   13.561   26.979   3.8048   26.625   5.4667   27.312   5.2987  179.806   20.214  182.731   19.233 -2.924973 27.90194 
1 1 1   13    1   59 o   82.010   25.701   5.8326   3.5884   7.9059   5.0390   3.6993   5.1114   93.594   30.574   74.958   29.790 18.63610 42.68744 
1 1 1   13    1   60 o   55.498   23.657   0.7364   3.5378  -0.1190   4.9790   1.6086   5.0279   60.851   26.958   66.349   28.241 -5.497829 39.04223 
1 1 1   13    1   61 o   45.891   21.188  -1.9533   3.4794   2.0552   4.8737  -6.1199   4.9689   66.488   28.028   47.195   22.791 19.29367 36.12429 
1 1 1   13    1   62 o   59.724   24.504   1.9122   3.5834   3.9689   5.3621   0.2525   4.8170   74.168   30.150   60.001   26.552 14.16739 40.17495 
1 1 1   13    2    0 o   75.669   17.143   5.0041   1.7314   5.0041   1.7314   5.0041   1.7314   75.669   17.143   75.669   17.143 0.000000 0.000000 
1 1 1   13    2    1 o  540.482   6.9203  223.659   5.7250  221.266   8.1661  225.972   8.0284  537.462   9.9265  543.159   9.6568 -5.697876 13.84883 
1 1 1   13    2    2 o  239.990   6.2125   44.094   2.2821   41.703   3.5213   45.825   2.9966  233.333   9.8594  244.629   8.0029 -11.29654 12.69861 
1 1 1   13    2    3 o  749.210   8.1726  429.835   9.3720  428.415   13.526  431.145   12.998  747.733   11.818  750.149   11.320 -2.415894 16.36514 
1 1 1   13    2    4 o  677.636   11.170  351.805   11.585   0.0000   0.0000  351.805   11.585  ?   ?   677.636   11.170 0.000000 11.16970 
1 1 1   13    2    5 o  332.676   4.1800   84.713   2.1285   80.949   3.4418   87.044   2.7085  325.159   6.9155  337.208   5.2476 -12.04837 8.681114 
1 1 1   13    2    6 o  295.296   7.0456   66.762   3.1845   0.0000   0.0000   66.762   3.1845  ?   ?   295.296   7.0456 0.000000 7.045596 
1 1 1   13    2    7 o  900.974   5.9658  621.424   8.2271  644.731   13.544  607.795   10.357  917.504   9.6444  890.961   7.5944 26.54291 12.27557 
1 1 1   13    2    8 f  663.084   5.0481  336.560   5.1235  339.501   8.1966  334.673   6.5639  665.875   8.0421  661.181   6.4859 4.694519 10.33163 
1 1 1   13    2    9 o  161.924   4.8646   20.070   1.2057   22.653   1.6437   17.061   1.7740  172.019   6.2426  149.070   7.8018 22.94962 9.991910 
1 1 1   13    2   10 o  1163.52   6.5328  1036.37   11.634  1047.02   16.614  1026.13   16.297  1169.30   9.2831  1157.58   9.1978 11.71704 13.06810 
1 1 1   13    2   11 o  175.658   4.6859   23.618   1.2599   24.196   1.8556   23.124   1.7161  177.779   6.8190  173.800   6.4511 3.979446 9.387001 
1 1 1   13    2   12 o  377.563   3.8850  109.109   2.2452  110.550   3.4130  108.010   2.9809  380.024   5.8675  375.643   5.1845 4.381409 7.829876 
1 1 1   13    2   13 o  422.417   3.7471  136.571   2.4228  135.922   3.4111  137.232   3.4417  421.394   5.2886  423.420   5.3104 -2.025940 7.494635 
1 1 1   13    2   14 o  384.124   4.1312  112.934   2.4290  111.151   3.7807  114.187   3.1696  381.052   6.4822  386.236   5.3615 -5.184326 8.412154 
1 1 1   13    2   15 o  204.404   5.6657   31.981   1.7726   30.995   2.6563   32.773   2.3801  201.205   8.6253  206.904   7.5154 -5.699295 11.44015 
1 1 1   13    2   16 o  1279.54   6.6493  1253.30   13.023  1236.79   17.008  1276.69   20.246  1270.98   8.7429  1291.22   10.244 -20.24023 13.46745 
1 1 1   13    2   17 o  1213.88   6.9329  1127.99   12.881  1112.57   21.954  1136.09   15.907  1205.26   11.901  1218.15   8.5315 -12.89648 14.64282 
1 1 1   13    2   18 o  173.838   6.4064   23.133   1.7046   20.313   2.6348   25.163   2.2355  162.518   10.651  181.294   8.0561 -18.77568 13.35463 
1 1 1   13    2   19 o  1171.67   5.9237  1050.84   10.623  1044.16   14.978  1057.59   15.070  1167.83   8.3792  1175.32   8.3770 -7.486816 11.84847 
1 1 1   13    2   20 o  497.728   4.7569  189.618   3.6240  197.366   4.9127  180.369   5.3676  507.770   6.3209  485.397   7.2246 22.37271 9.599432 
1 1 1   13    2   21 o  1084.60   6.5887  900.516   10.938  897.054   15.434  904.009   15.504  1082.38   9.3158  1086.56   9.3223 -4.187500 13.17913 
1 1 1   13    2   22 o  811.309   5.3311  503.836   6.6202  515.031   10.351  496.086   8.6120  820.172   8.2451  804.994   6.9894 15.17841 10.80899 
1 1 1   13    2   23 o  919.966   5.6572  647.851   7.9661  643.055   10.576  654.141   12.111  916.480   7.5392  924.296   8.5606 -7.815918 11.40713 
1 1 1   13    2   24 o  677.414   4.8808  351.253   5.0608  351.266   7.2608  351.241   7.0576  677.367   7.0031  677.349   6.8073 0.1751709E-01 9.766414 
1 1 1   13    2   25 o  790.180   5.5265  477.958   6.6841  471.083   8.8048  487.308   10.269  784.409   7.3334  797.753   8.4096 -13.34375 11.15798 
1 1 1   13    2   26 o  548.944   5.5062  230.674   4.6265  225.207   7.2994  234.345   5.9813  542.300   8.7939  553.253   7.0632 -10.95270 11.27926 
1 1 1   13    2   27 o  363.210   7.0256  101.003   3.9058   96.037   7.3546  102.954   4.6096  353.969   13.575  366.673   8.2131 -12.70422 15.86582 
1 1 1   13    2   28 o  632.401   5.2761  306.149   5.1071  308.325   7.4230  304.194   7.0375  634.558   7.6425  630.307   7.2945 4.250610 10.56491 
1 1 1   13    2   29 o  392.839   7.0427  118.161   4.2347  117.680   6.1039  118.608   5.8799  391.936   10.175  393.495   9.7625 -1.559021 14.10077 
1 1 1   13    2   30 f  477.164   5.7445  174.311   4.1956  177.243   6.0588  171.609   5.8156  481.075   8.2281  473.375   8.0264 7.700073 11.49460 
1 1 1   13    2   31 o  741.157   5.8119  420.559   6.5932  428.416   10.280  415.069   8.5934  747.849   8.9807  736.201   7.6260 11.64740 11.78172 
1 1 1   13    2   32 o  481.052   5.9023  177.180   4.3460  176.738   6.2916  177.583   6.0103  480.335   8.5574  481.501   8.1551 -1.166779 11.82097 
1 1 1   13    2   33 o  258.223   10.205   51.107   4.0335   50.799   4.9666   51.703   6.9130  257.344   12.609  258.758   17.558 -1.413727 21.61648 
1 1 1   13    2   34 o  384.551   8.1302  113.297   4.7855  114.075   7.1488  112.666   6.4417  385.615   12.112  383.308   10.980 2.306915 16.34773 
1 1 1   13    2   35 o  429.168   6.8991  141.085   4.5320  142.215   6.0876  139.679   6.7879  430.734   9.2335  426.785   10.391 3.948853 13.90068 
1 1 1   13    2   36 o  424.756   6.4891  138.199   4.2189  141.252   6.1068  135.411   5.8352  429.222   9.2953  420.272   9.0710 8.949707 12.98792 
1 1 1   13    2   37 o  163.064   13.002   20.560   3.2183   18.827   4.6800   22.114   4.4327  154.819   20.233  168.497   17.440 -13.67868 26.71188 
1 1 1   13    2   38 o  182.115   12.826   25.618   3.5523   23.328   5.1605   27.681   4.8974  172.572   19.901  188.686   17.144 -16.11369 26.26766 
1 1 1   13    2   39 f  124.516   17.611   12.206   3.2628   12.317   4.3284   12.059   4.9657  123.848   23.696  121.862   27.300 1.985611 36.14959 
1 1 1   13    2   40 o  333.873   8.1116   85.495   4.1453   89.052   5.8479   81.904   5.8770  340.409   11.223  326.395   11.764 14.01413 16.25886 
1 1 1   13    2   41 o  137.962   17.416   14.953   3.5957   17.353   5.1336   12.642   5.0380  147.372   23.551  124.557   27.189 22.81535 35.97039 
1 1 1   13    2   42 o  431.361   6.4643  142.644   4.2681  141.224   6.1314  143.980   5.9448  428.814   9.3415  433.038   8.9690 -4.223724 12.95020 
1 1 1   13    2   43 o  494.797   6.2695  187.697   4.7482  194.951   6.9215  181.248   6.5259  503.805   8.9758  485.814   8.7761 17.99081 12.55323 
1 1 1   13    2   44 o  440.834   6.8765  149.076   4.6399  151.494   7.2006  147.359   6.0677  443.681   10.603  437.913   9.0524 5.767761 13.94160 
1 1 1   13    2   45 o  193.286   12.209   28.937   3.5935   30.112   4.8352   27.487   5.3708  196.303   16.238  186.757   19.056 9.545181 25.03570 
1 1 1   13    2   46 o  278.514   10.980   59.801   4.6810   53.628   6.9979   64.799   6.2972  261.711   17.571  289.208   14.225 -27.49634 22.60769 
1 1 1   13    2   47 f  100.568   22.757   8.3036   3.4212   8.7456   5.1064   7.9436   4.6084  102.707   30.364   98.123   28.800 4.583809 41.84991 
1 1 1   13    2   48 o   85.461   25.022   5.9607   3.4826   9.4162   5.4135   3.5211   4.5488  106.093   31.236   75.452   28.615 30.64140 42.36149 
1 1 1   13    2   49 o  198.945   11.907   30.723   3.6090   29.204   5.1237   32.219   5.0845  192.344   17.598  202.447   16.553 -10.10333 24.16010 
1 1 1   13    2   50 o  348.298   8.4827   93.384   4.5222   91.528   6.1132   95.628   6.7208  343.946   11.612  351.263   12.500 -7.317047 17.06142 
1 1 1   13    2   51 o  290.009   9.7255   64.898   4.3171   63.270   6.4607   66.211   5.8028  284.421   14.892  291.996   12.983 -7.575012 19.75723 
1 1 1   13    2   52 o   57.428   24.885  -0.1481   4.0384   0.2454   5.6860  -0.5487   5.7365   68.627   29.633   66.654   29.256 1.972733 41.64213 
1 1 1   13    2   53 o  262.263   10.348   53.207   4.1540   52.486   5.9837   53.879   5.7714  258.475   15.191  262.221   14.435 -3.745789 20.95589 
1 1 1   13    2   54 o  266.138   10.186   54.817   4.1493   52.705   6.0847   56.653   5.6729  258.678   15.438  268.969   13.826 -10.29099 20.72451 
1 1 1   13    2   55 o  237.487   12.114   44.025   4.3888   46.497   6.9262   42.366   5.6731  240.751   18.949  231.221   16.131 9.530197 24.88475 
1 1 1   13    2   56 o  400.501   10.138  124.421   6.2148  114.964   8.4252  135.708   9.2045  382.391   14.395  415.398   14.477 -33.00705 20.41520 
1 1 1   13    2   57 o  263.652   12.235   54.374   4.9373   54.129   7.2385   54.587   6.7518  259.014   18.377  261.086   16.988 -2.071381 25.02625 
1 1 1   13    2   58 o  158.534   15.404   20.134   3.6908   23.178   5.2363   17.128   5.2029  167.217   20.916  141.141   24.999 26.07529 32.59470 
1 1 1   13    2   59 o   66.830   25.422   3.1127   3.5970  -2.9960   5.2188   8.6408   4.9647   55.561   25.757   97.311   30.188 -41.75035 39.68264 
1 1 1   13    2   60 o   76.436   25.712   5.0181   3.5572   9.2180   5.0733   0.9564   4.9891   99.008   30.483   64.067   27.711 34.94167 41.19630 
1 1 1   13    2   61 o   99.367   24.517   8.9021   3.7060   10.113   4.8943   7.2750   5.6736  102.952   29.526   88.512   32.260 14.43916 43.73262 
1 1 1   13    2   62 o  102.976   25.331   9.7500   3.9651   14.715   5.6024   4.7668   5.6128  123.279   29.979   77.629   31.096 45.65043 43.19368 
1 1 1   13    3    0 o  826.496   12.268  523.472   15.512  523.472   15.512  523.472   15.512  826.496   12.268  826.496   12.268 0.000000 0.000000 
1 1 1   13    3    1 o  561.565   7.0315  241.450   6.0439  235.102   8.5131  247.901   8.5820  554.009   10.039  568.899   9.8556 -14.89032 14.06836 
1 1 1   13    3    2 f  596.258   5.9141  272.170   5.3975  266.630   9.4395  274.861   6.5792  589.968   10.453  599.156   7.1740 -9.187012 12.67818 
1 1 1   13    3    3 o  734.628   8.2350  413.265   9.2597  407.804   13.042  418.816   13.149  729.543   11.680  739.332   11.619 -9.788391 16.47494 
1 1 1   13    3    4 o  250.659   9.4940   48.121   3.6425   0.0000   0.0000   48.121   3.6425  ?   ?   250.659   9.4940 0.000000 9.493998 
1 1 1   13    3    5 o  521.404   7.3591  208.153   5.8731  192.749   8.0494  225.690   8.5885  501.624   10.484  542.804   10.337 -41.18045 14.72301 
1 1 1   13    3    6 o  429.875   5.8157  141.463   3.8266  143.542   4.7658  137.691   6.4197  432.991   7.1909  423.997   9.8920 8.993896 12.22952 
1 1 1   13    3    7 o  590.680   5.5091  267.083   4.9809  256.863   6.8524  278.532   7.2527  579.202   7.7294  603.133   7.8562 -23.93115 11.02105 
1 1 1   13    3    8 o  755.945   6.1452  437.464   7.1105  431.829   9.8783  443.523   10.243  750.958   8.5941  761.049   8.7932 -10.09045 12.29546 
1 1 1   13    3    9 o  761.209   5.4648  443.549   6.3671  454.912   10.388  436.710   8.0585  770.766   8.8048  755.268   6.9708 15.49884 11.23020 
1 1 1   13    3   10 o  869.964   5.3355  579.332   7.1047  589.687   10.209  569.606   9.8940  877.616   7.5996  862.548   7.4941 15.06763 10.67313 
1 1 1   13    3   11 o  615.970   4.1858  290.408   3.9465  285.376   5.9137  294.448   5.2991  610.565   6.3279  620.212   5.5820 -9.646790 8.438054 
1 1 1   13    3   12 o  1034.24   5.6122  818.789   8.8843  819.141   13.540  818.522   11.773  1034.33   8.5521  1034.00   7.4389 0.3338623 11.33474 
1 1 1   13    3   13 o   61.100   12.192   2.9614   1.1003   3.6722   1.7675   2.5117   1.4059   67.892   17.036   56.440   15.701 11.45182 23.16805 
1 1 1   13    3   14 o  433.949   4.0672  144.131   2.7015  141.354   4.1317  146.206   3.5704  429.719   6.2816  437.046   5.3373 -7.326630 8.242895 
1 1 1   13    3   15 o  736.331   5.1117  415.000   5.7611  406.193   8.1628  423.741   8.1323  728.421   7.3213  743.994   7.1412 -15.57312 10.22733 
1 1 1   13    3   16 o  887.951   5.2288  603.507   7.1065  601.851   10.893  604.734   9.3768  886.643   8.0267  888.805   6.8925 -2.161865 10.57990 
1 1 1   13    3   17 o  683.076   4.6610  357.132   4.8732  350.816   7.3608  362.060   6.5023  676.957   7.1038  687.743   6.1769 -10.78619 9.413763 
1 1 1   13    3   18 o  781.084   4.6646  466.967   5.5767  461.439   7.8487  472.605   7.9252  776.401   6.6045  785.739   6.5897 -9.338013 9.329728 
1 1 1   13    3   19 o  1118.30   6.1338  957.298   10.499  981.659   16.496  940.708   13.613  1132.28   9.5182  1108.49   8.0230 23.78809 12.44850 
1 1 1   13    3   20 o  983.780   5.3434  740.810   8.0461  739.393   11.427  742.203   11.332  982.757   7.5964  984.626   7.5189 -1.868958 10.68826 
1 1 1   13    3   21 o  568.695   5.2784  247.554   4.5946  247.171   6.6784  247.899   6.3311  568.201   7.6789  569.048   7.2687 -0.8468018 10.57357 
1 1 1   13    3   22 o  1036.97   5.9648  823.128   9.4674  816.904   12.512  831.464   14.480  1032.95   7.9137  1042.05   9.0786 -9.100220 12.04355 
1 1 1   13    3   23 o  667.758   5.0970  341.313   5.2096  337.389   7.0056  346.167   7.7920  663.860   6.8944  672.419   7.5707 -8.558350 10.23957 
1 1 1   13    3   24 o  868.582   6.0408  577.528   8.0311  571.089   11.352  583.981   11.364  863.613   8.5875  873.311   8.5013 -9.697632 12.08381 
1 1 1   13    3   25 o  871.748   6.1336  581.759   8.1842  592.677   11.894  571.943   11.279  879.757   8.8330  864.249   8.5260 15.50793 12.27661 
1 1 1   13    3   26 o  641.993   5.0572  315.492   4.9694  301.454   6.9766  329.950   7.0802  627.480   7.2640  656.475   7.0463 -28.99561 10.12005 
1 1 1   13    3   27 o  609.250   5.1406  284.137   4.7938  286.937   7.0272  281.699   6.5562  612.168   7.4997  606.570   7.0616 5.597412 10.30102 
1 1 1   13    3   28 o  455.401   6.3491  158.777   4.4256  161.771   6.4740  156.150   6.0637  459.583   9.2032  451.544   8.7734 8.039093 12.71501 
1 1 1   13    3   29 o  383.946   6.4436  112.864   3.7868  105.116   6.0253  117.923   4.8684  370.404   10.627  392.410   8.1055 -22.00604 13.36571 
1 1 1   13    3   30 o  666.995   5.4456  340.581   5.5596  343.337   8.2202  338.257   7.5476  669.567   8.0208  664.627   7.4193 4.939392 10.92606 
1 1 1   13    3   31 o  113.590   18.125   10.156   3.0453  -1.8083   4.8175   18.120   3.9302   59.369   26.399  152.666   17.113 -93.29728 31.46083 
1 1 1   13    3   32 o  538.718   5.7142  222.201   4.7118  231.763   6.9959  214.261   6.3745  550.059   8.3093  528.906   7.8740 21.15289 11.44745 
1 1 1   13    3   33 o  377.339   7.2546  109.053   4.1900  110.643   5.7832  107.296   6.0790  379.952   9.9442  374.122   10.616 5.830139 14.54587 
1 1 1   13    3   34 o  342.104   7.9301   89.662   4.1525   88.580   7.0448   90.239   5.1404  339.692   13.549  343.107   9.7880 -3.415131 16.71490 
1 1 1   13    3   35 o  117.223   18.923   10.851   3.2796   9.1731   4.5128   12.730   4.7742  106.722   27.466  125.970   25.633 -19.24749 37.56875 
1 1 1   13    3   36 o  533.167   6.2934  217.738   5.1359  222.308   6.9883  212.371   7.5736  538.547   8.4777  526.280   9.4019 12.26721 12.65962 
1 1 1   13    3   37 o  316.187   9.0135   76.662   4.3622   77.474   5.4099   75.151   7.3754  317.696   11.125  312.469   15.421 5.227112 19.01521 
1 1 1   13    3   38 o  355.875   7.9448   97.091   4.3276   97.052   5.5130   97.153   6.9855  355.615   10.128  355.501   12.838 0.1138000 16.35204 
1 1 1   13    3   39 o  270.314   8.3656   56.040   3.4613   57.557   4.9803   54.622   4.8139  273.655   11.890  266.594   11.797 7.060852 16.74943 
1 1 1   13    3   40 o   54.198   23.030   0.1052   3.3333   2.4397   4.8466  -1.9903   4.5917   73.465   29.068   56.786   25.474 16.67890 38.65031 
1 1 1   13    3   41 o  472.914   7.1237  171.482   5.1565  172.161   7.4067  170.842   7.1833  473.382   10.222  471.612   9.9511 1.769440 14.26596 
1 1 1   13    3   42 o  345.959   7.1253   91.789   3.7731   91.995   5.4501   91.599   5.2286  345.959   10.292  345.269   9.8937 0.6896667 14.27648 
1 1 1   13    3   43 o  270.189   8.7672   56.063   3.6258   56.536   5.4877   55.697   4.8303  270.728   13.243  268.937   11.734 1.791107 17.69364 
1 1 1   13    3   44 o   57.715   23.021   1.3975   3.0628  -1.1658   4.4606   3.6840   4.2128   57.921   25.595   75.331   27.747 -17.41076 37.74920 
1 1 1   13    3   45 o  628.596   6.5008  303.107   6.2547  301.958   8.3547  304.572   9.4345  626.823   8.7079  629.181   9.7965 -2.357971 13.10726 
1 1 1   13    3   46 o  590.606   7.2945  267.825   6.5942  269.982   9.7084  265.977   8.9847  591.865   10.717  587.730   9.9875 4.135620 14.64910 
1 1 1   13    3   47 o  239.375   9.6835   44.127   3.5480   42.393   5.0967   45.756   4.9422  233.344   14.339  242.724   13.354 -9.379608 19.59444 
1 1 1   13    3   48 o  201.818   11.411   31.557   3.5105   35.284   5.1258   28.264   4.8177  212.264   15.892  189.598   16.774 22.66643 23.10679 
1 1 1   13    3   49 o  142.988   17.021   16.202   3.6521   7.9197   5.4498   22.954   4.9203   98.423   31.770  169.796   19.273 -71.37337 37.15934 
1 1 1   13    3   50 o  468.646   7.7436  168.909   5.5547  175.121   8.2853  163.838   7.4863  475.842   11.376  460.569   10.619 15.27350 15.56207 
1 1 1   13    3   51 o   42.516   20.315  -4.7327   3.7160 -10.7315   5.3702   0.7783   5.1472   44.873   22.097   67.492   28.646 -22.61878 36.17833 
1 1 1   13    3   52 o  159.457   17.165   20.210   4.1234   21.012   5.7461   19.360   5.9207  159.814   24.252  152.359   26.341 7.455017 35.80538 
1 1 1   13    3   53 o  337.657   8.6514   87.917   4.4713   87.949   6.4991   87.888   6.1611  336.293   12.626  336.449   11.964 -0.1556702 17.39398 
1 1 1   13    3   54 o  184.876   13.703   26.831   3.8501   24.967   5.6441   28.453   5.2654  175.145   21.506  188.530   18.484 -13.38460 28.35775 
1 1 1   13    3   55 f  355.417   8.8619   97.584   4.8210   96.944   7.5245   98.029   6.2790  351.824   13.973  355.072   11.553 -3.247620 18.13051 
1 1 1   13    3   56 o  175.265   14.414   24.306   3.8325   20.055   5.3354   28.837   5.5088  155.104   23.185  188.637   19.353 -33.53381 30.20087 
1 1 1   13    3   57 o  101.797   27.320   9.1192   4.3457   10.239   6.2848   8.0932   6.0154  105.878   34.111   96.282   33.409 9.595390 47.74683 
1 1 1   13    3   58 o  111.212   21.887   10.482   3.5930   6.2391   5.0568   14.807   5.1060   86.214   30.576  130.084   26.543 -43.87011 40.49016 
1 1 1   13    3   59 f  262.294   10.747   53.755   4.3146   63.948   6.6857   46.479   5.6482  282.590   15.516  240.886   15.400 41.70427 21.86089 
1 1 1   13    3   60 o  155.600   15.524   19.622   3.6480   15.365   5.1932   23.770   5.1256  130.537   26.886  168.233   20.316 -37.69531 33.69918 
1 1 1   13    3   61 o  159.599   15.660   20.774   3.7762   18.278   4.9179   24.359   5.8945  144.720   22.969  166.702   23.775 -21.98265 33.05762 
1 1 1   13    3   62 o   72.864   26.852   4.4733   3.9463   5.8918   5.4857   2.9520   5.6812   81.651   31.315   71.630   30.231 10.02136 43.52644 
1 1 1   13    4    0 o  746.414   8.1091  426.653   9.2621  426.653   9.2621  426.653   9.2621  746.414   8.1091  746.414   8.1091 0.000000 0.000000 
1 1 1   13    4    1 o  596.671   5.9202  272.545   5.4068  264.748   9.3515  276.461   6.6267  587.891   10.392  600.898   7.2049 -13.00677 12.64563 
1 1 1   13    4    2 o  220.401   7.0104   37.192   2.3650   37.468   3.6258   36.988   3.1201  221.155   10.711  219.761   9.2757 1.394531 14.16919 
1 1 1   13    4    3 o  682.578   7.9596  356.759   8.3159  343.899   11.507  370.817   12.032  669.989   11.221  695.710   11.299 -25.72113 15.92373 
1 1 1   13    4    4 o  518.744   10.087  206.114   8.0095   0.0000   0.0000  206.114   8.0095  ?   ?   518.744   10.087 0.000000 10.08748 
1 1 1   13    4    5 o  465.177   9.9839  165.738   7.1086   0.0000   0.0000  165.738   7.1086  ?   ?   465.177   9.9839 0.000000 9.983852 
1 1 1   13    4    6 f  131.889   8.9621   13.382   1.7985   13.517   2.3130   13.176   2.8600  132.328   11.535  130.295   14.591 2.033340 18.59994 
1 1 1   13    4    7 o  808.347   7.3573  500.278   9.1030  489.642   10.953  524.037   16.370  799.630   8.9486  826.969   12.933 -27.33832 15.72678 
1 1 1   13    4    8 o  229.169   6.8635   40.207   2.4075   41.038   2.9645   38.597   4.1261  231.506   8.3660  224.130   12.072 7.376282 14.68750 
1 1 1   13    4    9 o  384.060   5.3943  112.908   3.1710  124.653   4.6635  102.808   4.3247  403.502   7.5509  366.440   7.7105 37.06119 10.79200 
1 1 1   13    4   10 o  506.501   4.1615  196.359   3.2263  196.543   4.5886  196.178   4.5371  506.709   5.9164  506.240   5.8553 0.4689331 8.323942 
1 1 1   13    4   11 o  129.391   5.4772   12.815   1.0847   11.951   1.7265   13.379   1.3943  124.595   9.1165  132.019   6.9242 -7.423782 11.44792 
1 1 1   13    4   12 o  735.044   4.5845  413.543   5.1579  410.055   7.8088  416.243   6.8698  731.876   6.9707  737.404   6.0866 -5.527588 9.254011 
1 1 1   13    4   13 o  918.463   5.2254  645.702   7.3459  657.226   11.406  637.532   9.6029  926.522   8.0425  912.581   6.8748 13.94073 10.58041 
1 1 1   13    4   14 o  414.030   4.7402  131.208   3.0040  131.451   4.9321  131.064   3.7875  414.370   7.7764  413.788   5.9801 0.5820313 9.809863 
1 1 1   13    4   15 o  783.514   5.7595  469.907   6.9072  470.297   16.096  469.819   7.6470  783.527   13.421  783.425   6.3771 0.1024170 14.85947 
1 1 1   13    4   16 o  1172.56   6.2445  1052.46   11.207  1072.45   17.518  1038.60   14.582  1183.47   9.6709  1164.74   8.1794 18.73889 12.66603 
1 1 1   13    4   17 o  363.470   4.6954  101.118   2.6122  105.076   4.6492   99.292   3.1578  370.470   8.1989  360.163   5.7282 10.30777 10.00171 
1 1 1   13    4   18 o  1305.64   6.3826  1304.91   12.755  1300.18   18.012  1309.68   18.066  1303.12   9.0303  1307.88   9.0244 -4.753662 12.76663 
1 1 1   13    4   19 o  394.816   4.3818  119.310   2.6480  117.626   3.8835  120.772   3.6201  391.996   6.4724  397.211   5.9543 -5.214874 8.794626 
1 1 1   13    4   20 o  1107.84   6.1334  939.475   10.400  940.381   16.009  938.812   13.681  1108.20   9.4376  1107.36   8.0716 0.8481445 12.41848 
1 1 1   13    4   21 o  219.289   7.4201   36.815   2.4906   36.650   3.9395   36.924   3.2145  218.422   11.828  219.592   9.5636 -1.169907 15.21038 
1 1 1   13    4   22 o   81.577   16.966   5.2926   2.0494   1.2216   3.5936   7.2547   2.4948   61.326   24.770   95.756   17.673 -34.43085 30.42786 
1 1 1   13    4   23 o  605.151   6.0291  280.333   5.5845  282.339   7.4707  277.792   8.4075  607.255   8.0375  602.307   9.1196 4.948120 12.15602 
1 1 1   13    4   24 o  725.443   5.7526  402.855   6.3876  412.510   9.3616  394.445   8.7376  733.989   8.3328  717.753   7.9533 16.23615 11.51915 
1 1 1   13    4   25 o  481.914   5.0556  177.772   3.7292  173.928   5.4273  181.210   5.1327  476.622   7.4394  486.511   6.8927 -9.888977 10.14168 
1 1 1   13    4   26 o  844.901   5.2961  546.448   6.8491  555.011   9.9935  538.864   9.4055  851.389   7.6687  838.930   7.3246 12.45874 10.60465 
1 1 1   13    4   27 o  1251.68   6.4779  1199.45   12.411  1201.18   17.708  1197.79   17.399  1252.35   9.2377  1250.59   9.0895 1.751587 12.95976 
1 1 1   13    4   28 o  993.612   6.6686  755.876   10.142  766.599   14.758  746.280   13.961  1000.41   9.6377  987.100   9.2402 13.31348 13.35168 
1 1 1   13    4   29 o  128.546   15.264   12.853   2.9446   8.3428   4.8768   15.440   3.6939  102.789   29.472  140.748   17.526 -37.95865 34.28925 
1 1 1   13    4   30 o  126.683   16.139   12.514   3.0583   7.6267   4.8293   15.787   3.9517   98.857   29.599  142.164   18.607 -43.30722 34.96185 
1 1 1   13    4   31 o  446.982   5.9402  152.968   4.0641  149.067   6.0020  156.271   5.5228  441.132   8.8891  451.707   7.9879 -10.57504 11.95086 
1 1 1   13    4   32 o  573.302   5.5905  251.643   4.9057  244.202   7.1319  258.326   6.7587  564.625   8.2523  580.763   7.6032 -16.13782 11.22090 
1 1 1   13    4   33 o  974.607   6.9499  727.466   10.368  711.145   14.678  743.716   14.646  963.245   9.9554  985.092   9.7134 -21.84711 13.90899 
1 1 1   13    4   34 o  113.488   23.193   10.304   3.8927   0.2770   6.0250   17.489   5.1000   73.177   31.022  148.774   23.149 -75.59743 38.70697 
1 1 1   13    4   35 o  442.616   7.1950  150.083   4.8744  151.108   6.1498  148.350   7.9945  443.996   9.0493  439.674   11.879 4.322021 14.93348 
1 1 1   13    4   36 o  294.442   8.4957   66.455   3.8288   69.503   5.1563   62.708   5.7165  300.946   11.194  285.713   13.072 15.23306 17.20961 
1 1 1   13    4   37 o  258.061   9.5536   51.081   3.7736   48.155   4.7966   55.834   6.1132  250.359   12.517  268.963   14.908 -18.60345 19.46561 
1 1 1   13    4   38 o  147.167   14.691   16.837   3.2651   18.261   4.3930   15.079   4.8804  152.521   19.246  137.353   24.092 15.16771 30.83577 
1 1 1   13    4   39 o  353.439   7.4907   95.767   4.0523   99.369   5.6064   91.827   5.8639  359.761   10.181  345.738   11.081 14.02322 15.04801 
1 1 1   13    4   40 o   76.320   24.907   4.4013   3.3445  -0.4423   4.6221   9.7243   4.8455   61.646   26.668  109.232   28.633 -47.58608 39.12822 
1 1 1   13    4   41 o  152.825   13.577   18.137   3.1427   20.581   4.9996   16.540   4.0409  161.439   20.710  144.924   18.650 16.51585 27.86973 
1 1 1   13    4   42 o  244.116   8.8045   45.754   3.2898   53.683   5.0065   39.728   4.3643  264.010   12.389  226.746   12.625 37.26369 17.68852 
1 1 1   13    4   43 o  348.402   7.3523   93.126   3.9208   96.291   6.2294   91.051   5.0455  353.639   11.508  344.201   9.5768 9.438568 14.97198 
1 1 1   13    4   44 o  567.995   6.0163  247.358   5.2305  256.120   7.8844  240.471   6.9902  577.331   8.9222  559.600   8.1609 17.73083 12.09161 
1 1 1   13    4   45 o  326.436   9.3678   81.954   4.6806   81.956   7.3109   81.952   6.0931  325.282   14.684  325.875   12.216 -0.5933838 19.10073 
1 1 1   13    4   46 o  154.460   15.095   18.685   3.5232   16.095   4.8346   21.618   5.1450  141.018   23.206  164.653   20.884 -23.63454 31.21948 
1 1 1   13    4   47 f  437.181   6.7557  146.720   4.5206  154.346   6.6670  140.230   6.1505  447.665   9.7299  426.789   9.4151 20.87537 13.53940 
1 1 1   13    4   48 o  177.915   12.965   24.641   3.5063   22.898   5.0910   26.213   4.8362  169.497   20.009  182.294   17.549 -12.79732 26.61469 
1 1 1   13    4   49 o   57.457   23.835   0.8625   3.4406  -1.0032   4.8290   2.7860   4.9034   60.337   26.649   73.782   29.223 -13.44490 39.54955 
1 1 1   13    4   50 o  138.388   16.899   15.207   3.5051   19.225   5.2255   11.920   4.7260  153.746   22.904  119.264   26.570 34.48271 35.07910 
1 1 1   13    4   51 o  162.033   15.745   20.712   3.8556   25.686   6.0308   17.274   5.0140  177.983   22.651  145.221   23.348 32.76175 32.53005 
1 1 1   13    4   52 o  371.171   9.5820  106.358   5.4437  104.657   8.2000  107.698   7.2793  366.083   14.634  372.250   12.776 -6.166687 19.42604 
1 1 1   13    4   53 f   83.780   25.554   5.8049   3.5751  -5.4977   5.2472   15.598   4.8842   52.039   24.657  137.052   24.166 -85.01286 34.52484 
1 1 1   13    4   54 o  310.145   9.2758   74.314   4.4034   80.600   6.5665   69.177   5.9358  321.383   13.349  297.879   13.019 23.50357 18.64617 
1 1 1   13    4   55 o  129.115   21.106   13.732   4.0270   25.447   6.2821   5.5605   5.2467  175.033   24.087   85.157   31.025 89.87630 39.27768 
1 1 1   13    4   56 o   85.413   25.822   6.1999   3.6624   10.502   5.2050   1.9809   5.1542  108.748   30.196   70.219   29.154 38.52971 41.97380 
1 1 1   13    4   57 o   99.014   27.436   8.6310   4.3016   5.6052   5.0630   16.483   8.1560   83.794   30.485  130.437   38.322 -46.64317 48.96814 
1 1 1   13    4   58 o  281.288   10.552   61.656   4.5433   42.449   7.0616   75.222   5.9347  227.079   20.539  309.566   12.525 -82.48743 24.05689 
1 1 1   13    4   59 o   70.552   25.437   3.8994   3.5135   2.7855   4.9078   5.0706   5.0321   70.553   28.781   80.116   30.164 -9.562973 41.69190 
1 1 1   13    4   60 o  140.590   17.563   16.309   3.6970   9.4011   5.0655   24.182   5.4081   99.751   30.416  168.809   21.412 -69.05721 37.19650 
1 1 1   13    4   61 o   51.465   22.690  -0.1480   3.4854  -1.9512   4.5913   2.3046   5.3546   53.216   24.487   69.058   29.259 -15.84229 38.15346 
1 1 1   13    5    0 o  513.352   6.7593  201.825   5.3091  201.825   5.3091  201.825   5.3091  513.352   6.7593  513.352   6.7593 0.000000 0.000000 
1 1 1   13    5    1 o  147.928   5.1614   16.751   1.1687   17.566   1.6573   15.944   1.6482  151.471   7.1481  144.110   7.4983 7.361404 10.35951 
1 1 1   13    5    2 o  583.975   7.3824  261.107   6.5987  252.136   9.2067  270.583   9.4626  573.728   10.484  594.349   10.402 -20.62109 14.76846 
1 1 1   13    5    3 o  865.466   9.1280  573.623   12.092  564.883   16.954  582.671   17.251  858.565   12.901  871.976   12.925 -13.41101 18.26213 
1 1 1   13    5    4 o  389.411   9.7541  116.139   5.8139   0.0000   0.0000  116.139   5.8139  ?   ?   389.411   9.7541 0.000000 9.754146 
1 1 1   13    5    5 o  411.204   9.9615  129.503   6.2698   0.0000   0.0000  129.503   6.2698  ?   ?   411.204   9.9615 0.000000 9.961505 
1 1 1   13    5    6 o  762.630   7.1310  445.277   8.3241  440.634   10.142  454.862   14.572  758.572   8.7346  770.505   12.356 -11.93237 15.13122 
1 1 1   13    5    7 o  634.662   6.5963  308.361   6.4078  318.605   8.0566  290.724   10.571  645.065   8.1598  616.063   11.211 29.00153 13.86590 
1 1 1   13    5    8 o  779.650   7.2852  465.370   8.6938  465.786   10.687  464.556   14.948  779.926   8.9525  778.687   12.542 1.238464 15.40907 
1 1 1   13    5    9 o  1351.40   10.534  1398.71   21.789  1404.59   26.817  1387.27   37.376  1353.99   12.940  1344.89   18.157 9.100098 22.29582 
1 1 1   13    5   10 o  917.622   9.8409  644.815   13.822  644.815   13.822   0.0000   0.0000  917.622   9.8409  ?   ?  0.000000 9.840878 
1 1 1   13    5   11 o  690.543   4.7729  364.990   5.0448  373.608   8.8671  360.865   6.1344  698.550   8.2930  686.606   5.8370 11.94403 10.14129 
1 1 1   13    5   12 o  1006.86   5.9639  776.009   9.1911  782.389   16.022  772.880   11.221  1010.78   10.356  1004.77   7.2961 6.002136 12.66821 
1 1 1   13    5   13 o  442.557   5.3268  149.916   3.6084  140.423   5.0881  159.521   5.1180  428.278   7.7617  456.482   7.3250 -28.20444 10.67240 
1 1 1   13    5   14 o  882.185   5.1574  595.692   6.9640  602.000   10.737  591.112   9.1495  886.756   7.9107  878.739   6.8025 8.016968 10.43328 
1 1 1   13    5   15 o  1521.43   7.6195  1772.07   17.744  1771.01   27.101  1772.87   23.475  1520.66   11.644  1521.60   10.079 -0.9362793 15.40024 
1 1 1   13    5   16 o  659.517   4.9487  332.926   4.9956  343.773   9.0753  328.211   5.9837  670.078   8.8484  654.810   5.9701 15.26819 10.67412 
1 1 1   13    5   17 o  1093.89   6.4320  915.978   10.769  921.764   18.655  913.086   13.189  1097.10   11.109  1092.10   7.8899 4.996948 13.62607 
1 1 1   13    5   18 o  1007.57   5.7138  777.082   8.8119  749.617   13.048  800.109   11.948  989.490   8.6154  1022.32   7.6355 -32.82587 11.51201 
1 1 1   13    5   19 o  658.259   4.7538  331.657   4.7896  330.861   7.4721  332.212   6.2403  657.409   7.4257  658.781   6.1886 -1.372375 9.666446 
1 1 1   13    5   20 o  388.859   4.7990  115.740   2.8563  118.061   4.7352  114.412   3.5812  392.694   7.8780  386.607   6.0519 6.087677 9.934255 
1 1 1   13    5   21 o  291.702   6.2510   65.136   2.7910   62.545   4.1875   67.208   3.7438  285.793   9.5726  296.278   8.2556 -10.48447 12.64083 
1 1 1   13    5   22 o  544.130   5.4048  226.636   4.5014  226.532   6.4870  226.732   6.2515  543.950   7.7914  544.198   7.5052 -0.2485352 10.81817 
1 1 1   13    5   23 o  1291.63   7.4847  1277.28   14.797  1265.72   18.019  1301.22   25.932  1285.65   9.1566  1303.18   13.001 -17.52405 15.90172 
1 1 1   13    5   24 o  794.848   5.0630  483.603   6.1597  487.841   8.9070  479.718   8.5277  798.243   7.2900  791.580   7.0383 6.663330 10.13316 
1 1 1   13    5   25 o  776.950   5.0927  462.075   6.0563  460.337   8.7264  463.690   8.4122  775.404   7.3525  778.235   7.0620 -2.830872 10.19467 
1 1 1   13    5   26 o  837.579   5.2896  537.021   6.7813  536.620   9.7915  537.390   9.4009  837.162   7.6414  837.779   7.3311 -0.6165771 10.58941 
1 1 1   13    5   27 o   40.366   18.590  -2.0778   2.6538  -4.5605   3.6554   0.6890   3.8589   43.143   20.482   60.902   25.251 -17.75933 32.51358 
1 1 1   13    5   28 o  1258.63   7.0083  1212.93   13.501  1256.57   21.623  1185.04   17.285  1280.64   11.031  1243.88   9.0786 36.75525 14.28670 
1 1 1   13    5   29 o  401.218   6.5321  123.250   4.0115  118.169   6.9034  125.840   4.9290  392.684   11.486  405.370   7.9440 -12.68594 13.96515 
1 1 1   13    5   30 f  354.184   6.5731   96.051   3.5634   97.962   5.5419   94.705   4.6528  357.574   10.126  351.632   8.6448 5.942139 13.31396 
1 1 1   13    5   31 o  406.996   6.1915  126.830   3.8571  134.871   5.9506  121.005   5.0651  419.579   9.2657  397.464   8.3257 22.11444 12.45681 
1 1 1   13    5   32 o  565.023   5.6240  244.432   4.8639  242.087   7.1440  246.458   6.6406  562.162   8.3025  567.256   7.6482 -5.093079 11.28836 
1 1 1   13    5   33 o  451.499   7.3132  156.139   5.0540  158.387   7.9032  154.584   6.5738  454.471   11.361  449.113   9.5629 5.358337 14.85018 
1 1 1   13    5   34 o  176.850   13.997   24.167   3.7579   26.620   4.6307   19.437   6.4309  185.336   16.496  156.022   27.956 29.31429 32.46000 
1 1 1   13    5   35 o  220.629   9.9507   37.327   3.3604   38.137   4.6235   36.420   4.8925  222.403   13.648  217.174   14.806 5.228897 20.13687 
1 1 1   13    5   36 o  237.758   9.3360   43.347   3.3975   42.597   4.7371   44.141   4.8756  235.094   13.218  239.312   13.364 -4.217941 18.79650 
1 1 1   13    5   37 o   66.034   23.462   2.9277   2.9787   0.7799   4.4412   4.6837   4.0158   64.864   27.008   80.403   27.318 -15.53906 38.41520 
1 1 1   13    5   38 o  450.417   6.1624  155.430   4.2485  162.230   6.3275  149.847   5.7329  459.888   8.9890  442.043   8.4731 17.84406 12.35293 
1 1 1   13    5   39 o  560.167   6.2643  240.441   5.3711  236.365   7.3488  245.116   7.8696  555.091   8.6493  565.203   9.0966 -10.11218 12.55227 
1 1 1   13    5   40 o  268.391   10.363   55.333   4.2570   60.051   5.5371   48.512   6.6571  279.311   12.952  249.858   17.518 29.45335 21.78563 
1 1 1   13    5   41 o  341.785   7.9278   89.616   4.1474   92.720   6.0812   86.918   5.6709  347.202   11.443  336.225   11.019 10.97736 15.88597 
1 1 1   13    5   42 o  219.728   9.9833   37.105   3.3576   33.020   5.0390   40.368   4.5029  205.980   16.111  228.503   12.927 -22.52306 20.65628 
1 1 1   13    5   43 o  277.897   8.2484   59.290   3.5085   55.915   5.1896   62.131   4.7615  269.306   12.590  284.134   10.948 -14.82809 16.68448 
1 1 1   13    5   44 o  204.999   10.608   32.434   3.3173   34.609   4.9316   30.638   4.4832  210.824   15.389  198.412   14.870 12.41164 21.39956 
1 1 1   13    5   45 o   78.300   27.380   4.4416   4.0438  -4.3933   6.7145   9.4696   5.0654   64.358   29.614  106.893   29.827 -42.53436 42.03119 
1 1 1   13    5   46 o  313.753   8.6123   75.690   4.1360   71.537   5.6174   80.607   6.1122  304.346   12.059  322.988   12.363 -18.64160 17.27039 
1 1 1   13    5   47 o  104.306   20.569   8.8413   3.1672   5.4564   4.6789   11.704   4.3029   85.141   29.469  119.307   24.386 -34.16615 38.25080 
1 1 1   13    5   48 o  323.172   8.2620   80.324   4.0869   84.191   6.0773   77.132   5.5220  329.953   12.033  315.981   11.417 13.97202 16.58784 
1 1 1   13    5   49 f  338.048   8.4364   87.941   4.3652   85.883   6.1608   90.016   6.1859  333.108   12.083  341.103   11.848 -7.994446 16.92288 
1 1 1   13    5   50 o  235.104   10.547   42.694   3.7953   45.694   5.5989   40.144   5.1623  241.576   15.220  226.454   14.978 15.12224 21.35369 
1 1 1   13    5   51 o  253.092   10.171   49.476   3.9401   51.832   5.8426   47.511   5.3362  257.296   14.899  246.560   14.200 10.73552 20.58201 
1 1 1   13    5   52 o   70.767   27.295   3.0027   4.1841   4.7509   6.2960   1.6198   5.5996   86.135   33.409   72.362   30.245 13.77299 45.06555 
1 1 1   13    5   53 o   45.985   21.291  -2.6384   3.5493  -4.0950   5.4514  -1.5667   4.6761   56.154   26.131   57.191   25.678 -1.036411 36.63588 
1 1 1   13    5   54 o   77.798   26.726   4.7390   3.8447   7.7174   6.4224   3.0754   4.7997   97.196   34.460   73.397   28.963 23.79867 45.01504 
1 1 1   13    5   55 o  176.814   15.125   24.760   4.0541   20.556   6.3155   27.707   5.2872  155.064   27.622  185.425   18.893 -30.36157 33.46485 
1 1 1   13    5   56 o  265.686   11.068   54.924   4.5010   37.929   7.0748   66.480   5.8340  214.883   21.812  291.356   13.082 -76.47388 25.43456 
1 1 1   13    5   57 o   81.041   27.951   5.4063   4.2075   5.8112   4.9185   4.3015   8.1242   84.382   30.131   87.461   36.482 -3.078621 47.31604 
1 1 1   13    5   58 o  114.417   21.536   11.062   3.6332   11.665   4.9628   10.365   5.3336  113.990   28.515  106.417   30.911 7.572815 42.05502 
1 1 1   13    5   59 o   79.023   25.689   5.3786   3.5590   4.9956   4.8857   5.8116   5.1949   79.332   29.751   83.527   30.805 -4.194725 42.82571 
1 1 1   13    5   60 o   53.350   23.412  -0.0442   3.6716   0.6067   4.8474  -0.9202   5.6236   62.098   27.084   61.798   27.915 0.2998390 38.89402 
1 1 1   13    5   61 o   43.460   20.285  -2.3869   3.3242  -4.6013   4.4862   0.3092   4.9501   46.745   22.331   61.150   26.996 -14.40522 35.03491 
1 1 1   13    6    1 o  750.610   5.7646  431.298   6.6230  427.255   9.3017  435.456   9.4323  746.989   8.1354  754.123   8.1716 -7.133728 11.53081 
1 1 1   13    6    2 o  1145.99   9.0113  1005.70   15.807  978.805   26.699  1020.22   19.613  1129.89   15.438  1154.05   11.103 -24.15515 19.01608 
1 1 1   13    6    3 o  255.417   7.4133   49.948   2.8982   44.714   4.1044   55.152   4.0929  241.604   11.099  268.349   9.9647 -26.74448 14.91577 
1 1 1   13    6    4 o  553.421   7.0831  234.482   6.0000  228.890   7.9733  241.784   9.1104  546.700   9.5284  561.843   10.594 -15.14337 14.24848 
1 1 1   13    6    5 o  868.067   9.3377  577.056   12.407  547.472   16.754  612.977   18.462  845.279   12.950  894.374   13.486 -49.09479 18.69664 
1 1 1   13    6    6 o  380.411   7.5291  110.795   4.3839  108.986   6.2353  112.563   6.1649  377.215   10.799  383.362   10.506 -6.147644 15.06684 
1 1 1   13    6    7 f  554.378   7.8937  235.307   6.6982  250.819   9.9986  222.678   9.0219  572.227   11.416  539.192   10.932 33.03552 15.80563 
1 1 1   13    6    8 o  319.702   8.2138   78.257   4.0194   84.902   5.9824   72.789   5.4267  332.922   11.740  308.266   11.501 24.65637 16.43470 
1 1 1   13    6    9 o  1036.29   10.703  822.468   16.977  838.667   24.584  807.703   23.471  1046.05   15.355  1026.60   14.937 19.45117 21.42143 
1 1 1   13    6   10 o  544.848   7.5189  227.269   6.2704  227.269   6.2704   0.0000   0.0000  544.848   7.5189  ?   ?  0.000000 7.518859 
1 1 1   13    6   11 o  231.581   5.4357   41.051   1.9268   38.731   2.4267   45.008   3.1694  224.929   7.0486  242.456   8.5403 -17.52644 11.07331 
1 1 1   13    6   12 o  447.794   4.8725  153.481   3.3397  156.081   4.2946  149.503   5.3119  451.552   6.2136  441.906   7.8533 9.646698 10.01418 
1 1 1   13    6   13 o  814.354   5.8462  507.630   7.2871  505.996   9.3153  510.206   11.698  812.993   7.4859  816.298   9.3625 -3.304626 11.98727 
1 1 1   13    6   14 o  835.603   5.0000  534.439   6.3950  538.108   9.8352  531.751   8.4173  838.391   7.6642  833.458   6.5981 4.933044 10.11310 
1 1 1   13    6   15 o  999.632   6.0818  764.902   9.3056  759.533   16.169  767.560   11.379  995.917   10.607  1001.32   7.4243 -5.402344 12.94737 
1 1 1   13    6   16 o  1230.42   7.0213  1158.94   13.223  1167.58   23.262  1154.81   16.073  1234.66   12.309  1228.15   8.5500 6.513428 14.98731 
1 1 1   13    6   17 o  795.932   5.3425  484.907   6.5086  480.927   11.084  487.002   8.0409  792.541   9.1371  797.617   6.5863 -5.076477 11.26349 
1 1 1   13    6   18 o  1093.03   6.0251  914.513   10.080  894.173   15.084  930.925   13.550  1080.66   9.1194  1102.71   8.0279 -22.04211 12.14955 
1 1 1   13    6   19 o  446.253   4.6009  152.425   3.1426  142.346   4.8887  159.523   4.1026  431.205   7.4070  456.508   5.8714 -25.30341 9.451869 
1 1 1   13    6   20 o  1011.52   5.7980  783.212   8.9769  790.158   13.941  778.291   11.733  1015.86   8.9656  1008.27   7.6029 7.588562 11.75522 
1 1 1   13    6   21 o  417.753   6.1231  133.593   3.9152  131.542   5.0682  136.628   6.1658  414.500   7.9884  422.401   9.5366 -7.901367 12.44029 
1 1 1   13    6   22 o  958.096   6.7938  702.734   9.9631  710.422   13.040  691.954   15.442  963.219   8.8450  950.508   10.614 12.71155 13.81621 
1 1 1   13    6   23 o  566.072   5.4235  245.286   4.6992  243.048   6.9434  247.178   6.3832  563.413   8.0514  568.201   7.3396 -4.788452 10.89471 
1 1 1   13    6   24 o  826.518   5.1637  522.914   6.5326  520.481   9.3515  525.233   9.1294  824.506   7.4100  828.271   7.2011 -3.764526 10.33268 
1 1 1   13    6   25 o  457.510   5.1208  160.225   3.5860  160.416   5.2967  160.064   4.8725  457.726   7.5602  457.240   6.9621 0.4861450 10.27750 
1 1 1   13    6   26 f  227.592   7.6470   39.661   2.6639   37.353   4.0472   41.425   3.5385  220.463   12.039  232.559   9.9406 -12.09583 15.61274 
1 1 1   13    6   27 o  509.966   5.6298  199.088   4.3944  195.112   6.0482  203.534   6.3956  504.781   7.8281  515.551   8.1048 -10.76978 11.26791 
1 1 1   13    6   28 o  285.974   7.7446   62.624   3.3900   65.187   6.2808   61.571   4.0269  291.575   14.073  283.523   9.2793 8.051971 16.85701 
1 1 1   13    6   29 o  696.952   5.6537  371.868   6.0312  370.680   9.4711  372.678   7.8223  695.669   8.8946  697.632   7.3255 -1.963989 11.52288 
1 1 1   13    6   30 o  296.121   7.1501   67.148   3.2408   73.132   4.8807   62.428   4.3342  308.939   10.321  285.450   9.9199 23.48859 14.31560 
1 1 1   13    6   31 o  143.884   14.111   16.035   3.0678   13.227   4.2391   19.123   4.4453  129.271   22.225  156.595   18.930 -27.32375 29.19459 
1 1 1   13    6   32 o  161.786   12.943   20.207   3.1783   17.413   4.3917   23.280   4.6055  149.153   19.720  173.146   17.623 -23.99345 26.44753 
1 1 1   13    6   33 o  561.364   6.1502  241.320   5.2845  255.825   9.0063  233.705   6.5259  577.682   10.186  552.339   7.7191 25.34326 12.78013 
1 1 1   13    6   34 o  744.442   6.5159  424.461   7.4247  423.872   9.2590  425.523   12.427  743.765   8.1331  744.854   10.900 -1.088989 13.59981 
1 1 1   13    6   35 o  233.324   8.9739   41.733   3.2049   48.573   4.8829   36.556   4.2479  251.188   12.742  217.814   12.798 33.37469 18.05924 
1 1 1   13    6   36 o  351.165   7.1161   94.487   3.8249   89.941   5.2928   99.456   5.5338  342.410   10.099  360.072   10.041 -17.66144 14.24083 
1 1 1   13    6   37 o  347.910   6.8713   92.748   3.6591   90.277   5.4518   94.775   4.9361  342.973   10.385  351.521   9.1740 -8.548035 13.85680 
1 1 1   13    6   38 o  479.008   5.9901  175.783   4.3918  183.061   6.6141  170.044   5.8736  488.524   8.8454  470.915   8.1488 17.60876 12.02678 
1 1 1   13    6   39 o  159.557   12.166   19.688   2.9489   18.463   4.3632   20.718   4.0011  153.310   19.001  163.059   16.247 -9.748810 25.00018 
1 1 1   13    6   40 o  242.926   9.8709   45.319   3.6703   53.602   5.4483   38.437   4.9663  263.452   13.557  222.792   14.645 40.65971 19.95657 
1 1 1   13    6   41 f  179.525   12.006   24.914   3.2799   24.197   4.8491   25.518   4.4532  175.753   18.294  180.962   16.251 -5.208908 24.46925 
1 1 1   13    6   42 o  220.857   10.304   37.502   3.4833   42.643   5.1272   33.094   4.7471  234.583   14.348  206.392   15.132 28.19154 20.85328 
1 1 1   13    6   43 o  157.083   13.480   19.184   3.2097   19.815   4.4748   18.516   4.6064  158.520   18.809  152.822   20.187 5.697800 27.59179 
1 1 1   13    6   44 o  684.019   6.3161  358.831   6.6128  354.867   9.0510  363.369   9.6849  679.590   8.7012  687.520   9.2033 -7.929871 12.66534 
1 1 1   13    6   45 o   88.962   24.517   6.4670   3.4456   18.715   6.5533   1.7876   4.0507  150.306   29.538   65.649   26.374 84.65678 39.59925 
1 1 1   13    6   46 o  291.658   9.8030   65.502   4.3763   62.910   5.4233   70.341   7.4093  285.300   12.419  300.242   16.182 -14.94244 20.39869 
1 1 1   13    6   47 o  125.779   16.969   12.554   3.1835   13.939   4.6966   11.377   4.3301  130.431   24.423  117.439   24.863 12.99185 34.85184 
1 1 1   13    6   48 o   74.455   24.572   4.2831   3.2517   1.4352   4.5508   7.2537   4.6478   66.792   27.534   94.150   29.209 -27.35842 40.14034 
1 1 1   13    6   49 o  235.100   10.290   42.652   3.7028   37.594   5.3770   47.213   5.1067  218.844   16.167  246.237   13.602 -27.39259 21.12759 
1 1 1   13    6   50 o  166.248   13.769   21.629   3.4722   19.822   5.0349   23.268   4.7947  156.605   21.578  170.966   18.624 -14.36118 28.50330 
1 1 1   13    6   51 o  107.673   23.546   9.6422   3.7725   8.9124   5.0804   10.539   5.6325  102.490   30.283  110.732   31.649 -8.242630 43.80299 
1 1 1   13    6   52 o  120.186   21.430   11.846   3.7976   16.115   6.2308   9.3231   4.7902  136.767   30.536  104.458   28.955 32.30868 42.08176 
1 1 1   13    6   53 o  197.607   12.602   30.494   3.7918   33.669   5.6348   27.867   5.1259  205.563   18.093  186.860   18.151 18.70364 25.62852 
1 1 1   13    6   54 o   96.987   24.994   7.9877   3.7337   11.593   5.8921   5.5689   4.8264  114.543   32.242   84.436   29.880 30.10714 43.95881 
1 1 1   13    6   55 o  104.801   23.987   9.3218   3.7647   7.8809   5.6918   10.442   5.0195   96.226   32.524  109.101   29.396 -12.87456 43.83997 
1 1 1   13    6   56 o   77.689   27.790   4.6901   4.1855  -1.4405   7.4223   7.5486   5.0683   71.436   32.187   93.461   30.669 -22.02567 44.45890 
1 1 1   13    6   57 o   78.419   28.881   4.7245   4.5642  -1.5249   5.4403   19.578   8.3872   60.851   27.474  142.321   37.846 -81.47017 46.76717 
1 1 1   13    6   58 o  120.473   20.848   12.182   3.7052   9.4591   5.0787   15.281   5.4176  101.932   30.316  131.153   27.848 -29.22116 41.16525 
1 1 1   13    6   59 o  189.090   13.372   28.430   3.8453   28.433   5.2779   28.427   5.6139  185.767   18.822  184.794   20.176 0.9733429 27.59170 
1 1 1   13    6   60 o   40.549   19.485  -4.3926   3.5277  -6.8040   4.5512  -0.7638   5.5831   43.562   21.216   61.887   27.897 -18.32464 35.04814 
1 1 1   13    6   61 o  162.328   14.354   21.313   3.5298   19.857   4.7221   23.156   5.3138  152.325   20.797  163.885   21.718 -11.56029 30.06983 
1 1 1   13    7    0 o  260.296   6.5469   51.959   2.6047   51.959   2.6047   51.959   2.6047  260.296   6.5469  260.296   6.5469 0.000000 0.000000 
1 1 1   13    7    1 o  282.865   6.5626   61.254   2.8414   61.254   2.8414   0.0000   0.0000  282.865   6.5626  ?   ?  0.000000 6.562604 
1 1 1   13    7    2 o  674.951   5.4747  348.720   5.6559  351.409   8.0742  346.128   7.9251  677.475   7.7864  672.369   7.7007 5.106262 10.95121 
1 1 1   13    7    3 o  737.198   8.3726  416.122   9.4474  397.640   12.768  438.486   14.045  720.479   11.578  756.545   12.128 -36.06561 16.76737 
1 1 1   13    7    4 o  520.293   10.704  207.337   8.5243   0.0000   0.0000  207.337   8.5243  ?   ?   520.293   10.704 0.000000 10.70391 
1 1 1   13    7    5 f  545.253   5.9560  227.583   4.9708  222.807   5.8314  240.278   9.5071  539.476   7.0620  560.090   11.090 -20.61407 13.14738 
1 1 1   13    7    6 o  617.628   5.5271  291.999   5.2251  292.951   5.9823  288.936   10.730  618.615   6.3180  614.180   11.414 4.435791 13.04562 
1 1 1   13    7    7 o  238.621   5.2704   43.585   1.9250   44.997   2.1163   36.818   4.6327  242.452   5.7027  218.761   13.908 23.69112 15.03150 
1 1 1   13    7    8 o  512.754   6.4459  201.266   5.0589  205.127   6.2428  193.879   8.6341  517.617   7.8795  503.126   11.212 14.49115 13.70363 
1 1 1   13    7    9 o  123.619   12.169   11.819   2.2727   11.322   2.7032   13.016   4.1973  120.630   14.962  128.414   22.155 -7.784256 26.73380 
1 1 1   13    7   10 o  918.775   7.9187  646.272   11.136  646.272   11.136   0.0000   0.0000  918.775   7.9187  ?   ?  0.000000 7.918725 
1 1 1   13    7   11 o  476.527   4.8581  173.809   3.5435  173.546   4.4731  174.254   5.8062  476.147   6.1375  477.083   7.9511 -0.9365845 10.04436 
1 1 1   13    7   12 o  524.109   5.0095  210.253   4.0187  210.589   5.1049  209.706   6.5168  524.505   6.3587  523.368   8.1350 1.137451 10.32532 
1 1 1   13    7   13 o  555.163   5.1337  235.908   4.3624  236.323   5.5401  235.230   7.0769  555.627   6.5143  554.301   8.3412 1.326599 10.58356 
1 1 1   13    7   14 o  829.006   5.4754  526.047   6.9477  516.901   9.5478  536.340   10.129  821.708   7.5913  837.005   7.9063 -15.29755 10.96070 
1 1 1   13    7   15 o  818.783   6.0798  513.171   7.6195  514.525   12.069  512.274   9.8252  819.742   9.6186  818.014   7.8471 1.727844 12.41353 
1 1 1   13    7   16 o  136.233   7.0807   14.246   1.4714   10.759   2.4579   16.193   1.8369  117.690   13.913  145.198   8.2998 -27.50793 16.20090 
1 1 1   13    7   17 o  401.924   5.0775  123.648   3.1237  128.939   4.9665  120.186   4.0179  410.390   7.9064  396.237   6.6248 14.15353 10.31502 
1 1 1   13    7   18 f  775.511   5.0128  460.339   5.9503  450.636   9.0135  467.833   7.9218  767.221   7.6755  781.756   6.6204 -14.53522 10.13616 
1 1 1   13    7   19 o  543.701   5.0304  226.269   4.1864  222.136   5.9761  230.251   5.8663  538.669   7.2481  548.426   6.9883 -9.757568 10.06834 
1 1 1   13    7   20 o  598.802   5.1789  274.459   4.7467  264.273   6.6994  284.727   6.7263  587.533   7.4496  609.852   7.2058 -22.31940 10.36437 
1 1 1   13    7   21 o  742.884   5.5834  422.445   6.3488  431.097   9.1376  414.369   8.8276  750.375   7.9558  735.676   7.8395 14.69867 11.16922 
1 1 1   13    7   22 o  229.948   6.9230   40.480   2.4367   36.502   3.9378   42.949   3.1018  217.965   11.847  236.835   8.5567 -18.86961 14.61436 
1 1 1   13    7   23 o  437.894   5.2272  146.779   3.5035  145.159   5.7472  147.737   4.4197  435.397   8.6238  439.295   6.5731 -3.898041 10.84327 
1 1 1   13    7   24 o  393.400   5.5153  118.470   3.3210  123.491   5.5985  115.744   4.1252  401.569   9.1083  388.821   6.9315 12.74783 11.44584 
1 1 1   13    7   25 o  951.576   5.8878  693.185   8.5756  700.267   13.479  688.369   11.115  956.231   9.2094  948.173   7.6589 8.057617 11.97799 
1 1 1   13    7   26 o  733.954   5.9602  412.392   6.6957  429.141   10.112  399.314   8.9351  748.574   8.8254  722.130   8.0838 26.44391 11.96808 
1 1 1   13    7   27 o  356.913   6.2682   97.526   3.4243  102.057   5.6824   94.943   4.2910  365.002   10.171  352.115   7.9617 12.88745 12.91666 
1 1 1   13    7   28 o  847.336   6.2455  549.690   8.1002  585.526   15.218  535.523   9.5683  874.131   11.374  836.276   7.4750 37.85468 13.61031 
1 1 1   13    7   29 o  423.862   6.5221  137.559   4.2314  142.474   6.2726  133.453   5.7321  431.260   9.5025  417.405   8.9720 13.85440 13.06880 
1 1 1   13    7   30 o  818.224   5.9223  512.582   7.4170  527.051   10.206  496.387   10.797  829.548   8.0379  804.997   8.7631 24.55060 11.89118 
1 1 1   13    7   31 o  723.841   5.8442  401.164   6.4750  407.155   8.8576  394.287   9.4890  729.089   7.9372  717.420   8.6413 11.66870 11.73334 
1 1 1   13    7   32 o  581.633   5.9285  259.039   5.2779  251.226   8.6615  263.654   6.6566  572.528   9.8838  586.705   7.4124 -14.17676 12.35452 
1 1 1   13    7   33 o  457.770   5.8369  160.466   4.0898  158.913   5.9986  161.816   5.5906  455.395   8.6058  459.578   7.9476 -4.182465 11.71423 
1 1 1   13    7   34 o  731.493   6.4694  409.833   7.2434  406.146   8.9869  416.670   12.237  728.034   8.0647  737.037   10.847 -9.002808 13.51674 
1 1 1   13    7   35 o  138.497   14.341   14.900   2.9960   13.089   4.1508   16.871   4.3287  128.376   21.911  146.563   19.803 -18.18730 29.53343 
1 1 1   13    7   36 o  631.000   5.5698  304.946   5.3794  307.499   7.8693  302.706   7.3705  633.371   8.1172  628.469   7.6620 4.901245 11.16228 
1 1 1   13    7   37 o  407.023   6.2516  126.921   3.8948  124.676   5.6512  128.953   5.3753  403.164   9.1577  410.079   8.5637 -6.915009 12.53798 
1 1 1   13    7   38 o  264.709   8.0080   53.729   3.2446   53.675   4.7802   53.776   4.4182  264.276   11.817  264.608   10.909 -0.3318176 16.08266 
1 1 1   13    7   39 o  451.062   6.6217  155.933   4.5717  156.582   6.2139  155.168   6.7500  451.724   8.9872  449.566   9.8094 2.158691 13.30385 
1 1 1   13    7   40 o  352.182   7.2632   95.106   3.9153   96.983   6.3054   93.928   4.9949  355.113   11.601  349.777   9.3296 5.336212 14.88672 
1 1 1   13    7   41 o  330.514   7.5700   83.795   3.8296   86.121   6.4079   82.503   4.7765  334.403   12.519  327.737   9.5216 6.665771 15.72863 
1 1 1   13    7   42 o  142.138   13.497   15.723   2.9013   18.913   4.4860   13.430   3.8039  154.781   19.359  129.956   19.744 24.82520 27.65150 
1 1 1   13    7   43 o  452.128   6.6859  156.789   4.6269  161.572   6.5162  151.924   6.5711  458.508   9.2849  444.532   9.6575 13.97614 13.39689 
1 1 1   13    7   44 o   55.682   23.838   0.0039   3.6200   13.451   6.7055  -5.5271   4.3005  126.463   33.935   45.899   21.910 80.56407 40.39327 
1 1 1   13    7   45 o  372.823   8.5525  106.842   4.8805  117.856   8.3791  101.187   6.0041  390.131   14.032  362.347   10.826 27.78442 17.72257 
1 1 1   13    7   46 o  305.974   9.6299   72.082   4.5100   68.891   5.6499   77.686   7.4877  298.544   12.364  316.149   15.473 -17.60486 19.80646 
1 1 1   13    7   47 o  201.119   11.024   31.308   3.3808   26.045   4.9684   35.846   4.6135  181.585   18.118  214.496   14.131 -32.91069 22.97720 
1 1 1   13    7   48 o  194.978   12.004   29.515   3.5649   34.266   5.0809   24.908   5.0031  209.032   16.002  177.191   18.731 31.84074 24.63563 
1 1 1   13    7   49 o  219.692   12.689   37.531   4.2487   15.909   8.0416   45.903   5.0041  134.489   37.601  242.785   13.519 -108.2962 39.95754 
1 1 1   13    7   50 o  169.614   13.588   22.500   3.4980   24.528   5.1683   20.786   4.7517  175.191   19.610  161.087   19.681 14.10381 27.78325 
1 1 1   13    7   51 o  266.950   11.375   55.187   4.6479   52.449   6.5851   57.905   6.5611  257.970   16.768  271.514   15.857 -13.54407 23.07823 
1 1 1   13    7   52 o  176.995   14.763   24.647   3.9629   33.913   6.6540   19.554   4.9332  204.913   21.538  155.159   21.337 49.75394 30.31707 
1 1 1   13    7   53 o  160.529   15.733   20.413   3.8161   19.972   5.9628   20.718   4.9664  154.382   26.169  159.784   20.800 -5.401718 33.42807 
1 1 1   13    7   54 o  186.169   13.641   27.229   3.8599   28.261   5.8689   26.443   5.1241  186.529   20.916  181.402   18.724 5.126984 28.07258 
1 1 1   13    7   55 o  107.710   22.794   9.7700   3.6407   15.131   5.3159   5.0345   4.9963  132.608   27.105   81.901   30.209 50.70715 40.58665 
1 1 1   13    7   56 o   68.195   26.357   2.9582   3.9078   3.2671   6.0930   2.7423   5.0932   78.232   32.008   72.424   29.406 5.807602 43.46512 
1 1 1   13    7   57 o  126.269   25.170   13.760   4.6939   15.797   5.6875   9.4085   8.3126  133.409   28.704  103.064   38.776 30.34435 48.24403 
1 1 1   13    7   58 o  257.237   11.979   51.891   4.7166   58.549   7.7649   47.999   5.9375  267.794   19.068  244.694   15.940 23.09972 24.85324 
1 1 1   13    7   59 o   44.969   21.381  -4.1174   4.0125  -3.7557   5.4691  -4.5391   5.9049   55.064   25.804   55.988   26.416 -0.9242592 36.92703 
1 1 1   13    7   60 f   95.046   25.379   8.1843   3.7615   4.6333   4.6601   14.823   6.3719   76.070   28.936  122.509   33.167 -46.43899 44.01550 
1 1 1   13    7   61 o   54.483   23.556   0.5334   3.6018   1.8686   4.5488  -1.7108   5.8971   64.104   27.053   60.507   27.809 3.596687 38.79648 
1 1 1   13    8    0 o  1091.00   10.645  911.534   17.772  911.534   17.772  911.534   17.772  1091.00   10.645  1091.00   10.645 0.000000 0.000000 
1 1 1   13    8    1 o  853.671   6.3256  557.873   8.2654  562.192   11.757  553.652   11.622  856.855   8.9643  850.324   8.9296 6.531189 12.65295 
1 1 1   13    8    2 o  627.041   5.3378  300.962   5.1231  296.147   7.1374  306.079   7.3578  621.948   7.4975  632.287   7.6026 -10.33948 10.67767 
1 1 1   13    8    3 o  1076.44   10.596  887.427   17.458  890.054   24.436  884.689   24.950  1077.65   14.814  1074.36   15.172 3.289795 21.20526 
1 1 1   13    8    4 o  241.626   5.9765   44.692   2.2103   44.295   2.5011   46.107   4.7236  240.542   6.7930  245.001   12.639 -4.458298 14.34900 
1 1 1   13    8    5 o  619.702   6.2943  293.977   5.9703  288.725   7.0163  307.759   11.366  614.111   7.4643  633.868   11.715 -19.75708 13.89078 
1 1 1   13    8    6 o  1202.80   8.2634  1107.66   15.213  1108.55   17.528  1104.92   30.629  1203.20   9.5176  1200.54   16.668 2.658569 19.19417 
1 1 1   13    8    7 o  323.995   5.1580   80.350   2.5579   79.674   2.8206   83.481   6.0695  322.623   5.7119  330.131   12.012 -7.508392 13.30049 
1 1 1   13    8    8 o  798.360   7.4992  487.954   9.1640  492.461   11.267  479.144   15.752  801.973   9.1786  790.860   13.012 11.11353 15.92386 
1 1 1   13    8    9 o  103.733   9.2173   8.3043   1.4483   8.3043   1.4483   0.0000   0.0000  103.733   9.2173  ?   ?  0.000000 9.217340 
1 1 1   13    8   10 o  1319.16   8.9646  1332.38   18.101  1361.10   21.287  1257.39   34.395  1333.20   10.432  1280.69   17.546 52.50586 20.41279 
1 1 1   13    8   11 o  889.549   6.8460  605.744   9.3213  606.791   10.659  602.342   19.217  890.283   7.8221  886.680   14.160 3.602417 16.17655 
1 1 1   13    8   12 o  364.280   4.9835  101.570   2.7787   99.822   3.4356  104.876   4.7247  361.118   6.2156  370.115   8.3401 -8.997009 10.40149 
1 1 1   13    8   13 o  333.602   5.2123   85.184   2.6615   85.482   3.3062   84.636   4.4861  334.172   6.4638  332.481   8.8152 1.690430 10.93106 
1 1 1   13    8   14 o  650.098   5.4362  323.493   5.4094  319.253   6.8031  330.782   8.9201  645.793   6.8824  657.296   8.8662 -11.50317 11.22394 
1 1 1   13    8   15 o  121.931   10.506   11.469   1.9416   6.1195   3.1922   14.610   2.4460   87.766   23.353  137.618   11.724 -49.85261 26.13100 
1 1 1   13    8   16 o  524.945   5.8075  210.934   4.6663  205.104   6.1657  218.750   7.1392  517.602   7.7824  534.520   8.7260 -16.91852 11.69228 
1 1 1   13    8   17 o  707.310   5.7993  382.949   6.2785  377.251   7.8975  392.736   10.350  701.988   7.3501  716.179   9.4417 -14.19116 11.96531 
1 1 1   13    8   18 o  524.742   5.5531  210.770   4.4601  208.462   5.6329  214.651   7.3025  521.831   7.0523  529.473   9.0106 -7.641357 11.44232 
1 1 1   13    8   19 o  757.459   5.0311  439.162   5.8330  449.030   9.1620  432.435   7.5640  765.839   7.8160  751.594   6.5751 14.24432 10.21378 
1 1 1   13    8   20 o  212.317   6.2730   34.508   2.0386   34.023   3.4243   34.774   2.5372  210.499   10.663  213.120   7.7779 -2.621719 13.19804 
1 1 1   13    8   21 o  1124.23   6.8074  967.571   11.714  975.034   16.637  960.233   16.496  1128.38   9.6328  1119.78   9.6246 8.596436 13.61698 
1 1 1   13    8   22 o  409.288   5.3257  128.229   3.3364  129.385   5.1366  127.384   4.3880  411.074   8.1637  407.908   7.0280 3.166290 10.77215 
1 1 1   13    8   23 o  451.859   5.1298  156.290   3.5479  153.526   5.7218  158.017   4.5222  447.773   8.3485  454.321   6.5030 -6.548431 10.58238 
1 1 1   13    8   24 o  489.092   5.2318  183.111   3.9166  184.152   6.3771  182.481   4.9629  490.394   8.4959  488.217   6.6413 2.176544 10.78365 
1 1 1   13    8   25 o  261.855   7.7561   52.503   3.1087   50.324   4.8864   53.984   4.0293  256.263   12.457  265.482   9.9157 -9.218903 15.92197 
1 1 1   13    8   26 f  787.589   6.5491  474.902   7.8950  493.403   13.172  464.528   9.8632  802.526   10.723  778.850   8.2736 23.67560 13.54370 
1 1 1   13    8   27 o  298.117   7.7461   68.055   3.5346   68.587   5.7142   67.726   4.4985  299.143   12.480  297.341   9.8841 1.802094 15.91975 
1 1 1   13    8   28 o  345.012   8.1013   91.159   4.2782   92.495   8.8261   90.749   4.8912  347.158   16.610  344.199   9.2839 2.959229 19.02863 
1 1 1   13    8   29 o  886.377   6.9903  601.608   9.4839  604.615   15.432  599.783   12.022  888.194   11.351  884.884   8.8762 3.309753 14.40953 
1 1 1   13    8   30 o  617.570   5.3575  291.988   5.0643  294.930   7.4843  289.504   6.8780  620.545   7.8797  614.843   7.3085 5.701599 10.74731 
1 1 1   13    8   31 o  609.918   5.3971  284.812   5.0385  288.688   7.5070  281.634   6.7970  613.906   7.9890  606.403   7.3229 7.502869 10.83742 
1 1 1   13    8   32 o  426.035   6.3450  138.997   4.1376  136.790   7.1173  140.123   5.0852  422.373   11.009  427.691   7.7679 -5.318176 13.47370 
1 1 1   13    8   33 o  147.014   12.382   16.703   2.7604   17.235   4.1969   16.297   3.6645  148.421   18.903  144.595   16.875 3.826630 25.33959 
1 1 1   13    8   34 o  520.148   7.2369  207.276   5.7617  205.581   6.5614  212.984   12.043  517.934   8.2766  526.364   14.948 -8.429443 17.08608 
1 1 1   13    8   35 o   76.729   21.461   4.6807   2.6192   6.5527   3.8882   3.1254   3.5439   90.891   26.390   70.050   25.502 20.84115 36.69831 
1 1 1   13    8   36 o  318.112   6.8493   77.537   3.3350   75.536   5.0001   79.141   4.4761  313.739   10.412  321.240   9.1033 -7.500854 13.83045 
1 1 1   13    8   37 f  175.995   10.540   23.863   2.8263   20.494   4.1991   26.654   3.8214  162.084   17.188  185.659   13.541 -23.57481 21.88095 
1 1 1   13    8   38 o  147.350   12.034   16.801   2.6903   16.491   3.9944   17.058   3.6397  144.908   18.426  147.801   16.363 -2.893631 24.64269 
1 1 1   13    8   39 o  123.058   16.081   11.884   2.9566   9.3704   3.9975   14.920   4.3928  107.452   24.808  136.940   21.680 -29.48743 32.94586 
1 1 1   13    8   40 o  291.082   7.9210   64.997   3.5291   68.686   6.2239   63.249   4.2845  298.543   13.620  286.967   9.7544 11.57626 16.75284 
1 1 1   13    8   41 o  416.570   6.4896  133.037   4.1379  132.730   6.5537  133.241   5.3359  415.539   10.304  416.648   8.3670 -1.109222 13.27325 
1 1 1   13    8   42 o  315.441   7.2173   76.332   3.4847   71.568   5.1214   80.439   4.7551  304.964   10.972  323.520   9.6026 -18.55643 14.58031 
1 1 1   13    8   43 o  148.762   12.996   17.208   2.9294   19.006   4.3477   15.713   3.9644  155.168   18.681  140.844   18.863 14.32373 26.54828 
1 1 1   13    8   44 o  243.744   9.9543   45.719   3.7138   39.500   7.0323   48.125   4.3734  223.616   20.784  249.855   11.436 -26.23915 23.72208 
1 1 1   13    8   45 o  267.678   9.9220   55.167   4.0652   56.161   5.1740   53.564   6.5714  269.595   12.539  261.890   16.477 7.705200 20.70552 
1 1 1   13    8   46 o  175.448   14.062   24.013   3.7446   26.816   4.7762   19.542   6.0324  184.666   17.091  154.367   26.484 30.29875 31.52040 
1 1 1   13    8   47 o  296.918   9.1747   67.870   4.1696   66.435   5.6238   69.621   6.2138  293.015   12.539  299.685   13.546 -6.670013 18.45897 
1 1 1   13    8   48 o  278.294   8.7284   59.614   3.7180   60.272   5.6788   59.120   4.9188  278.766   13.309  276.526   11.621 2.239990 17.66877 
1 1 1   13    8   49 o  153.919   14.192   18.575   3.3060   20.039   4.9892   17.429   4.4142  157.715   21.205  147.294   20.104 10.42082 29.22007 
1 1 1   13    8   50 o  313.196   8.3261   75.523   3.9914   77.689   6.0741   73.876   5.2952  316.459   12.540  309.018   11.195 7.441101 16.81009 
1 1 1   13    8   51 o   49.458   22.384  -1.7040   3.6361  -0.9416   5.0417  -2.5304   5.2491   61.489   27.190   58.613   26.671 2.875809 38.08724 
1 1 1   13    8   52 o   81.405   25.572   5.4131   3.5499   5.3995   6.2088   5.4196   4.3269   88.098   33.427   82.963   28.356 5.135010 43.83395 
1 1 1   13    8   53 o  141.643   17.154   16.046   3.6432   10.759   5.7984   19.495   4.6830  110.849   32.239  155.108   20.205 -44.25907 38.04720 
1 1 1   13    8   54 o   90.405   24.904   6.9316   3.5560  -2.8412   5.3482   14.675   4.7608   57.965   26.582  132.200   24.428 -74.23527 36.10133 
1 1 1   13    8   55 o  130.398   19.458   13.905   3.7648   14.261   5.4848   13.587   5.1769  127.698   28.754  125.064   27.768 2.633934 39.97260 
1 1 1   13    8   56 o   58.738   24.511   1.0978   3.6695   0.4783   4.8461   1.9302   5.6178   63.343   27.355   71.795   30.169 -8.452084 40.72379 
1 1 1   13    8   57 f  205.825   13.360   33.468   4.1863   32.878   5.3150   34.431   6.7942  201.849   17.372  203.389   22.184 -1.539993 28.17697 
1 1 1   13    8   58 o   74.747   25.747   4.5961   3.5694  -0.0716   4.9164   9.7987   5.1905   61.317   26.995  103.176   30.640 -41.85979 40.83501 
1 1 1   13    8   59 o  267.341   14.734   57.259   6.0057   41.425   8.4670   73.293   8.5201  217.333   25.967  298.528   18.741 -81.19498 32.02358 
1 1 1   13    8   60 o  181.597   15.515   26.783   4.2711   24.938   5.6639   29.215   6.5033  170.189   22.278  183.001   23.779 -12.81282 32.58445 
1 1 1   13    8   61 o  169.038   16.003   23.431   4.0913   18.791   5.5290   29.048   6.0826  143.685   26.102  183.071   22.158 -39.38672 34.23847 
1 1 1   13    9    0 o  539.273   7.1383  222.717   5.8898  222.717   5.8898  222.717   5.8898  539.273   7.1383  539.273   7.1383 0.000000 0.000000 
1 1 1   13    9    1 o  569.717   7.2964  248.484   6.3626   0.0000   0.0000  248.484   6.3626  ?   ?   569.717   7.2964 0.000000 7.296360 
1 1 1   13    9    2 o  689.287   8.0556  363.757   8.4990  357.546   11.581  371.005   12.511  683.258   11.074  695.967   11.745 -12.70837 16.14216 
1 1 1   13    9    3 o  1558.89   14.337  1862.12   34.209  1848.44   47.647  1876.67   49.144  1552.24   20.054  1563.96   20.530 -11.71985 28.69917 
1 1 1   13    9    4 o  386.076   5.7017  114.096   3.3694  109.039   3.8168  131.951   7.1720  377.411   6.6072  415.070   11.289 -37.65891 13.08024 
1 1 1   13    9    5 o  738.604   6.8979  417.623   7.7983  418.931   9.3697  414.674   14.068  739.715   8.2755  735.760   12.492 3.954712 14.98405 
1 1 1   13    9    6 o  1429.15   10.928  1564.19   23.904  1572.70   29.303  1547.27   41.329  1432.79   13.362  1420.41   19.009 12.37866 23.23564 
1 1 1   13    9    7 o  547.436   5.4541  229.392   4.5701  229.504   5.1598  228.984   9.8450  547.557   6.1565  546.781   11.763 0.7758179 13.27701 
1 1 1   13    9    8 o  767.716   7.4182  451.204   8.7171  454.076   10.645  445.356   15.187  770.099   9.0310  762.485   13.013 7.614746 15.83981 
1 1 1   13    9    9 o  602.422   8.2751  277.844   7.6303  277.844   7.6303   0.0000   0.0000  602.422   8.2751  ?   ?  0.000000 8.275089 
1 1 1   13    9   10 o  813.863   7.7309  507.084   9.6305  513.381   11.809  494.579   16.641  818.838   9.4221  803.502   13.531 15.33600 16.48800 
1 1 1   13    9   11 o  508.513   5.6001  197.932   4.3588  196.273   4.8266  205.267   10.149  506.368   6.2274  517.668   12.809 -11.29996 14.24277 
1 1 1   13    9   12 o  738.427   7.1647  417.419   8.0979  417.419   8.0979   0.0000   0.0000  738.427   7.1647  ?   ?  0.000000 7.164661 
1 1 1   13    9   13 o  808.200   6.7636  500.013   8.3669  502.325   11.835  497.703   11.831  809.969   9.5458  806.233   9.5869 3.736755 13.52894 
1 1 1   13    9   14 o  1002.77   7.5994  769.801   11.664  766.620   16.405  773.053   16.588  1000.55   10.712  1004.73   10.786 -4.185059 15.20159 
1 1 1   13    9   15 o  627.428   6.1014  301.339   5.8595  298.006   6.5874  313.971   12.824  623.931   6.8977  640.210   13.087 -16.27966 14.79347 
1 1 1   13    9   16 o  244.151   7.7635   45.636   2.9012   44.698   3.2199   49.684   6.6891  241.618   8.7064  253.993   17.309 -12.37483 19.37538 
1 1 1   13    9   17 o  1059.63   6.4438  859.517   10.451  877.454   14.952  842.384   14.614  1070.50   9.1255  1048.89   9.1025 21.60962 12.88914 
1 1 1   13    9   18 o  1024.16   6.3504  802.929   9.9549  789.085   13.723  818.303   14.462  1015.17   8.8319  1033.78   9.1398 -18.60620 12.70980 
1 1 1   13    9   19 o  635.610   5.3186  309.242   5.1743  313.940   7.3114  304.528   7.3239  640.365   7.4594  630.689   7.5867 9.676086 10.63959 
1 1 1   13    9   20 o  1395.84   7.8846  1491.73   16.846  1506.48   23.994  1477.40   23.656  1402.43   11.177  1388.84   11.128 13.59619 15.77259 
1 1 1   13    9   21 o  992.562   6.3801  754.185   9.6929  771.813   13.876  737.390   13.545  1003.95   9.0301  981.309   9.0180 22.64276 12.76193 
1 1 1   13    9   22 o  829.149   5.7791  526.273   7.3344  517.138   10.428  535.217   10.318  821.815   8.2897  836.068   8.0629 -14.25293 11.56414 
1 1 1   13    9   23 o  213.091   7.3957   34.766   2.4122   36.446   4.2025   33.940   2.9458  217.721   12.665  210.523   9.1418 7.198456 15.62002 
1 1 1   13    9   24 o  684.548   6.1883  358.743   6.4840  354.399   10.489  361.431   8.2490  680.215   10.074  687.042   7.8442 -6.827332 12.76801 
1 1 1   13    9   25 o  776.214   6.4356  461.273   7.6461  456.851   12.308  464.052   9.7572  772.259   10.413  778.462   8.1887 -6.202515 13.24697 
1 1 1   13    9   26 o  564.944   5.8992  244.337   5.1012  245.914   7.6318  243.064   6.8583  566.653   8.7992  563.396   7.9530 3.257080 11.86071 
1 1 1   13    9   27 o  240.790   8.9348   44.408   3.2930   38.165   5.3248   48.274   4.1904  222.486   15.738  251.005   10.907 -28.51793 19.14781 
1 1 1   13    9   28 o  321.016   7.9038   78.919   3.8836   75.293   11.312   79.404   4.1349  311.810   23.883  321.986   8.3899 -10.17630 25.31417 
1 1 1   13    9   29 o  362.549   6.5871  100.645   3.6553  101.902   6.4848  100.060   4.4254  364.609   11.620  361.449   7.9990 3.160187 14.10684 
1 1 1   13    9   30 f  523.169   5.9413  209.568   4.7576  214.809   8.0485  206.753   5.8985  529.451   9.9316  519.577   7.4169 9.874512 12.39546 
1 1 1   13    9   31 o  320.653   7.1462   78.747   3.5073   82.709   6.2834   76.955   4.2272  328.364   12.502  316.923   8.7142 11.44077 15.23904 
1 1 1   13    9   32 o  263.450   8.2220   53.177   3.3155   47.944   5.8752   55.623   4.0161  249.319   15.472  269.378   9.7402 -20.05910 18.28260 
1 1 1   13    9   33 o  321.053   9.3179   79.013   4.5789   79.628   6.2413   78.297   6.7384  322.077   12.660  319.286   13.788 2.791534 18.71896 
1 1 1   13    9   34 o  664.079   5.7642  337.741   5.8590  339.920   8.1650  335.427   8.4124  666.002   8.0096  661.551   8.3078 4.450562 11.54004 
1 1 1   13    9   35 o  406.370   5.9726  126.487   3.7150  128.980   5.5779  124.500   4.9803  410.145   8.8851  403.025   8.0733 7.119720 12.00512 
1 1 1   13    9   36 o  188.141   9.7193   27.229   2.7893   30.023   4.2521   25.119   3.6957  197.040   14.194  180.239   13.494 16.80060 19.58430 
1 1 1   13    9   37 o  351.820   6.4358   94.843   3.4657  100.026   5.1838   90.655   4.6603  361.059   9.3800  343.778   8.8566 17.28152 12.90056 
1 1 1   13    9   38 o   72.542   22.691   4.0635   2.7985   8.0723   3.8972  -0.2045   4.0212   99.782   25.440   58.250   25.036 41.53164 35.69251 
1 1 1   13    9   39 o  519.642   5.9265  206.913   4.7138  220.355   7.5256  198.233   6.0470  535.792   9.1764  508.399   7.7708 27.39221 12.02463 
1 1 1   13    9   40 o  359.809   7.5509   99.300   4.1585  103.433   8.1257   97.833   4.8404  366.130   14.500  356.992   8.8584 9.137939 16.99150 
1 1 1   13    9   41 o  328.784   6.8729   82.897   3.4588   85.189   5.2621   81.154   4.5895  332.874   10.328  325.045   9.2246 7.829041 13.84761 
1 1 1   13    9   42 o  323.852   7.0212   80.454   3.4804   79.300   5.1943   81.394   4.6885  321.048   10.570  325.437   9.4124 -4.389099 14.15359 
1 1 1   13    9   43 o  277.941   7.6467   59.302   3.2531   56.195   4.9360   61.688   4.3254  269.971   11.945  283.175   9.9794 -13.20334 15.56516 
1 1 1   13    9   44 o  120.992   17.791   11.636   3.1964   16.821   6.7017   10.110   3.6367  141.686   31.695  111.557   22.079 30.12938 38.62770 
1 1 1   13    9   45 o  301.642   9.0287   69.993   4.1686   74.396   5.2974   62.833   6.7554  310.570   11.144  283.948   15.603 26.62170 19.17398 
1 1 1   13    9   46 o   57.502   22.617   1.5988   2.9180   3.6460   4.0708  -0.5649   4.1849   74.061   27.276   57.537   25.128 16.52406 37.08588 
1 1 1   13    9   47 o   91.301   22.347   6.8611   3.0976   5.5836   4.2839   8.2609   4.4844   84.613   28.217   99.613   28.159 -15.00027 39.86419 
1 1 1   13    9   48 o  184.692   12.379   26.528   3.4791   27.678   4.8651   25.323   4.9773  187.332   17.158  178.698   18.463 8.633865 25.20493 
1 1 1   13    9   49 o  365.639   7.9369  102.849   4.4419  104.986   6.3056  100.744   6.2583  368.479   11.180  360.910   11.329 7.569641 15.91665 
1 1 1   13    9   50 o  232.878   10.797   41.934   3.8485   39.603   5.1806   44.803   5.7488  224.727   15.149  238.833   15.815 -14.10576 21.90042 
1 1 1   13    9   51 o  103.980   21.652   8.9298   3.3341   7.6190   4.9509   10.018   4.5101   95.535   30.223  108.631   27.189 -13.09536 40.65294 
1 1 1   13    9   52 o   68.260   25.536   3.0678   3.5953   7.4775   6.4143   1.0478   4.3413   96.757   34.424   63.450   26.584 33.30783 43.49387 
1 1 1   13    9   53 o  127.910   18.414   13.221   3.5012   12.751   5.3374   13.577   4.6386  121.347   29.110  127.156   24.723 -5.809395 38.19193 
1 1 1   13    9   54 o  176.001   13.887   24.398   3.7106   14.990   5.4682   32.427   5.0518  131.833   27.966  201.947   16.487 -70.11444 32.46371 
1 1 1   13    9   55 o   99.906   26.115   8.6326   4.0382   13.787   6.8232   5.8537   5.0097  122.426   34.779   85.428   30.419 36.99767 46.20539 
1 1 1   13    9   56 o  140.274   18.365   16.038   3.8484   16.540   5.1584   15.408   5.7794  138.993   25.174  131.602   29.429 7.391296 38.72702 
1 1 1   13    9   57 o   93.452   26.635   7.6866   3.9950   5.7946   5.0037   11.013   6.6351   84.081   30.349  108.358   35.064 -24.27722 46.37383 
1 1 1   13    9   58 o   70.607   26.965   3.5635   4.0567   2.6972   4.8775   5.5075   7.3064   70.130   28.660   87.069   35.266 -16.93897 45.44267 
1 1 1   13    9   59 o  121.296   20.039   12.443   3.5905   14.034   4.7985   10.420   5.4121  125.266   25.882  104.433   31.349 20.83289 40.65321 
1 1 1   13    9   60 o   79.947   24.719   5.7132   3.3319  -1.3384   4.5990   13.503   4.8339   54.865   24.965  121.375   26.741 -66.51079 36.58337 
1 1 1   13   10    0 o  218.364   7.2995   36.620   2.4336   36.620   2.4336   36.620   2.4336  218.364   7.2995  218.364   7.2995 0.000000 0.000000 
1 1 1   13   10    1 o  604.460   6.1585  279.684   5.6979  273.783   9.6926  282.800   7.0435  597.923   10.591  607.784   7.5712 -9.861389 13.01870 
1 1 1   13   10    2 o  723.162   8.2741  400.386   9.1585  385.593   12.311  418.722   13.705  709.556   11.335  739.372   12.111 -29.81531 16.58758 
1 1 1   13   10    3 o  253.053   6.1617   49.018   2.3866   48.897   2.7288   49.411   4.9224  252.733   7.0541  253.978   12.662 -1.244385 14.49468 
1 1 1   13   10    4 o  959.649   8.0534  705.052   11.829  701.497   14.252  712.928   21.210  957.147   9.7279  964.614   14.366 -7.467285 17.34934 
1 1 1   13   10    5 o  584.521   6.3121  261.538   5.6473  260.009   6.6706  265.407   10.611  582.784   7.4780  588.668   11.776 -5.883911 13.94991 
1 1 1   13   10    6 o  517.987   6.1790  205.385   4.8990  202.809   5.6963  212.702   9.6014  514.710   7.2304  526.986   11.903 -12.27643 13.92722 
1 1 1   13   10    7 o  1182.41   8.2363  1070.36   14.906  1083.58   17.368  1033.39   29.044  1189.61   9.5385  1161.19   16.341 28.41968 18.92125 
1 1 1   13   10    8 f  1440.71   13.674  1590.08   30.154  1590.08   30.154   0.0000   0.0000  1440.71   13.674  ?   ?  0.000000 13.67405 
1 1 1   13   10    9 o  516.010   6.7948  203.827   5.3667  205.314   6.3930  200.279   9.8757  517.863   8.0653  511.347   12.618 6.515533 14.97525 
1 1 1   13   10   10 o  293.347   7.5408   65.877   3.3859   67.015   3.9464   62.700   6.5909  295.857   8.7147  285.659   15.128 10.19763 17.45845 
1 1 1   13   10   11 o  900.401   8.2289  620.675   11.341  624.829   13.850  612.224   19.755  903.332   10.017  893.922   14.438 9.410095 17.57294 
1 1 1   13   10   12 o  1390.32   10.983  1480.29   23.372  1489.32   28.713  1462.56   40.233  1394.34   13.454  1381.10   19.032 13.24146 23.30746 
1 1 1   13   10   13 o  736.618   7.6422  415.394   8.6165  404.745   10.172  442.439   16.211  727.066   9.1407  759.943   13.937 -32.87781 16.66677 
1 1 1   13   10   14 o  390.475   7.5085  116.724   4.4876  124.520   5.3599   98.445   8.2069  403.284   8.6831  358.438   14.959 44.84610 17.29632 
1 1 1   13   10   15 f  1229.05   8.6411  1156.55   16.256  1132.99   22.115  1184.23   23.976  1216.25   11.879  1243.39   12.598 -27.13928 17.31566 
1 1 1   13   10   16 o  105.289   12.461   8.6104   1.9692   6.7501   2.3871   12.573   3.4840   92.311   17.536  126.724   18.508 -34.41301 25.49611 
1 1 1   13   10   17 o  270.326   6.3762   55.940   2.6382   55.329   3.2175   57.193   4.6090  268.829   7.8194  273.271   11.019 -4.441345 13.51157 
1 1 1   13   10   18 o  928.946   6.6256  660.602   9.4208  658.889   12.008  663.345   15.192  927.660   8.4572  930.668   10.665 -3.007874 13.61118 
1 1 1   13   10   19 f  647.008   5.3705  320.436   5.3185  313.140   7.2819  328.777   7.7865  639.544   7.4388  655.307   7.7630 -15.76312 10.75170 
1 1 1   13   10   20 o  286.194   6.3001   62.702   2.7598   60.078   3.7958   65.644   4.0197  280.104   8.8536  292.791   8.9695 -12.68680 12.60308 
1 1 1   13   10   21 o  339.655   6.3954   88.317   3.3249   89.543   4.3719   86.636   5.1204  341.968   8.3525  336.337   9.9463 5.631409 12.98819 
1 1 1   13   10   22 o  567.889   5.5384  246.870   4.8141  255.823   6.8729  238.246   6.7452  578.030   7.7682  557.815   7.9001 20.21478 11.07961 
1 1 1   13   10   23 o   49.605   20.662   0.3732   2.6005  -3.2601   3.9811   3.0773   3.4344   49.041   22.650   69.541   25.137 -20.49932 33.83665 
1 1 1   13   10   24 o  445.402   7.5489  151.899   5.1464  148.699   6.9872  155.694   7.6089  440.591   10.361  450.808   11.027 -10.21704 15.13086 
1 1 1   13   10   25 o   87.060   23.656   6.0197   3.2345   8.9560   4.1747   1.6101   5.1160  105.771   25.976   72.541   29.465 33.23035 39.27981 
1 1 1   13   10   26 o  340.850   6.8430   88.953   3.5701   83.902   5.4608   92.724   4.7180  330.921   10.781  347.945   8.8589 -17.02451 13.95388 
1 1 1   13   10   27 o  410.335   6.4985  128.916   4.0815  124.529   8.8994  130.084   4.5930  402.945   14.429  412.167   7.2804 -9.221832 16.16190 
1 1 1   13   10   28 o  376.174   6.4585  108.348   3.7187  108.781   6.8756  108.169   4.4212  376.711   11.924  375.826   7.6856 0.8848877 14.18660 
1 1 1   13   10   29 o  363.291   6.4650  101.059   3.5950   93.655   6.0275  105.147   4.4787  349.544   11.266  370.518   7.8973 -20.97415 13.75817 
1 1 1   13   10   30 o  603.833   5.7010  279.172   5.2691  276.916   8.6191  280.518   6.6582  601.156   9.3671  605.206   7.1875 -4.050049 11.80691 
1 1 1   13   10   31 o  414.773   6.3410  131.746   4.0256  134.256   6.8635  130.429   4.9704  418.460   10.716  412.625   7.8698 5.834381 13.29515 
1 1 1   13   10   32 o  507.943   6.3858  197.599   4.9648  198.328   7.7576  197.093   6.4613  508.615   9.9648  507.165   8.3234 1.450684 12.98369 
1 1 1   13   10   33 o  202.340   12.317   31.543   3.7966   32.045   5.5551   31.104   5.2008  203.180   18.050  200.293   17.129 2.887604 24.88419 
1 1 1   13   10   34 o  194.497   10.592   29.109   3.1415   29.817   5.4445   28.756   3.8464  195.804   18.382  193.031   13.096 2.772919 22.56957 
1 1 1   13   10   35 o  336.255   7.0647   86.639   3.6361   97.374   6.5093   81.771   4.3837  356.068   11.943  326.561   8.7702 29.50699 14.81768 
1 1 1   13   10   36 o  455.060   6.2632  158.652   4.3625  158.038   7.4931  158.967   5.3657  453.695   10.790  455.385   7.6980 -1.690399 13.25464 
1 1 1   13   10   37 o  247.260   8.6138   46.895   3.2600   35.260   6.1311   51.481   3.8492  212.651   19.038  258.990   9.7101 -46.33861 21.37143 
1 1 1   13   10   38 o  197.975   10.559   30.193   3.1881   32.397   4.5773   28.115   4.4430  204.489   14.723  190.310   15.384 14.17816 21.29371 
1 1 1   13   10   39 o  388.273   6.3843  115.549   3.7942  117.762   6.0412  114.107   4.8758  391.535   10.081  385.648   8.2600 5.886780 13.03246 
1 1 1   13   10   40 o  212.437   9.7534   34.672   3.1714   39.309   5.6590   32.548   3.8293  224.798   16.563  205.243   12.245 19.55537 20.59816 
1 1 1   13   10   41 o  388.217   6.3234  115.548   3.7574  119.948   5.7290  112.227   4.9776  395.102   9.4733  382.322   8.5058 12.77960 12.73152 
1 1 1   13   10   42 o  194.827   9.9208   29.265   2.9487   32.078   4.5132   27.170   3.8949  203.157   14.612  187.069   13.698 16.08815 20.02819 
1 1 1   13   10   43 o  378.796   7.3086  110.130   4.2375  111.928   7.5874  109.314   5.1084  380.687   13.021  377.138   8.8494 3.549225 15.74378 
1 1 1   13   10   44 o   63.194   21.982   2.8499   2.6050   0.8243   3.9631   4.3908   3.4566   61.143   25.490   76.009   25.346 -14.86581 35.94710 
1 1 1   13   10   45 o   97.738   23.317   7.8563   3.4396   7.6542   4.1347   8.3104   6.1978   96.310   26.974  101.979   33.937 -5.669945 43.35093 
1 1 1   13   10   46 o  135.694   14.419   14.446   2.9488   12.670   4.2229   16.136   4.1196  124.649   22.980  142.160   19.442 -17.51106 30.10135 
1 1 1   13   10   47 o  203.884   10.462   32.153   3.2540   32.350   4.8391   31.990   4.3964  203.187   15.681  202.448   14.279 0.7392426 21.20838 
1 1 1   13   10   48 o  388.792   7.1966  116.156   4.2827  113.267   6.2889  118.655   5.8484  382.977   10.728  392.290   9.7400 -9.313354 14.49011 
1 1 1   13   10   49 o   61.302   23.447   2.1873   3.0704   0.4202   4.4493   3.7938   4.2424   62.263   26.535   75.027   27.804 -12.76445 38.43449 
1 1 1   13   10   50 f  118.779   20.602   11.496   3.6098   9.0681   4.6064   15.359   5.8111  103.403   28.286  134.387   29.094 -30.98387 40.57830 
1 1 1   13   10   51 o  135.535   18.370   14.752   3.7128   7.6281   5.9802   19.221   4.7361   96.877   33.328  154.160   20.586 -57.28291 39.17344 
1 1 1   13   10   52 o   52.156   22.433   0.0349   3.2326  -1.9364   4.7064   1.7954   4.4477   56.383   25.497   66.840   27.347 -10.45712 37.38916 
1 1 1   13   10   53 o  113.890   20.725   10.685   3.4797   17.365   5.2621   5.4945   4.6387  144.090   24.751   83.636   29.320 60.45448 38.37033 
1 1 1   13   10   54 o  254.420   10.287   50.192   4.0058   45.062   5.8642   54.681   5.4850  238.302   16.173  263.934   13.624 -25.63281 21.14634 
1 1 1   13   10   55 o   81.232   26.939   5.4655   3.9066   4.5315   6.7510   5.9357   4.7901   84.785   34.053   85.205   29.799 -0.4203415 45.25046 
1 1 1   13   10   56 o  147.049   17.010   17.473   3.7580   18.039   5.0596   16.776   5.6125  146.183   23.402  138.544   27.437 7.639130 36.06149 
1 1 1   13   10   57 o  186.408   14.847   27.725   4.2010   29.282   5.2749   25.025   6.9468  189.574   18.411  168.823   27.855 20.75185 33.38951 
1 1 1   13   10   58 o   65.776   25.199   2.9872   3.5499   1.8621   4.7423   4.4211   5.3538   66.309   27.783   78.055   30.656 -11.74612 41.37305 
1 1 1   13   10   59 o  119.526   19.239   12.028   3.4003   8.1610   4.6225   16.587   5.0196   93.636   29.142  136.978   24.857 -43.34186 38.30318 
1 1 1   13   10   60 o   39.550   18.925  -3.7539   3.2503  -0.5590   4.4054  -7.5705   4.8150   55.777   24.991   43.875   21.466 11.90177 32.94448 
1 1 1   13   11    0 o  201.026   12.110   31.275   3.6952   31.275   3.6952   31.275   3.6952  201.026   12.110  201.026   12.110 0.000000 0.000000 
1 1 1   13   11    1 o  661.255   6.5004  334.716   6.5793  326.470   7.8184  354.723   12.179  653.026   7.8220  680.560   11.691 -27.53308 14.06668 
1 1 1   13   11    2 o  794.690   7.1490  483.452   8.6959  484.527   10.580  481.215   15.265  795.521   8.6892  792.623   12.582 2.898438 15.29115 
1 1 1   13   11    3 o  440.369   5.9177  148.441   3.9888  144.305   4.6583  159.809   7.7224  434.174   7.0096  456.815   11.044 -22.64066 13.08108 
1 1 1   13   11    4 o  1840.62   13.610  2595.32   38.343  2650.39   48.050  2498.78   63.618  1859.56   16.882  1804.42   23.034 55.13330 28.55824 
1 1 1   13   11    5 o  762.951   7.1136  445.603   8.3072  440.140   9.8870  458.721   15.320  758.216   8.5193  773.862   12.934 -15.64697 15.48725 
1 1 1   13   11    6 o  480.327   6.1610  176.603   4.5296  179.768   5.3651  168.750   8.4519  484.593   7.2332  469.402   11.764 15.19095 13.80943 
1 1 1   13   11    7 o  362.214   8.0120  100.442   4.4420  100.442   4.4420   0.0000   0.0000  362.214   8.0120  ?   ?  0.000000 8.011981 
1 1 1   13   11    8 o  1246.80   10.040  1190.31   19.160  1214.07   23.869  1147.27   32.129  1259.01   12.386  1223.44   17.157 35.57068 21.16111 
1 1 1   13   11    9 o  174.279   10.178   23.337   2.7032   22.908   3.0430   24.941   5.8863  172.564   11.588  178.970   21.948 -6.406052 24.81931 
1 1 1   13   11   10 o  988.772   8.6541  748.518   13.098  756.712   16.088  732.410   22.556  994.074   10.573  977.687   15.073 16.38715 18.41124 
1 1 1   13   11   11 o  1183.64   9.7544  1072.74   17.672  1059.90   21.295  1101.16   31.674  1176.39   11.826  1198.57   17.265 -22.17542 20.92720 
1 1 1   13   11   12 o  1140.58   9.5482  996.104   16.669  977.859   19.898  1039.04   30.524  1129.96   11.505  1164.27   17.129 -34.30969 20.63376 
1 1 1   13   11   13 o  617.594   5.4591  291.956   5.1605  286.802   6.3626  301.864   8.8222  612.092   6.7912  627.893   9.1795 -15.80072 11.41859 
1 1 1   13   11   14 o  587.017   5.9883  263.772   5.3805  258.036   7.0825  271.601   8.2741  580.554   7.9703  595.586   9.0762 -15.03308 12.07900 
1 1 1   13   11   15 o  606.062   6.0990  281.169   5.6577  271.848   7.4053  294.239   8.7689  595.882   8.1192  619.901   9.2418 -24.01941 12.30170 
1 1 1   13   11   16 o  1361.16   8.3992  1418.55   17.499  1423.67   22.503  1410.72   27.834  1363.43   10.783  1356.95   13.401 6.475586 17.20041 
1 1 1   13   11   17 o  721.416   5.9428  398.390   6.5622  399.567   8.3158  396.447   10.684  722.433   7.5203  719.521   9.7007 2.911438 12.27429 
1 1 1   13   11   18 o  431.406   5.7867  142.465   3.8211  146.916   4.7866  134.645   6.3444  438.068   7.1387  419.311   9.8852 18.75690 12.19334 
1 1 1   13   11   19 o  834.151   6.3999  532.662   8.1713  528.196   10.320  540.166   13.378  830.576   8.1177  839.812   10.407 -9.236572 13.19884 
1 1 1   13   11   20 o  337.722   5.9359   87.311   3.0684   90.653   4.2265   83.586   4.4619  344.089   8.0249  330.389   8.8232 13.69934 11.92678 
1 1 1   13   11   21 o  1047.83   7.9900  840.680   12.815  853.639   18.286  828.175   17.963  1055.62   11.318  1039.76   11.287 15.86060 15.98396 
1 1 1   13   11   22 o  622.621   6.9219  296.792   6.5966  309.433   9.2648  283.795   9.3946  635.633   9.5227  608.705   10.083 26.92828 13.86918 
1 1 1   13   11   23 o  201.331   10.293   31.130   3.1613   36.324   4.0100   22.601   5.1384  217.391   12.099  170.392   20.088 46.99869 23.45046 
1 1 1   13   11   24 o  1075.79   7.4991  886.151   12.348  897.100   16.004  870.043   19.412  1082.23   9.6611  1065.56   11.902 16.67407 15.32962 
1 1 1   13   11   25 f  300.824   7.3329   69.292   3.3764   71.755   4.8020   66.884   4.7484  306.050   10.251  295.470   10.499 10.57910 14.67370 
1 1 1   13   11   26 o  552.129   6.1067  233.391   5.1608  233.743   7.3314  233.045   7.2660  552.439   8.6703  551.617   8.6058 0.8225708 12.21609 
1 1 1   13   11   27 o  535.297   8.3732  219.464   6.8605  221.689   10.183  217.615   9.2835  537.759   12.372  532.864   11.382 4.895325 16.81120 
1 1 1   13   11   28 o  374.302   7.4818  107.295   4.2864  108.846   6.6778  106.207   5.5901  376.821   11.578  372.310   9.8095 4.511536 15.17471 
1 1 1   13   11   29 o  438.801   5.9400  147.428   3.9895  152.889   6.7102  144.442   4.9618  446.671   9.8147  434.275   7.4645 12.39584 12.33073 
1 1 1   13   11   30 o  580.125   5.7090  257.689   5.0693  254.302   8.0936  259.876   6.5029  576.075   9.1789  582.491   7.2937 -6.416260 11.72390 
1 1 1   13   11   31 o  361.838   7.0592  100.285   3.9097   91.458   6.0995  106.440   5.0937  345.302   11.541  372.683   8.9294 -27.38083 14.59176 
1 1 1   13   11   32 o  523.095   5.8023  209.546   4.6457  215.968   7.9412  206.204   5.7281  530.738   9.7755  518.817   7.2132 11.92120 12.14868 
1 1 1   13   11   33 f  542.838   7.1182  225.760   5.9144  234.089   8.2363  216.893   8.4982  552.501   9.7394  531.741   10.441 20.75952 14.27853 
1 1 1   13   11   34 o   66.127   22.016   3.2043   2.6084   1.9433   4.8723   3.7108   3.0882   71.947   28.918   71.363   23.958 0.5838242 37.55299 
1 1 1   13   11   35 o  405.371   6.3441  125.894   3.9363  125.367   6.7724  126.163   4.8374  404.098   10.949  405.694   7.7900 -1.596130 13.43767 
1 1 1   13   11   36 o  298.332   7.4459   68.224   3.4001   65.855   6.0902   69.297   4.0982  292.556   13.601  300.563   8.9081 -8.007172 16.25817 
1 1 1   13   11   37 o  360.309   7.9327   99.554   4.3749   93.667   7.2501  102.925   5.4862  348.818   13.579  366.167   9.7887 -17.34863 16.73962 
1 1 1   13   11   38 o  172.910   11.581   23.091   3.0474   28.403   6.2148   21.409   3.4966  189.898   21.775  166.126   13.878 23.77208 25.82154 
1 1 1   13   11   39 o  120.295   17.691   11.439   3.1601   0.0157   8.8274   13.118   3.3844   85.959   37.021  129.005   17.599 -43.04588 40.99102 
1 1 1   13   11   40 o  156.460   14.502   19.059   3.4336   43.547   14.978   17.700   3.5275  225.918   44.896  150.537   15.532 75.38071 47.50655 
1 1 1   13   11   41 o  340.151   7.4527   88.778   3.8802   91.297   6.9874   87.654   4.6658  343.982   13.271  337.789   9.0242 6.193085 16.04876 
1 1 1   13   11   42 o  502.520   6.5427  193.686   5.0325  186.568   8.5936  197.401   6.2084  492.101   11.409  507.041   7.9995 -14.94019 13.93407 
1 1 1   13   11   43 o  179.821   11.775   25.045   3.2230   21.233   6.2485   26.427   3.7621  161.658   26.146  184.414   13.420 -22.75645 29.38865 
1 1 1   13   11   44 o  413.466   6.4622  131.172   4.0897  132.530   6.2194  130.137   5.4283  414.909   9.7933  411.419   8.6200 3.490143 13.04655 
1 1 1   13   11   45 o  272.960   10.101   57.406   4.2203   51.978   4.9214   72.488   8.2039  259.295   12.400  304.143   17.699 -44.84760 21.61079 
1 1 1   13   11   46 o  245.643   8.5383   46.416   3.2103   44.092   4.7236   48.411   4.3764  238.272   13.001  250.363   11.420 -12.09125 17.30451 
1 1 1   13   11   47 o  346.357   7.2962   92.178   3.8680   96.837   5.8073   88.463   5.1857  354.184   10.712  338.710   10.003 15.47360 14.65613 
1 1 1   13   11   48 o  235.211   9.2962   42.636   3.3468   44.637   5.1294   41.152   4.4165  239.208   14.071  230.090   12.588 9.118546 18.88018 
1 1 1   13   11   49 o  190.948   12.008   28.358   3.4918   32.124   4.8094   24.161   5.0779  202.181   15.663  173.906   19.407 28.27461 24.93968 
1 1 1   13   11   50 o  194.190   11.344   29.299   3.3570   31.408   5.0093   27.581   4.5229  199.432   16.560  187.015   15.953 12.41667 22.99430 
1 1 1   13   11   51 o  251.501   11.317   49.021   4.3567   43.434   7.3146   52.093   5.4238  232.516   20.771  258.139   13.777 -25.62347 24.92487 
1 1 1   13   11   52 o   68.928   24.766   3.4221   3.3277   2.4901   4.8071   4.2798   4.6112   71.267   28.696   78.012   28.972 -6.744980 40.77802 
1 1 1   13   11   53 o  277.180   9.9514   59.475   4.2220   64.276   6.2039   55.334   5.7621  286.487   14.148  265.427   14.235 21.06049 20.06966 
1 1 1   13   11   54 o   96.929   25.827   8.0816   3.9008   10.254   7.0647   7.1286   4.6787  107.252   36.235   91.432   29.429 15.82047 46.68009 
1 1 1   13   11   55 o   54.210   23.214   0.3315   3.4345  -3.1828   4.8616   3.8327   4.8525   53.590   24.849   75.716   29.341 -22.12618 38.44960 
1 1 1   13   11   56 o   51.438   23.288  -1.5058   3.9395  -0.4866   4.6721  -4.0132   7.3281   59.166   26.168   65.276   30.350 -6.110394 40.07341 
1 1 1   13   11   57 o  115.979   20.941   11.339   3.5806   10.790   4.9046   11.965   5.2394  109.075   28.911  114.509   29.657 -5.434120 41.41691 
1 1 1   13   11   58 o   58.630   24.141   1.5392   3.4936   5.5423   5.1440  -1.8884   4.7598   81.851   30.560   55.041   25.181 26.80930 39.59790 
1 1 1   13   11   59 o   58.894   23.727   1.9310   3.2883  -0.4605   4.3787   5.0242   4.9798   56.203   25.068   78.448   29.895 -22.24488 39.01441 
1 1 1   13   11   60 o  124.510   19.436   13.175   3.5831   13.714   4.5660   12.312   5.7809  123.234   25.060  111.140   32.152 12.09402 40.76443 
1 1 1   13   12    0 o  223.016   8.1559   38.223   2.7756   38.223   2.7756   38.223   2.7756  223.016   8.1559  223.016   8.1559 0.000000 0.000000 
1 1 1   13   12    1 o  851.594   7.5006  555.177   9.7768  555.262   11.920  555.001   17.090  851.599   9.1447  851.205   13.117 0.3944702 15.99024 
1 1 1   13   12    2 o  196.418   7.2741   29.534   2.1869   29.943   2.5526   28.404   4.2402  197.765   8.4327  191.998   14.536 5.766998 16.80496 
1 1 1   13   12    3 o  866.092   7.6342  574.247   10.120  577.810   12.347  566.954   17.666  868.712   9.2859  860.305   13.416 8.407471 16.31596 
1 1 1   13   12    4 o  1566.56   11.855  1879.54   28.426  1909.36   35.344  1824.91   47.834  1578.65   14.627  1542.56   20.260 36.09021 24.98813 
1 1 1   13   12    5 o  1088.77   8.9229  907.591   14.870  914.435   18.193  893.818   25.809  1092.76   10.877  1080.02   15.612 12.73779 19.02776 
1 1 1   13   12    6 o  646.252   8.0304  319.733   7.9434  319.733   7.9434   0.0000   0.0000  646.252   8.0304  ?   ?  0.000000 8.030411 
1 1 1   13   12    7 o  1457.41   11.323  1626.64   25.260  1638.60   31.164  1603.73   43.130  1462.51   13.921  1446.18   19.485 16.33521 23.94688 
1 1 1   13   12    8 o  912.121   8.2200  636.938   11.476  638.825   14.026  633.117   19.961  913.392   10.032  909.053   14.346 4.338379 17.50581 
1 1 1   13   12    9 f  1193.72   9.7666  1091.10   17.845  1112.02   22.227  1053.16   29.932  1204.95   12.052  1172.22   16.683 32.73523 20.58031 
1 1 1   13   12   10 o  285.920   7.8967   62.585   3.4559   59.382   4.0061   71.905   6.8326  278.487   9.3982  306.346   14.572 -27.85953 17.33943 
1 1 1   13   12   11 o  931.618   8.4239  664.482   12.012  653.613   14.379  689.587   21.854  923.887   10.168  948.654   15.051 -24.76740 18.16355 
1 1 1   13   12   12 o  830.538   8.0428  528.099   10.224  539.860   12.616  505.591   17.453  839.662   9.8163  812.347   14.036 27.31488 17.12820 
1 1 1   13   12   13 o  709.274   6.6276  385.103   7.1952  400.177   10.388  371.201   9.9758  722.931   9.3877  696.267   9.3606 26.66376 13.25702 
1 1 1   13   12   14 o  241.906   9.3120   44.808   3.4479   44.065   5.6236   45.256   4.3645  239.290   15.436  243.075   11.731 -3.785309 19.38795 
1 1 1   13   12   15 o  628.484   5.6718  302.353   5.4561  307.836   6.8782  293.048   8.9605  634.122   7.0865  618.630   9.4630 15.49213 11.82234 
1 1 1   13   12   16 o  633.851   9.2988  307.647   9.0216  307.647   9.0216   0.0000   0.0000  633.851   9.2988  ?   ?  0.000000 9.298827 
1 1 1   13   12   17 o  691.121   5.9126  365.636   6.2547  360.240   7.7652  375.605   10.554  685.958   7.3958  700.336   9.8457 -14.37823 12.31401 
1 1 1   13   12   18 o  424.579   5.8639  137.994   3.8108  139.136   4.6954  135.790   6.5230  426.307   7.1958  421.077   10.121 5.230133 12.41824 
1 1 1   13   12   19 o  744.493   6.9043  424.336   7.8678  423.907   10.708  424.840   11.598  744.007   9.4033  744.784   10.174 -0.7770996 13.85388 
1 1 1   13   12   20 o  530.073   7.2935  215.122   5.9176  214.327   7.1546  216.843   10.528  529.043   8.8354  531.960   12.930 -2.917480 15.66072 
1 1 1   13   12   21 f  312.872   7.1621   74.946   3.4299   73.822   4.2148   77.151   5.9014  310.482   8.8689  317.320   12.150 -6.837402 15.04293 
1 1 1   13   12   22 o  640.268   6.2697  313.838   6.1444  302.853   7.6025  334.529   10.434  628.902   7.8978  660.852   10.315 -31.95032 12.99106 
1 1 1   13   12   23 o  1082.45   6.8410  897.085   11.334  897.376   15.961  896.790   16.099  1082.41   9.6336  1082.04   9.7203 0.3614502 13.68543 
1 1 1   13   12   24 o  563.634   5.8290  243.205   5.0288  247.480   7.0888  238.874   7.1349  568.481   8.1468  558.500   8.3464 9.981201 11.66325 
1 1 1   13   12   25 o  791.199   6.1647  479.265   7.4656  480.897   10.514  477.607   10.602  792.397   8.6691  789.675   8.7714 2.721802 12.33256 
1 1 1   13   12   26 o  1216.74   8.2639  1133.85   15.391  1165.60   25.336  1115.28   19.375  1232.92   13.425  1206.47   10.492 26.45154 17.03892 
1 1 1   13   12   27 o  174.810   11.923   23.535   3.1713   22.014   4.7290   24.777   4.2751  168.234   18.680  178.980   15.766 -10.74611 24.44409 
1 1 1   13   12   28 o  587.889   6.1996  264.636   5.5786  257.961   7.8689  271.380   7.9101  580.276   8.8595  595.190   8.6827 -14.91394 12.40482 
1 1 1   13   12   29 o  527.324   7.0012  212.964   5.6510  212.114   7.3290  214.209   8.8741  526.141   9.1007  528.589   10.968 -2.447937 14.25220 
1 1 1   13   12   30 o  631.166   6.9254  305.119   6.6905  312.277   8.8106  295.369   10.283  638.352   9.0173  620.648   10.824 17.70459 14.08810 
1 1 1   13   12   31 o  361.759   7.3945  100.257   4.0945  100.839   6.0984   99.778   5.5249  362.589   10.988  360.745   10.006 1.843994 14.86134 
1 1 1   13   12   32 o  178.382   12.081   24.536   3.2791   27.453   4.9536   22.261   4.3748  188.027   17.409  169.194   17.129 18.83302 24.42323 
1 1 1   13   12   33 o  153.467   14.401   18.267   3.3433   11.872   4.7494   24.547   4.7070  121.325   26.332  177.629   17.542 -56.30441 31.63959 
1 1 1   13   12   34 o  179.858   10.333   24.905   2.8327   19.381   5.1120   27.353   3.4029  156.731   21.908  188.348   11.864 -31.61707 24.91437 
1 1 1   13   12   35 o  348.418   6.6494   93.020   3.5461   97.318   6.3016   91.028   4.2898  355.933   11.567  344.562   8.1339 11.37067 14.14040 
1 1 1   13   12   36 o  246.374   9.5763   46.585   3.6113   47.930   6.3723   45.949   4.3831  248.622   16.845  244.516   11.711 4.105789 20.51567 
1 1 1   13   12   37 o  379.469   6.8169  110.375   3.9594  120.618   7.6378  106.610   4.6302  395.942   12.603  372.821   8.1138 23.12103 14.98876 
1 1 1   13   12   38 o  198.153   9.5956   30.152   2.9103   25.406   5.4556   32.039   3.4408  179.784   20.174  203.851   11.069 -24.06685 23.01073 
1 1 1   13   12   39 f  214.352   10.798   35.418   3.5315   21.402   13.896   36.385   3.6514  158.840   50.675  217.235   11.018 -58.39534 51.85919 
1 1 1   13   12   40 o  134.239   13.916   14.055   2.8178   22.460   5.6434   11.263   3.2523  168.045   22.506  119.086   18.438 48.95882 29.09455 
1 1 1   13   12   41 o  136.494   14.026   14.542   2.8887   17.608   5.5022   13.376   3.3941  147.509   25.279  130.122   17.484 17.38741 30.73639 
1 1 1   13   12   42 o  104.239   18.768   8.7172   2.8843  -1.0217   5.6715   12.115   3.3499   66.156   29.062  123.457   18.280 -57.30071 34.33342 
1 1 1   13   12   43 o   79.099   22.845   5.0502   2.9206   8.2431   5.7870   3.9590   3.3830  101.308   32.742   73.232   25.073 28.07625 41.23979 
1 1 1   13   12   44 o  241.553   10.453   44.966   3.8649   44.731   6.4517   45.097   4.8269  238.746   17.783  241.079   13.130 -2.333405 22.10492 
1 1 1   13   12   45 o  155.137   16.758   18.973   3.9162   17.660   6.2086   19.841   5.0468  145.648   28.870  157.252   21.534 -11.60396 36.01617 
1 1 1   13   12   46 o  220.386   10.948   37.495   3.6931   44.793   7.2617   34.949   4.2892  237.670   20.151  211.941   13.289 25.72905 24.13863 
1 1 1   13   12   47 o  194.833   12.380   29.509   3.6727   41.022   7.4205   25.774   4.2267  226.529   21.665  181.251   15.380 45.27763 26.56965 
1 1 1   13   12   48 o  173.298   11.831   23.354   3.1194   27.299   4.5802   19.941   4.2601  186.189   16.234  158.414   17.882 27.77592 24.15204 
1 1 1   13   12   49 o  108.933   20.259   9.6823   3.2536   3.2731   4.2816   18.441   5.0053   72.636   27.711  150.498   22.413 -77.86185 35.64006 
1 1 1   13   12   50 o  123.321   16.930   12.157   3.1114   10.760   4.7952   13.172   4.0891  112.389   27.983  126.792   21.860 -14.40340 35.50882 
1 1 1   13   12   51 o  206.552   12.226   33.255   3.8481   37.305   6.7931   31.341   4.6696  215.213   20.885  199.429   15.417 15.78369 25.95910 
1 1 1   13   12   52 o  128.044   17.512   13.183   3.3421   9.1055   5.1308   16.189   4.4048  102.632   30.460  140.714   21.102 -38.08183 37.05489 
1 1 1   13   12   53 o   61.202   24.083   2.0243   3.3099   1.9986   4.9207   2.0455   4.4731   69.560   28.647   67.509   27.501 2.050674 39.71104 
1 1 1   13   12   54 o  225.119   15.589   40.215   5.3384   29.483   7.1445   53.782   8.0327  186.966   25.641  257.234   20.574 -70.26808 32.87441 
1 1 1   13   12   55 o   97.108   26.311   8.2288   4.0079   2.2972   4.7239   23.470   7.5721   68.974   28.198  161.673   31.732 -92.69849 42.45065 
1 1 1   13   12   56 o  114.421   25.380   11.400   4.3285   8.6353   4.9688   20.103   8.8149   98.057   30.164  142.520   39.189 -44.46347 49.45337 
1 1 1   13   12   57 o  224.498   12.226   39.729   4.1854   23.652   6.6382   50.337   5.3923  163.535   27.495  251.621   14.057 -88.08655 30.88052 
1 1 1   13   12   58 o   98.079   22.763   8.4207   3.3513   1.8376   4.6422   15.586   4.8432   65.351   27.441  133.107   24.680 -67.75674 36.90678 
1 1 1   13   12   59 o  119.404   18.590   11.985   3.2871   10.757   4.5401   13.339   4.7654  107.621   27.469  120.915   26.482 -13.29414 38.15484 
1 1 1   13   13    0 o  1459.25   13.663  1630.87   30.510  1630.87   30.510  1630.87   30.510  1459.25   13.663  1459.25   13.663 0.000000 0.000000 
1 1 1   13   13    1 o  1163.65   9.3383  1036.77   16.633  1064.43   20.915  989.158   27.434  1178.94   11.590  1136.15   15.776 42.78479 19.57563 
1 1 1   13   13    2 o  986.120   8.3342  744.482   12.580  752.552   15.487  728.833   21.566  991.362   10.206  975.352   14.446 16.00977 17.68765 
1 1 1   13   13    3 o  1313.61   10.274  1321.33   20.657  1337.26   25.550  1291.27   35.103  1321.32   12.633  1297.89   17.670 23.42981 21.72138 
1 1 1   13   13    4 o  1192.83   9.6099  1089.45   17.546  1120.16   21.895  1034.33   29.331  1209.38   11.828  1161.73   16.495 47.65247 20.29737 
1 1 1   13   13    5 o  1094.91   10.936  918.049   18.328  918.049   18.328   0.0000   0.0000  1094.91   10.936  ?   ?  0.000000 10.93644 
1 1 1   13   13    6 f  310.107   6.6731   73.615   3.1674   74.294   3.6180   71.387   6.5539  311.523   7.5878  305.257   14.027 6.266479 15.94773 
1 1 1   13   13    7 o  936.852   8.3669  671.959   11.998  674.947   14.766  666.152   20.584  938.845   10.275  932.456   14.422 6.389465 17.70795 
1 1 1   13   13    8 o  1223.32   9.9522  1145.91   18.635  1169.06   23.311  1104.92   31.019  1235.44   12.327  1200.65   16.879 34.79370 20.90096 
1 1 1   13   13    9 o  119.441   14.799   11.098   2.6477   13.225   3.0881   5.1971   5.1445  130.415   15.792   87.789   30.872 42.62627 34.67630 
1 1 1   13   13   10 o  225.613   9.0503   38.973   3.1253   42.091   3.6736   30.804   5.9468  234.448   10.237  199.439   19.740 35.00903 22.23635 
1 1 1   13   13   11 o  593.820   7.2819  269.948   6.6186  269.419   7.9450  271.148   11.964  593.198   8.7504  594.935   13.139 -1.737488 15.78585 
1 1 1   13   13   12 o  1336.27   10.735  1367.47   21.956  1373.15   26.931  1356.21   37.917  1338.81   13.142  1329.85   18.628 8.958130 22.79721 
1 1 1   13   13   13 o  498.653   9.2712  190.398   7.0763  180.891   9.2438  203.855   10.998  485.944   12.428  515.807   13.930 -29.86276 18.66811 
1 1 1   13   13   14 o  1134.46   8.4001  985.396   14.586  980.082   20.510  990.835   20.748  1131.15   11.846  1137.34   11.919 -6.182373 16.80424 
1 1 1   13   13   15 o  766.336   9.9394  449.732   11.659   0.0000   0.0000  449.732   11.659  ?   ?   766.336   9.9394 0.000000 9.939380 
1 1 1   13   13   16 o  348.469   6.6890   92.960   3.5678   92.249   4.5706   94.070   5.7080  347.099   8.6031  350.463   10.641 -3.364319 13.68352 
1 1 1   13   13   17 o  626.382   9.8293  300.476   9.4240   0.0000   0.0000  300.476   9.4240  ?   ?   626.382   9.8293 0.000000 9.829339 
1 1 1   13   13   18 o  648.418   6.6479  321.876   6.5979  313.249   8.7060  333.518   10.113  639.588   8.8930  659.905   10.012 -20.31714 13.39148 
1 1 1   13   13   19 o  1015.91   9.2343  790.366   14.359  796.021   17.833  779.938   24.214  1019.36   11.429  1008.57   15.686 10.79114 19.40792 
1 1 1   13   13   20 o  275.173   8.5103   57.983   3.5844   58.018   4.2063   57.891   6.8499  275.227   9.9848  274.252   16.393 0.9741211 19.19448 
1 1 1   13   13   21 o  698.495   6.3553  373.519   6.7947  376.979   8.6240  367.856   11.033  701.652   8.0300  692.983   10.402 8.668457 13.14094 
1 1 1   13   13   22 o  286.979   7.8323   63.063   3.4404   63.919   4.1700   61.239   6.0883  288.884   9.4307  282.629   14.074 6.255096 16.94132 
1 1 1   13   13   23 o  1039.39   6.7192  827.146   10.690  833.178   15.060  821.020   15.176  1042.96   9.4338  1035.31   9.5766 7.650879 13.44280 
1 1 1   13   13   24 o  527.123   5.9866  212.725   4.8302  217.822   6.8070  207.555   6.8550  533.311   8.3389  520.580   8.6031 12.73090 11.98122 
1 1 1   13   13   25 o  389.768   7.6789  116.339   4.5812  112.569   7.8667  118.274   5.6353  383.153   13.414  392.936   9.3698 -9.783417 16.36226 
1 1 1   13   13   26 o  311.368   8.7772   74.264   4.1831   73.545   7.3372   74.610   5.0917  309.174   15.554  312.026   10.661 -2.851318 18.85707 
1 1 1   13   13   27 o  294.893   8.1644   66.610   3.6852   68.463   5.5567   65.156   4.9238  298.811   12.149  291.553   11.033 7.258759 16.41158 
1 1 1   13   13   28 o  125.545   16.738   12.323   3.1363   6.5361   4.0189   21.336   5.0160   91.242   26.927  165.274   20.252 -74.03163 33.69268 
1 1 1   13   13   29 o  583.526   6.2603  260.755   5.5914  273.285   8.0578  249.118   7.7653  597.198   8.8151  570.175   8.8977 27.02289 12.52498 
1 1 1   13   13   30 o  381.840   7.0502  111.683   4.1205  119.394   6.1006  105.213   5.5877  394.619   10.100  370.459   9.8543 24.15945 14.11100 
1 1 1   13   13   31 o  383.682   7.0252  112.774   4.1257  111.039   6.0470  114.285   5.6431  380.499   10.383  386.085   9.5492 -5.585175 14.10645 
1 1 1   13   13   32 o  604.638   6.7959  280.073   6.2894  288.108   8.5405  270.552   9.2967  613.003   9.1022  593.891   10.227 19.11255 13.69106 
1 1 1   13   13   33 f  400.678   7.0261  123.014   4.3090  136.854   6.4420  111.807   5.7968  422.360   9.9648  381.764   9.9202 40.59619 14.06084 
1 1 1   13   13   34 o  512.036   6.5872  200.885   5.1626  207.967   7.7088  195.126   6.9518  520.632   9.6736  504.386   9.0047 16.24591 13.21596 
1 1 1   13   13   35 o  208.143   11.399   33.382   3.6179   40.544   5.9675   29.220   4.5493  228.541   17.185  194.112   15.439 34.42892 23.10166 
1 1 1   13   13   36 o  565.390   8.1260  245.167   7.0323  253.020   9.7891  236.793   10.109  573.836   11.145  554.974   11.900 18.86121 16.30441 
1 1 1   13   13   37 o  357.795   6.7229   98.131   3.6818   95.753   6.3250   99.349   4.5280  352.860   11.711  359.868   8.2205 -7.007813 14.30797 
1 1 1   13   13   38 o  172.631   10.577   22.991   2.7814   32.008   5.2863   19.540   3.2708  202.641   17.206  158.646   13.601 43.99448 21.93265 
1 1 1   13   13   39 o  268.694   9.1753   55.451   3.7735   41.383   15.277   56.365   3.8942  219.056   46.974  270.876   9.3924 -51.82027 47.90369 
1 1 1   13   13   40 o  109.711   16.933   9.5440   2.7519   11.868   5.3419   8.7044   3.2108  119.845   29.354  103.818   20.928 16.02745 36.05057 
1 1 1   13   13   41 f  197.939   10.222   30.225   3.0864   25.791   5.7936   31.982   3.6470  180.294   21.413  203.370   11.766 -23.07573 24.43253 
1 1 1   13   13   42 o  123.985   15.601   12.105   2.8952   10.308   5.6860   12.734   3.3639  111.365   31.788  126.688   17.842 -15.32355 36.45287 
1 1 1   13   13   43 o   42.105   19.302  -1.9029   2.8163   2.6448   5.2435  -3.7467   3.3387   75.375   30.104   41.776   19.757 33.59929 36.00793 
1 1 1   13   13   44 o  139.870   18.788   15.571   3.9206   9.9788   5.8067   20.255   5.3150  109.301   32.395  158.662   22.518 -49.36095 39.45259 
1 1 1   13   13   45 o  296.388   9.9293   67.691   4.5045   74.295   6.8644   62.697   5.9696  309.317   14.499  284.365   13.715 24.95190 19.95782 
1 1 1   13   13   46 o  112.168   19.104   10.143   3.1624   11.619   6.4360   9.6725   3.6310  116.700   33.972  108.525   22.593 8.175331 40.79922 
1 1 1   13   13   47 o  247.356   10.106   47.206   3.8262   44.864   7.3799   48.067   4.4746  237.385   20.512  249.253   11.728 -11.86824 23.62864 
1 1 1   13   13   48 o   63.871   25.365   1.9735   3.7032  -5.7988   6.4201   5.8488   4.5334   59.164   27.799   86.153   29.027 -26.98862 40.19122 
1 1 1   13   13   49 o  188.045   13.265   27.625   3.7937   28.861   7.6482   27.222   4.3690  186.217   27.675  185.978   15.489 0.2388611 31.71438 
1 1 1   13   13   50 o  128.214   19.132   13.279   3.6397   3.1850   7.5648   16.320   4.1519   85.560   35.405  142.223   19.592 -56.66306 40.46464 
1 1 1   13   13   51 o  150.608   20.246   18.378   4.5490   14.723   12.865   18.900   4.8632  128.139   48.233  152.262   21.463 -24.12262 52.79285 
1 1 1   13   13   52 o  101.124   24.509   8.6653   3.7540   8.6040   7.4989   8.6857   4.3366  102.249   37.116  100.562   27.419 1.687096 46.14513 
1 1 1   13   13   53 o  106.217   27.180   9.7725   4.4371   5.1867   6.7389   13.282   5.8953   87.603   34.398  122.163   31.366 -34.56027 46.55191 
1 1 1   13   13   54 o  244.588   10.470   46.485   3.9195   50.705   5.9244   43.199   5.2270  252.833   15.382  233.668   14.689 19.16420 21.26905 
1 1 1   13   13   55 o  138.198   17.900   15.542   3.6974   12.633   4.9749   19.131   5.5264  119.666   27.707  149.684   25.003 -30.01802 37.32061 
1 1 1   13   13   56 o  108.215   25.910   10.306   4.2347   15.142   4.8637  -4.8460   8.6096  132.342   24.925   69.159   32.398 63.18326 40.87624 
1 1 1   13   13   57 o  130.556   17.987   14.059   3.4989   8.9072   4.7425   20.212   5.1833   98.436   29.300  153.946   22.676 -55.50958 37.05018 
1 1 1   13   13   58 o   76.247   25.050   5.0493   3.3810   2.7088   4.5333   7.9830   5.0753   67.910   27.677   92.415   30.708 -24.50468 41.33989 
1 1 1   13   13   59 o   76.574   25.279   5.1800   3.4414   5.1054   4.3864   5.2995   5.5501   77.250   28.334   80.165   31.291 -2.915482 42.21305 
1 1 1   13   14    0 o  1864.01   23.942  2664.42   68.284  2664.42   68.284  2664.42   68.284  1864.01   23.942  1864.01   23.942 0.000000 0.000000 
1 1 1   13   14    1 o  949.265   8.1771  689.871   11.881  677.798   14.276  717.069   21.429  940.845   9.9137  967.434   14.471 -26.58881 17.54132 
1 1 1   13   14    2 o  687.216   6.8987  361.522   7.2565  372.668   9.0274  341.170   12.199  697.685   8.4535  667.425   11.941 30.26062 14.63039 
1 1 1   13   14    3 o  335.482   7.6489   86.161   3.9277   86.161   3.9277   0.0000   0.0000  335.482   7.6489  ?   ?  0.000000 7.648884 
1 1 1   13   14    4 o  1250.94   12.112  1198.54   23.190  1198.54   23.190   0.0000   0.0000  1250.94   12.112  ?   ?  0.000000 12.11155 
1 1 1   13   14    5 o  647.138   6.8386  320.585   6.7738  319.770   8.1254  322.441   12.265  646.279   8.2140  648.824   12.350 -2.545288 14.83228 
1 1 1   13   14    6 o  1301.42   10.258  1296.96   20.434  1309.17   25.179  1273.39   34.972  1307.35   12.583  1288.81   17.728 18.53931 21.73958 
1 1 1   13   14    7 o  463.633   6.8531  164.551   4.8633  172.576   6.0387  149.738   8.2042  474.775   8.3097  442.151   12.123 32.62393 14.69720 
1 1 1   13   14    8 o  455.472   7.0610  158.812   4.9227  158.742   5.9681  158.962   8.7067  455.341   8.5631  455.550   12.487 -0.2089233 15.14087 
1 1 1   13   14    9 o  910.567   8.3474  634.799   11.634  638.422   14.283  627.659   20.054  913.070   10.220  905.069   14.476 8.001221 17.72024 
1 1 1   13   14   10 o  355.199   7.5623   96.590   4.1115   98.277   4.8911   92.525   7.5904  358.266   8.9194  347.497   14.271 10.76828 16.82875 
1 1 1   13   14   11 o  304.345   8.3778   70.918   3.9027   71.702   4.5963   68.893   7.3884  305.998   9.8134  299.360   16.185 6.638092 18.92731 
1 1 1   13   14   12 o  946.647   10.711  686.316   15.520  653.446   20.906  726.669   23.164  923.403   14.792  973.697   15.543 -50.29419 21.45612 
1 1 1   13   14   13 o  502.773   13.760  193.691   10.589   0.0000   0.0000  193.691   10.589  ?   ?   502.773   13.760 0.000000 13.76021 
1 1 1   13   14   14 o  1265.84   10.457  1227.18   20.262  1264.92   36.011  1209.70   24.509  1284.19   18.321  1256.57   12.743 27.62488 22.31652 
1 1 1   13   14   15 o  589.331   7.8925  265.915   7.1194  262.301   12.000  267.878   8.8442  585.078   13.399  591.436   9.7697 -6.357178 16.58281 
1 1 1   13   14   16 o  631.883   6.8767  305.674   6.6510  305.896   9.2665  305.438   9.5520  632.013   9.5790  631.526   9.8817 0.4864502 13.76242 
1 1 1   13   14   17 o  144.728   14.683   16.220   3.2077   9.5988   4.4702   23.249   4.6055  109.540   26.866  173.208   17.617 -63.66721 32.12657 
1 1 1   13   14   18 o  788.284   6.3493  475.707   7.6609  485.353   9.8115  460.641   12.262  796.161   8.0512  775.504   10.330 20.65778 13.09705 
1 1 1   13   14   19 o  594.010   6.5851  270.133   5.9872  272.916   6.8989  261.642   12.051  597.029   7.5494  584.275   13.476 12.75317 15.44620 
1 1 1   13   14   20 o  657.953   6.2354  331.414   6.2796  331.380   7.8117  331.475   10.557  657.860   7.7578  657.817   10.485 0.4345703E-01 13.04316 
1 1 1   13   14   21 o  614.284   6.2860  288.888   5.9103  282.195   7.2192  302.493   10.293  607.070   7.7693  628.373   10.701 -21.30347 13.22431 
1 1 1   13   14   22 o  554.736   6.3851  235.601   5.4215  232.403   6.6571  241.899   9.3426  550.903   7.8947  561.899   10.863 -10.99579 13.42854 
1 1 1   13   14   23 o  429.181   6.8557  141.034   4.5036  135.768   5.4558  152.296   7.9790  421.041   8.4657  445.789   11.694 -24.74704 14.43639 
1 1 1   13   14   24 o  119.977   14.509   11.201   2.6103   10.642   3.5342   11.873   3.8720  115.938   20.674  122.491   21.433 -6.552902 29.77863 
1 1 1   13   14   25 o  701.532   6.8909  376.854   7.3993  404.085   12.500  362.166   9.1805  726.103   11.247  687.610   8.7228 38.49268 14.23318 
1 1 1   13   14   26 o  297.104   8.5569   67.618   3.8913   70.088   5.1897   64.446   5.8812  302.380   11.213  289.862   13.256 12.51770 17.36221 
1 1 1   13   14   27 o  334.812   7.8643   85.866   4.0303   84.633   5.1714   87.774   6.4319  332.302   10.167  338.290   12.422 -5.988159 16.05212 
1 1 1   13   14   28 o  259.600   8.3536   51.633   3.3193   54.523   4.8100   49.005   4.5864  266.622   11.786  252.767   11.855 13.85477 16.71661 
1 1 1   13   14   29 o  336.600   7.3747   86.792   3.7995   84.203   5.3242   89.479   5.4237  331.380   10.497  341.612   10.373 -10.23215 14.75737 
1 1 1   13   14   30 o  386.710   6.9024  114.554   4.0856  116.052   5.7981  113.077   5.7580  389.052   9.7366  384.029   9.7957 5.023529 13.81148 
1 1 1   13   14   31 o  266.864   8.2953   54.584   3.3884   53.881   4.9229   55.216   4.6708  264.918   12.141  268.231   11.377 -3.312195 16.63797 
1 1 1   13   14   32 o  469.028   6.9259  168.551   4.9721  171.689   6.8731  165.106   7.2017  473.138   9.4907  463.908   10.142 9.229462 13.89018 
1 1 1   13   14   33 o  535.178   6.4281  219.435   5.2656  218.912   7.6203  219.913   7.2845  534.221   9.3193  535.497   8.8874 -1.275635 12.87768 
1 1 1   13   14   34 o  246.655   9.3400   46.678   3.5262   43.366   5.5364   48.938   4.5739  236.751   15.361  252.364   11.841 -15.61362 19.39507 
1 1 1   13   14   35 o  263.561   10.904   53.360   4.3987   61.643   5.7069   41.238   6.9042  283.036   13.173  229.898   19.814 53.13838 23.79339 
1 1 1   13   14   36 o  355.346   7.5693   96.827   4.1170  102.969   6.2817   92.202   5.4509  366.014   11.213  346.469   10.279 19.54517 15.21092 
1 1 1   13   14   37 o  120.714   17.065   11.489   3.0652   9.1247   4.7598   13.165   4.0065  105.795   28.676  128.487   21.105 -22.69180 35.60534 
1 1 1   13   14   38 o  195.056   14.790   29.543   4.3829   27.519   13.820   29.769   4.6215  177.932   49.129  195.656   15.560 -17.72411 51.53383 
1 1 1   13   14   39 o  241.748   10.652   44.955   3.9414   37.032   6.2799   50.104   5.0627  217.411   19.064  254.571   13.036 -37.16051 23.09498 
1 1 1   13   14   40 o  239.262   10.216   44.037   3.7414   40.829   5.6541   46.535   4.9902  228.937   16.241  245.158   13.349 -16.22134 21.02246 
1 1 1   13   14   41 o  163.502   11.712   20.714   2.9118   24.022   5.4091   19.364   3.4551  174.024   20.714  157.532   14.492 16.49187 25.27992 
1 1 1   13   14   42 o   43.760   19.825  -1.5317   2.8608   1.0337   5.3073  -2.5823   3.3964   70.068   29.377   45.330   20.931 24.73803 36.07078 
1 1 1   13   14   43 o  115.673   17.225   10.647   2.9567   3.6382   5.7827   13.128   3.4405   81.497   31.904  128.491   17.986 -46.99308 36.62509 
1 1 1   13   14   44 o  424.107   8.7940  138.369   5.7086  135.146   8.0860  141.572   8.0605  417.988   12.639  427.929   12.306 -9.940948 17.64018 
1 1 1   13   14   45 o  265.994   9.0064   54.465   3.6668   63.202   6.9828   51.138   4.3087  284.293   16.113  257.388   10.937 26.90552 19.47437 
1 1 1   13   14   46 o  307.062   8.3238   72.542   3.9121   75.722   7.0524   71.129   4.7019  311.955   14.770  303.674   10.116 8.280182 17.90187 
1 1 1   13   14   47 o   66.779   24.198   3.0623   3.1856   5.2526   6.3612   2.3291   3.6803   88.903   33.810   65.460   25.500 23.44302 42.34833 
1 1 1   13   14   48 f  231.104   12.219   41.521   4.3070   48.323   7.5661   38.260   5.2386  246.145   20.262  220.727   15.606 25.41727 25.57556 
1 1 1   13   14   49 o  234.430   10.608   42.502   3.8064   37.434   7.1341   44.519   4.5005  215.407   21.944  239.187   12.335 -23.78011 25.17330 
1 1 1   13   14   50 o  110.788   21.691   10.131   3.5465   13.682   7.9499   9.2482   3.9627  123.550   38.179  104.750   25.053 18.80016 45.66499 
1 1 1   13   14   51 f  176.809   16.212   24.793   4.3384   13.345   12.444   26.377   4.6289  123.541   47.215  182.186   16.788 -58.64488 50.11082 
1 1 1   13   14   52 o  177.965   17.900   25.380   4.8097   28.536   7.5142   23.189   6.2600  183.509   27.607  166.372   25.387 17.13777 37.50507 
1 1 1   13   14   53 o  208.421   12.573   34.048   3.9923   30.034   6.9132   36.057   4.8902  189.674   24.376  213.421   15.067 -23.74716 28.65688 
1 1 1   13   14   54 o  106.806   23.151   9.7099   3.6755   7.5195   6.5766   10.705   4.4323   94.812   34.706  110.800   26.493 -15.98828 43.66223 
1 1 1   13   14   55 o  134.143   20.583   14.951   4.0912   10.305   6.5551   17.915   5.2363  105.612   34.889  144.875   24.486 -39.26363 42.62443 
1 1 1   13   14   56 o   66.508   27.281   2.1953   4.4403  -8.8873   6.4829   11.988   6.0941   52.642   25.565  112.555   33.142 -59.91270 41.85622 
1 1 1   13   14   57 o   75.436   26.035   4.8001   3.6505   2.9471   6.1132   5.8271   4.5510   74.946   31.481   82.104   29.019 -7.157211 42.81523 
1 1 1   13   14   58 o   60.729   24.907   1.8852   3.7003  -7.6494   5.9099   8.0332   4.7457   50.421   24.469   92.532   29.624 -42.11154 38.42263 
1 1 1   13   14   59 o   64.308   26.395   2.3475   4.1596   4.4688   5.8667   0.2032   5.8985   77.590   31.538   65.080   29.056 12.51051 42.88234 
1 1 1   13   15    1 o  1055.36   10.780  852.950   17.413  852.950   17.413   0.0000   0.0000  1055.36   10.780  ?   ?  0.000000 10.77976 
1 1 1   13   15    2 o  1174.01   11.614  1055.63   20.870  1055.63   20.870   0.0000   0.0000  1174.01   11.614  ?   ?  0.000000 11.61406 
1 1 1   13   15    3 o  451.297   6.3779  155.906   4.4056  154.503   5.2967  159.056   7.9361  449.238   7.7031  455.720   11.377 -6.481964 13.73973 
1 1 1   13   15    4 o  935.144   8.1710  669.515   11.696  663.511   14.123  682.622   20.867  930.859   9.9120  943.877   14.443 -13.01764 17.51737 
1 1 1   13   15    5 o  1099.49   9.0949  925.615   15.306  938.277   18.920  901.630   26.040  1106.86   11.167  1084.65   15.685 22.20435 19.25393 
1 1 1   13   15    6 o  1008.22   8.6138  778.281   13.293  790.595   16.414  754.809   22.660  1016.06   10.554  992.477   14.917 23.57959 18.27273 
1 1 1   13   15    7 o  339.413   9.0007   88.207   4.6760   86.728   6.3447   89.965   6.9182  336.486   12.319  342.686   13.189 -6.200775 18.04766 
1 1 1   13   15    8 o  369.301   8.9474  104.426   5.0576  108.327   6.9544  100.045   7.3687  376.063   12.082  361.367   13.322 14.69574 17.98463 
1 1 1   13   15    9 o  905.097   10.212  627.345   14.147  619.941   19.504  635.565   20.551  899.477   14.167  910.694   14.743 -11.21722 20.44635 
1 1 1   13   15   10 o  1122.75   11.646  965.540   20.014  961.864   27.976  969.394   28.645  1120.15   16.317  1124.49   16.643 -4.338013 23.30708 
1 1 1   13   15   11 o  689.285   13.578  364.040   14.325   0.0000   0.0000  364.040   14.325  ?   ?   689.285   13.578 0.000000 13.57788 
1 1 1   13   15   12 o  940.285   10.777  677.159   15.511  637.164   20.692  728.457   23.434  911.784   14.826  974.832   15.705 -63.04797 21.59818 
1 1 1   13   15   13 o  1116.14   17.014  955.276   29.066   0.0000   0.0000  955.276   29.066  ?   ?   1116.14   17.014 0.000000 17.01381 
1 1 1   13   15   14 o  196.739   13.043   29.788   3.9055   27.520   4.4504   37.383   8.1454  188.835   15.535  219.172   24.712 -30.33690 29.18930 
1 1 1   13   15   15 o  1191.01   8.7857  1086.21   16.016  1094.25   22.710  1078.25   22.591  1195.08   12.415  1186.31   12.441 8.772095 17.57626 
1 1 1   13   15   16 o  1140.89   8.5905  996.715   15.001  1009.32   21.379  984.491   21.055  1147.76   12.169  1133.56   12.135 14.20093 17.18577 
1 1 1   13   15   17 o  985.775   7.9822  744.066   12.044  770.367   17.470  720.242   16.627  1002.79   11.382  969.631   11.203 33.15668 15.97034 
1 1 1   13   15   18 o  628.915   8.0874  302.870   7.7852  303.582   9.6574  301.547   13.157  629.565   10.022  627.228   13.704 2.336792 16.97761 
1 1 1   13   15   19 o  794.339   6.4928  483.067   7.8942  484.048   9.8962  481.350   13.090  795.064   8.1320  792.675   10.789 2.388733 13.51042 
1 1 1   13   15   20 o  807.389   6.5683  499.083   8.1171  490.841   10.066  514.412   13.727  800.607   8.2139  819.413   10.944 -18.80640 13.68390 
1 1 1   13   15   21 o  190.882   10.089   27.990   2.9373   28.510   3.4068   26.483   5.7976  192.537   11.615  184.476   20.901 8.060623 23.91154 
1 1 1   13   15   22 o  353.898   7.1608   95.900   3.8789   92.740   4.6159  103.495   7.1558  347.977   8.6663  367.440   12.723 -19.46341 15.39442 
1 1 1   13   15   23 o  270.449   8.4550   56.020   3.5000   59.149   4.1498   48.309   6.5144  277.864   9.7573  250.270   17.108 27.59407 19.69514 
1 1 1   13   15   24 o  812.549   9.2794  505.796   11.541  506.006   13.800  505.308   21.048  812.542   11.096  811.204   16.952 1.337280 20.26054 
1 1 1   13   15   25 o  838.471   11.331  538.926   14.542   0.0000   0.0000  538.926   14.542  ?   ?   838.471   11.331 0.000000 11.33073 
1 1 1   13   15   26 o  605.655   6.5266  280.900   6.0504  290.059   9.2903  274.154   7.9731  615.212   9.8659  598.198   8.7079 17.01337 13.15914 
1 1 1   13   15   27 f  111.648   15.990   9.7708   2.6544   6.0576   3.7542   13.483   3.7537   87.884   26.048  130.971   19.304 -43.08632 32.42147 
1 1 1   13   15   28 o  287.014   7.7074   63.109   3.3860   63.274   4.8860   62.957   4.6965  287.229   11.114  286.531   10.709 0.6986084 15.43341 
1 1 1   13   15   29 o  805.748   6.3880  497.254   7.8783  509.552   11.386  485.958   10.912  815.320   9.1236  796.243   8.9538 19.07672 12.78322 
1 1 1   13   15   30 o  813.505   6.4184  506.920   7.9920  527.383   11.609  488.483   11.019  829.389   9.1446  798.235   9.0186 31.15430 12.84364 
1 1 1   13   15   31 o  405.513   7.2294  126.002   4.4872  125.492   6.0335  126.634   6.7124  404.489   9.7452  406.224   10.796 -1.734436 14.54348 
1 1 1   13   15   32 o  401.465   6.8716  123.499   4.2226  124.833   6.0719  122.249   5.8761  403.372   9.8345  399.196   9.6169 4.175262 13.75506 
1 1 1   13   15   33 o  296.329   8.3211   67.334   3.7742   74.001   5.8974   62.710   4.9118  310.281   12.418  285.743   11.230 24.53790 16.74260 
1 1 1   13   15   34 o  139.574   17.532   15.279   3.6628   11.206   4.4430   23.918   6.4711  117.669   25.412  173.430   25.108 -55.76074 35.72359 
1 1 1   13   15   35 o  123.247   15.841   11.910   2.9191   14.152   4.4774   10.252   3.8497  133.057   22.805  112.768   23.081 20.28889 32.44689 
1 1 1   13   15   36 o  219.390   9.8048   36.965   3.2925   43.003   4.9142   32.048   4.4352  235.852   13.671  203.378   14.339 32.47385 19.81213 
1 1 1   13   15   37 o  169.370   12.461   22.207   3.2078   23.463   4.8296   21.215   4.2909  172.967   18.531  164.646   17.285 8.320770 25.34056 
1 1 1   13   15   38 o   94.441   25.830   7.2508   3.8414 -16.9503   14.898   8.9743   3.9758   85.615   40.843  104.827   25.110 -19.21204 47.94422 
1 1 1   13   15   39 f  205.554   11.073   32.619   3.4710   36.134   5.3766   30.107   4.5450  215.299   16.439  196.687   15.215 18.61263 22.39994 
1 1 1   13   15   40 o  395.164   7.7180  119.878   4.6682  117.931   6.8013  121.612   6.4190  391.238   11.358  397.478   10.551 -6.240082 15.50203 
1 1 1   13   15   41 o   98.970   23.086   8.0195   3.4331   8.6233   4.9321   7.4519   4.7816  102.357   29.723   95.996   29.600 6.360107 41.94806 
1 1 1   13   15   42 o  208.722   11.863   33.736   3.7741   28.929   5.7459   37.383   5.0053  191.136   19.933  219.000   15.023 -27.86406 24.96044 
1 1 1   13   15   43 o  242.106   11.479   45.245   4.2538   39.560   6.0882   50.668   5.9460  224.358   17.877  254.922   15.310 -30.56331 23.53660 
1 1 1   13   15   44 o  206.958   12.952   33.288   4.0823   33.150   6.1490   33.396   5.4590  204.435   19.903  206.021   17.476 -1.585876 26.48680 
1 1 1   13   15   45 o   65.615   25.588   2.2949   3.7088   0.2703   5.8529   3.6534   4.7942   70.231   30.195   76.976   29.333 -6.744568 42.09727 
1 1 1   13   15   46 o   49.519   21.400  -0.1826   2.9704   3.4879   6.1002  -1.3234   3.4008   81.620   32.511   48.940   21.941 32.67945 39.22172 
1 1 1   13   15   47 o  247.752   11.690   47.519   4.4329   47.661   7.5784   47.445   5.4654  244.507   20.437  246.379   14.557 -1.872177 25.09167 
1 1 1   13   15   48 o  165.538   13.590   21.457   3.4130   30.581   6.2693   17.614   4.0688  194.902   21.365  148.466   18.291 46.43538 28.12561 
1 1 1   13   15   49 o  108.779   21.076   9.7271   3.3825   12.309   6.6166   8.8135   3.9356  118.429   34.437  102.288   25.282 16.14144 42.72110 
1 1 1   13   15   50 f  102.162   31.247   8.9531   5.3407   9.6563   18.827   8.8915   5.5695  125.104   53.972  101.941   32.031 23.16358 62.76090 
1 1 1   13   15   51 o  243.101   13.747   46.328   5.0943   39.005   7.7152   51.989   6.7834  218.063   23.485  255.764   17.432 -37.70114 29.24759 
1 1 1   13   15   52 o  329.005   9.4593   83.762   4.7636   71.401   7.5728   91.855   6.1277  299.968   16.558  343.557   11.653 -43.58878 20.24706 
1 1 1   13   15   53 o  297.229   10.161   68.575   4.6227   57.975   7.3729   75.441   5.9339  268.748   18.028  310.646   12.480 -41.89853 21.92603 
1 1 1   13   15   54 o  179.897   15.411   25.815   4.2026   20.919   6.8617   28.755   5.3164  153.266   30.323  188.181   18.705 -34.91461 35.62827 
1 1 1   13   15   55 o   48.083   22.116  -2.1446   3.7401  -3.3920   6.8035  -1.6043   4.4773   63.636   29.468   54.637   24.773 8.999454 38.49752 
1 1 1   13   15   56 o   36.246   18.130 -10.6468   4.2078 -10.8121   6.2345 -10.5084   5.7026   48.605   23.911   45.946   22.653 2.659782 32.93769 
1 1 1   13   15   57 o   66.730   25.065   3.3147   3.4706   1.7043   5.9468   4.1466   4.2740   70.310   30.333   73.251   27.748 -2.941528 41.11019 
1 1 1   13   15   58 o   55.110   24.496  -0.3098   4.1436   15.305   7.5522  -7.0348   4.9562  120.121   37.227   45.641   22.209 74.48003 43.34848 
1 1 1   13   16    0 o  167.421   16.897   22.117   4.2289   22.117   4.2289   22.117   4.2289  167.421   16.897  167.421   16.897 0.000000 0.000000 
1 1 1   13   16    1 o  536.121   8.1894  220.058   6.7202  232.560   9.8619  209.220   9.1821  551.027   11.693  522.652   11.478 28.37506 16.38480 
1 1 1   13   16    2 o  646.146   8.5232  319.660   8.4295  318.959   11.882  320.371   11.961  645.299   12.030  646.724   12.083 -1.424011 17.05020 
1 1 1   13   16    3 o  341.036   8.5411   89.049   4.4585   90.276   6.1888   87.725   6.4285  343.310   11.777  338.410   12.411 4.899933 17.10937 
1 1 1   13   16    4 o  868.182   9.7328  577.177   12.934  569.778   18.081  584.930   18.508  862.358   13.698  873.740   13.839 -11.38141 19.47219 
1 1 1   13   16    5 o  327.805   9.0716   82.279   4.5516   79.584   6.1873   85.457   6.7196  322.319   12.541  333.985   13.145 -11.66522 18.16772 
1 1 1   13   16    6 o  1272.33   12.528  1240.10   24.397  1263.98   35.127  1217.86   33.910  1283.87   17.875  1260.28   17.579 23.59827 25.07097 
1 1 1   13   16    7 o  524.709   7.1789  210.774   5.7656  210.275   7.0764  211.761   9.9443  524.044   8.8222  525.769   12.357 -1.725525 15.18303 
1 1 1   13   16    8 o  626.191   7.4222  300.197   7.1140  293.099   8.5447  316.229   12.843  618.692   9.0230  642.459   13.060 -23.76648 15.87363 
1 1 1   13   16    9 o  1209.05   10.036  1119.47   18.572  1114.64   22.646  1129.39   32.457  1206.24   12.266  1213.59   17.473 -7.343140 21.34817 
1 1 1   13   16   10 o  955.445   10.813  699.180   15.813  715.375   22.934  684.505   21.832  966.049   15.510  945.016   15.093 21.03339 21.64158 
1 1 1   13   16   11 o  827.323   8.2751  524.074   10.479  516.372   12.579  541.543   18.944  821.132   10.008  840.573   14.724 -19.44049 17.80334 
1 1 1   13   16   12 o  832.905   8.3899  531.185   10.696  529.826   12.946  534.108   18.987  831.743   10.169  834.753   14.860 -3.010559 18.00621 
1 1 1   13   16   13 o  789.272   8.2958  476.990   10.022  478.400   12.199  474.062   17.578  790.344   10.084  786.437   14.603 3.907654 17.74615 
1 1 1   13   16   14 o  721.640   8.2796  398.752   9.1453  394.279   10.912  409.310   16.765  717.500   9.9359  730.706   14.990 -13.20575 17.98359 
1 1 1   13   16   15 o  353.474   7.9650   95.668   4.3093   95.355   5.9714   96.009   6.2252  352.815   11.058  354.009   11.489 -1.193909 15.94549 
1 1 1   13   16   16 o  476.817   7.2707  174.071   5.3064  178.658   7.4013  169.220   7.6119  482.966   10.012  470.015   10.581 12.95099 14.56671 
1 1 1   13   16   17 f  605.522   8.1569  280.763   7.5600  284.996   9.4039  273.030   12.712  609.980   10.072  596.808   13.916 13.17139 17.17826 
1 1 1   13   16   18 o  337.235   8.6839   87.094   4.4825   90.652   6.2327   83.283   6.4513  343.957   11.839  329.646   12.786 14.31067 17.42506 
1 1 1   13   16   19 o  838.438   7.7003  538.291   9.8821  540.307   13.832  536.188   14.123  839.791   10.761  836.562   11.030 3.229126 15.40946 
1 1 1   13   16   20 o  463.337   7.8585  164.396   5.5732  166.216   7.7348  162.432   8.0374  465.769   10.850  460.409   11.405 5.360138 15.74131 
1 1 1   13   16   21 o  591.570   6.3825  267.937   5.7792  269.868   7.1421  264.275   9.8360  593.634   7.8602  587.276   10.942 6.358459 13.47276 
1 1 1   13   16   22 o  114.267   27.995   10.478   4.8577   9.8956   5.4701   12.649   10.566  111.485   30.956  131.346   44.314 -19.86070 54.05513 
1 1 1   13   16   23 o  234.132   15.489   42.255   5.5195   42.153   6.3122   42.587   11.376  233.581   17.789  232.189   32.933 1.391479 37.43047 
1 1 1   13   16   24 o  1049.61   7.5681  843.755   12.159  849.988   15.547  833.941   19.509  1053.23   9.6440  1042.86   12.222 10.37109 15.56864 
1 1 1   13   16   25 o   65.096   23.413   2.7434   2.9748   4.8113   3.5568  -2.0706   5.4267   79.920   25.652   62.818   27.971 17.10182 37.95257 
1 1 1   13   16   26 o  822.027   7.0281  517.549   8.8429  525.583   11.251  504.568   14.302  828.190   8.8758  811.119   11.520 17.07123 14.54247 
1 1 1   13   16   27 o  131.269   13.301   13.363   2.6355   14.098   3.5534   12.463   3.9292  134.214   17.731  125.434   21.222 8.780624 27.65475 
1 1 1   13   16   28 o  365.274   6.7224  102.200   3.7585   99.345   5.2027  105.317   5.4356  359.984   9.4423  370.635   9.5814 -10.65118 13.45214 
1 1 1   13   16   29 o  635.191   6.1380  309.025   5.9677  313.686   8.4030  304.282   8.4766  639.721   8.5817  630.035   8.7899 9.685669 12.28449 
1 1 1   13   16   30 o  398.697   6.8901  121.787   4.2047  124.946   5.6574  117.890   6.2846  403.664   9.1564  391.983   10.475 11.68173 13.91261 
1 1 1   13   16   31 o  350.351   7.8553   94.087   4.2125  102.332   6.2367   87.169   5.7124  365.090   11.160  336.965   11.076 28.12531 15.72340 
1 1 1   13   16   32 o  444.873   6.9864  151.671   4.7573  155.949   7.2881  148.494   6.2797  450.712   10.564  439.956   9.3252 10.75537 14.09130 
1 1 1   13   16   33 o  250.502   10.409   48.182   3.9911   46.134   4.8690   52.376   6.9679  244.549   13.055  259.808   17.626 -15.25835 21.93417 
1 1 1   13   16   34 o  127.292   15.337   12.672   2.9280   11.812   4.1723   13.508   4.1099  121.202   23.337  130.258   21.354 -9.056831 31.63260 
1 1 1   13   16   35 o  332.744   7.7215   84.915   3.9326   84.387   5.8185   85.359   5.3359  331.282   11.475  333.317   10.459 -2.034698 15.52588 
1 1 1   13   16   36 f   50.614   20.972   0.5474   2.6592   4.9930   3.9940  -2.9924   3.5640   81.626   27.247   45.866   21.271 35.76044 34.56604 
1 1 1   13   16   37 o  138.641   18.506   15.175   3.8290   8.2248   12.551   15.889   4.0207  119.181   46.897  141.802   19.002 -22.62135 50.60051 
1 1 1   13   16   38 o  331.502   8.0526   84.356   4.0859   77.568   6.0202   90.153   5.5635  317.232   12.398  342.324   10.618 -25.09201 16.32364 
1 1 1   13   16   39 o   69.756   23.841   3.5544   3.0587   5.1868   4.4308   2.0682   4.2278   83.633   28.693   68.047   27.077 15.58612 39.45205 
1 1 1   13   16   40 o  299.182   9.5458   68.849   4.3714   70.036   5.9044   67.410   6.5030  301.145   12.809  295.094   14.397 6.051117 19.27085 
1 1 1   13   16   41 o  110.082   20.310   9.7839   3.2960   7.2540   4.9087   11.861   4.4478   95.025   30.098  120.204   24.990 -25.17846 39.11956 
1 1 1   13   16   42 o  216.869   11.306   36.384   3.7400   43.019   5.8140   31.700   4.8848  234.574   16.294  201.285   15.987 33.28914 22.82705 
1 1 1   13   16   43 o   87.637   24.747   6.2945   3.4653   3.6155   5.1165   8.5647   4.7099   78.403   30.199  101.511   28.916 -23.10880 41.81063 
1 1 1   13   16   44 o  152.915   16.848   18.468   3.8780   18.341   5.8945   18.564   5.1494  149.035   26.826  151.391   22.941 -2.355301 35.29773 
1 1 1   13   16   45 o  346.505   9.1865   92.484   4.8723   92.197   7.2764   92.718   6.5600  344.575   13.796  346.031   12.386 -1.455231 18.54027 
1 1 1   13   16   46 o  310.780   12.812   74.909   6.0945   76.754   7.8340   72.082   9.6998  312.855   16.417  300.752   21.207 12.10312 26.81871 
1 1 1   13   16   47 o  158.138   17.465   19.867   4.1568   23.726   6.3766   17.015   5.4815  169.844   25.301  143.074   25.988 26.76932 36.26979 
1 1 1   13   16   48 o  299.460   10.607   69.350   4.8617   64.808   7.4722   72.684   6.4022  286.650   17.108  305.520   13.691 -18.87064 21.91182 
1 1 1   13   16   49 o  241.942   13.343   45.721   4.9222   51.508   8.2953   42.576   6.1151  252.818   21.645  231.830   17.359 20.98784 27.74636 
1 1 1   13   16   50 f  149.862   23.809   18.598   5.2786   18.867   12.422   18.539   5.8313  139.387   48.031  148.254   26.678 -8.867538 54.94244 
1 1 1   13   16   51 o   79.194   28.494   4.7469   4.4065   17.841   7.1043  -3.4406   5.6176  141.258   33.386   58.251   26.905 83.00700 42.87755 
1 1 1   13   16   52 o   70.330   25.178   3.6909   3.4365   0.8903   6.2038   4.9307   4.1277   71.858   30.991   79.009   27.660 -7.151558 41.53958 
1 1 1   13   16   53 o  173.216   15.667   23.942   4.1088   16.661   6.7845   28.160   5.1634  134.980   33.093  186.617   18.312 -51.63751 37.82165 
1 1 1   13   16   54 o   89.055   25.626   6.8891   3.6812   4.4718   6.3234   8.1283   4.5275   82.477   33.017   95.779   28.656 -13.30165 43.71790 
1 1 1   13   16   55 o  122.744   24.965   13.131   4.5307   9.4826   6.5240   16.529   6.2968  100.978   34.807  133.786   31.305 -32.80811 46.81359 
1 1 1   13   16   56 o   48.738   21.952  -1.0408   3.4487  -8.1003   6.1926   2.1332   4.1522   51.749   25.098   64.410   26.396 -12.66083 36.42352 
1 1 1   13   16   57 f   77.151   26.578   5.1577   3.8037   7.2513   8.2362   4.5901   4.2884   91.706   37.333   75.088   27.929 16.61839 46.62349 
1 1 1   13   16   58 o   61.463   26.222   1.3256   4.3528  -0.7732   7.7735   2.2843   5.2537   70.318   32.174   68.531   29.006 1.786934 43.31820 
1 1 1   13   17    0 o  650.021   12.114  323.853   12.043  323.853   12.043  323.853   12.043  650.021   12.114  650.021   12.114 0.000000 0.000000 
1 1 1   13   17    1 o  368.407   8.2791  103.916   4.6685  106.069   6.5837  101.739   6.6211  372.126   11.559  364.444   11.869 7.681854 16.56762 
1 1 1   13   17    2 o  1138.61   9.3895  992.733   16.364  987.675   19.906  1003.28   28.739  1135.55   11.453  1143.98   16.413 -8.430298 20.01374 
1 1 1   13   17    3 o  334.993   7.0371   85.911   3.6083   85.379   4.3232   87.132   6.5509  333.930   8.4582  337.246   12.691 -3.315460 15.25103 
1 1 1   13   17    4 o  878.964   8.0287  591.511   10.802  588.364   13.069  598.295   19.188  876.537   9.7410  883.600   14.187 -7.063538 17.20942 
1 1 1   13   17    5 o  1035.76   8.8567  821.455   14.041  833.975   17.366  797.820   23.861  1043.49   10.873  1020.24   15.280 23.25232 18.75334 
1 1 1   13   17    6 o  1216.88   9.8811  1134.01   18.404  1117.81   22.086  1170.80   33.293  1207.98   11.945  1235.60   17.604 -27.61731 21.27367 
1 1 1   13   17    7 o  212.722   10.446   34.656   3.4010   38.298   4.1203   26.870   6.0250  223.263   12.102  185.847   21.582 37.41556 24.74358 
1 1 1   13   17    8 o  331.545   10.489   84.188   5.3228   86.700   7.5395   81.693   7.5157  336.334   14.645  326.465   15.040 9.869232 20.99296 
1 1 1   13   17    9 o  756.636   9.9464  438.444   11.519  435.662   16.304  441.215   16.277  753.969   14.128  758.767   14.015 -4.798157 19.90030 
1 1 1   13   17   10 f  348.972   8.4947   93.249   4.5374   97.059   5.4496   84.638   8.1925  355.995   10.001  332.249   16.109 23.74609 18.96151 
1 1 1   13   17   11 o  724.555   8.0134  401.963   8.8871  417.103   11.022  373.828   15.025  737.990   9.7573  698.398   14.055 39.59204 17.11025 
1 1 1   13   17   12 o  605.682   7.9855  280.890   7.4031  286.503   8.9575  268.795   13.150  611.639   9.5680  592.172   14.508 19.46710 17.37900 
1 1 1   13   17   13 o  778.683   8.4364  464.302   10.055  459.451   12.042  475.473   18.274  774.509   10.158  787.512   15.161 -13.00311 18.24890 
1 1 1   13   17   14 o  786.180   8.4824  473.297   10.207  475.029   12.390  469.638   18.006  787.512   10.279  782.654   15.031 4.857178 18.20960 
1 1 1   13   17   15 o  377.949   9.2975  109.400   5.3786  110.355   6.3633  107.010   10.066  379.543   10.953  373.453   17.609 6.090485 20.73771 
1 1 1   13   17   16 o  331.429   9.4926   84.131   4.8155   88.113   6.1597   77.871   7.7227  339.108   11.867  318.641   15.834 20.46719 19.78783 
1 1 1   13   17   17 o  626.216   7.2870  300.258   6.9846  306.388   9.8041  293.940   9.9530  632.436   10.128  619.434   10.498 13.00177 14.58680 
1 1 1   13   17   18 o  251.135   10.454   48.317   4.0186   49.971   5.6011   46.562   5.7690  254.876   14.417  245.905   15.405 8.970734 21.09853 
1 1 1   13   17   19 o  759.285   7.6074  441.467   8.8412  469.769   12.779  415.483   12.245  783.029   10.662  736.382   10.864 46.64703 15.22187 
1 1 1   13   17   20 o  298.886   12.242   68.475   5.6006   70.847   6.4068   60.789   11.533  303.955   13.771  279.439   27.313 24.51575 30.58801 
1 1 1   13   17   21 o  236.644   14.747   43.128   5.3152   45.518   6.0315   34.823   11.245  242.970   16.313  208.834   36.507 34.13559 39.98592 
1 1 1   13   17   22 o  403.140   8.6508  124.494   5.3380  123.732   7.5359  125.262   7.5624  401.719   12.256  404.198   12.224 -2.478729 17.30959 
1 1 1   13   17   23 o  190.187   10.548   27.808   3.0584   29.118   3.5512   24.046   6.0179  194.505   11.987  175.171   23.001 19.33333 25.93676 
1 1 1   13   17   24 o  408.473   7.7627  127.805   4.8534  132.869   6.2031  119.812   7.7935  416.382   9.7330  395.189   12.884 21.19235 16.14729 
1 1 1   13   17   25 o  161.676   12.162   20.165   2.9876   22.516   3.4896   13.711   5.7813  170.750   13.461  130.398   29.638 40.35262 32.55179 
1 1 1   13   17   26 o  381.835   7.4587  111.691   4.3592  112.825   5.2577  109.196   7.7970  383.687   8.9527  377.126   13.507 6.561401 16.20489 
1 1 1   13   17   27 o  255.754   9.0549   50.139   3.5447   48.933   4.1721   53.269   6.7210  252.576   10.792  262.580   16.811 -10.00386 19.97670 
1 1 1   13   17   28 o  227.353   8.4006   39.618   2.9234   34.214   3.9011   46.539   4.4150  210.762   12.144  246.240   11.714 -35.47763 16.87288 
1 1 1   13   17   29 o  303.366   7.7497   70.531   3.5985   70.175   5.2957   70.836   4.9049  302.353   11.443  303.842   10.547 -1.488586 15.56178 
1 1 1   13   17   30 o  254.452   8.6111   49.644   3.3538   53.040   4.7126   46.159   4.7740  262.801   11.715  244.751   12.788 18.04980 17.34299 
1 1 1   13   17   31 o  153.695   11.980   18.259   2.7960   18.498   4.0369   18.038   3.8761  153.861   17.450  152.003   16.949 1.857956 24.32623 
1 1 1   13   17   32 o   90.552   22.680   6.6184   3.1367   7.8518   3.6494   3.1304   6.1371   98.504   24.344   82.658   32.708 15.84583 40.77340 
1 1 1   13   17   33 o   65.338   21.790   3.1409   2.5547   4.1139   3.7772   2.3206   3.4683   76.218   26.472   65.232   24.928 10.98682 36.36162 
1 1 1   13   17   34 o  281.166   8.0838   60.641   3.4790   63.693   5.0407   57.864   4.8076  287.824   11.442  274.336   11.449 13.48746 16.18631 
1 1 1   13   17   35 o  218.641   11.590   36.875   3.8650   43.345   4.7327   23.920   6.6969  236.851   13.106  172.757   26.143 64.09335 29.24446 
1 1 1   13   17   36 o  341.383   7.5584   89.403   3.9495   88.606   5.6655   90.157   5.5087  339.422   10.905  342.439   10.510 -3.016632 15.14517 
1 1 1   13   17   37 o  178.415   15.291   24.795   4.1353   3.0597   13.066   27.214   4.3594  108.522   45.827  186.960   15.370 -78.43858 48.33541 
1 1 1   13   17   38 o  114.932   18.660   10.533   3.1701   9.7553   4.3855   11.384   4.5877  108.921   26.547  117.813   26.126 -8.892387 37.24638 
1 1 1   13   17   39 o  318.329   8.9889   77.890   4.3798   90.365   5.9709   63.360   6.4440  342.423   11.392  285.679   14.788 56.74429 18.66701 
1 1 1   13   17   40 o  158.891   13.595   19.669   3.2746   20.256   4.9377   19.208   4.3750  159.460   20.720  155.783   18.723 3.676743 27.92632 
1 1 1   13   17   41 o  150.244   14.594   17.663   3.3137   23.474   5.0130   13.153   4.4161  172.126   19.364  127.069   23.573 45.05694 30.50674 
1 1 1   13   17   42 f  351.022   8.9164   94.793   4.7907   96.742   6.7430   92.807   6.8075  353.736   12.454  346.357   12.841 7.378693 17.88815 
1 1 1   13   17   43 o  166.061   14.335   21.562   3.6079   33.751   5.7081   13.452   4.6559  206.850   18.215  127.931   24.671 78.91861 30.66678 
1 1 1   13   17   44 o  275.087   9.9117   58.339   4.1734   55.217   6.2244   60.889   5.6251  265.851   15.362  280.269   13.113 -14.41745 20.19719 
1 1 1   13   17   45 o  129.911   20.131   13.612   3.8734   18.310   6.1546   10.531   4.9842  147.999   28.198  111.583   28.939 36.41615 40.40537 
1 1 1   13   17   46 o  181.710   18.420   26.240   5.0523   25.821   6.2056   27.063   8.7009  178.319   23.293  177.709   33.209 0.6098633 40.56342 
1 1 1   13   17   47 o   81.232   26.214   5.2971   3.7104  -2.1638   5.4630   11.686   5.0552   60.923   27.517  117.176   28.467 -56.25310 39.59227 
1 1 1   13   17   48 o   54.100   23.685  -0.4909   3.7383   1.8510   5.4761  -2.5347   5.1157   72.517   30.075   57.685   26.280 14.83191 39.93934 
1 1 1   13   17   49 o   90.717   31.223   6.6305   5.2487  -4.2550   19.975   7.4378   5.4399  108.415   50.306   94.828   31.797 13.58657 59.51265 
1 1 1   13   17   50 o  195.072   15.491   30.085   4.5872   35.445   7.0682   26.184   6.0295  208.304   22.528  178.740   22.540 29.56461 31.86775 
1 1 1   13   17   51 o  104.318   26.683   9.3923   4.2777   17.422   6.4012   2.9133   5.7501  140.749   30.587   76.375   31.154 64.37386 43.65912 
1 1 1   13   17   52 o  126.859   25.678   13.810   4.8148   19.135   6.6564   7.9672   6.9730  146.902   30.597   97.516   35.730 49.38603 47.04099 
1 1 1   13   17   53 o  234.801   14.549   43.676   5.2031   37.001   6.8102   53.036   8.0644  211.988   21.275  254.393   20.895 -42.40546 29.82049 
1 1 1   13   17   54 f   75.444   28.408   4.2170   4.4635   14.296   6.6448  -4.0707   6.0253  123.000   34.106   58.247   27.228 64.75233 43.64106 
1 1 1   13   17   55 o  133.663   21.590   15.141   4.2665   20.082   6.2403   10.804   5.8465  149.568   28.295  106.691   32.703 42.87714 43.24450 
1 1 1   13   17   56 o  174.448   18.696   25.215   4.9143   22.675   8.3460   26.564   6.0801  149.932   36.671  175.660   23.180 -25.72838 43.38262 
1 1 1   13   17   57 o   93.295   29.812   8.2346   4.8079   9.9898   5.9331   4.8773   8.2055  100.529   33.192   84.667   36.059 15.86185 49.00954 
1 1 1   13   18    0 o   75.818   34.530   6.4112   4.3465   6.4112   4.3465   6.4112   4.3465   75.818   34.530   75.818   34.530 0.000000 0.000000 
1 1 1   13   18    1 o  764.084   9.2186  447.067   10.781  438.862   14.937  455.991   15.578  756.830   12.894  771.438   13.193 -14.60797 18.44729 
1 1 1   13   18    2 o  1030.92   8.8495  813.811   13.964  801.342   16.827  841.396   25.028  1022.86   10.748  1047.66   15.607 -24.79327 18.95010 
1 1 1   13   18    3 o  453.151   6.9330  157.206   4.8088  158.703   5.8736  154.162   8.3747  455.268   8.4288  448.587   12.197 6.680969 14.82604 
1 1 1   13   18    4 o  860.268   8.0289  566.632   10.572  561.843   12.778  577.024   18.824  856.534   9.7462  867.711   14.173 -11.17682 17.20059 
1 1 1   13   18    5 o  817.464   7.8543  511.640   9.8276  509.430   11.850  516.508   17.588  815.615   9.4922  820.958   13.997 -5.343140 16.91172 
1 1 1   13   18    6 o  421.849   8.7612  136.266   5.6570  132.421   7.4935  141.362   8.6260  415.763   11.775  429.518   13.121 -13.75586 17.62978 
1 1 1   13   18    7 o  706.527   9.7905  382.293   10.588  395.757   15.608  370.817   14.410  718.588   14.190  695.622   13.534 22.96576 19.60976 
1 1 1   13   18    8 o  1057.47   9.3209  856.360   15.087  831.622   17.948  915.936   27.852  1041.94   11.254  1092.88   16.650 -50.94080 20.09672 
1 1 1   13   18    9 o  463.533   7.8776  164.514   5.5891  167.128   6.7785  158.962   9.8779  467.153   9.4800  455.408   14.171 11.74509 17.04938 
1 1 1   13   18   10 o  574.325   7.8735  252.558   6.9214  250.512   8.3288  257.125   12.443  571.931   9.5141  579.194   14.036 -7.262939 16.95665 
1 1 1   13   18   11 o  273.051   10.464   57.108   4.3732   54.100   5.0576   66.022   8.7060  265.715   12.435  292.627   19.550 -26.91245 23.16951 
1 1 1   13   18   12 o  598.249   8.0963  274.052   7.4137  276.157   8.9509  269.454   13.231  600.471   9.7388  592.857   14.580 7.613892 17.53371 
1 1 1   13   18   13 o  1269.84   10.624  1235.22   20.649  1235.88   25.194  1233.86   36.043  1269.89   12.962  1267.92   18.572 1.970215 22.64784 
1 1 1   13   18   14 o  1022.80   9.5356  801.245   14.928  829.083   18.418  747.939   25.487  1040.23   11.568  987.375   16.864 52.85431 20.45040 
1 1 1   13   18   15 o  866.716   10.683  575.488   14.172  575.488   14.172   0.0000   0.0000  866.716   10.683  ?   ?  0.000000 10.68285 
1 1 1   13   18   16 o  471.037   7.6610  169.897   5.5234  167.364   7.5778  172.770   8.0679  467.395   10.592  474.859   11.100 -7.464264 15.34296 
1 1 1   13   18   17 o  281.521   11.543   60.733   4.9737   59.696   5.7445   63.839   9.9405  279.041   13.450  287.198   22.801 -8.156464 26.47189 
1 1 1   13   18   18 o  468.523   9.3377  168.148   6.6964  171.723   7.8180  158.303   12.975  473.406   10.789  453.990   18.672 19.41617 21.56532 
1 1 1   13   18   19 o  407.389   8.3548  127.113   5.2097  132.774   7.3444  121.381   7.3911  416.217   11.528  397.928   12.135 18.28906 16.73788 
1 1 1   13   18   20 o  661.424   7.6273  335.040   7.7218  335.127   10.684  334.944   11.173  661.302   10.555  661.082   11.042 0.2208862 15.27541 
1 1 1   13   18   21 o  389.500   8.6734  116.217   5.1709  118.120   7.2541  114.252   7.3729  392.499   12.075  385.994   12.479 6.504578 17.36457 
1 1 1   13   18   22 o  516.948   8.0255  204.701   6.3502  208.245   9.0236  201.223   8.9383  521.175   11.312  512.306   11.399 8.869202 16.05871 
1 1 1   13   18   23 o  265.984   9.1522   54.213   3.7261   62.947   4.6390   38.333   6.2551  286.550   10.577  222.466   18.539 64.08386 21.34345 
1 1 1   13   18   24 o  278.311   11.243   59.403   4.7894   75.803   7.0251   45.161   6.5466  314.167   14.609  241.638   17.826 72.52910 23.04770 
1 1 1   13   18   25 o  677.094   6.7131  351.148   6.9573  347.493   8.5935  358.102   11.853  673.413   8.3372  683.252   11.333 -9.839294 14.06964 
1 1 1   13   18   26 o  378.961   7.4530  110.028   4.3231  108.917   5.1822  112.571   7.8396  376.950   8.9818  382.852   13.378 -5.901672 16.11352 
1 1 1   13   18   27 o  378.899   7.4960  110.004   4.3473  105.696   5.2162  119.802   7.8665  371.293   9.1785  394.935   13.013 -23.64160 15.92452 
1 1 1   13   18   28 o  170.156   12.464   22.357   3.2235   23.745   3.7829   18.675   6.1592  175.161   14.233  152.680   27.361 22.48094 30.84139 
1 1 1   13   18   29 o  394.368   6.7810  119.166   4.0932  117.962   5.4080  120.780   6.2630  392.196   9.0088  396.725   10.314 -4.528687 13.69434 
1 1 1   13   18   30 o  366.245   6.9004  102.791   3.8683  111.221   5.4692   94.353   5.4719  380.754   9.3845  350.617   10.196 30.13733 13.85746 
1 1 1   13   18   31 o  326.384   8.5151   81.702   4.2539   80.546   5.1419   84.209   7.5725  323.897   10.372  330.609   14.964 -6.711731 18.20712 
1 1 1   13   18   32 o  133.796   12.941   13.901   2.6171   9.6882   3.6738   18.241   3.7290  109.665   22.637  152.906   16.179 -43.24104 27.82412 
1 1 1   13   18   33 o  241.450   8.5537   44.731   3.1612   46.039   4.4914   43.446   4.4501  244.654   11.994  237.323   12.293 7.330933 17.17460 
1 1 1   13   18   34 o  343.716   7.2076   90.593   3.7919   98.518   5.5264   83.543   5.2126  358.097   10.083  329.728   10.328 28.36877 14.43371 
1 1 1   13   18   35 o   59.706   22.110   2.1910   2.6816   1.3742   3.8465   2.9635   3.7406   62.999   25.563   69.778   26.059 -6.779282 36.50347 
1 1 1   13   18   36 o  182.681   16.000   26.023   4.4287   0.0000   0.0000   26.023   4.4287  ?   ?   182.681   16.000 0.000000 15.99978 
1 1 1   13   18   37 o  255.378   9.5336   50.133   3.7266   54.184   5.0639   45.347   5.5038  265.079   12.481  241.659   14.953 23.41991 19.47723 
1 1 1   13   18   38 o  215.545   10.067   35.747   3.3214   36.221   4.6882   35.271   4.7061  215.931   14.265  213.012   14.521 2.919464 20.35556 
1 1 1   13   18   39 o   88.134   21.339   6.3366   2.8479   4.2063   4.2777   8.0324   3.8166   77.944   28.071   98.801   25.167 -20.85704 37.70153 
1 1 1   13   18   40 f  194.443   11.321   29.259   3.3549   32.483   4.9094   26.435   4.5952  203.865   15.858  183.615   16.527 20.25020 22.90482 
1 1 1   13   18   41 o  199.049   11.973   30.710   3.6309   36.267   5.2541   25.630   5.0235  215.336   16.056  180.144   18.480 35.19171 24.48113 
1 1 1   13   18   42 o  256.656   14.459   51.296   5.6571   51.296   5.6571   0.0000   0.0000  256.656   14.459  ?   ?  0.000000 14.45919 
1 1 1   13   18   43 o  234.721   10.514   42.504   3.7774   43.988   5.5740   41.245   5.1369  237.211   15.436  229.902   14.675 7.309174 21.29806 
1 1 1   13   18   44 o   62.071   24.355   1.9686   3.3760  -5.9912   4.9203   9.0494   4.6407   49.264   23.493  103.781   28.392 -54.51692 36.85187 
1 1 1   13   18   45 o  122.865   24.721   12.516   4.4880   11.167   5.4727   15.286   7.8425  114.379   30.643  131.734   37.239 -17.35506 48.22562 
1 1 1   13   18   46 o  115.598   21.286   10.932   3.6275   14.219   5.6571   8.6368   4.7273  129.245   29.276  101.093   29.025 28.15166 41.22540 
1 1 1   13   18   47 o  146.054   17.893   17.041   3.9164   15.588   5.9831   18.130   5.1805  134.964   29.763  148.555   23.570 -13.59087 37.96540 
1 1 1   13   18   48 o  116.675   23.472   11.332   4.0466   14.638   6.4285   9.1628   5.2078  129.223   32.525  103.350   30.691 25.87323 44.71906 
1 1 1   13   18   49 o  308.433   12.837   74.114   6.0602   86.361   13.642   71.103   6.7644  321.547   27.997  301.290   14.668 20.25674 31.60655 
1 1 1   13   18   50 o  148.427   20.224   17.956   4.4749   20.355   6.6563   15.979   6.0448  153.413   29.417  135.227   29.990 18.18625 42.00924 
1 1 1   13   18   51 o  208.711   16.003   34.647   5.0733   33.238   6.7566   36.467   7.6815  200.875   22.354  209.085   24.465 -8.210785 33.13963 
1 1 1   13   18   52 o   60.696   25.963   0.6220   4.2877   4.1858   6.0158  -3.0576   6.1128   81.035   32.283   61.303   28.226 19.73154 42.88183 
1 1 1   13   18   53 o  167.458   26.063   24.115   6.4630   24.115   6.4630   0.0000   0.0000  167.458   26.063  ?   ?  0.000000 26.06265 
1 1 1   13   18   54 o  206.937   18.619   35.017   5.8344   21.961   9.0832   44.188   7.6124  147.270   39.487  229.904   21.897 -82.63463 45.15166 
1 1 1   13   18   55 o   74.750   28.865   4.1519   4.6836   3.9261   8.2727   4.2584   5.6819   84.104   36.022   78.034   31.276 6.070122 47.70502 
1 1 1   13   18   56 o  135.413   20.386   15.556   4.0944   20.210   5.9619   11.402   5.6327  149.553   27.040  108.318   31.853 41.23399 41.78286 
1 1 1   13   19    0 o  263.855   14.934   53.834   5.9873   53.834   5.9873   53.834   5.9873  263.855   14.934  263.855   14.934 0.000000 0.000000 
1 1 1   13   19    1 o  386.712   8.8792  114.516   5.2557  118.586   7.5454  110.680   7.3248  393.411   12.530  380.069   12.591 13.34195 17.76372 
1 1 1   13   19    2 o  946.589   10.367  686.289   15.021  669.446   20.700  705.022   21.830  934.551   14.471  959.020   14.872 -24.46906 20.75014 
1 1 1   13   19    3 o  556.761   7.1348  237.323   6.0802  228.756   7.2572  257.501   11.137  546.569   8.6746  579.717   12.551 -33.14807 15.25722 
1 1 1   13   19    4 o  633.308   8.9048  307.133   8.6319  304.465   11.885  310.112   12.557  630.380   12.318  636.164   12.896 -5.784302 17.83356 
1 1 1   13   19    5 o  437.203   8.8532  146.374   5.9245  144.280   7.9526  148.985   8.8812  433.958   11.973  440.928   13.159 -6.970490 17.79080 
1 1 1   13   19    6 o  314.404   8.1523   75.690   3.9232   75.721   4.5819   75.603   7.5944  314.440   9.5200  313.602   15.873 0.8386536 18.50899 
1 1 1   13   19    7 o  826.877   8.3419  523.549   10.558  526.281   12.978  518.202   18.156  828.919   10.229  822.201   14.427 6.717590 17.68504 
1 1 1   13   19    8 o  402.801   8.2827  124.239   5.1066  122.789   6.0789  127.715   9.4130  400.396   9.9190  408.142   15.068 -7.745331 18.03938 
1 1 1   13   19    9 o  122.551   19.895   11.825   3.6040   12.806   4.1852   9.0116   7.0891  127.259   22.299  110.326   36.275 16.93288 42.58043 
1 1 1   13   19   10 o  984.279   9.1247  741.951   13.747  755.159   17.020  717.163   23.316  992.828   11.200  967.038   15.752 25.78973 19.32799 
1 1 1   13   19   11 o  478.483   8.3884  175.320   6.1435  174.698   7.2908  176.844   11.409  477.573   9.9739  480.210   15.522 -2.635986 18.45019 
1 1 1   13   19   12 o  382.116   9.0758  111.826   5.3082  109.487   6.2174  118.115   10.195  378.044   10.745  392.362   16.976 -14.31799 20.09089 
1 1 1   13   19   13 f  576.548   9.8713  254.620   8.7113  254.620   8.7113   0.0000   0.0000  576.548   9.8713  ?   ?  0.000000 9.871346 
1 1 1   13   19   14 o  456.435   10.209  159.596   7.1324  159.596   7.1324   0.0000   0.0000  456.435   10.209  ?   ?  0.000000 10.20914 
1 1 1   13   19   15 o   86.713   27.903   5.6409   4.2064   9.4779   4.7732  -7.6977   8.8996  108.860   28.362   72.350   33.574 36.51038 43.94982 
1 1 1   13   19   16 o  538.968   8.7768  222.490   7.2405  224.264   8.5453  217.972   13.633  541.032   10.319  532.916   16.714 8.115784 19.64249 
1 1 1   13   19   17 f  805.541   7.6921  496.929   9.4843  477.372   12.891  520.008   14.004  789.296   10.670  823.748   11.106 -34.45142 15.40160 
1 1 1   13   19   18 o   81.566   26.229   4.9959   3.7171   5.6076   5.2030   4.3583   5.3123   89.672   31.074   84.471   31.151 5.201401 43.99947 
1 1 1   13   19   19 o  247.698   11.421   47.031   4.3299   45.534   5.9794   48.682   6.2784  242.994   16.169  251.258   16.415 -8.264038 23.04115 
1 1 1   13   19   20 o  378.621   8.8065  109.825   5.1036  110.739   7.2523  108.928   7.1835  379.994   12.469  376.877   12.453 3.117645 17.62225 
1 1 1   13   19   21 o  1389.34   10.079  1479.44   21.433  1539.56   31.535  1427.83   29.218  1416.16   14.548  1363.96   13.995 52.19580 20.18733 
1 1 1   13   19   22 o  565.615   9.1150  245.161   7.8913  258.160   14.120  239.255   9.5163  579.639   15.915  558.582   11.130 21.05750 19.42054 
1 1 1   13   19   23 o  354.595   9.4911   96.377   5.1513  102.761   7.2898   90.010   7.2803  365.903   13.016  342.380   13.892 23.52295 19.03717 
1 1 1   13   19   24 o  376.928   9.2795  108.906   5.3537  108.412   7.4685  109.427   7.6784  375.785   12.985  377.513   13.288 -1.727905 18.57893 
1 1 1   13   19   25 f  385.014   7.3754  113.572   4.3464  114.978   5.2459  110.494   7.7625  387.296   8.8492  379.286   13.371 8.010162 16.03414 
1 1 1   13   19   26 o  286.767   8.7691   63.042   3.8490   63.115   4.7371   62.900   6.6030  286.809   10.791  285.570   15.161 1.238403 18.60874 
1 1 1   13   19   27 o  189.937   10.861   27.777   3.1443   24.741   3.6666   36.214   6.1125  178.911   13.488  215.848   18.686 -36.93660 23.04553 
1 1 1   13   19   28 o  467.611   7.4962  167.586   5.3653  164.735   6.0816  177.597   11.395  463.513   8.5720  480.237   15.503 -16.72397 17.71472 
1 1 1   13   19   29 o  328.764   7.9468   82.865   3.9990   82.722   4.7531   83.212   7.3986  328.360   9.4571  328.752   14.703 -0.3923645 17.48195 
1 1 1   13   19   30 o  405.763   7.5035  126.216   4.6602  121.774   5.5545  136.779   8.5646  398.399   9.1087  421.645   13.271 -23.24582 16.09583 
1 1 1   13   19   31 o  228.153   8.6452   39.934   3.0190   35.714   4.1271   44.791   4.4279  215.110   12.590  241.361   11.986 -26.25162 17.38253 
1 1 1   13   19   32 o  324.979   7.1467   80.970   3.5549   81.101   5.0170   80.839   5.0380  324.954   10.087  324.422   10.146 0.5319519 14.30646 
1 1 1   13   19   33 f  224.777   8.9452   38.784   3.0776   40.325   4.3285   37.209   4.3766  228.548   12.420  219.403   13.092 9.144867 18.04611 
1 1 1   13   19   34 o  176.959   10.696   24.164   2.8835   24.076   4.0219   24.258   4.1363  175.922   15.082  176.517   15.465 -0.5954285 21.60196 
1 1 1   13   19   35 o  266.903   11.074   54.816   4.5240   40.959   12.094   57.070   4.8781  222.316   36.829  272.250   11.706 -49.93347 38.64480 
1 1 1   13   19   36 o  319.482   8.9751   78.418   4.3889   69.534   5.9521   89.003   6.4973  300.215   12.953  339.747   12.494 -39.53262 17.99685 
1 1 1   13   19   37 o  224.082   9.7701   38.621   3.3510   42.942   4.8202   34.579   4.6619  235.393   13.434  210.915   14.529 24.47758 19.78807 
1 1 1   13   19   38 o  264.970   9.0121   53.979   3.6550   47.341   5.2279   60.327   5.1121  246.988   13.885  279.633   11.944 -32.64488 18.31520 
1 1 1   13   19   39 o  154.394   13.089   18.560   3.0641   16.139   4.4260   20.788   4.2462  141.931   21.008  162.470   17.343 -20.53836 27.24177 
1 1 1   13   19   40 o  147.572   13.874   17.014   3.0969   14.069   4.2880   20.224   4.4776  131.959   22.005  159.791   18.659 -27.83188 28.85049 
1 1 1   13   19   41 o  231.327   10.537   41.262   3.7308   43.310   5.2968   39.245   5.2557  235.714   14.755  224.147   15.413 11.56708 21.33711 
1 1 1   13   19   42 o   58.589   22.998   1.7028   3.0115   3.4264   4.2642  -0.0125   4.2537   73.729   27.766   59.771   25.721 13.95784 37.84830 
1 1 1   13   19   43 o  119.048   20.444   11.476   3.5910   13.685   5.4606   9.7929   4.7668  127.518   28.673  107.882   28.458 19.63651 40.39754 
1 1 1   13   19   44 o  248.442   13.175   48.031   4.9921   50.211   5.9802   43.018   9.0669  253.240   15.503  229.512   26.284 23.72849 30.51489 
1 1 1   13   19   45 o   66.025   24.847   2.7417   3.4136   4.7970   5.0746   1.0430   4.6134   82.603   30.448   65.388   27.401 17.21549 40.96208 
1 1 1   13   19   46 o  206.661   12.393   33.259   3.9020   35.760   5.6688   31.006   5.3792  212.510   17.586  197.637   17.979 14.87299 25.14931 
1 1 1   13   19   47 o   90.897   25.758   6.9293   3.7474   5.6839   5.7022   7.8762   4.9718   87.867   32.293   96.765   30.241 -8.897858 44.24221 
1 1 1   13   19   48 o  238.927   15.318   44.942   5.5725   61.599   20.064   43.550   5.8007  244.772   54.905  234.779   16.242 9.993164 57.25721 
1 1 1   13   19   49 o  356.352   12.450   98.928   6.7906   84.675   12.118  105.453   8.1990  320.574   24.891  366.702   14.608 -46.12750 28.86077 
1 1 1   13   19   50 o  228.589   14.141   41.151   4.9235   43.372   6.7042   38.550   7.2542  232.095   19.039  216.843   22.168 15.25240 29.22171 
1 1 1   13   19   51 o  119.720   24.476   12.227   4.3338   9.5663   5.9438   15.247   6.3326  103.398   33.158  129.873   32.052 -26.47445 46.11715 
1 1 1   13   19   52 o  122.001   25.064   12.818   4.5239   8.2423   5.9677   19.001   6.9365   96.809   33.294  144.593   32.171 -47.78406 46.29805 
1 1 1   13   19   53 o   72.064   29.080   3.0219   4.9484  -3.0220   8.6787   5.9333   6.0235   72.446   33.454   86.442   32.894 -13.99541 46.91704 
1 1 1   13   19   54 o  159.361   18.338   20.898   4.3916   15.297   6.3627   25.994   6.0689  126.781   32.604  174.404   23.318 -47.62321 40.08495 
1 1 1   13   19   55 o  112.899   24.672   11.325   4.1444   7.2062   6.0674   14.928   5.6745   89.500   33.234  126.298   29.830 -36.79825 44.65804 
1 1 1   13   19   56 o   52.495   24.671  -3.5710   5.0619  -2.4679   6.6503  -5.0903   7.8048   62.852   29.115   63.287   30.011 -0.4347000 41.81336 
1 1 1   13   20    0 o  1359.55   18.770  1417.39   39.043  1417.39   39.043  1417.39   39.043  1359.55   18.770  1359.55   18.770 0.000000 0.000000 
1 1 1   13   20    1 o  162.640   14.904   20.449   3.6689   20.771   5.0332   20.084   5.3593  163.188   20.610  160.130   22.486 3.058228 30.50217 
1 1 1   13   20    2 o  564.939   8.8776  244.408   7.6765  251.007   10.865  237.831   10.848  572.343   12.402  557.100   12.721 15.24243 17.76645 
1 1 1   13   20    3 o  1034.50   11.009  819.831   17.433  807.044   24.099  833.867   25.248  1025.93   15.347  1042.78   15.818 -16.84827 22.03949 
1 1 1   13   20    4 o  911.350   8.4395  636.006   11.773  632.926   14.284  642.529   20.788  909.015   10.266  915.459   14.835 -6.444641 18.04117 
1 1 1   13   20    5 o  119.741   17.561   11.233   3.1228   10.608   3.6505   12.941   6.0303  115.691   21.403  127.031   31.233 -11.33927 37.86290 
1 1 1   13   20    6 o  374.823   7.9193  107.577   4.5434  110.400   5.4075  100.798   8.3787  379.672   9.3050  362.572   15.098 17.09995 17.73485 
1 1 1   13   20    7 o  752.821   8.1766  433.978   9.4218  420.065   11.262  466.438   17.201  740.555   9.9351  780.003   14.407 -39.44861 17.50076 
1 1 1   13   20    8 o  574.162   8.0100  252.435   7.0394  252.887   8.5424  251.478   12.426  574.602   9.7128  572.735   14.174 1.866089 17.18288 
1 1 1   13   20    9 o  1433.48   11.549  1574.47   25.340  1551.13   30.515  1626.32   45.483  1422.42   14.016  1455.08   20.422 -32.65967 24.76864 
1 1 1   13   20   10 o  567.919   8.1091  246.985   7.0490  242.794   8.4031  256.936   12.950  563.006   9.7511  578.861   14.615 -15.85541 17.56973 
1 1 1   13   20   11 o  371.879   9.3202  105.924   5.3051  108.995   6.2167   97.692   10.177  377.181   10.768  356.212   18.731 20.96951 21.60521 
1 1 1   13   20   12 o  466.835   10.199  166.956   7.2876  166.956   7.2876   0.0000   0.0000  466.835   10.199  ?   ?  0.000000 10.19891 
1 1 1   13   20   13 o  439.807   8.7888  148.149   5.9164  139.818   6.8708  172.044   11.636  427.191   10.508  473.522   16.055 -46.33078 19.18795 
1 1 1   13   20   14 o  1255.30   10.646  1207.39   20.454  1206.41   24.962  1209.39   35.685  1254.42   13.001  1254.82   18.580 -0.3953857 22.67632 
1 1 1   13   20   15 f  135.906   20.805   14.527   4.1902   13.639   4.7917   17.411   8.6386  130.929   24.818  146.943   38.092 -16.01416 45.46407 
1 1 1   13   20   16 o  495.480   8.9628  188.061   6.7974  181.148   7.8931  207.902   13.373  486.197   10.606  520.352   16.790 -34.15527 19.85935 
1 1 1   13   20   17 f  411.434   9.7787  129.705   6.1581  126.944   7.1437  137.691   12.150  406.941   11.469  423.240   18.755 -16.29938 21.98392 
1 1 1   13   20   18 o  375.247   8.6875  107.872   4.9898  111.946   7.0487  103.780   7.0645  382.090   12.052  367.861   12.547 14.22940 17.39771 
1 1 1   13   20   19 o  672.756   7.6610  346.672   7.8888  346.796   11.013  346.542   11.306  672.609   10.697  672.332   10.986 0.2767334 15.33381 
1 1 1   13   20   20 f  316.250   9.7300   76.654   4.7099   74.139   6.5725   79.309   6.7528  310.789   13.816  321.448   13.725 -10.65823 19.47464 
1 1 1   13   20   21 o  644.367   9.1565  318.207   9.0309  344.088   16.124  306.377   10.901  669.150   15.742  632.049   11.268 37.10089 19.35974 
1 1 1   13   20   22 o  262.179   11.276   52.726   4.5251   51.296   6.4301   54.128   6.3692  257.763   16.383  264.890   15.781 -7.127563 22.74682 
1 1 1   13   20   23 o  580.625   9.1589  258.425   8.1397  271.242   14.281  252.258   9.9064  593.915   15.709  573.413   11.287 20.50159 19.34359 
1 1 1   13   20   24 o  708.425   9.1375  384.755   9.9081  405.639   17.391  374.719   12.056  726.178   15.647  698.808   11.271 27.37012 19.28360 
1 1 1   13   20   25 o  318.112   10.134   77.625   4.9343   78.059   6.9693   77.190   6.9872  318.634   14.290  316.844   14.407 1.790314 20.29219 
1 1 1   13   20   26 o  199.560   9.9766   30.552   3.0474   30.859   3.4767   29.536   6.3310  200.164   11.395  194.179   21.670 5.984360 24.48366 
1 1 1   13   20   27 o  229.902   9.6175   40.549   3.3844   41.604   3.7721   36.197   7.6634  232.812   10.585  214.647   23.722 18.16527 25.97632 
1 1 1   13   20   28 o  201.937   10.383   31.385   3.1984   27.902   3.6435   43.086   6.6779  190.105   12.593  235.397   18.688 -45.29219 22.53464 
1 1 1   13   20   29 o  748.730   7.0852  429.685   8.1198  434.437   10.165  421.307   13.497  752.544   8.8249  740.369   11.910 12.17426 14.82324 
1 1 1   13   20   30 o  248.976   9.5033   47.581   3.6216   50.987   4.2654   38.784   6.8553  257.620   10.817  222.729   20.333 34.89098 23.03112 
1 1 1   13   20   31 o  713.370   7.1054  390.158   7.7584  389.010   9.5926  392.328   13.192  711.982   8.8023  714.157   12.069 -2.175415 14.93767 
1 1 1   13   20   32 o   52.764   20.352   1.4310   2.3262   3.8783   3.1973  -1.3213   3.3906   72.526   24.377   49.376   22.038 23.14989 32.86209 
1 1 1   13   20   33 o  215.314   8.9928   35.598   2.9637   37.218   4.1238   33.867   4.2623  219.503   12.324  209.178   13.383 10.32558 18.19260 
1 1 1   13   20   34 o   90.725   25.321   6.6694   3.6500   2.1028   7.4671   8.1031   4.1839   84.844   35.148   99.615   26.837 -14.77139 44.22219 
1 1 1   13   20   35 o  200.990   11.096   31.192   3.4003   30.880   4.7596   31.517   4.8595  199.090   15.747  201.109   15.917 -2.019501 22.39014 
1 1 1   13   20   36 o   46.047   19.685  -0.0241   2.4620   0.2231   3.4192  -0.2903   3.5479   55.055   23.356   54.071   23.378 0.9841881 33.04602 
1 1 1   13   20   37 o  217.814   9.7092   36.501   3.2370   35.105   4.5681   37.909   4.5876  212.533   14.123  221.006   13.628 -8.472870 19.62579 
1 1 1   13   20   38 o  155.623   12.560   18.827   2.9663   22.645   4.2528   15.211   4.1395  169.859   16.568  137.962   20.201 31.89764 26.12670 
1 1 1   13   20   39 o  178.273   11.789   24.639   3.1986   20.516   4.6236   28.424   4.4296  160.832   19.159  190.733   15.302 -29.90080 24.51957 
1 1 1   13   20   40 f   69.234   23.398   3.5860   2.9457   3.8614   4.1508   3.3065   4.1811   75.476   27.581   72.923   27.488 2.553085 38.93914 
1 1 1   13   20   41 o   66.123   23.355   3.0969   2.9474   5.0087   4.4688   1.6250   3.9212   82.199   28.780   63.919   25.854 18.27937 38.68758 
1 1 1   13   20   42 o  173.502   12.982   23.454   3.4227   19.073   5.0747   27.111   4.6358  153.643   22.225  185.645   16.486 -32.00171 27.67164 
1 1 1   13   20   43 o  115.309   23.862   10.986   4.0727   9.6764   4.7772   14.469   7.7918  107.106   28.601  128.594   37.364 -21.48795 47.05412 
1 1 1   13   20   44 o  153.750   15.143   18.609   3.5175   28.589   5.2159   10.284   4.7637  189.849   18.171  110.231   28.138 79.61761 33.49566 
1 1 1   13   20   45 o  114.347   20.805   10.680   3.5072   13.496   5.0911   8.1376   4.8385  126.588   27.093   98.378   29.666 28.21027 40.17653 
1 1 1   13   20   46 o  136.302   17.837   14.872   3.6320   12.711   5.2961   16.790   4.9903  121.931   28.831  142.765   23.666 -20.83410 37.29977 
1 1 1   13   20   47 o  163.968   16.704   21.365   4.1336   23.269   6.6266   20.153   5.2887  166.621   26.899  156.810   22.695 9.811020 35.19399 
1 1 1   13   20   48 o  161.446   20.216   21.136   4.8862   36.145   10.938   17.394   5.4614  200.539   36.999  143.767   25.765 56.77243 45.08609 
1 1 1   13   20   49 o   56.960   24.944  -0.3525   4.1491  -3.4925   5.6698   3.2679   6.0880   58.352   26.979   78.985   32.119 -20.63351 41.94602 
1 1 1   13   20   50 o  159.012   18.088   20.428   4.3241   20.581   6.2807   20.289   5.9621  154.574   27.556  154.256   26.188 0.3185120 38.01549 
1 1 1   13   20   51 o   94.851   27.754   7.8745   4.2857   7.8663   6.2794   7.8816   5.8638   95.758   34.061   95.373   32.992 0.3842087 47.41936 
1 1 1   13   20   52 o   71.626   29.817   2.3022   5.4112   3.0600   9.3209   1.9169   6.6459   87.211   37.799   75.472   32.304 11.73843 49.72258 
1 1 1   13   20   53 o  112.083   24.779   11.018   4.1380   8.6226   5.8126   13.478   5.8921   96.810   32.867  119.937   31.639 -23.12744 45.62069 
1 1 1   13   20   54 o  102.842   25.622   9.4872   4.0185   8.6259   5.5870   10.410   5.7841   95.858   32.224  104.094   32.632 -8.236145 45.86093 
1 1 1   13   20   55 f   87.246   30.584   6.9625   5.0471   7.4219   6.3771   6.1924   8.2568   90.098   33.950   88.709   36.872 1.389023 50.12132 
1 1 1   13   21    0 o  621.675   12.868  296.371   12.233  296.371   12.233  296.371   12.233  621.675   12.868  621.675   12.868 0.000000 0.000000 
1 1 1   13   21    1 o  497.375   9.0976  189.461   6.9260  186.632   9.5785  192.561   10.026  493.479   12.681  501.235   13.069 -7.755890 18.21004 
1 1 1   13   21    2 o  385.979   9.6821  114.110   5.7201  111.810   7.7314  116.892   8.5022  381.934   13.225  390.470   14.226 -8.536987 19.42362 
1 1 1   13   21    3 o  963.914   10.681  711.790   15.758  716.316   22.192  707.187   22.381  966.502   15.001  960.294   15.227 6.207397 21.37486 
1 1 1   13   21    4 o  582.802   7.5221  260.076   6.7102  253.161   7.9981  276.513   12.331  574.935   9.0887  600.607   13.413 -25.67169 16.20221 
1 1 1   13   21    5 f  839.893   8.2606  540.199   10.619  534.618   12.780  552.648   19.087  835.424   9.9944  848.953   14.689 -13.52899 17.76665 
1 1 1   13   21    6 o  664.721   7.7273  338.342   7.8620  337.248   9.4541  340.794   14.156  663.564   9.3083  666.721   13.872 -3.156982 16.70532 
1 1 1   13   21    7 o  1103.49   9.7605  932.742   16.486  925.411   20.114  947.747   28.777  1098.90   11.958  1111.34   16.917 -12.44165 20.71663 
1 1 1   13   21    8 o  448.612   8.4461  154.127   5.7996  148.463   6.9471  167.150   10.535  440.220   10.310  466.857   14.743 -26.63672 17.99010 
1 1 1   13   21    9 o  438.861   8.5728  147.504   5.7586  145.911   6.9908  150.868   10.157  436.407   10.466  443.510   14.962 -7.102997 18.25906 
1 1 1   13   21   10 o  1224.63   12.778  1149.64   23.952  1149.64   23.952   0.0000   0.0000  1224.63   12.778  ?   ?  0.000000 12.77800 
1 1 1   13   21   11 o  1399.92   14.004  1502.92   30.006  1502.92   30.006   0.0000   0.0000  1399.92   14.004  ?   ?  0.000000 14.00356 
1 1 1   13   21   12 o  976.992   9.3268  731.194   13.947  744.587   17.268  706.057   23.657  985.663   11.446  959.151   16.114 26.51160 19.76493 
1 1 1   13   21   13 o  731.857   8.6025  410.259   9.6365  401.051   11.469  432.368   17.772  723.461   10.357  750.613   15.469 -27.15210 18.61594 
1 1 1   13   21   14 f  256.138   12.356   50.302   4.8443   48.453   5.5606   56.121   9.8668  250.882   14.543  268.782   24.244 -17.89958 28.27150 
1 1 1   13   21   15 o  532.945   8.7998  217.586   7.1783  220.990   8.6689  210.161   12.804  536.982   10.547  523.182   15.989 13.80035 19.15403 
1 1 1   13   21   16 o  639.086   8.7631  312.901   8.5721  314.056   10.360  310.394   15.263  640.114   10.574  635.797   15.684 4.316223 18.91573 
1 1 1   13   21   17 o  251.231   13.329   48.563   5.1071   48.580   5.9416   48.517   9.9930  251.034   15.540  249.144   26.616 1.889603 30.82058 
1 1 1   13   21   18 o  472.699   8.0785  171.177   5.8450  168.328   8.0534  174.348   8.4965  468.531   11.230  476.800   11.642 -8.269196 16.17558 
1 1 1   13   21   19 o  415.403   8.6351  132.224   5.4904  130.623   7.7313  133.852   7.7985  412.626   12.241  417.699   12.198 -5.072540 17.28092 
1 1 1   13   21   20 o  377.603   12.396  109.417   7.1647   0.0000   0.0000  109.417   7.1647  ?   ?   377.603   12.396 0.000000 12.39640 
1 1 1   13   21   21 o  565.242   9.1197  244.901   7.8901  251.760   13.335  241.206   9.7871  572.301   15.223  560.714   11.404 11.58722 19.02077 
1 1 1   13   21   22 o  894.582   9.4489  613.573   12.938  630.576   22.304  604.950   15.883  905.339   16.096  887.849   11.688 17.48999 19.89161 
1 1 1   13   21   23 o   83.633   27.286   5.2525   4.0141   2.5139   5.4933   8.3902   5.8799   77.550   30.863  104.106   32.937 -26.55592 45.13743 
1 1 1   13   21   24 o  369.543   9.2967  104.724   5.2585  109.048   7.5347  100.618   7.3424  376.723   13.067  361.848   13.257 14.87482 18.61423 
1 1 1   13   21   25 o  361.953   9.5291  100.493   5.2793  108.237   7.6419   93.423   7.3018  375.234   13.305  348.566   13.686 26.66864 19.08769 
1 1 1   13   21   26 o  213.324   14.750   35.196   4.7867   44.619   6.4220   23.416   7.1802  239.824   17.618  170.926   28.445 68.89824 33.45878 
1 1 1   13   21   27 o  259.335   12.340   51.697   4.8982   46.078   6.6892   58.192   7.1922  243.579   18.071  274.049   17.234 -30.46985 24.97112 
1 1 1   13   21   28 o  226.277   9.6386   39.297   3.3383   39.710   3.8639   38.083   6.6298  227.355   11.103  220.881   19.821 6.473892 22.71878 
1 1 1   13   21   29 f   77.353   21.673   4.7815   2.6688   4.8807   3.0097   4.4166   5.7727   78.582   23.330   85.757   32.304 -7.175072 39.84792 
1 1 1   13   21   30 o   70.076   22.209   3.7690   2.6725   7.2496   3.0397  -8.0811   5.6088   94.722   21.463   51.050   24.541 43.67216 32.60244 
1 1 1   13   21   31 o  364.703   7.9869  102.042   4.4585  104.791   5.3874   96.066   7.9423  369.393   9.5285  352.836   14.706 16.55780 17.52335 
1 1 1   13   21   32 o  187.449   13.227   27.216   3.7705   26.360   3.9469   36.159   12.756  184.310   14.098  206.964   41.708 -22.65337 44.02621 
1 1 1   13   21   33 o  432.588   9.0056  143.733   5.9629  139.568   9.4069  146.531   7.7097  425.068   14.458  436.272   11.545 -11.20456 18.50251 
1 1 1   13   21   34 o  457.143   7.2196  160.335   5.0517  157.436   7.5537  162.681   6.7947  452.267   10.912  460.024   9.6498 -7.757263 14.56663 
1 1 1   13   21   35 o  114.886   15.377   10.400   2.6362   11.844   3.7277   8.9551   3.7286  121.448   20.802  104.655   23.812 16.79333 31.61856 
1 1 1   13   21   36 o  446.541   6.8751  153.007   4.6991  161.058   6.7046  145.233   6.5879  457.574   9.5729  434.433   9.9073 23.14053 13.77659 
1 1 1   13   21   37 f  308.243   7.9971   72.991   3.7731   76.182   5.3511   69.836   5.3210  314.355   11.121  300.890   11.553 13.46500 16.03631 
1 1 1   13   21   38 o  413.310   8.5038  131.323   5.3797  141.651   6.5927  110.742   9.3066  428.875   10.043  377.360   16.113 51.51556 18.98622 
1 1 1   13   21   39 o  165.855   13.150   21.422   3.3110   21.843   4.6243   20.978   4.7430  166.116   18.502  162.471   19.460 3.644989 26.85114 
1 1 1   13   21   40 o  209.147   11.408   33.878   3.6382   34.362   5.2644   33.435   5.0336  209.284   16.570  206.583   16.045 2.701691 23.06496 
1 1 1   13   21   41 o  188.524   11.669   27.576   3.3505   29.452   4.9840   26.029   4.5258  193.416   17.008  181.915   16.431 11.50153 23.64861 
1 1 1   13   21   42 o  146.211   17.539   16.975   3.8468   20.875   4.4738   5.9134   7.5344  162.078   18.358   95.107   36.643 66.97128 40.98416 
1 1 1   13   21   43 o  282.763   9.3662   61.638   4.0537   64.337   5.8885   59.206   5.5889  287.806   13.367  276.137   13.223 11.66962 18.80231 
1 1 1   13   21   44 o   65.855   24.065   2.9409   3.1599   1.9202   4.5163   3.9198   4.4228   68.079   27.672   76.223   28.361 -8.144081 39.62408 
1 1 1   13   21   45 o   67.706   25.239   3.0053   3.5060   6.7176   5.0574  -0.4294   4.8647   91.232   30.659   61.895   27.060 29.33696 40.89257 
1 1 1   13   21   46 o  140.655   18.969   15.938   3.9798   20.426   6.1161   12.642   5.2412  156.195   26.531  121.404   28.664 34.79081 39.05822 
1 1 1   13   21   47 o  114.169   28.110   11.224   4.8796   7.5777   11.488   12.027   5.3900  107.308   43.933  117.580   29.886 -10.27193 53.13409 
1 1 1   13   21   48 o  320.319   23.839   84.220   11.604   84.220   11.604   0.0000   0.0000  320.319   23.839  ?   ?  0.000000 23.83899 
1 1 1   13   21   49 o   71.128   28.971   2.4605   4.9633   6.7700   5.8496  -8.6177   9.3787   91.207   32.828   68.265   32.522 22.94213 46.21008 
1 1 1   13   21   50 o  261.531   18.780   55.203   7.4677   48.378   11.008   61.021   10.164  234.267   31.497  269.915   24.883 -35.64786 40.14009 
1 1 1   13   21   51 o   78.803   32.401   3.3996   6.2820   0.0000   0.0000   3.3996   6.2820  ?   ?    78.803   32.401 0.000000 32.40118 
1 1 1   13   21   52 o   86.461   26.745   6.5635   3.9001   4.6126   5.3470   8.7814   5.7011   79.344   30.785   97.880   32.547 -18.53648 44.79964 
1 1 1   13   21   53 o   61.327   25.507   1.5823   3.9549   2.2277   5.6549   0.9644   5.5334   71.235   30.118   66.901   29.060 4.334831 41.85207 
1 1 1   13   21   54 o   86.893   30.568   6.8303   5.0441   4.0057   6.5258   11.022   7.9501   78.951   32.794  104.115   38.151 -25.16433 50.30896 
1 1 1   13   22    0 o  149.155   30.006   19.011   6.0725   19.011   6.0725   19.011   6.0725  149.155   30.006  149.155   30.006 0.000000 0.000000 
1 1 1   13   22    1 o  166.712   16.776   21.543   4.2226   22.898   5.9940   20.207   5.9496  170.937   23.533  160.110   25.103 10.82687 34.40848 
1 1 1   13   22    2 o  393.100   9.8489  118.375   5.9260  116.421   7.9992  120.751   8.8223  389.686   13.411  396.805   14.526 -7.119141 19.76991 
1 1 1   13   22    3 o  698.054   9.5660  373.258   10.221  359.711   13.946  388.981   15.024  684.981   13.301  712.259   13.781 -27.27838 19.15271 
1 1 1   13   22    4 f  836.435   10.122  535.978   12.959  518.767   17.684  555.943   19.045  822.507   14.046  851.399   14.615 -28.89227 20.27034 
1 1 1   13   22    5 o  613.914   7.6920  288.612   7.2280  280.792   8.5902  307.571   13.376  605.458   9.2694  633.336   13.798 -27.87842 16.62227 
1 1 1   13   22    6 o  732.335   7.9788  410.718   8.9437  406.041   10.731  421.357   16.184  728.044   9.6298  741.224   14.265 -13.18085 17.21114 
1 1 1   13   22    7 o  195.697   13.898   29.516   4.1359   26.341   4.9372   36.988   7.5731  184.376   17.713  218.035   23.041 -33.65945 29.06283 
1 1 1   13   22    8 o  143.276   21.594   16.138   4.5885   16.138   4.5885   0.0000   0.0000  143.276   21.594  ?   ?  0.000000 21.59357 
1 1 1   13   22    9 o  939.520   11.165  676.483   16.056  676.483   16.056   0.0000   0.0000  939.520   11.165  ?   ?  0.000000 11.16497 
1 1 1   13   22   10 o  1050.13   9.6577  844.877   15.523  836.451   18.844  862.666   27.382  1044.60   11.786  1059.95   16.877 -15.34790 20.58521 
1 1 1   13   22   11 f  854.702   8.9016  559.609   11.645  553.003   14.064  574.013   20.768  849.449   10.817  864.761   15.690 -15.31238 19.05782 
1 1 1   13   22   12 f  199.916   14.309   30.822   4.3496   35.323   5.1830   20.103   7.9981  213.906   15.945  157.968   34.079 55.93808 37.62499 
1 1 1   13   22   13 o  683.817   8.6163  358.217   9.0185  364.000   11.012  346.441   15.716  689.156   10.440  671.774   15.284 17.38141 18.50920 
1 1 1   13   22   14 o  470.851   9.1360  169.868   6.5843  173.009   7.9501  163.009   11.749  475.064   10.933  460.622   16.664 14.44260 19.93038 
1 1 1   13   22   15 o  608.183   8.7262  283.399   8.1232  285.248   9.7989  279.336   14.525  610.010   10.495  603.043   15.736 6.967407 18.91454 
1 1 1   13   22   16 o  134.722   22.803   14.382   4.5345   15.947   5.3362   10.315   8.6015  141.513   25.577  118.376   39.982 23.13639 47.46350 
1 1 1   13   22   17 o  716.529   10.866  393.694   11.917  384.746   16.108  404.510   17.710  707.735   14.870  725.485   15.949 -17.75067 21.80572 
1 1 1   13   22   18 o  195.130   33.464   30.503   9.6349   0.0000   0.0000   30.503   9.6349  ?   ?   195.130   33.464 0.000000 33.46398 
1 1 1   13   22   19 o  551.064   11.609  232.994   9.7918   0.0000   0.0000  232.994   9.7918  ?   ?   551.064   11.609 0.000000 11.60890 
1 1 1   13   22   20 o  364.915   9.2074  102.085   5.1428   97.221   6.9366  108.021   7.6635  355.840   12.736  375.024   13.351 -19.18365 18.45091 
1 1 1   13   22   21 o  161.461   16.461   20.272   4.0111   27.178   5.6168   13.084   5.7301  186.615   19.974  127.054   29.953 59.56095 36.00241 
1 1 1   13   22   22 o   67.215   25.928   2.3182   3.7760   1.2930   5.1371   3.5233   5.5692   71.092   29.274   81.744   31.501 -10.65147 43.00310 
1 1 1   13   22   23 o  203.624   14.226   32.043   4.4059   39.134   6.1015   24.316   6.3689  224.553   17.901  175.374   24.386 49.17972 30.25098 
1 1 1   13   22   24 o  173.414   16.706   23.392   4.3796   24.761   5.9142   21.731   6.5169  177.389   22.273  164.989   26.720 12.40024 34.78545 
1 1 1   13   22   25 o  277.901   12.347   59.355   5.2520   55.434   6.3779   67.613   9.2566  267.779   15.629  294.793   20.645 -27.01404 25.89340 
1 1 1   13   22   26 o  393.301   9.5262  118.701   5.7348  119.969   7.9828  117.349   8.2439  394.909   13.207  390.481   13.793 4.427765 19.09616 
1 1 1   13   22   27 o  316.538   10.871   76.969   5.2668   76.381   7.2375   77.631   7.6788  314.792   15.021  317.236   15.814 -2.444000 21.81081 
1 1 1   13   22   28 o  237.079   9.5166   43.148   3.4534   45.094   3.9967   37.411   6.8603  242.264   10.778  218.566   20.755 23.69733 23.38696 
1 1 1   13   22   29 o  269.799   8.7595   55.864   3.6173   56.914   4.1768   52.711   7.2354  272.207   10.025  260.249   18.280 11.95850 20.84797 
1 1 1   13   22   30 o  131.357   15.855   13.522   3.1233   14.183   3.2408   4.8893   11.705  134.536   16.055  108.869   44.433 25.66795 47.24468 
1 1 1   13   22   31 o  486.134   8.1547  181.367   6.0679  180.153   6.5333  188.985   16.369  484.392   8.8118  492.095   21.733 -7.702179 23.45110 
1 1 1   13   22   32 o  119.058   28.153   11.663   5.0498   8.1402   7.2030   15.068   7.0816  104.535   36.542  134.283   34.324 -29.74753 50.13440 
1 1 1   13   22   33 o  474.966   8.4578  173.247   6.1488  180.919   7.7830  160.505   10.030  484.921   10.486  455.684   14.380 29.23654 17.79689 
1 1 1   13   22   34 o  253.601   8.3645   49.400   3.2468   51.218   4.4813   47.392   4.7107  257.828   11.355  247.535   12.473 10.29356 16.86790 
1 1 1   13   22   35 o  271.143   8.1615   56.475   3.3872   52.577   4.6034   61.076   5.0018  261.139   11.517  281.437   11.611 -20.29727 16.35418 
1 1 1   13   22   36 o  185.786   10.286   26.661   2.9135   22.948   3.9635   31.026   4.2974  171.334   15.274  199.685   14.152 -28.35072 20.82198 
1 1 1   13   22   37 o  224.138   9.5047   38.662   3.2608   39.904   4.6402   37.451   4.5832  226.698   13.433  219.528   13.709 7.169357 19.19260 
1 1 1   13   22   38 o   81.432   22.059   5.4124   2.8175   5.9570   4.0680   4.9104   3.9061   86.404   27.403   80.158   26.944 6.245926 38.43015 
1 1 1   13   22   39 o  218.912   10.350   36.947   3.4681   39.034   4.9344   34.910   4.8755  223.778   14.484  211.384   15.170 12.39407 20.97364 
1 1 1   13   22   40 o  298.235   8.4123   68.423   3.8401   70.447   5.3722   66.309   5.4913  301.905   11.625  292.745   12.255 9.159912 16.89190 
1 1 1   13   22   41 o  238.533   12.229   44.160   4.4499   45.807   5.2667   40.051   8.3190  242.349   14.261  222.320   24.873 20.02914 28.67122 
1 1 1   13   22   42 o  151.474   14.696   18.029   3.3643   18.322   4.7321   17.730   4.7840  150.700   21.093  147.963   21.775 2.737122 30.31603 
1 1 1   13   22   43 o   91.563   22.805   6.9579   3.1841   1.3178   4.5442   12.398   4.4629   65.979   27.383  122.141   24.720 -56.16258 36.89061 
1 1 1   13   22   44 o  111.061   20.511   10.081   3.3583   9.0291   4.9468   10.979   4.5737  103.041   29.723  114.014   26.681 -10.97231 39.94162 
1 1 1   13   22   45 o  192.604   13.219   29.011   3.8735   26.953   5.5895   30.912   5.3729  182.982   20.299  197.089   18.009 -14.10754 27.13657 
1 1 1   13   22   46 o   82.668   29.821   5.1448   4.8299   2.0216   18.265   5.3796   5.0082  112.108   50.504   84.242   30.370 27.86650 58.93234 
1 1 1   13   22   47 o  299.926   14.433   70.523   6.6260   70.523   6.6260   0.0000   0.0000  299.926   14.433  ?   ?  0.000000 14.43344 
1 1 1   13   22   48 o  232.526   12.893   42.387   4.5709   39.072   6.1120   46.594   6.8854  220.596   18.266  240.659   18.843 -20.06380 26.24294 
1 1 1   13   22   49 o   64.849   27.513   1.0526   4.7449  -7.7960   10.050   3.5908   5.3826   71.900   34.084   76.857   30.562 -4.957443 45.77937 
1 1 1   13   22   50 o   96.710   26.711   8.1954   4.0846   3.9611   5.9682   11.926   5.6021   79.796   32.029  114.603   31.129 -34.80676 44.66445 
1 1 1   13   22   51 o   73.654   27.100   4.1512   4.0172   2.9129   5.2275   5.9373   6.2779   72.712   29.687   86.923   33.460 -14.21027 44.73139 
1 1 1   13   22   52 o  152.682   17.418   19.066   3.9977   28.464   5.8045   10.586   5.5140  184.440   20.931  106.038   31.601 78.40154 37.90421 
1 1 1   13   22   53 o  206.468   14.091   34.113   4.4266   24.491   6.3830   43.029   6.1442  166.463   25.893  229.231   17.647 -62.76814 31.33515 
1 1 1   13   22   54 o  103.948   28.161   10.086   4.5917   12.296   5.7555   6.2182   7.6154  112.220   31.964   87.573   35.802 24.64664 47.99480 
1 1 1   13   23    0 o  948.898   15.267  690.528   22.161  690.528   22.161  690.528   22.161  948.898   15.267  948.898   15.267 0.000000 0.000000 
1 1 1   13   23    1 o  799.871   10.088  490.202   12.350  487.426   17.186  493.167   17.761  797.171   14.085  801.802   14.472 -4.631226 20.19418 
1 1 1   13   23    2 o  392.998   10.027  118.335   6.0317  109.927   8.3668  127.433   8.7034  378.549   14.440  407.609   13.950 -29.06030 20.07783 
1 1 1   13   23    3 o  605.892   9.4717  281.238   8.7840  272.842   12.005  290.912   12.887  596.497   13.149  615.884   13.670 -19.38721 18.96749 
1 1 1   13   23    4 o  157.500   18.136   19.306   4.2923   18.513   5.9468   20.169   6.2017  152.790   26.382  159.653   26.294 -6.863327 37.24775 
1 1 1   13   23    5 o  472.531   9.4746  171.064   6.8527  171.064   6.8527   0.0000   0.0000  472.531   9.4746  ?   ?  0.000000 9.474595 
1 1 1   13   23    6 o  696.153   9.5782  371.303   10.206  371.303   10.206   0.0000   0.0000  696.153   9.5782  ?   ?  0.000000 9.578212 
1 1 1   13   23    7 o  309.120   8.2550   73.191   3.9058   72.967   4.4016   74.022   8.4715  308.610   9.3181  309.874   17.938 -1.263275 20.21365 
1 1 1   13   23    8 o  494.313   8.4962  187.172   6.4283  186.187   7.8525  189.173   11.193  492.898   10.408  496.492   14.729 -3.594604 18.03512 
1 1 1   13   23    9 o  503.397   8.5684  194.124   6.6020  187.629   7.8595  209.690   12.168  494.794   10.378  522.651   15.210 -27.85736 18.41341 
1 1 1   13   23   10 o  1104.88   9.9899  935.533   16.894  927.420   20.550  952.453   29.675  1099.71   12.208  1113.29   17.415 -13.57788 21.26777 
1 1 1   13   23   11 o  494.753   8.7627  187.538   6.6358  183.615   8.0217  196.043   11.811  489.419   10.708  505.288   15.271 -15.86923 18.65106 
1 1 1   13   23   12 o  659.134   10.294  333.020   10.386  316.700   13.994  353.029   15.495  642.321   14.234  678.060   14.930 -35.73859 20.62788 
1 1 1   13   23   13 o  1028.75   11.713  811.671   18.443  812.408   25.811  810.902   26.363  1028.17   16.401  1027.11   16.769 1.050171 23.45600 
1 1 1   13   23   14 o  328.779   13.057   82.957   6.5709   93.504   8.9407   70.568   9.6897  348.743   16.749  301.843   21.106 46.90033 26.94427 
1 1 1   13   23   15 o  431.539   11.476  142.843   7.5802  154.350   10.605  130.821   10.839  448.172   15.459  412.404   17.172 35.76791 23.10495 
1 1 1   13   23   16 o  321.640   11.348   79.358   5.5869   77.287   6.5759   84.733   10.593  317.258   13.542  330.767   21.032 -13.50858 25.01469 
1 1 1   13   23   17 o  242.485   17.920   45.519   6.6041   49.458   9.0967   41.129   9.6030  251.748   23.894  228.475   28.049 23.27252 36.84629 
1 1 1   13   23   18 o  430.476   9.7173  142.091   6.4027  140.614   7.6038  145.691   11.870  428.059   11.605  434.916   17.831 -6.857635 21.27485 
1 1 1   13   23   19 o   50.351   22.727  -1.9497   3.7195  -1.5668   5.0430  -2.4065   5.5080   61.420   27.175   62.308   27.929 -0.8880653 38.96792 
1 1 1   13   23   20 o  356.831   9.3346   97.640   5.0983   98.359   6.8770   96.761   7.5968  357.857   12.555  354.785   13.989 3.072388 18.79714 
1 1 1   13   23   21 o  294.444   10.642   66.533   4.7961   66.085   6.4111   67.101   7.2273  293.131   14.289  294.754   16.080 -1.623169 21.51161 
1 1 1   13   23   22 o  329.528   9.8750   83.313   4.9808   84.807   6.7444   81.520   7.3873  332.135   13.267  325.454   14.830 6.681122 19.89765 
1 1 1   13   23   23 o  488.503   8.4917  182.989   6.3494  176.236   8.7556  190.479   9.2213  478.946   11.943  497.899   12.100 -18.95279 17.00154 
1 1 1   13   23   24 f  292.497   11.856   65.741   5.3081   64.228   6.5461   68.648   9.0703  288.399   14.880  297.126   20.062 -8.727203 24.97753 
1 1 1   13   23   25 o  437.880   9.0130  147.106   6.0408  139.281   8.0815  157.015   9.0938  425.602   12.406  451.754   13.151 -26.15234 18.07923 
1 1 1   13   23   26 o  548.375   8.4403  230.677   7.0844  226.219   9.5759  236.067   10.530  542.504   11.532  553.997   12.418 -11.49225 16.94651 
1 1 1   13   23   27 o  338.277   10.449   87.909   5.4103   88.935   7.4794   86.784   7.8356  339.669   14.386  335.383   15.264 4.285400 20.97482 
1 1 1   13   23   28 o  235.559   16.419   43.093   5.8831   39.108   6.6960   56.582   12.319  223.598   19.768  265.646   30.872 -42.04752 36.65928 
1 1 1   13   23   29 o  300.087   9.3957   69.160   4.3156   72.863   4.6058   42.522   12.353  307.972   9.7708  227.256   36.770 80.71552 38.04592 
1 1 1   13   23   30 o  105.618   28.351   9.1333   4.6794   20.155   6.7135  -1.2811   6.5259  157.244   28.961   70.830   31.144 86.41440 42.52823 
1 1 1   13   23   31 o  182.701   18.110   26.171   4.9978   30.312   7.1972   22.314   6.9455  194.904   24.678  165.638   28.419 29.26601 37.63814 
1 1 1   13   23   32 o  150.751   14.904   17.748   3.3939   18.338   3.8752   15.805   7.0312  152.845   16.844  137.329   33.702 15.51593 37.67655 
1 1 1   13   23   33 o  167.222   13.174   21.727   3.3446   23.106   3.7770   16.718   7.1983  172.220   14.462  140.977   33.798 31.24316 36.76193 
1 1 1   13   23   34 o  349.660   8.4945   93.948   4.5462   93.003   5.3284   96.477   8.7163  347.623   10.014  352.477   16.156 -4.853363 19.00789 
1 1 1   13   23   35 o  218.568   9.1306   36.740   3.0546   37.035   4.1781   36.402   4.4772  218.621   12.538  216.508   13.579 2.112457 18.48223 
1 1 1   13   23   36 o  375.481   7.3099  108.255   4.2011  111.762   5.9447  104.756   5.9379  380.923   10.196  368.714   10.521 12.20895 14.65117 
1 1 1   13   23   37 o  278.879   8.6967   59.816   3.7123   56.387   5.2729   63.187   5.2274  270.000   12.759  286.005   11.941 -16.00522 17.47505 
1 1 1   13   23   38 o  217.889   10.246   36.596   3.4171   38.614   4.7164   34.367   4.9578  222.729   13.904  209.620   15.563 13.10913 20.86938 
1 1 1   13   23   39 o  160.688   12.671   20.111   3.0912   19.741   4.3602   20.485   4.3831  157.686   18.412  160.751   18.131 -3.064331 25.84012 
1 1 1   13   23   40 o  130.969   19.267   13.762   3.7470   12.773   4.2458   17.247   7.9678  124.895   23.059  140.446   36.669 -15.55109 43.31689 
1 1 1   13   23   41 o  202.985   11.174   31.947   3.4584   32.079   4.8169   31.808   4.9685  202.143   15.691  201.089   16.282 1.054031 22.61231 
1 1 1   13   23   42 o   78.704   23.847   5.0339   3.1209   11.822   4.4990  -1.2625   4.3330  118.988   25.471   56.052   24.973 62.93594 35.67125 
1 1 1   13   23   43 o  135.464   16.803   14.605   3.4092   9.0295   4.7195   20.689   4.9302  103.134   28.795  160.210   20.581 -57.07614 35.39379 
1 1 1   13   23   44 o  142.779   16.620   16.220   3.5643   10.478   4.9787   22.256   5.1049  110.511   29.051  166.045   20.523 -55.53429 35.56842 
1 1 1   13   23   45 o  248.476   16.537   48.809   6.2534   31.265   17.931   51.239   6.6723  169.521   57.725  254.256   17.247 -84.73485 60.24645 
1 1 1   13   23   46 o   61.718   27.104  -0.4489   4.9293   11.063   10.643  -3.5929   5.5618  114.481   43.686   57.655   26.679 56.82653 51.18811 
1 1 1   13   23   47 o  292.884   13.751   67.220   6.1646   49.488   11.060   75.211   7.4249  238.957   30.967  308.300   15.787 -69.34279 34.75904 
1 1 1   13   23   48 o  128.870   25.684   14.226   4.8884   6.1452   10.389   16.524   5.5401   98.965   41.265  138.340   27.133 -39.37572 49.38655 
1 1 1   13   23   49 o  155.415   22.025   20.105   5.0928   7.7917   10.573   23.824   5.8114  102.366   42.056  168.733   23.109 -66.36757 47.98643 
1 1 1   13   23   50 o  269.520   15.333   57.920   6.2992   34.312   10.702   70.433   7.7918  188.250   38.443  295.704   17.290 -107.4545 42.15216 
1 1 1   13   23   51 o  124.835   21.430   13.209   3.9474   7.9061   5.6023   18.436   5.5628   93.406   32.251  144.910   26.037 -51.50346 41.44935 
1 1 1   13   23   52 o  166.493   33.866   26.608   8.3366   0.0000   0.0000   26.608   8.3366  ?   ?   166.493   33.866 0.000000 33.86608 
1 1 1   13   23   53 o   34.760   17.547 -13.3232   4.4317 -13.7427   5.4051 -12.4629   7.7411   40.325   20.225   53.773   26.490 -13.44805 33.32811 
1 1 1   13   24    0 o  580.092   13.433  258.254   11.913  258.254   11.913  258.254   11.913  580.092   13.433  580.092   13.433 0.000000 0.000000 
1 1 1   13   24    1 o  245.380   17.559   46.503   6.5513   46.503   6.5513   0.0000   0.0000  245.380   17.559  ?   ?  0.000000 17.55884 
1 1 1   13   24    2 o   88.537   31.794   5.1472   5.4837   5.1472   5.4837   0.0000   0.0000   88.537   31.794  ?   ?  0.000000 31.79383 
1 1 1   13   24    3 o  275.272   16.062   58.389   6.7383   58.389   6.7383   0.0000   0.0000  275.272   16.062  ?   ?  0.000000 16.06228 
1 1 1   13   24    4 o  282.945   12.080   61.392   5.2316   65.363   7.0116   56.404   7.8577  291.326   15.783  270.135   19.128 21.19098 24.79868 
1 1 1   13   24    5 o  260.754   12.272   52.145   4.8980   55.415   6.5285   47.933   7.4082  268.141   15.979  248.839   19.609 19.30217 25.29524 
1 1 1   13   24    6 o  240.276   10.827   44.257   3.9818   43.546   4.6691   46.154   7.6249  237.910   12.870  243.986   20.610 -6.076294 24.29827 
1 1 1   13   24    7 o  795.082   8.3292  484.287   10.136  467.888   11.937  526.672   19.191  781.332   9.9816  828.182   15.139 -46.84924 18.13379 
1 1 1   13   24    8 o  706.042   10.195  382.100   11.018  391.052   15.590  373.169   15.572  713.732   14.271  697.174   14.593 16.55823 20.41111 
1 1 1   13   24    9 o  544.920   10.238  227.619   8.5394  217.596   11.469  240.090   12.793  532.405   14.073  559.138   14.948 -26.73254 20.53018 
1 1 1   13   24   10 o  377.037   9.8358  108.963   5.6763  102.445   6.9376  122.162   9.8726  365.420   12.404  398.697   16.178 -33.27664 20.38552 
1 1 1   13   24   11 o  225.178   12.750   39.034   4.3765   35.776   5.2377   46.569   7.9660  215.165   16.019  244.823   21.475 -29.65810 26.79113 
1 1 1   13   24   12 o  161.448   17.361   20.280   4.2228   21.250   5.1075   18.183   7.5072  164.759   20.711  149.829   33.568 14.92987 39.44254 
1 1 1   13   24   13 o  211.179   13.854   34.394   4.4532   31.552   5.3102   41.129   8.1748  201.766   17.364  229.496   23.609 -27.73076 29.30655 
1 1 1   13   24   14 o  187.819   15.388   27.297   4.3849   26.704   5.2271   28.705   8.0557  185.264   18.689  190.206   28.552 -4.941666 34.12429 
1 1 1   13   24   15 o  414.805   11.976  132.056   7.6034  140.986   11.057  124.045   10.472  428.005   16.878  401.446   17.043 26.55936 23.98616 
1 1 1   13   24   16 o  312.792   14.032   75.183   6.7181   70.719   9.1430   80.422   9.9044  302.107   19.884  322.190   20.186 -20.08401 28.33401 
1 1 1   13   24   17 o  610.919   9.0035  286.138   8.4191  283.313   10.027  292.889   15.500  607.663   10.781  616.817   16.418 -9.154297 19.64075 
1 1 1   13   24   18 o  515.817   9.3136  204.032   7.3533  204.146   8.7669  203.761   13.504  515.744   11.106  514.248   17.157 1.495850 20.43732 
1 1 1   13   24   19 o   52.256   23.949  -3.0096   4.3322  -1.5132   5.0020  -7.5010   8.6660   61.223   27.077   70.800   32.947 -9.576900 42.64587 
1 1 1   13   24   20 o  377.993   9.1150  109.581   5.2736  110.153   7.1726  108.907   7.7805  378.640   12.376  376.350   13.507 2.290039 18.31926 
1 1 1   13   24   21 o  353.124   9.6683   95.673   5.2257   91.817   7.0861  100.270   7.7374  345.534   13.398  361.010   14.002 -15.47580 19.37992 
1 1 1   13   24   22 o  198.533   14.713   30.514   4.4392   34.598   5.9073   25.216   6.7285  210.813   18.494  178.206   25.385 32.60695 31.40740 
1 1 1   13   24   23 o  295.779   12.109   67.250   5.4821   66.208   6.6414   69.476   9.7118  292.784   14.869  298.512   21.397 -5.728210 26.05605 
1 1 1   13   24   24 o  390.942   9.3354  117.293   5.5862  111.720   7.5456  124.051   8.3098  381.056   12.937  401.435   13.524 -20.37964 18.71532 
1 1 1   13   24   25 o  342.906   10.023   90.296   5.2608   89.805   7.1008   90.894   7.8329  341.487   13.585  343.332   14.905 -1.845367 20.16724 
1 1 1   13   24   26 o  667.383   9.7227  342.034   9.9318  330.061   11.555  375.899   19.434  655.148   11.523  696.671   18.224 -41.52338 21.56161 
1 1 1   13   24   27 o  482.265   10.489  178.747   7.7429  175.371   8.9710  188.608   15.331  477.317   12.279  492.543   20.336 -15.22552 23.75556 
1 1 1   13   24   28 o  257.056   12.785   50.909   5.0302   49.622   7.1238   52.189   7.1037  252.199   18.585  258.813   18.045 -6.613815 25.90430 
1 1 1   13   24   29 o  488.559   9.2693  183.360   6.9316  175.895   9.6313  191.382   9.9838  477.597   13.175  498.201   13.092 -20.60461 18.57400 
1 1 1   13   24   30 o  153.529   13.216   18.318   3.0755   19.016   3.4706   15.764   6.6373  156.175   14.691  137.672   32.090 18.50237 35.29329 
1 1 1   13   24   31 o  168.790   12.975   22.114   3.3265   20.560   3.7492   27.866   7.2120  162.264   15.275  186.069   26.036 -23.80415 30.18601 
1 1 1   13   24   32 o  204.983   10.788   32.445   3.3728   32.238   3.7992   33.216   7.3279  204.070   12.219  203.967   23.926 0.1020355 26.86605 
1 1 1   13   24   33 o  239.139   9.9881   44.013   3.6560   41.457   4.1676   52.549   7.6157  231.540   11.799  258.630   19.379 -27.08920 22.68813 
1 1 1   13   24   34 o  240.294   10.611   44.484   3.9026   43.088   4.4694   48.964   8.0068  235.888   12.423  248.822   21.226 -12.93484 24.59417 
1 1 1   13   24   35 o  274.954   10.320   58.240   4.3430   63.524   5.1425   45.097   8.1105  286.884   11.711  238.065   22.525 48.81941 25.38784 
1 1 1   13   24   36 o  322.402   8.2086   79.900   4.0507   81.935   5.7523   77.898   5.7053  325.785   11.536  317.609   11.736 8.175995 16.45591 
1 1 1   13   24   37 o  276.262   11.758   58.965   4.9719   58.965   4.9719   0.0000   0.0000  276.262   11.758  ?   ?  0.000000 11.75798 
1 1 1   13   24   38 o  178.705   11.107   24.752   3.0230   24.898   4.1745   24.591   4.3834  178.194   15.458  176.829   16.381 1.364578 22.52365 
1 1 1   13   24   39 f   96.419   24.230   7.7136   3.5717   8.5052   4.0286   4.8056   7.7213  100.966   25.932   92.194   36.622 8.771439 44.87389 
1 1 1   13   24   40 o  142.342   14.502   15.924   3.1155   18.092   4.3758   13.696   4.4369  150.328   19.475  129.227   23.288 21.10066 30.35781 
1 1 1   13   24   41 o  169.470   12.902   22.415   3.3217   19.196   4.7303   25.547   4.6654  154.423   20.521  179.699   17.171 -25.27669 26.75744 
1 1 1   13   24   42 o   84.425   23.340   5.9037   3.1169   8.5300   4.3485   3.1286   4.4700  100.497   27.480   72.794   28.174 27.70322 39.35627 
1 1 1   13   24   43 o  158.322   14.757   19.746   3.5350   21.163   4.8948   18.201   5.1107  162.029   20.173  148.904   23.177 13.12465 30.72712 
1 1 1   13   24   44 o  125.955   20.670   12.966   3.8468   11.321   5.1507   15.042   5.7846  114.484   29.278  132.169   29.357 -17.68513 41.46139 
1 1 1   13   24   45 o  162.087   19.429   21.225   4.7243   29.068   10.150   19.056   5.3377  178.183   38.353  151.519   23.800 26.66415 45.13714 
1 1 1   13   24   46 o  176.191   18.247   24.972   4.8495   40.456   10.592   20.865   5.4549  213.977   33.433  158.575   23.157 55.40204 40.66928 
1 1 1   13   24   47 o  217.053   13.427   37.057   4.4389   32.833   6.3971   40.979   6.1646  200.271   21.191  225.936   17.974 -25.66434 27.78702 
1 1 1   13   24   48 o  109.908   23.849   10.324   3.8968   9.5206   5.7247   11.018   5.3193  102.911   32.493  110.766   30.436 -7.854225 44.52164 
1 1 1   13   24   49 o   74.976   29.940   3.4984   5.1858 -11.5701   9.8534   9.2711   6.0987   65.452   31.724  100.811   33.668 -35.35860 46.26014 
1 1 1   13   24   50 o   93.004   27.121   7.7316   4.0987  -3.1230   6.0562   16.905   5.5675   59.922   27.767  137.903   27.343 -77.98089 38.96972 
1 1 1   13   24   51 o  160.405   17.596   21.103   4.2491   20.774   6.3750   21.366   5.6999  151.434   28.551  156.723   24.568 -5.289688 37.66624 
1 1 1   13   24   52 o  222.721   14.963   39.939   5.0714   46.711   6.5098   29.482   8.0888  238.387   17.973  177.795   30.842 60.59190 35.69632 
1 1 1   13   25    0 o   47.742   31.418  -1.0673   5.8361  -1.0673   5.8361  -1.0673   5.8361   47.742   31.418   47.742   31.418 0.000000 0.000000 
1 1 1   13   25    1 o  545.287   13.741  228.231   11.469   0.0000   0.0000  228.231   11.469  ?   ?   545.287   13.741 0.000000 13.74143 
1 1 1   13   25    2 o  395.237   15.374  119.998   9.3004   0.0000   0.0000  119.998   9.3004  ?   ?   395.237   15.374 0.000000 15.37361 
1 1 1   13   25    3 o  617.136   14.251  292.418   13.462   0.0000   0.0000  292.418   13.462  ?   ?   617.136   14.251 0.000000 14.25118 
1 1 1   13   25    4 f  221.237   22.502   38.145   7.5139   0.0000   0.0000   38.145   7.5139  ?   ?   221.237   22.502 0.000000 22.50206 
1 1 1   13   25    5 o  662.466   14.531  337.029   14.734   0.0000   0.0000  337.029   14.734  ?   ?   662.466   14.531 0.000000 14.53120 
1 1 1   13   25    6 o  244.450   12.162   45.845   4.5505   46.077   5.6596   45.420   7.6534  244.433   15.202  241.856   20.879 2.576553 25.82698 
1 1 1   13   25    7 o  314.066   10.354   75.627   4.9772   68.955   6.0840   89.128   8.6545  299.717   13.262  340.460   16.608 -40.74231 21.25299 
1 1 1   13   25    8 o  722.739   8.6382  400.286   9.5560  399.594   11.819  401.592   16.240  721.863   10.696  723.028   14.675 -1.164429 18.15930 
1 1 1   13   25    9 o  548.039   8.5130  230.160   7.1411  228.524   8.8011  233.313   12.217  545.898   10.533  551.099   14.484 -5.200806 17.90865 
1 1 1   13   25   10 o  655.888   8.6085  329.684   8.6423  320.497   10.406  350.111   15.516  646.466   10.516  674.952   15.019 -28.48608 18.33491 
1 1 1   13   25   11 o  519.345   8.6667  206.719   6.8893  208.974   8.4832  202.349   11.807  521.982   10.618  513.083   15.034 8.898987 18.40566 
1 1 1   13   25   12 o  148.751   18.802   17.319   4.1854   18.561   5.1588   14.927   7.1593  153.347   22.661  135.490   34.446 17.85727 41.23174 
1 1 1   13   25   13 o  719.248   10.970  396.900   12.077  413.263   17.804  382.957   16.435  732.926   15.871  705.689   15.216 27.23645 21.98644 
1 1 1   13   25   14 o  364.575   12.773  102.081   7.1277  105.033   9.8400   98.822   10.339  369.252   17.410  357.459   18.964 11.79251 25.74369 
1 1 1   13   25   15 o  181.938   16.130   25.679   4.4454   26.490   5.2360   23.585   8.4134  184.372   18.818  170.642   33.408 13.73056 38.34295 
1 1 1   13   25   16 o  173.384   17.209   23.391   4.5068   27.213   5.3758   14.353   8.2671  186.820   19.067  133.054   38.437 53.76610 42.90611 
1 1 1   13   25   17 o  591.555   9.0732  268.359   8.2153  266.126   9.8121  273.595   15.024  588.825   10.887  595.904   16.472 -7.079224 19.74474 
1 1 1   13   25   18 f  629.184   9.0911  303.617   8.7552  301.364   10.460  308.888   16.000  626.550   10.907  633.065   16.512 -6.515137 19.78904 
1 1 1   13   25   19 o  353.096   10.920   95.726   5.9019   99.007   6.8783   86.568   11.491  358.914   12.521  333.267   22.662 25.64661 25.89077 
1 1 1   13   25   20 o  543.927   9.4281  226.997   7.8493  228.432   9.4087  223.713   14.236  545.347   11.272  538.375   17.276 6.971802 20.62779 
1 1 1   13   25   21 o  688.432   9.2151  363.638   9.7103  366.566   11.815  357.546   17.044  690.785   11.175  680.780   16.356 10.00421 19.80911 
1 1 1   13   25   22 o  452.999   9.6969  157.516   6.7235  155.719   8.1290  161.409   11.963  450.085   11.800  457.132   17.097 -7.046692 20.77338 
1 1 1   13   25   23 o  121.770   27.009   12.061   4.9023   15.609   5.5698  -0.1401   10.328  138.851   27.180   92.597   39.961 46.25401 48.32849 
1 1 1   13   25   24 o  245.274   14.677   46.554   5.4847   44.546   6.2327   53.448   11.547  239.426   17.120  258.726   29.696 -19.30043 34.27724 
1 1 1   13   25   25 f  165.233   17.944   21.386   4.4654   16.358   5.9721   27.760   6.7247  141.699   28.522  187.003   24.051 -45.30495 37.30931 
1 1 1   13   25   26 o  351.876   10.335   95.162   5.5664   96.152   7.6391   94.042   8.1278  353.049   14.136  348.936   15.218 4.112762 20.77075 
1 1 1   13   25   27 o   75.464   28.050   3.5616   4.3241   2.4581   6.0552   4.7100   6.1770   79.384   32.121   88.100   33.362 -8.715218 46.31198 
1 1 1   13   25   28 o  107.145   27.386   9.4225   4.5083   10.364   6.3919   8.4900   6.3595  112.694   34.123  104.179   34.363 8.514847 48.42702 
1 1 1   13   25   29 o  196.958   16.480   30.278   4.9226   25.302   6.8196   35.691   7.1129  177.313   25.891  212.373   22.210 -35.05984 34.11164 
1 1 1   13   25   30 o  597.416   10.874  274.806   9.9438  278.960   17.897  272.951   11.960  597.892   19.556  594.570   13.142 3.322388 23.56142 
1 1 1   13   25   31 o   46.831   19.833   0.1558   2.4585   1.3864   2.6474  -7.5552   6.6269   54.670   21.530   58.091   27.578 -3.420914 34.98687 
1 1 1   13   25   32 o  222.889   10.472   38.258   3.5727   42.065   4.0338   24.402   7.6950  233.601   11.282  171.946   30.347 61.65572 32.37651 
1 1 1   13   25   33 o  432.203   8.5954  143.587   5.6862  146.524   6.9398  137.586   9.9188  436.161   10.395  421.053   15.390 15.10791 18.57221 
1 1 1   13   25   34 o  151.573   14.600   17.975   3.3453   20.277   3.7751   9.5554   7.2188  160.851   15.526  109.052   36.629 51.79907 39.78362 
1 1 1   13   25   35 o  287.199   9.7960   63.523   4.3063   63.018   4.9376   65.126   8.8016  285.764   11.289  287.268   20.145 -1.504547 23.09193 
1 1 1   13   25   36 o  106.278   21.385   9.2108   3.3582   10.434   3.6100   1.3459   9.1531  113.219   21.620   88.614   37.920 24.60443 43.65017 
1 1 1   13   25   37 o  195.864   12.656   29.820   3.7739   29.694   4.2437   30.296   8.2524  195.029   14.316  191.416   29.081 3.613113 32.41404 
1 1 1   13   25   38 o   93.289   24.023   7.2113   3.4509   9.3908   3.8081  -2.7995   8.1614  106.501   23.943   74.628   33.677 31.87267 41.32051 
1 1 1   13   25   39 o  184.112   11.523   26.319   3.2308   20.526   4.3515   33.436   4.8229  160.758   17.993  206.521   15.367 -45.76244 23.66247 
1 1 1   13   25   40 o  320.078   8.6884   78.910   4.2566   79.590   6.1463   78.284   5.9008  320.350   12.535  317.843   12.129 2.507416 17.44239 
1 1 1   13   25   41 o  221.474   10.561   37.916   3.5801   34.089   5.0143   41.895   5.1132  208.146   15.858  231.360   14.512 -23.21477 21.49623 
1 1 1   13   25   42 o  345.264   9.1792   91.973   4.8509   93.789   6.4428   89.597   7.3711  347.618   12.109  338.871   14.211 8.747192 18.67027 
1 1 1   13   25   43 o   49.134   22.198  -1.5649   3.5583  -0.3780   4.9907  -2.7922   5.0748   62.563   27.379   56.636   25.944 5.927155 37.71810 
1 1 1   13   25   44 o   73.400   28.068   3.4812   4.3992   0.3326   9.8244   4.2709   4.9201   86.071   38.013   78.831   29.793 7.239738 48.29718 
1 1 1   13   25   45 o  130.668   24.412   14.388   4.7030   14.311   10.446   14.407   5.2671  123.300   43.923  129.302   27.461 -6.001923 51.80091 
1 1 1   13   25   46 o  111.003   23.227   10.418   3.8196   11.865   5.6124   9.1687   5.2132  115.232   31.099  101.926   30.806 13.30572 43.77412 
1 1 1   13   25   47 o  136.869   18.693   15.284   3.8137   15.764   5.5555   14.856   5.2447  134.299   27.936  130.737   27.099 3.561157 38.91986 
1 1 1   13   25   48 o  169.800   17.029   23.283   4.3662   23.201   6.0987   23.369   6.2537  164.810   24.957  164.990   25.592 -0.1794891 35.74674 
1 1 1   13   25   49 o  104.154   25.578   9.5892   4.0480   8.8351   6.2667   10.129   5.3028   98.054   34.095  104.633   30.945 -6.578545 46.04457 
1 1 1   13   25   50 o  204.420   18.500   34.337   5.7257   8.2096   9.6780   48.406   7.1019   98.009   40.248  242.212   19.317 -144.2036 44.64337 
1 1 1   13   25   51 o  159.684   19.905   21.378   4.7594   26.595   5.9256   11.895   7.9893  176.311   22.468  107.566   38.403 68.74529 44.49236 
1 1 1   13   26    0 o  642.075   13.902  316.512   13.648  316.512   13.648  316.512   13.648  642.075   13.902  642.075   13.902 0.000000 0.000000 
1 1 1   13   26    1 o  137.616   21.944   14.976   4.4670   17.082   6.3074   12.856   6.3272  145.746   29.290  126.039   32.565 19.70684 43.79933 
1 1 1   13   26    2 o  310.672   11.666   74.052   5.5474   68.347   7.5243   80.846   8.2110  297.628   16.582  323.771   16.625 -26.14316 23.48107 
1 1 1   13   26    3 o  173.770   17.640   23.479   4.6267   20.564   6.2579   26.992   6.8713  160.875   26.324  185.137   24.878 -24.26242 36.21978 
1 1 1   13   26    4 o  357.979   10.881   98.293   5.9623   90.370   7.9436  108.516   9.0230  342.891   15.135  375.682   15.691 -32.79071 21.80127 
1 1 1   13   26    5 o  202.499   15.533   31.710   4.7778   31.359   6.4668   32.131   7.0897  200.439   21.410  202.562   23.290 -2.122589 31.63569 
1 1 1   13   26    6 o  482.106   8.6674  178.139   6.3959  173.376   7.7952  187.949   11.188  475.434   10.712  494.515   14.781 -19.08023 18.25442 
1 1 1   13   26    7 o  235.671   10.482   42.599   3.7811   40.790   4.2839   48.978   8.0440  230.203   12.201  250.999   21.134 -20.79614 24.40370 
1 1 1   13   26    8 o  273.956   11.505   57.593   4.8243   56.797   5.9176   59.171   8.3302  271.486   14.291  276.259   19.832 -4.772491 24.44477 
1 1 1   13   26    9 o  340.912   10.066   89.134   5.2525   88.265   6.4894   90.784   8.9438  339.052   12.505  343.380   17.017 -4.328308 21.11723 
1 1 1   13   26   10 o   80.905   27.037   4.8081   3.9329   6.6319   4.7311   0.7291   7.0754   92.975   29.559   80.123   33.772 12.85207 44.88091 
1 1 1   13   26   11 o  267.048   14.942   55.017   6.0830   52.206   8.7673   57.627   8.4469  258.817   22.350  272.406   20.407 -13.58844 30.26512 
1 1 1   13   26   12 o  786.237   11.242  474.467   13.529  474.909   19.562  474.062   18.732  785.358   16.273  784.852   15.593 0.5063477 22.53796 
1 1 1   13   26   13 o  343.544   10.307   90.552   5.4201   90.424   6.5542   90.831   9.6399  343.097   12.480  342.636   18.449 0.4613647 22.27394 
1 1 1   13   26   14 o  362.940   10.336  101.078   5.7420  104.625   7.0006   93.786   10.037  369.041   12.393  348.028   18.914 21.01242 22.61237 
1 1 1   13   26   15 o  230.150   13.737   40.877   4.8170   43.471   5.7641   34.870   8.7709  237.029   15.981  209.610   28.041 27.41933 32.27478 
1 1 1   13   26   16 o  207.870   14.665   33.421   4.6361   33.754   5.4624   32.564   8.7666  208.485   17.273  202.059   29.192 6.426132 33.91930 
1 1 1   13   26   17 o  165.700   17.801   21.435   4.4439   20.626   5.1226   23.896   8.9338  161.835   21.189  170.855   35.328 -9.019760 41.19549 
1 1 1   13   26   18 o  528.821   9.3960  214.570   7.6054  218.551   9.2236  206.114   13.443  533.401   11.297  516.799   16.994 16.60193 20.40651 
1 1 1   13   26   19 o  194.391   16.487   29.362   4.8592   29.129   5.5372   30.145   10.135  193.139   18.975  191.983   35.806 1.156128 40.52341 
1 1 1   13   26   20 o  236.695   16.354   43.443   5.8885   43.443   5.8885   0.0000   0.0000  236.695   16.354  ?   ?  0.000000 16.35375 
1 1 1   13   26   21 o  413.065   10.460  131.059   6.6135  123.662   7.6544  152.844   13.136  400.930   12.473  444.122   19.323 -43.19260 22.99932 
1 1 1   13   26   22 o  549.933   9.6755  232.216   8.1443  234.906   9.6583  225.596   15.152  552.752   11.416  539.736   18.340 13.01630 21.60283 
1 1 1   13   26   23 o  480.942   8.7737  177.527   6.4587  167.315   8.5935  190.785   9.7911  466.317   12.040  497.764   12.851 -31.44757 17.60989 
1 1 1   13   26   24 o  528.935   8.7469  214.758   7.0815  220.160   9.8090  208.877   10.234  534.844   11.982  520.742   12.840 14.10187 17.56203 
1 1 1   13   26   25 o  422.467   9.6083  137.118   6.2131  138.051   8.4714  136.032   9.1401  423.211   13.078  419.833   14.224 3.378479 19.32176 
1 1 1   13   26   26 o  356.009   10.461   97.466   5.7003   99.996   7.8683   94.671   8.2695  359.854   14.285  349.878   15.442 9.975311 21.03600 
1 1 1   13   26   27 o   93.386   28.518   6.9830   4.4506   6.0064   6.1706   8.0418   6.4254   93.011   33.683  102.257   34.556 -9.246269 48.25630 
1 1 1   13   26   28 o  241.080   14.140   45.073   5.1949   45.346   7.3578   44.801   7.3357  240.187   20.201  238.710   20.269 1.476852 28.61658 
1 1 1   13   26   29 o  273.451   16.116   58.204   6.7157   53.703   12.240   60.142   8.0329  256.478   31.865  277.070   19.057 -20.59280 37.12857 
1 1 1   13   26   30 o  436.864   10.093  146.882   6.7493  140.853   9.3700  153.383   9.7300  426.589   14.350  445.183   14.279 -18.59393 20.24421 
1 1 1   13   26   31 o  293.938   14.558   66.928   6.5500   62.992   10.830   69.197   8.2247  280.684   25.486  297.370   18.157 -16.68521 31.29237 
1 1 1   13   26   32 o  276.324   10.222   58.803   4.3234   61.664   5.1091   51.588   8.1139  282.671   11.808  255.497   20.932 27.17403 24.03278 
1 1 1   13   26   33 o  166.527   13.154   21.584   3.3256   20.451   3.6925   26.452   7.6528  161.635   15.100  179.353   28.855 -17.71767 32.56735 
1 1 1   13   26   34 o  211.789   11.204   34.707   3.6191   35.622   4.0868   31.378   7.7917  214.285   12.514  196.420   26.601 17.86470 29.39756 
1 1 1   13   26   35 o   85.825   22.739   6.0465   3.0350   6.8301   3.2457   0.5923   8.5628   91.065   23.216   84.342   36.393 6.722221 43.16691 
1 1 1   13   26   36 o  156.708   14.741   19.252   3.4943   21.246   3.9045   11.229   7.8317  164.435   15.704  115.798   38.130 48.63676 41.23741 
1 1 1   13   26   37 o  206.441   12.656   33.137   3.9798   34.658   4.5311   28.003   8.3247  210.740   14.129  182.727   30.864 28.01265 33.94413 
1 1 1   13   26   38 o  159.202   12.883   19.780   3.1123   17.184   4.2548   22.767   4.5644  146.462   19.461  169.440   17.869 -22.97800 26.42050 
1 1 1   13   26   39 o  211.206   10.706   34.558   3.4496   32.192   4.8070   37.070   4.9534  202.434   15.635  217.537   14.968 -15.10350 21.64435 
1 1 1   13   26   40 o  226.906   10.179   39.771   3.5354   37.335   4.8209   42.606   5.2001  218.354   14.507  233.272   14.638 -14.91832 20.60897 
1 1 1   13   26   41 o   65.095   24.009   2.8378   3.1559   0.3267   4.1658   6.2201   4.8347   59.878   25.601   88.241   29.974 -28.36265 39.41947 
1 1 1   13   26   42 o  240.399   14.972   45.422   5.4818   24.470   16.384   48.063   5.8171  153.948   54.991  247.101   15.458 -93.15361 57.12188 
1 1 1   13   26   43 f  206.267   14.944   33.541   4.6861   41.800   10.132   31.294   5.2853  220.745   30.829  198.077   17.617 22.66750 35.50782 
1 1 1   13   26   44 o  106.257   21.717   9.4270   3.4127   7.2396   4.6720   11.930   4.9971   92.223   29.379  117.139   28.208 -24.91595 40.72842 
1 1 1   13   26   45 o  118.473   20.671   11.617   3.6121   9.1514   4.9901   14.331   5.2354  101.982   29.979  128.648   27.425 -26.66563 40.63099 
1 1 1   13   26   46 o  144.168   17.456   16.801   3.7734   23.671   5.5431   10.869   5.1513  169.067   21.937  110.385   29.795 58.68181 37.00013 
1 1 1   13   26   47 o  197.353   14.829   31.001   4.4467   36.070   6.3365   26.082   6.2418  209.791   19.974  175.715   23.822 34.07552 31.08744 
1 1 1   13   26   49 o  177.089   18.289   25.762   4.8861   44.085   6.2919  -2.0740   7.7551  232.434   17.821   69.513   31.926 162.9212 36.56334 
1 1 1   13   26   50 o   43.921   21.276  -6.1084   4.4165  -7.2625   5.4910  -3.9938   7.4327   48.867   23.685   64.164   30.072 -15.29740 38.27921 
1 1 1   13   27    0 o  636.117   13.965  310.771   13.582  310.771   13.582  310.771   13.582  636.117   13.965  636.117   13.965 0.000000 0.000000 
1 1 1   13   27    1 o  304.258   11.810   71.058   5.4998   70.276   7.6089   71.914   7.9587  301.703   16.540  305.115   17.110 -3.412323 23.79784 
1 1 1   13   27    2 o  633.509   9.9834  307.804   9.6805  294.300   13.303  323.006   14.114  618.810   14.045  648.252   14.225 -29.44135 19.98976 
1 1 1   13   27    3 o  400.813   10.588  123.247   6.4958  123.292   9.0007  123.198   9.3841  400.439   14.685  400.204   15.319 0.2349243 21.22096 
1 1 1   13   27    4 o  676.899   10.117  351.446   10.482  340.323   14.335  364.228   15.367  665.407   14.074  688.270   14.587 -22.86346 20.27012 
1 1 1   13   27    5 o  283.866   12.277   61.875   5.3341   58.305   7.2316   66.135   7.8999  274.572   17.295  292.422   17.734 -17.84927 24.77122 
1 1 1   13   27    6 o  463.662   10.081  164.906   7.1545  160.279   9.7701  170.256   10.506  456.631   13.979  470.535   14.587 -13.90479 20.20377 
1 1 1   13   27    7 o  283.601   12.844   61.787   5.5755   60.159   7.6777   63.604   8.1098  278.750   18.093  286.561   18.590 -7.811554 25.94087 
1 1 1   13   27    8 o  367.328   12.699  103.654   7.1402   98.822   10.669  107.575   9.6096  357.215   19.587  373.683   16.801 -16.46738 25.80569 
1 1 1   13   27    9 o  374.113   12.376  107.508   7.0866   91.076   10.155  123.104   9.8937  342.884   19.430  399.813   16.167 -56.92868 25.27638 
1 1 1   13   27   10 o   99.781   30.734   7.8082   5.1564   6.9655   7.7919   8.4648   6.8778  103.173   37.775  106.430   35.753 -3.256790 52.01229 
1 1 1   13   27   11 o  430.799   9.5534  142.361   6.2995  139.398   7.7479  148.138   10.820  426.025   11.882  438.522   16.120 -12.49716 20.02613 
1 1 1   13   27   12 o  358.926   10.246   98.863   5.6288  100.292   6.8547   95.904   9.8632  361.282   12.396  351.987   18.371 9.295105 22.16171 
1 1 1   13   27   13 o  251.627   12.520   48.661   4.8219   52.918   5.8663   39.792   8.4667  261.791   14.699  224.825   25.028 36.96622 29.02578 
1 1 1   13   27   14 o  407.275   10.036  127.300   6.2563  126.625   7.5720  128.751   11.106  405.926   12.187  408.377   17.768 -2.450348 21.54547 
1 1 1   13   27   15 o  290.877   12.051   65.023   5.3656   64.024   6.3925   67.406   9.8708  287.999   14.548  293.921   22.103 -5.921844 26.46092 
1 1 1   13   27   16 o  375.889   10.631  108.499   6.1168  114.085   7.4111   96.563   10.833  385.185   12.570  352.516   20.161 32.66916 23.75903 
1 1 1   13   27   17 o  162.270   18.877   20.641   4.6010   18.459   5.4655   25.948   8.5241  152.127   24.289  178.733   32.349 -26.60591 40.45280 
1 1 1   13   27   18 o  124.719   29.007   12.699   5.4329   12.699   5.4329   0.0000   0.0000  124.719   29.007  ?   ?  0.000000 29.00731 
1 1 1   13   27   19 o  458.358   11.920  161.563   8.3627  161.563   8.3627   0.0000   0.0000  458.358   11.920  ?   ?  0.000000 11.91992 
1 1 1   13   27   20 o  233.389   14.734   42.172   5.2366   42.518   6.0429   41.129   10.493  233.906   16.995  226.061   31.153 7.845596 35.48675 
1 1 1   13   27   21 o   57.067   25.545  -1.8617   4.5910  -2.9297   5.2442   1.6423   9.4990   58.836   26.728   92.922   39.147 -34.08612 47.40176 
1 1 1   13   27   22 o  420.042   9.3096  135.488   5.9854  134.122   8.1808  137.062   8.7802  417.287   12.808  421.661   13.604 -4.374481 18.68490 
1 1 1   13   27   23 o  393.086   9.7040  118.716   5.8386  115.536   7.8433  122.668   8.7439  387.137   13.236  398.660   14.330 -11.52328 19.50728 
1 1 1   13   27   24 f  159.084   18.838   19.929   4.4978   15.041   5.9809   26.292   6.8239  135.152   29.721  181.242   25.287 -46.08997 39.02248 
1 1 1   13   27   25 o  129.707   23.224   13.566   4.4414   10.104   5.9028   18.084   6.7430  111.009   32.598  148.028   30.765 -37.01854 44.82255 
1 1 1   13   27   26 o   74.139   28.158   3.2302   4.4086   5.1387   6.0027   0.9952   6.4959   88.827   33.042   76.694   32.345 12.13354 46.23871 
1 1 1   13   27   27 o  161.578   23.900   20.968   5.7325   8.4714   10.237   26.677   6.9189  112.756   42.889  182.079   25.528 -69.32350 49.91109 
1 1 1   13   27   28 o  234.221   17.763   42.930   6.3206   46.851   11.848   41.371   7.4727  238.486   33.372  228.702   21.603 9.783905 39.75427 
1 1 1   13   27   29 o   64.934   28.246  -0.5055   5.2429  -2.3454   8.3712   0.6820   6.7253   77.556   34.621   76.669   32.648 0.8870544 47.58709 
1 1 1   13   27   30 o  511.445   11.178  201.645   8.7508  231.243   15.016  186.426   10.768  544.560   18.016  490.621   14.339 53.93842 23.02559 
1 1 1   13   27   31 o  258.639   14.493   52.010   5.7142   49.914   7.9871   54.209   8.1787  251.215   20.963  262.025   20.557 -10.80980 29.36089 
1 1 1   13   27   32 o  387.535   11.400  115.890   6.7623  114.184   9.4300  117.697   9.7024  383.115   16.081  388.877   16.300 -5.762329 22.89760 
1 1 1   13   27   33 o   92.445   31.772   6.5712   5.4339   6.9282   7.5861   6.1950   7.7872   99.515   37.120   97.556   37.335 1.959160 52.64795 
1 1 1   13   27   34 o  208.006   11.895   33.546   3.7714   35.548   4.1120   22.945   9.4639  213.970   12.611  161.995   38.698 51.97469 40.70132 
1 1 1   13   27   35 o   61.646   23.261   2.2966   2.9962   0.8153   3.2703   10.039   7.4764   56.108   23.253  110.586   37.276 -54.47844 43.93425 
1 1 1   13   27   36 o  330.131   9.4418   83.985   4.7710   87.638   5.5476   73.608   9.3498  336.890   10.758  304.768   20.157 32.12225 22.84822 
1 1 1   13   27   37 o   93.730   24.002   7.2978   3.4585   4.8199   3.8644   17.267   7.7513   79.121   26.799  140.442   35.916 -61.32126 44.81261 
1 1 1   13   27   38 o  135.122   18.517   14.622   3.7290   14.994   4.1761   13.157   8.2839  136.140   20.692  122.669   39.125 13.47077 44.25989 
1 1 1   13   27   39 o  326.212   9.1110   82.054   4.5492   83.875   5.8925   79.368   7.1575  329.013   11.701  318.936   14.662 10.07663 18.75851 
1 1 1   13   27   40 o  125.148   17.777   12.574   3.3096   9.9313   4.2726   16.538   5.2332  108.384   26.072  140.973   25.176 -32.58866 36.24384 
1 1 1   13   27   41 o   55.955   24.873  -1.0431   4.2731   13.496   14.481  -2.4298   4.4722  126.508   50.185   53.464   24.440 73.04381 55.82009 
1 1 1   13   27   42 o   91.446   28.018   7.0773   4.2918  -9.5806   9.3147   11.567   4.8357   67.396   32.191  115.925   27.642 -48.52953 42.43051 
1 1 1   13   27   43 o   97.809   21.957   8.0262   3.2065   6.0851   4.3896   10.247   4.6953   85.827   28.560  108.581   28.052 -22.75431 40.03247 
1 1 1   13   27   44 o   62.162   24.231   2.2396   3.3246   6.9653   4.6212  -2.8305   4.7866   90.444   29.262   54.145   24.947 36.29852 38.45291 
1 1 1   13   27   45 o  108.402   21.975   9.8959   3.5213   8.0111   5.0002   11.751   4.9599   95.626   30.386  115.452   28.289 -19.82556 41.51610 
1 1 1   13   27   46 o   66.098   25.887   2.6814   3.8082   11.469   5.8726  -3.6953   5.0026  111.484   32.451   53.103   24.819 58.38042 40.85354 
1 1 1   13   27   47 o   88.233   27.370   6.8706   4.0813  -0.2605   5.7607   14.057   5.7829   65.200   28.936  123.528   30.715 -58.32841 42.19855 
1 1 1   13   27   48 o   89.079   25.156   7.0300   3.5806   11.734   5.3465   3.2047   4.8216  112.181   30.386   71.613   28.773 40.56798 41.84702 
1 1 1   13   27   49 o   65.026   26.495   2.3179   4.1531   7.0915   5.0197  -8.0406   7.3944   88.509   30.530   57.822   27.892 30.68796 41.35290 
1 1 1   13   28    0 o  700.732   14.390  377.216   15.419  377.216   15.419  377.216   15.419  700.732   14.390  700.732   14.390 0.000000 0.000000 
1 1 1   13   28    1 o  494.468   10.170  187.594   7.6974  189.832   10.951  185.408   10.822  496.777   14.402  490.955   14.401 5.821777 20.36668 
1 1 1   13   28    2 o  182.867   17.090   25.996   4.7281   24.423   6.6999   27.557   6.6732  175.454   25.711  187.002   23.858 -11.54822 35.07478 
1 1 1   13   28    3 o  398.361   10.874  121.805   6.6304  126.115   9.4079  117.551   9.3459  404.787   15.184  390.735   15.627 14.05191 21.78905 
1 1 1   13   28    4 o  397.245   10.925  121.130   6.6425  119.057   9.2964  123.292   9.4945  393.247   15.445  400.172   15.501 -6.924744 21.88184 
1 1 1   13   28    5 o  570.376   10.387  249.658   9.0678  240.466   12.504  259.854   13.169  559.034   14.613  581.092   14.807 -22.05804 20.80319 
1 1 1   13   28    6 f  373.114   9.7350  106.801   5.5596  106.248   6.9780  107.763   9.1997  371.882   12.259  374.009   16.070 -2.126587 20.21229 
1 1 1   13   28    7 o  283.283   13.012   61.687   5.6421   62.258   7.6747   61.015   8.3229  283.510   17.776  280.311   19.520 3.199097 26.40084 
1 1 1   13   28    8 o  160.473   20.873   20.258   5.0055   25.590   7.1843   15.228   6.9779  179.251   27.025  136.397   33.635 42.85422 43.14672 
1 1 1   13   28    9 o  319.849   10.896   78.546   5.3345   76.596   6.6210   82.154   9.0061  315.559   13.708  325.697   18.138 -10.13779 22.73496 
1 1 1   13   28   10 o  740.709   9.0387  420.842   10.248  417.338   12.579  427.757   17.671  737.185   11.148  745.138   15.494 -7.952820 19.08739 
1 1 1   13   28   11 o  360.939   10.306  100.005   5.6939  100.468   7.0064   99.104   9.7713  361.496   12.662  358.236   17.820 3.259399 21.86084 
1 1 1   13   28   12 o  334.530   10.738   85.936   5.4981   88.450   6.6482   80.497   9.7798  339.146   12.807  321.846   19.951 17.29935 23.70767 
1 1 1   13   28   13 o  205.645   14.902   32.750   4.6589   34.497   5.6561   29.063   8.2166  210.588   17.712  190.434   29.114 20.15392 34.07794 
1 1 1   13   28   14 o  412.573   9.9549  130.673   6.2865  129.170   7.6371  133.833   11.071  409.879   12.173  416.216   17.378 -6.336914 21.21769 
1 1 1   13   28   15 o  571.897   9.1606  250.989   8.0188  247.641   9.7537  257.972   14.085  567.684   11.225  578.217   15.915 -10.53357 19.47553 
1 1 1   13   28   16 o  405.597   12.190  126.530   7.5680  126.530   7.5680   0.0000   0.0000  405.597   12.190  ?   ?  0.000000 12.19039 
1 1 1   13   28   17 o   72.941   29.862   1.6451   5.3073   1.6451   5.3073   0.0000   0.0000   72.941   29.862  ?   ?  0.000000 29.86181 
1 1 1   13   28   18 o  468.518   9.9412  168.597   7.1291  169.977   8.6359  165.644   12.632  470.046   12.003  462.559   17.842 7.486847 21.50355 
1 1 1   13   28   19 o  245.854   14.066   46.756   5.2713   44.887   6.1362   52.018   10.298  240.329   16.787  255.997   26.672 -15.66830 31.51500 
1 1 1   13   28   20 o  187.290   18.570   27.469   5.2534   23.697   6.0459   39.096   10.614  172.598   23.496  219.344   32.606 -46.74574 40.18935 
1 1 1   13   28   21 o  152.406   22.923   18.541   5.1819   19.724   5.9857   15.002   10.352  156.459   25.901  135.316   43.799 21.14334 50.88426 
1 1 1   13   28   22 o  463.506   10.627  165.231   7.5397  156.680   8.8162  188.514   14.548  450.861   12.775  492.311   19.306 -41.45096 23.14969 
1 1 1   13   28   23 o  196.117   15.920   29.968   4.7376   28.008   6.3259   32.472   7.1492  187.894   22.440  202.157   23.546 -14.26320 32.52619 
1 1 1   13   28   24 o  299.032   11.464   68.872   5.2472   62.492   7.1834   76.169   7.6829  283.386   16.634  313.119   16.085 -29.73233 23.13882 
1 1 1   13   28   25 o  263.756   12.672   53.677   5.1158   57.903   7.0979   49.109   7.3801  272.522   17.103  250.208   19.423 22.31381 25.87941 
1 1 1   13   28   26 o  193.897   24.608   30.120   7.1389   0.0000   0.0000   30.120   7.1389  ?   ?   193.897   24.608 0.000000 24.60817 
1 1 1   13   28   27 o  222.767   17.602   38.853   5.9529   34.898   9.6416   41.289   7.5675  205.989   31.588  228.309   21.925 -22.31955 38.45079 
1 1 1   13   28   28 o  342.900   11.701   90.688   6.1412   87.280   8.3627   94.677   9.0475  335.177   16.301  348.882   16.943 -13.70441 23.51089 
1 1 1   13   28   29 o  135.259   25.507   14.970   5.0870   8.4730   6.8831   22.791   7.5516  104.214   35.762  165.619   30.927 -61.40498 47.27945 
1 1 1   13   28   30 o  208.624   17.567   34.174   5.5574   23.567   7.4737   47.292   8.3115  168.674   30.050  243.828   22.525 -75.15480 37.55467 
1 1 1   13   28   31 o  104.455   30.598   9.0613   5.2066   13.190   7.2951   4.7743   7.4333  124.390   36.157   91.799   36.101 32.59072 51.09393 
1 1 1   13   28   32 o  144.898   26.921   17.321   5.7510   22.563   7.4738   9.7128   9.0047  164.240   30.863  112.356   40.689 51.88428 51.06956 
1 1 1   13   28   33 o  125.446   30.821   13.326   5.8754   11.655   7.8978   15.397   8.7921  117.702   38.268  132.861   39.974 -15.15880 55.33828 
1 1 1   13   28   34 f   72.166   30.005   1.5431   5.4702  -1.7181   7.9863   4.4253   7.5078   76.156   33.919   90.369   36.044 -14.21241 49.49453 
1 1 1   13   28   35 o  310.813   9.6839   74.474   4.6070   79.549   5.4076   61.039   8.7982  320.889   11.010  277.023   20.903 43.86551 23.62562 
1 1 1   13   28   36 o  136.292   17.085   14.764   3.4857   16.151   3.8704   8.8089   8.0203  142.303   18.185  106.182   38.409 36.12149 42.49612 
1 1 1   13   28   37 o  136.184   19.577   14.927   3.9635   14.390   4.0894   23.256   16.097  133.287   20.718  154.912   54.595 -21.62564 58.39341 
1 1 1   13   28   38 o   73.725   25.980   4.0162   3.6450   4.5979   3.7368  -7.3872   16.546   77.246   26.352   97.665   45.474 -20.41945 52.55784 
1 1 1   13   28   39 o   70.063   30.655  -0.2704   6.2539   0.6947   9.4074  -1.0347   8.3717   86.256   37.672   78.294   34.808 7.962425 51.29137 
1 1 1   13   28   40 o  137.757   23.545   15.725   4.7862   49.505   15.834   12.328   5.0211  226.807   47.149  119.954   27.878 106.8528 54.77432 
1 1 1   13   28   41 o  172.704   17.242   23.812   4.4969   11.677   10.158   26.770   5.0151  115.836   43.005  182.803   18.164 -66.96793 46.68388 
1 1 1   13   28   42 o  194.249   15.151   29.856   4.4690   41.507   5.5037   7.3039   7.6570  228.897   15.806   97.286   37.071 131.6110 40.30009 
1 1 1   13   28   43 o   45.024   20.624  -1.8769   3.2069  -3.9888   4.6096   0.1041   4.4645   50.321   23.616   60.280   26.143 -9.959206 35.23019 
1 1 1   13   28   44 o  131.548   17.737   14.049   3.4804   19.835   5.2099   9.3857   4.6771  154.106   22.773  103.069   28.626 51.03759 36.57969 
1 1 1   13   28   45 o   47.788   21.760  -1.6390   3.5013  -2.2284   5.4532  -1.2256   4.5670   59.093   27.003   56.346   25.331 2.747681 37.02489 
1 1 1   13   28   46 o  143.316   17.885   16.807   3.8379   15.519   5.2595   18.275   5.6129  132.551   26.844  144.450   26.358 -11.89917 37.62047 
1 1 1   13   28   47 o  184.418   14.880   27.276   4.1645   19.093   5.4351   38.912   6.4810  148.149   24.848  216.893   19.738 -68.74319 31.73365 
1 1 1   13   28   48 f   58.927   25.647   0.3930   4.3270   6.5867   5.3663 -11.1171   7.3155   86.547   31.400   53.585   26.267 32.96260 40.93843 
1 1 1   13   29    0 o  234.218   20.611   43.190   7.2575   43.190   7.2575   43.190   7.2575  234.218   20.611  234.218   20.611 0.000000 0.000000 
1 1 1   13   29    1 o  225.241   15.139   39.247   5.1892   38.512   7.3426   39.980   7.3346  221.815   21.913  226.146   21.446 -4.330978 30.66121 
1 1 1   13   29    2 o  487.282   10.397  182.267   7.7543  170.820   10.684  195.008   11.272  471.004   14.820  503.285   14.633 -32.28128 20.82631 
1 1 1   13   29    3 o  320.865   12.323   79.128   6.0520   74.634   8.4153   83.942   8.7099  310.412   17.786  329.353   17.339 -18.94019 24.83871 
1 1 1   13   29    4 o   91.245   29.447   6.3729   4.6820   1.7844   6.4174   11.595   6.8462   79.570   32.736  119.789   35.086 -40.21941 47.98642 
1 1 1   13   29    5 o  322.258   11.828   79.797   5.8343   77.486   8.0037   82.417   8.5225  316.525   16.578  326.357   17.121 -9.831848 23.83154 
1 1 1   13   29    6 o  393.501   9.5362  118.816   5.7437  125.717   7.1786  106.539   9.5754  404.511   11.594  371.582   16.836 32.92892 20.44181 
1 1 1   13   29    7 o  772.432   8.9704  457.709   10.606  454.054   13.044  464.838   18.217  768.862   11.084  776.663   15.324 -7.800964 18.91272 
1 1 1   13   29    8 o  406.529   12.553  127.079   7.8107  112.092   11.950  138.256   10.320  379.746   20.637  423.423   15.924 -43.67715 26.06631 
1 1 1   13   29    9 o  478.963   10.936  176.211   8.0177  175.338   11.211  177.126   11.471  476.927   15.357  479.290   15.637 -2.362518 21.91680 
1 1 1   13   29   10 o  359.706   12.243   99.489   6.7409   95.998   9.1086  103.716   10.023  352.596   16.877  366.297   17.877 -13.70099 24.58522 
1 1 1   13   29   11 o  356.344   10.471   97.524   5.7110   89.089   6.9063  115.762   10.156  340.225   13.262  387.096   17.141 -46.87082 21.67253 
1 1 1   13   29   12 o  287.181   12.141   63.426   5.3368   63.108   6.4843   64.093   9.3959  285.734   14.878  286.414   21.591 -0.6802673 26.22094 
1 1 1   13   29   13 o  276.704   12.422   58.905   5.2612   59.435   6.2789   57.655   9.6393  277.248   14.850  270.983   23.472 6.265350 27.77497 
1 1 1   13   29   14 o  148.249   25.074   17.632   5.4867   17.632   5.4867   0.0000   0.0000  148.249   25.074  ?   ?  0.000000 25.07378 
1 1 1   13   29   15 o  277.925   15.126   59.779   6.4103   59.779   6.4103   0.0000   0.0000  277.925   15.126  ?   ?  0.000000 15.12577 
1 1 1   13   29   16 o  258.175   13.230   51.481   5.2104   48.510   6.2168   58.493   9.5515  249.990   16.337  272.811   23.091 -22.82057 28.28547 
1 1 1   13   29   17 o  229.932   14.829   40.976   5.1912   46.059   6.1862   28.875   9.5449  243.436   16.703  187.294   34.568 56.14104 38.39238 
1 1 1   13   29   18 o  166.576   19.574   21.849   4.8955   21.306   5.8137   23.171   9.0763  163.339   23.967  166.572   36.599 -3.232361 43.74757 
1 1 1   13   29   19 o  407.506   10.849  127.726   6.7671  127.852   8.0875  127.433   12.358  407.270   12.974  404.643   19.952 2.627289 23.79946 
1 1 1   13   29   20 o  321.162   12.204   79.462   5.9991   73.796   6.9772   95.528   11.749  309.033   14.750  348.867   22.117 -39.83456 26.58482 
1 1 1   13   29   21 o   78.593   29.839   3.6600   4.9496  -0.0819   5.6175   16.649   10.466   68.724   29.565  140.604   43.865 -71.87981 52.89888 
1 1 1   13   29   22 o  398.089   11.265  122.034   6.8642  117.385   7.9886  135.150   13.418  389.939   13.385  415.204   21.183 -25.26547 25.05757 
1 1 1   13   29   23 o  381.751   14.152  112.670   8.2690  103.904   10.311  128.468   13.842  364.845   18.524  403.969   22.476 -39.12445 29.12593 
1 1 1   13   29   24 o  102.441   34.379   8.1938   6.3591   0.0000   0.0000   8.1938   6.3591  ?   ?   102.441   34.379 0.000000 34.37891 
1 1 1   13   29   25 o  268.366   15.867   56.059   6.4889   45.063   12.187   60.410   7.6658  232.810   35.309  277.924   18.119 -45.11482 39.68657 
1 1 1   13   29   26 o  221.953   15.472   38.387   5.2235   26.437   7.0703   52.748   7.7508  180.704   26.337  259.021   19.697 -78.31683 32.88777 
1 1 1   13   29   27 o   99.710   30.115   8.1276   4.9831   6.3369   6.7210   10.314   7.4259   95.361   35.058  112.723   37.129 -17.36198 51.06517 
1 1 1   13   29   28 o  256.510   14.349   51.142   5.6111   48.097   7.6659   54.655   8.2354  246.767   20.481  263.100   20.615 -16.33295 29.05919 
1 1 1   13   29   29 o  103.820   30.015   8.9415   5.0395   9.2527   6.6752   8.5290   7.6847  106.919   35.202  105.838   37.676 1.080879 51.56261 
1 1 1   13   29   30 o  337.813   12.285   88.209   6.3521   88.103   8.5624   88.339   9.4729  336.223   16.638  335.479   18.520 0.7445374 24.89577 
1 1 1   13   29   31 o  247.954   16.630   48.153   6.2751   57.451   8.2704   35.538   9.6333  269.524   20.194  206.693   31.441 62.83083 37.36744 
1 1 1   13   29   32 o  130.043   29.420   14.235   5.7191   13.817   7.5593   14.795   8.7457  126.477   36.818  130.357   40.005 -3.880302 54.36870 
1 1 1   13   29   33 o  267.670   14.928   55.921   6.0918   57.968   8.9233   54.134   8.3368  269.624   21.809  260.857   21.059 8.766724 30.31700 
1 1 1   13   29   34 o  195.249   20.265   30.410   5.9681   20.871   8.7053   38.869   8.1978  154.136   37.301  218.862   24.915 -64.72563 44.85707 
1 1 1   13   29   35 o  318.819   10.992   78.567   5.3642   80.238   5.6616   63.905   16.771  322.046   11.486  268.000   42.286 54.04587 43.81784 
1 1 1   13   29   36 o  259.182   12.116   52.072   4.8066   54.989   5.0291   21.280   16.339  266.280   12.339  149.536   54.708 116.7443 56.08271 
1 1 1   13   29   37 o  160.598   15.593   20.361   3.7847   21.387   4.2276   16.218   8.4937  164.145   17.076  134.139   39.021 30.00513 42.59377 
1 1 1   13   29   38 o  249.570   17.132   49.273   6.5049   51.879   9.9294   47.315   8.6096  250.788   26.256  241.048   23.639 9.739288 35.33015 
1 1 1   13   29   39 o   77.094   32.719   1.6096   6.7139  -4.3482   13.611   3.5253   7.7182   91.299   42.067   86.538   35.782 4.760864 55.22665 
1 1 1   13   29   40 o  188.774   15.406   28.196   4.4128   31.829   5.3829   20.750   7.7055  199.578   17.808  152.442   33.900 47.13594 38.29317 
1 1 1   13   29   41 o   62.643   24.125   2.3713   3.2648  -1.1931   4.5458   6.1686   4.6920   56.985   25.470   86.717   29.528 -29.73205 38.99538 
1 1 1   13   29   42 o   38.862   18.682  -4.4403   3.2506  -1.0255   4.7263  -7.5053   4.4778   58.439   26.056   42.861   20.911 15.57796 33.40944 
1 1 1   13   29   43 f  164.840   14.681   21.597   3.6653   24.041   5.5033   19.649   4.9136  170.508   21.569  154.020   21.423 16.48875 30.39998 
1 1 1   13   29   44 f  144.331   16.724   16.848   3.6261   19.343   5.4116   14.815   4.8850  150.619   24.301  130.894   25.298 19.72488 35.07839 
1 1 1   13   29   45 o  112.726   21.965   10.828   3.6537   11.133   4.9283   10.457   5.4443  110.764   28.800  106.210   31.340 4.553802 42.56313 
1 1 1   13   29   46 o   82.202   27.968   5.8493   4.2091   7.7788   5.0534   1.4783   7.6060   92.469   30.638   76.634   33.661 15.83526 45.51618 
1 1 1   13   30    0 o  583.822   15.036  262.301   13.417  262.301   13.417  262.301   13.417  583.822   15.036  583.822   15.036 0.000000 0.000000 
1 1 1   13   30    1 o  375.894   11.484  108.586   6.6071  113.410   9.5667  104.186   9.1359  383.347   16.304  367.440   16.244 15.90768 23.01517 
1 1 1   13   30    2 o  517.805   10.638  205.932   8.4314  207.808   11.902  204.043   11.946  519.249   14.975  514.477   15.170 4.772156 21.31615 
1 1 1   13   30    3 o  655.844   10.509  330.343   10.550  323.759   14.573  337.594   15.293  648.194   14.688  661.771   15.098 -13.57703 21.06400 
1 1 1   13   30    4 o  327.834   12.115   82.640   6.0791   91.782   8.7847   74.239   8.4211  344.775   16.646  309.375   17.859 35.40005 24.41438 
1 1 1   13   30    5 o  318.089   12.314   77.816   5.9955   82.540   8.4162   72.949   8.5430  326.471   16.900  306.550   18.290 19.92105 24.90284 
1 1 1   13   30    6 o  377.714   10.029  109.547   5.7980  105.178   7.1112  118.210   10.014  369.759   12.565  391.217   16.723 -21.45847 20.91725 
1 1 1   13   30    7 o  287.815   11.409   63.672   5.0262   64.756   6.1745   61.542   8.6536  289.950   13.913  280.957   20.259 8.992981 24.57586 
1 1 1   13   30    8 o   99.485   26.134   8.0296   4.0310   7.2628   4.8591   9.7222   7.2192   96.049   29.876  111.760   36.599 -15.71018 47.24511 
1 1 1   13   30    9 o   59.091   26.871  -3.0532   5.3168   4.2945   8.1329  -8.5373   7.0262   94.801   37.609   59.398   28.256 35.40214 47.04050 
1 1 1   13   30   10 o  215.909   17.525   36.293   5.7416   39.453   7.7992   32.555   8.4835  223.826   23.097  201.627   28.266 22.19885 36.50235 
1 1 1   13   30   11 o  478.172   15.734  176.561   11.515  176.561   11.515   0.0000   0.0000  478.172   15.734  ?   ?  0.000000 15.73359 
1 1 1   13   30   12 o  343.246   13.714   90.801   7.2053   90.801   7.2053   0.0000   0.0000  343.246   13.714  ?   ?  0.000000 13.71441 
1 1 1   13   30   13 o  316.277   14.102   77.141   6.8268   77.141   6.8268   0.0000   0.0000  316.277   14.102  ?   ?  0.000000 14.10207 
1 1 1   13   30   14 o  265.444   13.408   54.445   5.4301   59.707   6.6284   43.707   9.4684  277.535   15.668  234.236   26.897 43.29865 31.12749 
1 1 1   13   30   15 o  550.864   9.6184  233.116   8.1099  231.550   9.8462  236.419   14.301  548.507   11.728  552.576   16.909 -4.069641 20.57763 
1 1 1   13   30   16 o  251.334   13.832   48.880   5.3007   49.922   6.3422   46.465   9.6545  253.441   16.438  241.499   26.557 11.94240 31.23260 
1 1 1   13   30   17 o  429.036   10.534  141.562   6.9177  138.276   8.2471  149.362   12.706  423.556   12.721  438.323   18.939 -14.76700 22.81431 
1 1 1   13   30   18 o  446.948   10.631  153.674   7.2725  147.877   8.6276  167.903   13.517  437.911   12.872  464.557   19.009 -26.64532 22.95731 
1 1 1   13   30   19 o   61.960   27.960  -2.5873   5.6256  -2.7444   7.1266  -2.3275   9.1636   70.539   31.683   81.819   36.394 -11.27991 48.25329 
1 1 1   13   30   20 o  249.407   17.189   48.520   6.5218   38.286   8.1294   67.001   10.924  219.136   24.665  290.529   24.804 -71.39343 34.98026 
1 1 1   13   30   21 o   96.538   32.868   7.1081   5.8131   4.0526   7.1680   12.979   9.9357   89.227   35.336  126.715   42.971 -37.48809 55.63339 
1 1 1   13   30   22 o  151.638   23.538   18.496   5.2860   14.025   5.9716   34.682   11.362  129.779   30.566  202.652   38.026 -72.87334 48.78817 
1 1 1   13   30   23 o  191.729   26.415   29.672   7.5460   27.068   10.028   33.072   11.458  178.395   37.894  196.953   39.384 -18.55746 54.65392 
1 1 1   13   30   24 o  345.211   11.125   91.837   5.8783   85.564   8.1845   98.519   8.4481  331.961   16.108  356.400   15.486 -24.43875 22.34484 
1 1 1   13   30   25 f  226.502   14.980   39.944   5.1642   51.286   7.2962   28.557   7.3105  255.603   18.781  187.885   26.128 67.71742 32.17724 
1 1 1   13   30   26 o  126.212   26.063   13.111   4.8682   22.935   6.7498   2.4605   7.0280  167.534   27.259   83.116   34.234 84.41795 43.76122 
1 1 1   13   30   27 o  217.162   16.248   36.882   5.3617   44.783   7.4196   28.247   7.7568  237.950   20.574  185.784   28.160 52.16576 34.87544 
1 1 1   13   30   28 o  183.876   18.879   26.733   5.2379   21.835   6.9231   33.290   8.0103  162.485   28.896  202.514   26.476 -40.02966 39.19090 
1 1 1   13   30   29 o   71.500   29.067   2.0150   4.9845   5.9657   6.8776  -2.3560   7.2342   93.931   35.284   71.240   31.965 22.69151 47.61024 
1 1 1   13   30   30 o  185.571   21.727   27.564   6.0546   31.335   7.7493   21.656   9.7006  196.026   26.507  156.592   40.252 39.43481 48.19568 
1 1 1   13   30   31 o  318.978   12.975   78.836   6.3350   70.887   8.7499   87.594   9.1840  299.742   19.172  333.873   18.038 -34.13058 26.32392 
1 1 1   13   30   32 o  115.744   30.266   11.367   5.4228   9.9225   7.9641   12.617   7.4044  110.577   38.438  120.996   36.746 -10.41956 53.17648 
1 1 1   13   30   33 o  318.975   16.890   79.856   8.2166   82.035   9.5427   73.608   16.157  322.013   19.452  293.051   36.835 28.96182 41.65570 
1 1 1   13   30   34 o  169.125   30.034   24.096   7.4900   22.880   8.5330   28.178   15.634  161.997   35.402  169.133   53.729 -7.136841 64.34333 
1 1 1   13   30   35 o  294.035   15.240   67.710   6.8354   65.674   9.9554   69.526   9.4019  285.480   22.978  295.009   20.958 -9.528687 31.09988 
1 1 1   13   30   36 f  330.334   14.322   85.143   7.2414   93.492   10.302   76.989   10.181  342.722   19.722  309.706   21.611 33.01587 29.25775 
1 1 1   13   30   37 o  157.348   27.141   20.815   6.3005   23.174   9.4919   18.957   8.4239  159.193   39.212  144.584   37.682 14.60965 54.38315 
1 1 1   13   30   38 o  254.640   19.867   52.047   7.6822   32.988   15.621   58.127   8.8230  177.246   53.271  268.002   21.694 -90.75635 57.51930 
1 1 1   13   30   39 o   61.148   24.845   1.5922   3.6389   2.7162   4.0786  -2.7946   8.0574   68.441   26.794   72.390   32.980 -3.949173 42.49248 
1 1 1   13   30   40 o   67.083   26.254   2.6249   3.9148   4.0889   4.5302  -1.6923   7.7795   76.286   28.640   73.067   32.934 3.218590 43.64574 
1 1 1   13   30   42 o  123.772   19.920   12.666   3.6457   18.296   5.6906   8.7458   4.7481  145.575   26.516   99.287   29.259 46.28742 39.48631 
1 1 1   13   30   43 o  140.791   16.808   16.059   3.5505   14.239   5.1534   17.704   4.8987  127.000   27.321  144.725   22.874 -17.72469 35.63234 
1 1 1   13   30   44 o   93.507   24.474   7.6637   3.5436   5.3659   4.7005   10.689   5.3936   80.970   29.386  107.399   31.052 -26.42978 42.75276 
1 1 1   13   30   45 o  201.839   14.947   32.658   4.5848   38.156   5.4908   19.998   8.3320  217.087   16.652  140.766   37.850 76.32101 41.35133 
1 1 1   13   31    0 o  212.865   24.601   36.395   7.7367   36.395   7.7367   36.395   7.7367  212.865   24.601  212.865   24.601 0.000000 0.000000 
1 1 1   13   31    1 o  226.851   16.003   39.936   5.5209   37.308   7.7703   42.616   7.8457  217.402   23.737  232.912   22.279 -15.50993 32.55448 
1 1 1   13   31    2 o  278.162   13.512   59.603   5.7531   55.331   7.9092   64.404   8.3838  266.382   19.534  287.594   19.155 -21.21231 27.35876 
1 1 1   13   31    3 o  311.193   13.262   74.584   6.3170   68.196   8.6277   81.966   9.2746  295.967   19.148  324.691   18.742 -28.72388 26.79325 
1 1 1   13   31    4 o  309.037   13.231   73.555   6.2586   71.010   8.6126   76.403   9.1104  302.133   18.716  313.337   19.087 -11.20416 26.73171 
1 1 1   13   31    5 o  280.802   11.960   60.662   5.1406   56.498   6.2179   69.655   9.1373  270.163   15.097  298.833   20.093 -28.67001 25.13285 
1 1 1   13   31    6 o  381.268   10.342  111.693   6.0353  114.684   7.4480  105.975   10.299  385.967   12.607  369.846   18.194 16.12164 22.13506 
1 1 1   13   31    7 o  413.764   9.9541  131.513   6.3041  135.598   7.8235  123.951   10.645  419.751   12.177  400.163   17.380 19.58853 21.22140 
1 1 1   13   31    8 o  636.852   11.373  311.943   11.086  311.943   11.086   0.0000   0.0000  636.852   11.373  ?   ?  0.000000 11.37306 
1 1 1   13   31    9 o  509.682   17.907  201.314   13.970  201.314   13.970   0.0000   0.0000  509.682   17.907  ?   ?  0.000000 17.90706 
1 1 1   13   31   10 o  460.031   12.142  162.919   8.5499  162.919   8.5499   0.0000   0.0000  460.031   12.142  ?   ?  0.000000 12.14246 
1 1 1   13   31   11 o  389.169   10.843  116.467   6.4588  110.559   7.9216  128.186   11.156  378.634   13.669  406.592   17.925 -27.95801 22.54205 
1 1 1   13   31   12 o  345.995   13.168   92.286   6.9737   95.622   9.5857   88.535   10.164  350.676   17.919  336.804   19.803 13.87167 26.70670 
1 1 1   13   31   13 o  148.445   25.953   17.817   5.6821   11.576   7.4401   26.550   8.8018  119.160   36.953  179.504   33.260 -60.34445 49.71694 
1 1 1   13   31   14 o  324.660   11.951   81.182   5.9389   83.515   7.2912   76.582   10.237  328.803   14.488  312.415   21.540 16.38864 25.95858 
1 1 1   13   31   15 o  287.403   15.307   64.074   6.7094   64.300   9.0096   63.792   10.053  286.341   20.696  284.289   23.308 2.052460 31.17021 
1 1 1   13   31   16 f  557.703   11.900  239.641   10.158  259.289   14.392  220.137   14.339  578.443   16.255  532.419   17.595 46.02496 23.95457 
1 1 1   13   31   17 o  312.993   14.937   75.795   7.1560   75.302   9.3855   76.479   11.060  310.085   19.879  311.159   23.392 -1.074432 30.69835 
1 1 1   13   31   18 o  322.997   12.611   80.482   6.2349   76.526   7.3530   90.605   11.762  314.374   15.281  338.963   22.803 -24.58868 27.44948 
1 1 1   13   31   19 o   77.971   29.639   3.6185   4.8873   2.3992   5.6119   7.4464   9.9437   76.644   30.955  108.942   42.061 -32.29792 52.22401 
1 1 1   13   31   20 o  320.864   12.676   79.462   6.2253   78.748   7.3316   81.307   11.785  318.877   15.021  320.181   24.227 -1.304596 28.50611 
1 1 1   13   31   21 o  165.074   29.191   22.376   7.1058   27.407   9.8727   16.969   10.235  179.847   37.096  140.694   43.295 39.15334 57.01400 
1 1 1   13   31   22 o  136.020   35.017   15.688   7.3338   20.385   9.8643   9.8822   10.966  153.279   41.171  118.081   44.515 35.19801 60.63516 
1 1 1   13   31   23 o  335.901   13.463   87.262   6.9218   80.539   7.9811  107.669   13.904  321.536   16.270  367.772   24.845 -46.23511 29.69842 
1 1 1   13   31   24 o  242.875   17.183   46.161   6.3466   42.869   7.2866   56.507   12.918  232.866   20.658  261.665   32.988 -28.79909 38.92200 
1 1 1   13   31   25 o   73.021   28.973   2.5756   4.8275  -2.7139   6.6293   8.5471   7.0437   67.308   30.364  104.673   36.162 -37.36540 47.21927 
1 1 1   13   31   26 o  112.236   28.149   10.511   4.8271   17.345   6.7301   3.2710   6.9273  143.541   31.497   85.001   34.370 58.54005 46.61919 
1 1 1   13   31   27 o  264.550   13.963   54.405   5.6338   52.118   7.7131   57.022   8.2487  256.921   19.765  268.615   20.211 -11.69409 28.26896 
1 1 1   13   31   28 o  222.846   17.639   39.056   5.9673   32.195   7.3478   52.347   10.227  199.639   24.564  254.105   26.693 -54.46642 36.27547 
1 1 1   13   31   29 o  210.515   19.130   35.077   6.0967   35.852   7.7680   33.835   9.8383  210.651   24.553  200.342   33.249 10.30833 41.33183 
1 1 1   13   31   30 o  191.686   19.432   29.188   5.6226   33.375   7.9926   25.086   7.9111  202.126   26.470  172.769   31.057 29.35719 40.80742 
1 1 1   13   31   31 f   67.598   30.470  -2.4268   6.6590  -1.2993   7.5957  -6.1712   13.842   75.034   33.267   91.991   42.399 -16.95758 53.89219 
1 1 1   13   31   32 o  260.711   19.516   53.915   7.7314   59.741   9.0027   37.543   15.091  273.402   21.691  198.779   49.724 74.62271 54.24928 
1 1 1   13   31   33 o   63.162   28.381  -1.9336   5.7246  -5.4592   8.2612   1.3231   7.9399   69.680   32.339   82.552   35.321 -12.87122 47.88979 
1 1 1   13   31   34 f  295.728   21.705   70.148   9.7563   0.0000   0.0000   70.148   9.7563  ?   ?   295.728   21.705 0.000000 21.70526 
1 1 1   13   31   35 o  146.646   29.180   18.324   6.3193   33.346   9.2256   5.0460   8.6737  197.550   31.574   94.552   38.379 102.9984 49.69773 
1 1 1   13   31   36 o  101.254   33.074   8.7156   5.8968   21.115   8.9997  -0.6125   7.8057  151.889   38.623   76.412   33.808 75.47729 51.32988 
1 1 1   13   31   37 o  169.525   16.573   22.870   4.2453   17.106   4.9347   39.285   8.3277  143.697   23.228  217.568   25.490 -73.87149 34.48621 
1 1 1   13   31   38 o  156.720   17.581   19.704   4.1446   18.440   4.7414   23.799   8.5333  149.996   21.246  162.334   35.345 -12.33772 41.23907 
1 1 1   13   31   39 o  197.101   21.739   31.818   6.4492   32.252   10.175   31.527   8.3380  187.903   36.695  191.242   29.428 -3.338928 47.03742 
1 1 1   13   31   40 o   45.922   21.525  -3.3208   3.8098  -1.7876   4.4534  -7.5057   7.3575   54.458   24.698   60.140   28.693 -5.681732 37.85884 
1 1 1   13   31   41 o  182.654   15.569   26.643   4.3112   27.924   5.1569   23.669   7.8570  185.527   18.403  161.122   32.970 24.40555 37.75827 
1 1 1   13   31   42 o   80.314   32.312   4.1776   6.0891   3.4292   9.2492   4.7502   8.0895   87.533   37.796   87.747   36.486 -0.2142715 52.53348 
1 1 1   13   31   43 o  103.464   23.330   9.2821   3.6066   10.960   4.9405   7.3675   5.2771  109.655   28.993   91.019   31.308 18.63589 42.67083 
1 1 1   13   31   44 f  125.118   23.377   13.532   4.3123   15.064   5.1289   9.8367   7.9657  130.055   26.660  101.706   38.018 28.34910 46.43452 
1 1 1   13   32    0 o  540.713   15.591  225.408   12.879  225.408   12.879  225.408   12.879  540.713   15.591  540.713   15.591 0.000000 0.000000 
1 1 1   13   32    1 o  432.485   11.352  143.893   7.5149  148.703   10.538  138.915   10.720  438.618   15.696  423.709   16.529 14.90909 22.79430 
1 1 1   13   32    2 o  637.268   10.968  312.320   10.698  304.371   14.757  321.123   15.531  627.642   15.361  644.530   15.743 -16.88776 21.99558 
1 1 1   13   32    3 o  316.459   13.772   77.236   6.6708   75.443   9.0795   79.340   9.8334  311.087   19.161  318.708   20.263 -7.620544 27.88808 
1 1 1   13   32    4 o  257.984   15.540   51.622   6.1076   57.420   8.2454   44.573   9.0914  270.986   20.021  236.943   25.468 34.04291 32.39498 
1 1 1   13   32    5 o  487.505   15.552  183.714   11.605  183.714   11.605   0.0000   0.0000  487.505   15.552  ?   ?  0.000000 15.55205 
1 1 1   13   32    6 o  215.848   23.790   36.912   7.7293   36.912   7.7293   0.0000   0.0000  215.848   23.790  ?   ?  0.000000 23.79007 
1 1 1   13   32    7 o  491.291   15.554  186.632   11.696  186.632   11.696   0.0000   0.0000  491.291   15.554  ?   ?  0.000000 15.55354 
1 1 1   13   32    8 o  252.987   15.348   49.660   5.9151   49.176   8.0428   50.230   8.7297  250.209   21.200  252.378   22.846 -2.168869 31.16705 
1 1 1   13   32    9 o  329.175   19.311   84.573   9.6870   0.0000   0.0000   84.573   9.6870  ?   ?   329.175   19.311 0.000000 19.31062 
1 1 1   13   32   10 o  158.230   34.353   20.875   8.0815   0.0000   0.0000   20.875   8.0815  ?   ?   158.230   34.353 0.000000 34.35317 
1 1 1   13   32   11 o  158.132   24.167   20.064   5.6637   14.842   7.6704   26.324   8.3985  132.997   36.550  178.996   31.820 -45.99893 48.46075 
1 1 1   13   32   12 o  123.865   29.673   12.692   5.5519   10.099   7.5086   15.821   8.2463  112.825   37.344  136.941   38.002 -24.11623 53.27979 
1 1 1   13   32   13 o  130.064   28.968   13.959   5.6191   15.030   7.7342   12.762   8.1775  133.617   36.694  124.295   38.774 9.321983 53.38409 
1 1 1   13   32   14 o  417.731   12.709  134.610   8.1259  127.904   10.967  142.774   12.100  405.702   17.661  428.339   18.455 -22.63742 25.54425 
1 1 1   13   32   15 o  178.210   19.707   25.062   5.2857   21.971   6.4040   31.670   9.3619  164.769   26.275  196.165   32.304 -31.39592 41.64076 
1 1 1   13   32   16 o  102.230   29.423   8.5633   4.8525   7.7198   5.8039   10.522   8.8446   99.298   32.831  116.388   40.504 -17.08930 52.13858 
1 1 1   13   32   17 o  321.590   12.517   79.799   6.1615   75.312   7.3538   90.370   11.287  311.764   15.410  338.751   21.886 -26.98663 26.76727 
1 1 1   13   32   18 o  364.424   12.001  102.426   6.6939  101.776   7.9571  103.998   12.381  362.672   14.334  363.132   22.385 -0.4600220 26.58085 
1 1 1   13   32   19 o   93.001   35.135   5.5574   6.8411   15.651   9.3417  -6.1166   10.046  135.482   41.303   78.531   36.168 56.95065 54.90053 
1 1 1   13   32   20 o  347.876   16.698   94.091   8.8912   84.949   12.046  105.033   13.179  326.916   24.245  363.927   23.790 -37.01114 33.96740 
1 1 1   13   32   21 o  133.965   28.425   14.870   5.6480   16.553   6.6637   10.579   10.643  140.458   31.742  119.246   44.069 21.21194 54.31110 
1 1 1   13   32   22 o  170.001   22.824   23.177   5.7890   25.941   6.7970   15.877   11.047  179.040   25.525  136.489   45.303 42.55093 51.99892 
1 1 1   13   32   23 o   70.283   29.793   0.7012   5.5564  -2.3531   6.3722   10.390   11.350   66.652   29.947  119.646   45.243 -52.99421 54.25591 
1 1 1   13   32   24 o   95.393   32.471   7.0685   5.6738   4.2651   6.4572   16.564   11.884   86.477   33.753  138.711   46.996 -52.23395 57.86047 
1 1 1   13   32   25 o  111.379   32.210   10.419   5.8026   12.508   6.6020   3.3261   12.165  121.287   34.126  103.865   44.059 17.42229 55.72908 
1 1 1   13   32   26 o  131.921   30.708   14.696   6.0846   14.477   6.9696   15.397   12.476  129.931   34.476  134.898   48.007 -4.967514 59.10386 
1 1 1   13   32   27 o  113.012   31.580   10.801   5.6740   17.701   6.9751  -2.6955   9.7554  144.252   32.385   82.365   37.026 61.88735 49.19006 
1 1 1   13   32   28 o   94.215   34.226   6.5080   6.3784   6.9518   7.2687   5.0220   13.301   98.265   36.398  109.880   46.310 -11.61520 58.90199 
1 1 1   13   32   29 o  322.013   15.384   80.809   7.5824   77.041   8.7098   92.601   15.409  312.776   18.273  335.023   30.380 -22.24637 35.45145 
1 1 1   13   32   30 f  126.658   29.044   13.572   5.5107   13.595   7.4446   13.545   8.1959  124.902   36.589  124.604   38.808 0.2972870 53.33681 
1 1 1   13   32   31 o   86.527   31.888   5.3299   5.5654  -0.5749   7.7036   11.776   8.0491   76.934   33.832  117.151   38.659 -40.21680 51.37296 
1 1 1   13   32   32 o  153.958   26.405   19.708   5.9985   17.158   8.3564   22.418   8.6158  138.464   38.190  159.485   36.131 -21.02054 52.57331 
1 1 1   13   32   33 o  243.652   17.611   46.997   6.5238   44.466   9.4104   49.338   9.0520  231.877   27.021  246.045   24.356 -14.16821 36.37792 
1 1 1   13   32   34 o  117.132   33.005   12.036   6.1708   2.2666   8.8313   21.357   8.6260   87.549   37.350  154.039   37.040 -66.48912 52.60250 
1 1 1   13   32   35 o  131.710   30.936   15.152   6.1305   7.8924   9.1783   20.999   8.2375  103.335   40.266  152.765   35.846 -49.43043 53.90997 
1 1 1   13   32   36 o   91.474   35.722   5.7476   7.2357   6.5646   14.911   5.4960   8.2753  111.406   48.047   93.552   37.657 17.85425 61.04586 
1 1 1   13   32   37 o  128.572   31.192   14.627   6.0757   13.800   9.6976   15.162   7.7952  121.747   42.410  127.986   37.425 -6.238754 56.56173 
1 1 1   13   32   38 o  299.717   11.617   69.960   5.3294   77.292   6.5813   55.993   9.0834  313.974   13.695  260.833   22.987 53.14011 26.75698 
1 1 1   13   32   39 o   88.115   26.636   6.6840   3.8970   3.5125   4.4500   17.119   8.0719   72.872   28.137  133.845   37.760 -60.97251 47.09053 
1 1 1   13   32   40 f  114.542   24.458   11.313   4.1575   13.000   4.8865   6.8897   7.9123  121.661   26.951   94.227   37.185 27.43456 45.92472 
1 1 1   13   32   41 o  173.716   17.102   24.434   4.4884   22.730   4.8521   34.541   11.816  166.191   19.442  183.501   42.848 -17.30952 47.05220 
1 1 1   13   32   42 o  104.231   27.293   9.7705   4.4057   12.910   4.8704  -4.3660   10.335  120.214   27.115   75.750   35.489 44.46487 44.66170 
1 1 1   13   33    2 o  103.999   37.369   7.7721   7.5766   7.7721   7.5766   0.0000   0.0000  103.999   37.369  ?   ?  0.000000 37.36914 
1 1 1   13   33    3 f  176.786   29.298   25.440   7.6503   25.440   7.6503   0.0000   0.0000  176.786   29.298  ?   ?  0.000000 29.29822 
1 1 1   13   33    4 o  316.693   13.385   77.395   6.4884   80.864   9.0811   73.777   9.2739  322.000   18.503  307.088   19.836 14.91180 27.12628 
1 1 1   13   33    5 o  124.288   25.223   12.582   4.6344   15.560   5.7761   7.1999   7.7646  137.706   28.349  102.354   37.674 35.35196 47.14811 
1 1 1   13   33    6 o   93.088   28.905   6.9019   4.5505   1.8296   5.6994   15.821   7.5576   75.265   30.894  137.185   35.662 -61.91968 47.18307 
1 1 1   13   33    7 o  121.426   25.080   12.020   4.5070   12.535   5.5573   11.030   7.7036  123.046   29.819  116.848   37.779 6.197670 48.12894 
1 1 1   13   33    8 f  283.208   12.383   61.838   5.3680   58.931   6.6093   67.472   9.2013  275.417   15.744  293.244   20.631 -17.82739 25.95207 
1 1 1   13   33    9 o  212.909   19.556   35.619   6.3018   30.879   9.5085   39.331   8.4153  193.375   33.328  221.987   25.214 -28.61253 41.79165 
1 1 1   13   33   10 o  542.501   12.262  226.913   10.182  217.314   14.785  235.572   14.042  528.521   18.277  551.040   16.648 -22.51868 24.72248 
1 1 1   13   33   11 o  121.806   32.032   12.366   6.0516   14.842   8.9472   10.277   8.2161  132.807   40.407  114.476   39.074 18.33123 56.20971 
1 1 1   13   33   12 o   76.845   29.241   3.4849   4.7597   7.0737   5.6836  -4.9420   8.7093   96.093   32.500   74.359   34.034 21.73387 47.05964 
1 1 1   13   33   13 o  111.532   28.042   10.280   4.7822   12.231   5.7952   6.1157   8.4663  121.162   31.093  100.475   38.806 20.68739 49.72608 
1 1 1   13   33   14 o   79.282   29.757   3.9286   4.8895   1.7796   5.7777   9.3514   9.1781   75.296   31.030  112.868   41.047 -37.57260 51.45613 
1 1 1   13   33   15 o  335.563   14.813   87.200   7.6081   89.918   10.128   83.678   11.526  338.729   19.618  325.155   23.314 13.57486 30.46988 
1 1 1   13   33   16 o  308.173   15.764   73.868   7.4111   72.469   9.6254   75.904   11.614  303.419   20.852  308.825   24.779 -5.405182 32.38539 
1 1 1   13   33   17 o  162.792   29.940   21.882   7.1853   23.134   10.015   20.555   10.315  163.510   40.280  153.568   42.459 9.941910 58.52616 
1 1 1   13   33   18 o   68.672   30.942  -2.7510   6.8593  -9.5716   9.7143   4.0310   9.6867   71.539   33.792   98.120   40.277 -26.58108 52.57460 
1 1 1   13   33   19 o  253.019   16.392   49.976   6.3141   52.610   7.4440   43.218   11.921  258.798   18.923  227.205   35.435 31.59305 40.17161 
1 1 1   13   33   20 f  193.614   20.019   29.681   5.8470   32.564   6.8544   21.976   11.204  202.020   22.552  157.474   44.508 44.54596 49.89570 
1 1 1   13   33   21 o  355.225   13.049   97.606   7.0949   96.903   8.2648   99.575   13.833  353.247   15.286  352.565   25.812 0.6827698 29.99867 
1 1 1   13   33   22 o  131.169   28.794   14.356   5.6225   14.596   6.4946   13.637   11.233  131.223   32.504  128.845   45.586 2.377930 55.98717 
1 1 1   13   33   23 o  174.687   22.373   24.487   5.8446   21.400   6.7099   34.192   11.898  160.953   28.267  197.918   40.638 -36.96480 49.50208 
1 1 1   13   33   24 o  255.590   17.183   51.233   6.6830   50.707   7.8071   52.677   12.928  253.056   20.328  250.367   34.664 2.689041 40.18461 
1 1 1   13   33   25 o  153.365   30.994   19.807   7.0253   19.807   7.0253   0.0000   0.0000  153.365   30.994  ?   ?  0.000000 30.99365 
1 1 1   13   33   26 o  228.084   21.614   41.516   7.4555   41.516   7.4555   0.0000   0.0000  228.084   21.614  ?   ?  0.000000 21.61362 
1 1 1   13   33   27 o  308.886   15.374   74.341   7.2685   76.149   8.4780   69.326   14.120  311.176   17.875  288.103   32.593 23.07230 37.17280 
1 1 1   13   33   28 o  293.673   14.078   67.051   6.3280   71.784   8.6667   61.646   9.2610  301.453   18.878  277.735   21.964 23.71762 28.96237 
1 1 1   13   33   29 o  398.976   11.747  123.236   7.1740  114.400   9.7505  133.665   10.593  382.194   16.668  413.073   16.754 -30.87936 23.63270 
1 1 1   13   33   30 o  183.731   21.467   27.199   5.9231   27.877   8.1792   26.452   8.5889  181.665   30.496  175.389   33.210 6.275604 45.08754 
1 1 1   13   33   31 o  246.465   17.116   47.973   6.4170   52.564   9.0954   43.422   9.0548  254.598   23.608  229.724   26.221 24.87424 35.28348 
1 1 1   13   33   32 o  189.014   21.155   28.857   6.0154   27.379   8.6144   30.262   8.4036  177.825   32.860  188.849   30.081 -11.02379 44.54934 
1 1 1   13   33   33 o  245.429   17.558   47.823   6.5522   36.694   9.3228   58.687   9.2106  207.609   30.225  268.940   22.584 -61.33160 37.73079 
1 1 1   13   33   34 f   72.803   32.034  -0.2790   6.9154  -4.8178   13.502   1.3350   8.0516   89.903   41.590   81.710   35.273 8.193085 54.53367 
1 1 1   13   33   35 o  122.363   38.937   13.807   8.2079   0.0000   0.0000   13.807   8.2079  ?   ?   122.363   38.937 0.000000 38.93652 
1 1 1   13   33   36 o  152.208   31.632   20.481   7.1289   17.355   13.321   21.736   8.4391  132.171   49.212  153.700   36.428 -21.52934 61.22768 
1 1 1   13   33   37 o   91.796   33.146   6.9142   5.9693   19.269   9.4233  -1.3662   7.7145  140.311   41.183   72.976   32.854 67.33508 52.68195 
1 1 1   13   33   38 o  211.277   28.166   38.618   8.8816   0.0000   0.0000   38.618   8.8816  ?   ?   211.277   28.166 0.000000 28.16575 
1 1 1   13   33   39 o   85.123   27.149   6.2553   3.9888   8.4178   4.5732  -0.6223   8.1556   97.122   28.741   75.279   33.846 21.84242 44.40267 
1 1 1   13   33   40 o  190.411   16.906   29.313   4.8758   31.680   5.3289   17.139   12.084  197.422   17.827  125.148   46.817 72.27374 50.09639 
1 1 1   13   33   41 o  114.358   23.803   11.360   4.0310   17.076   4.7047  -4.4205   7.8174  141.702   22.439   65.891   30.869 75.81069 38.16253 
1 1 1   13   34    0 o   71.534   41.547   5.1632   7.4635   5.1632   7.4635   5.1632   7.4635   71.534   41.547   71.534   41.547 0.000000 0.000000 
1 1 1   13   34    1 o   77.057   30.092   3.1068   5.1345  -4.4357   7.4106   10.070   7.1205   68.498   31.368  111.954   36.333 -43.45554 48.00024 
1 1 1   13   34    2 o  142.017   25.349   16.361   5.3081   22.108   7.5076   10.616   7.5058  163.697   31.101  114.748   37.306 48.94834 48.56969 
1 1 1   13   34    3 o  185.547   19.581   27.130   5.4771   19.473   7.4422   36.178   8.0896  152.853   32.792  212.690   25.349 -59.83719 41.44733 
1 1 1   13   34    4 o  523.398   12.106  211.191   9.6986  204.984   14.111  216.749   13.352  513.412   17.957  528.592   16.503 -15.17950 24.38815 
1 1 1   13   34    5 o  240.646   18.659   45.352   6.8192   46.663   10.247   44.310   9.1359  240.646   28.364  235.456   25.770 5.189285 38.32290 
1 1 1   13   34    6 o  142.796   29.236   16.812   6.1749   17.760   9.5158   16.122   8.1156  144.083   41.121  137.923   37.469 6.160522 55.63190 
1 1 1   13   34    7 o  130.619   30.641   14.192   6.0202   8.4789   8.8083   19.200   8.2471  109.221   40.137  150.618   36.218 -41.39690 54.06224 
1 1 1   13   34    8 o  190.936   22.296   28.974   6.3935   30.512   9.6359   27.764   8.5455  191.587   34.110  183.582   31.548 8.005295 46.46241 
1 1 1   13   34    9 o  323.021   15.642   80.882   7.7338   73.890   11.354   86.935   10.564  305.047   24.524  332.647   20.852 -27.59921 32.19050 
1 1 1   13   34   10 o   47.383   23.356 -12.5813   6.0494 -10.9269   9.4237 -13.7409   7.8896   68.416   32.595   56.799   27.722 11.61697 42.78946 
1 1 1   13   34   11 o  341.383   15.160   90.304   7.9218  103.433   12.043   80.290   10.518  362.373   21.814  319.183   21.656 43.18973 30.73816 
1 1 1   13   34   12 o  606.804   12.525  284.233   11.633  272.748   16.740  294.959   16.178  591.436   18.492  615.836   17.162 -24.40045 25.22869 
1 1 1   13   34   13 o  103.107   30.040   8.7442   5.0305   9.0451   6.0868   8.0958   8.9351  105.632   33.521  107.867   40.276 -2.234810 52.40085 
1 1 1   13   34   14 o  403.338   14.677  126.031   9.0613  117.551   13.010  134.021   12.628  385.995   22.112  413.812   19.937 -27.81699 29.77296 
1 1 1   13   34   15 f  347.819   16.651   94.081   8.8645   93.297   12.938   94.775   12.170  342.237   24.868  345.860   23.123 -3.623199 33.95676 
1 1 1   13   34   16 o  352.325   15.715   96.399   8.4747   79.340   11.271  118.586   12.854  316.047   23.467  387.650   21.752 -71.60327 31.99773 
1 1 1   13   34   17 o  285.299   17.450   63.672   7.5835   54.295   9.7666   77.909   12.035  260.475   24.796  312.065   25.416 -51.58990 35.50782 
1 1 1   13   34   18 o  238.951   16.994   44.695   6.1748   40.811   7.3666   53.872   11.323  226.759   21.480  257.138   29.292 -30.37907 36.32392 
1 1 1   13   34   19 o  193.374   20.171   29.655   5.8825   33.256   6.9468   20.527   11.059  204.010   22.628  152.016   44.613 51.99438 50.02341 
1 1 1   13   34   20 o  236.273   17.462   43.806   6.2702   42.970   7.3404   46.060   12.060  232.798   20.820  234.289   34.677 -1.490784 40.44659 
1 1 1   13   34   21 o  328.722   14.269   83.842   7.1792   82.060   8.4888   88.318   13.454  323.789   17.190  330.809   26.801 -7.020874 31.84034 
1 1 1   13   34   22 o  140.209   29.302   16.455   6.0859   13.105   7.0377   26.390   12.118  123.693   35.385  170.598   45.552 -46.90517 57.68147 
1 1 1   13   34   23 o  195.907   25.273   31.148   7.4017   31.148   7.4017   0.0000   0.0000  195.907   25.273  ?   ?  0.000000 25.27310 
1 1 1   13   34   24 o  163.216   30.076   22.307   7.2368   22.307   7.2368   0.0000   0.0000  163.216   30.076  ?   ?  0.000000 30.07603 
1 1 1   13   34   25 o  313.513   15.272   76.568   7.3284   70.047   8.5067   95.339   14.432  298.004   18.745  342.025   27.809 -44.02069 33.53701 
1 1 1   13   34   26 f  206.271   21.674   34.112   6.7407   26.639   7.6172   61.091   14.473  178.916   28.792  267.090   36.346 -88.17444 46.36826 
1 1 1   13   34   27 o   83.580   33.313   3.7534   6.4090   5.2267   7.2718  -1.3732   13.565   91.650   35.805   97.849   43.847 -6.198753 56.60895 
1 1 1   13   34   28 o  160.494   29.072   21.685   6.8788   17.386   7.8928   35.265   14.028  140.178   36.446  192.910   47.762 -52.73262 60.07977 
1 1 1   13   34   29 f   94.755   33.015   7.1418   5.8771   14.727   8.1607  -1.0310   8.4708  128.327   38.489   78.997   35.072 49.33080 52.07197 
1 1 1   13   34   30 o  171.126   22.885   23.906   5.8441   26.545   8.3408   21.362   8.1910  175.478   32.242  155.350   35.255 20.12772 47.77501 
1 1 1   13   34   31 o  299.428   14.361   70.096   6.5817   65.134   9.2356   75.215   9.3819  284.329   21.378  306.507   20.109 -22.17874 29.34953 
1 1 1   13   34   32 o  164.225   24.743   22.409   6.0267   13.722   8.5341   31.051   8.5119  122.637   39.775  190.456   30.207 -67.81906 49.94460 
1 1 1   13   34   33 o  185.968   32.544   30.253   8.9262   0.0000   0.0000   30.253   8.9262  ?   ?   185.968   32.544 0.000000 32.54434 
1 1 1   13   34   34 o  168.551   27.678   24.214   6.8927   28.734   11.897   21.930   8.4565  170.599   44.937  154.763   36.322 15.83620 57.78125 
1 1 1   13   34   35 o   74.934   31.562   2.0073   6.1725   11.921   8.9637  -6.9327   8.5122  114.067   40.682   66.797   31.576 47.27046 51.49852 
1 1 1   13   34   36 o   94.565   33.644   7.6034   6.1269   8.2215   9.3824   7.1439   8.0899  101.795   40.391   96.222   37.718 5.573387 55.26333 
1 1 1   13   34   37 o  112.679   33.069   11.746   6.0764   8.3000   9.3012   14.312   8.0257  100.942   40.164  121.317   38.491 -20.37440 55.63021 
1 1 1   13   34   38 o   85.811   32.543   5.8228   5.8830   17.166   9.3029  -1.7363   7.5943  129.344   41.483   70.504   32.081 58.83987 52.44125 
1 1 1   13   34   39 o  224.251   22.169   42.125   7.5098   37.111   9.5173   50.399   12.225  201.601   31.905  230.863   35.751 -29.26207 47.91722 
1 1 1   13   35    0 o  231.770   24.665   43.124   8.5007   43.124   8.5007   43.124   8.5007  231.770   24.665  231.770   24.665 0.000000 0.000000 
1 1 1   13   35    1 o   59.713   27.173  -2.9815   5.4495  -2.4084   7.6566  -3.5698   7.7579   73.906   33.042   71.968   32.622 1.937782 46.43277 
1 1 1   13   35    2 o  359.096   13.816   99.702   7.5938   97.881   10.700  101.551   10.779  353.365   19.863  360.046   19.633 -6.681030 27.92878 
1 1 1   13   35    3 o  476.854   12.242  175.434   8.9353  182.491   12.766  168.656   12.511  484.452   17.216  465.579   17.556 18.87198 24.58854 
1 1 1   13   35    4 o  435.890   10.561  146.290   7.0463  144.418   8.7522  149.738   11.879  432.353   13.225  438.620   17.694 -6.266571 22.09058 
1 1 1   13   35    5 f  319.931   12.222   78.973   5.9853   84.989   7.6495   69.476   9.6114  331.191   15.090  296.942   21.288 34.24881 26.09386 
1 1 1   13   35    6 o  359.734   11.284   99.731   6.2131   95.866   7.6379  107.292   10.682  351.987   14.177  370.350   18.907 -18.36252 23.63203 
1 1 1   13   35    7 o  443.781   10.481  151.639   7.1194  151.387   8.8891  152.091   11.890  442.653   13.120  442.026   17.574 0.6269836 21.93098 
1 1 1   13   35    8 o  139.923   24.262   15.876   5.0079   19.554   6.2469   9.2629   8.3776  154.594   27.403  110.562   39.341 44.03185 47.94397 
1 1 1   13   35    9 o  149.195   22.861   17.904   5.0542   20.915   6.3472   12.687   8.3553  160.165   26.840  123.391   39.287 36.77434 47.57986 
1 1 1   13   35   10 o  305.885   16.404   72.915   7.6525   75.980   11.700   70.625   10.116  308.688   24.977  298.779   22.281 9.908722 33.47108 
1 1 1   13   35   11 o  230.904   20.262   42.078   7.0888   39.585   10.484   44.178   9.6218  218.971   32.245  233.802   27.407 -14.83095 42.31846 
1 1 1   13   35   12 o   66.670   30.129  -2.8624   6.5602  -5.3157   9.6309  -0.7388   8.9604   77.754   35.662   83.612   36.635 -5.858109 51.12669 
1 1 1   13   35   13 o  108.791   35.211   9.6352   6.6908   5.1425   9.8676   13.459   9.1030  101.464   41.023  126.583   41.081 -25.11897 58.05590 
1 1 1   13   35   14 o  275.336   14.702   58.949   6.1735   62.796   7.6307   51.660   10.503  283.217   17.691  252.674   27.608 30.54291 32.78962 
1 1 1   13   35   15 o  241.367   16.492   45.547   6.0565   39.763   7.2342   59.105   11.075  223.814   21.377  270.559   27.107 -46.74457 34.52183 
1 1 1   13   35   16 o  269.488   15.431   56.607   6.3384   56.416   7.6210   57.034   11.416  267.901   18.702  264.807   28.621 3.093719 34.18998 
1 1 1   13   35   17 o  187.245   21.873   28.013   6.1507   23.802   7.3061   38.258   11.396  169.646   29.189  212.279   36.383 -42.63283 46.64524 
1 1 1   13   35   18 o   79.905   33.197   2.0143   6.6885   3.4475   8.5385  -0.2616   10.760   91.717   37.750   91.521   40.122 0.1954346 55.08962 
1 1 1   13   35   19 o  117.900   35.482   11.792   6.9265   11.821   8.8400   11.746   11.148  119.449   40.532  122.439   45.130 -2.989670 60.65910 
1 1 1   13   35   20 o  390.845   12.917  118.290   7.7274  118.004   9.2267  118.963   14.142  389.381   15.481  385.771   24.070 3.609924 28.61876 
1 1 1   13   35   21 o  102.179   36.807   7.9203   7.3546   7.9203   7.3546   0.0000   0.0000  102.179   36.807  ?   ?  0.000000 36.80666 
1 1 1   13   35   23 o  464.206   12.236  166.838   8.6944  167.242   10.447  165.926   15.683  463.575   14.723  456.767   22.431 6.808014 26.83135 
1 1 1   13   35   24 o   59.837   27.784  -4.5221   6.1090  -3.8264   7.1005  -6.5043   11.985   66.934   30.671   84.555   39.140 -17.62080 49.72559 
1 1 1   13   35   25 o  110.525   34.968   10.389   6.6274   10.114   7.6287   11.237   13.381  110.287   37.652  122.735   48.383 -12.44838 61.30695 
1 1 1   13   35   26 o  232.990   20.931   43.458   7.3849   44.089   8.5747   41.646   14.532  232.881   24.419  211.380   46.203 21.50085 52.25931 
1 1 1   13   35   27 o  157.661   28.971   21.007   6.7335   16.946   7.7507   33.505   13.597  138.060   36.224  187.260   47.395 -49.20049 59.65327 
1 1 1   13   35   28 o  164.535   28.855   22.904   7.0020   18.315   8.1009   36.460   13.923  142.851   36.817  194.882   47.181 -52.03119 59.84655 
1 1 1   13   35   29 o   90.593   35.206   5.4995   7.0016   13.686   8.3017 -14.6727   13.031  123.076   39.158   76.947   37.095 46.12947 53.93880 
1 1 1   13   35   30 o  173.422   34.312   26.574   8.7853   24.282   11.372   29.966   13.837  158.403   44.864  172.210   49.720 -13.80685 66.96902 
1 1 1   13   35   31 o  141.171   37.092   18.257   8.1192   0.0000   0.0000   18.257   8.1192  ?   ?   141.171   37.092 0.000000 37.09208 
1 1 1   13   35   32 o   60.474   28.572  -6.2544   6.9527   6.6286   13.559 -10.8499   8.0983  108.247   46.233   59.726   28.903 48.52127 54.52387 
1 1 1   13   35   33 o  202.473   20.869   33.430   6.3750   52.395   9.1624   15.633   8.8756  251.463   24.100  127.914   40.466 123.5485 47.09928 
1 1 1   13   35   34 o   70.235   30.067   1.1623   5.7585   4.9553   8.3148  -2.3339   7.9828   90.468   37.246   72.021   32.818 18.44739 49.64166 
1 1 1   13   35   35 o  109.559   32.621   10.995   5.8778   17.844   8.5720   4.9175   8.0751  134.987   39.181   89.048   36.689 45.93906 53.67701 
1 1 1   13   35   36 o   76.832   31.403   3.3337   5.8574  -2.8799   8.6537   8.5874   7.9572   72.904   33.573   99.517   37.822 -26.61246 50.57324 
1 1 1   13   35   37 o  105.853   33.083   10.466   5.9502   19.746   9.0345   3.3576   7.9074  139.338   40.161   83.193   35.413 56.14570 53.54416 
1 1 1   13   35   38 o   93.198   35.064   7.5304   6.7973   5.0292   8.5731   11.764   11.154   88.837   37.296  109.923   43.905 -21.08642 57.60789 
1 1 1   13   36    0 o   50.763   34.191  -2.8809   7.6352  -2.8809   7.6352  -2.8809   7.6352   50.763   34.191   50.763   34.191 0.000000 0.000000 
1 1 1   13   36    1 o  647.537   11.560  323.389   11.457  317.641   16.084  329.311   16.325  639.245   16.438  650.915   16.386 -11.66943 23.20993 
1 1 1   13   36    2 f  363.939   13.593  102.457   7.5718  102.210   10.982  102.680   10.454  360.775   19.965  362.070   18.929 -1.294617 27.51170 
1 1 1   13   36    3 o  215.103   19.257   36.445   6.2732   26.164   8.9145   46.531   8.8294  176.450   34.242  241.392   24.223 -64.94218 41.94377 
1 1 1   13   36    4 o  468.789   10.414  169.258   7.4725  172.246   9.4040  164.138   12.308  472.072   13.015  458.997   17.519 13.07440 21.82448 
1 1 1   13   36    5 o  147.534   22.518   17.509   4.9238   17.900   6.2252   16.856   8.0470  147.185   28.664  140.303   36.957 6.881317 46.76990 
1 1 1   13   36    6 o  220.932   16.182   38.130   5.4340   38.517   6.7402   37.411   9.1849  220.836   20.163  214.290   28.726 6.546158 35.09590 
1 1 1   13   36    7 o  252.114   14.089   49.371   5.4151   51.777   6.7219   44.922   9.1397  257.301   17.167  236.431   25.668 20.87006 30.87928 
1 1 1   13   36    8 o   98.102   29.538   7.8703   4.7993   5.6961   5.9511   11.915   8.1167   90.366   33.024  119.797   38.783 -29.43111 50.93829 
1 1 1   13   36    9 o  289.152   13.468   64.700   5.9608   63.708   7.4869   66.418   9.8514  285.443   17.217  289.372   22.417 -3.929840 28.26518 
1 1 1   13   36   10 o  151.437   30.123   19.099   6.7366   31.444   10.409   10.202   8.8367  192.250   36.713  114.238   40.430 78.01210 54.61181 
1 1 1   13   36   11 o  198.328   23.469   31.534   6.9861   33.957   10.471   29.590   9.3790  200.520   35.410  187.607   33.910 12.91321 49.02771 
1 1 1   13   36   12 o  175.479   27.080   25.161   7.0394   23.783   10.132   26.447   9.7877  164.842   40.457  175.335   37.599 -10.49249 55.23056 
1 1 1   13   36   13 o  580.357   13.447  260.816   11.945  258.066   17.450  263.242   16.386  573.327   19.885  580.062   18.456 -6.735107 27.12955 
1 1 1   13   36   14 o  236.428   17.429   43.864   6.2629   42.042   7.6441   47.585   10.923  229.765   22.005  240.565   30.341 -10.80003 37.48045 
1 1 1   13   36   15 o  241.519   17.036   45.731   6.2574   43.114   7.5387   51.528   11.220  232.878   21.388  250.592   29.837 -17.71425 36.71154 
1 1 1   13   36   16 o  221.238   19.095   38.665   6.4029   38.436   7.5608   39.246   12.039  219.113   22.882  213.568   38.233 5.544693 44.55697 
1 1 1   13   36   17 o  350.321   13.672   95.164   7.3309   91.978   8.6706  103.151   13.728  343.387   16.497  358.416   25.184 -15.02924 30.10574 
1 1 1   13   36   18 o  108.516   33.320   9.8646   6.0662   10.779   7.2742   7.7768   10.992  113.495   36.712  110.561   43.766 2.933723 57.12503 
1 1 1   13   36   19 f  118.197   41.272   11.501   9.1870   11.501   9.1870   0.0000   0.0000  118.197   41.272  ?   ?  0.000000 41.27203 
1 1 1   13   36   20 o   70.409   33.110  -7.8973   9.1392  -7.8973   9.1392   0.0000   0.0000   70.409   33.110  ?   ?  0.000000 33.10981 
1 1 1   13   36   21 o  176.490   25.481   25.496   6.6841   17.700   7.8515   46.023   12.740  142.279   36.019  230.757   37.345 -88.47784 51.88456 
1 1 1   13   36   22 o  132.787   32.408   15.186   6.5289   13.956   7.5910   18.682   12.798  126.249   36.936  142.810   48.767 -16.56025 61.17573 
1 1 1   13   36   23 o   85.862   33.632   4.4188   6.4286   2.1404   7.4586   11.002   12.678   82.749   34.766  120.725   47.246 -37.97562 58.65921 
1 1 1   13   36   24 o  185.890   24.673   28.292   6.8468   30.680   8.0596   22.098   12.978  191.817   28.301  152.026   49.023 39.79095 56.60575 
1 1 1   13   36   25 o   74.560   32.332   0.2994   6.8267  -3.7707   7.9500   11.727   13.321   70.935   32.485  122.407   48.267 -51.47189 58.18079 
1 1 1   13   36   26 o  146.258   32.023   18.595   6.9702   31.991   8.2636 -14.4374   12.976  195.173   28.502   77.260   37.188 117.9133 46.85444 
1 1 1   13   36   27 o  224.155   26.514   41.701   8.9207   40.592   11.591   43.312   13.972  213.926   36.720  214.970   43.947 -1.043274 57.26827 
1 1 1   13   36   28 o  230.887   25.490   44.080   8.8581   41.477   11.303   48.225   14.261  216.926   35.251  227.811   42.462 -10.88564 55.18727 
1 1 1   13   36   29 o  392.273   17.708  121.946   10.633  118.492   13.926  126.774   16.463  380.629   24.027  389.589   27.791 -8.960205 36.73731 
1 1 1   13   36   30 o  132.566   41.505   16.722   9.3605   26.550   13.233   6.8808   13.242  160.480   49.203  108.171   45.931 52.30917 67.31004 
1 1 1   13   36   31 o  454.565   13.563  161.888   9.4368  165.802   11.492  153.785   16.535  457.576   16.408  430.417   25.209 27.15970 30.07855 
1 1 1   13   36   32 o  144.250   28.573   18.169   6.0855   13.969   8.4744   22.641   8.7444  120.989   39.655  155.163   37.283 -34.17361 54.42958 
1 1 1   13   36   33 o  202.719   20.741   33.738   6.3451   33.028   9.1555   34.395   8.8017  191.870   32.324  197.805   30.014 -5.934708 44.10934 
1 1 1   13   36   34 o   76.914   31.136   3.4940   5.6920  -3.5585   8.4616   9.3231   7.6927   71.066   32.893  102.028   37.507 -30.96233 49.88694 
1 1 1   13   36   35 o  179.507   22.519   27.054   6.0511   37.648   8.9949   18.296   8.1785  206.271   29.314  136.310   37.852 69.96092 47.87600 
1 1 1   13   36   36 o   78.795   32.886   3.3178   6.6070   5.6073   8.0380  -1.4513   11.601   89.465   36.702   84.397   38.868 5.068222 53.45816 
1 1 1   13   37    0 o   71.196   42.313   4.8234   8.0504   4.8234   8.0504   4.8234   8.0504   71.196   42.313   71.196   42.313 0.000000 0.000000 
1 1 1   13   37    1 o  162.523   24.492   21.386   5.9035   16.903   8.2146   26.174   8.4899  140.013   37.555  176.820   32.569 -36.80739 49.71051 
1 1 1   13   37    2 o  321.049   14.719   79.962   7.2330   84.093   10.074   75.566   10.392  326.703   20.245  308.768   22.135 17.93491 29.99684 
1 1 1   13   37    3 o  417.700   12.973  134.951   8.2940  142.021   11.625  127.621   11.836  426.518   17.807  403.693   19.156 22.82474 26.15420 
1 1 1   13   37    4 o  309.602   12.690   74.110   6.0138   75.880   7.5131   70.954   10.033  312.034   15.782  299.148   22.067 12.88562 27.13005 
1 1 1   13   37    5 o  324.647   12.744   81.500   6.3326   78.344   7.7112   88.036   11.098  317.001   15.943  333.450   21.865 -16.44907 27.06053 
1 1 1   13   37    6 o  135.042   24.895   14.919   4.9561   15.082   6.1453   14.616   8.3825  133.961   30.636  130.403   38.986 3.558121 49.58296 
1 1 1   13   37    7 o  231.149   16.263   41.787   5.7171   35.926   6.8284   55.528   10.456  212.595   21.270  262.351   26.396 -49.75572 33.89880 
1 1 1   13   37    8 o  344.086   12.276   91.505   6.4652   93.721   7.9418   87.151   11.132  347.412   14.935  331.543   22.063 15.86923 26.64237 
1 1 1   13   37    9 o  129.386   26.681   13.853   5.1084   14.217   6.2904   13.148   8.7544  129.559   31.927  124.576   40.272 4.983505 51.39236 
1 1 1   13   37   10 o  531.259   13.336  218.581   10.844  212.231   15.839  224.184   14.878  519.727   19.910  535.332   18.157 -15.60522 26.94636 
1 1 1   13   37   11 o  553.543   13.618  237.465   11.538  252.325   17.392  225.784   15.420  566.478   20.059  536.751   18.769 29.72742 27.47074 
1 1 1   13   37   12 o  391.231   15.789  119.160   9.4551  104.092   13.314  134.492   13.430  360.818   24.248  412.252   21.356 -51.43423 32.31200 
1 1 1   13   37   13 o  383.116   16.108  114.380   9.4461  105.410   13.490  123.009   13.231  362.874   24.430  393.690   22.046 -30.81589 32.90660 
1 1 1   13   37   14 o   76.080   33.286  -0.5226   7.3731   0.3980   11.059  -1.2593   9.8927   93.631   40.870   85.773   38.000 7.858383 55.80658 
1 1 1   13   37   15 o   92.105   32.513   6.4095   5.7112  -0.1199   6.8344   21.524   10.398   74.333   32.292  154.906   42.550 -80.57306 53.41647 
1 1 1   13   37   16 o  290.719   15.509   66.032   6.8764   69.296   8.1650   58.069   12.753  296.771   18.061  263.816   32.254 32.95465 36.96652 
1 1 1   13   37   17 o  561.898   13.624  245.109   11.717  245.109   11.717   0.0000   0.0000  561.898   13.624  ?   ?  0.000000 13.62405 
1 1 1   13   37   18 o   86.530   34.796   3.8275   7.0583   3.8275   7.0583   0.0000   0.0000   86.530   34.796  ?   ?  0.000000 34.79649 
1 1 1   13   37   19 f  412.100   12.897  131.754   8.1351  131.829   9.6778  131.574   15.019  411.043   15.382  404.205   24.389 6.837830 28.83486 
1 1 1   13   37   20 o  343.028   15.044   91.800   7.8989   89.754   9.4166   96.657   14.509  337.191   18.314  343.246   27.857 -6.055481 33.33779 
1 1 1   13   37   21 o  225.240   25.167   41.427   8.5282   43.877   10.958   37.665   13.581  227.428   32.394  201.461   45.159 25.96687 55.57655 
1 1 1   13   37   22 o  300.558   20.746   72.190   9.4857   67.255   12.342   79.311   14.826  284.647   28.721  306.435   32.086 -21.78854 43.06288 
1 1 1   13   37   23 o  235.776   20.869   44.642   7.4537   50.506   8.8857   30.719   13.692  249.324   23.563  177.236   48.885 72.08804 54.26776 
1 1 1   13   37   24 o  136.543   38.145   16.935   8.2795   9.4963   10.580   28.687   13.298  111.372   43.279  170.691   48.575 -59.31929 65.05813 
1 1 1   13   37   25 o  174.878   32.566   26.585   8.3962   25.054   10.882   28.837   13.199  162.726   43.031  170.682   48.332 -7.956146 64.71199 
1 1 1   13   37   26 o  275.217   18.908   60.477   7.9167   57.674   9.4068   67.283   14.658  265.879   23.351  276.861   35.399 -10.98184 42.40705 
1 1 1   13   37   27 o  234.868   21.183   44.682   7.5334   50.873   8.9811   29.985   13.837  248.928   23.864  171.170   49.808 77.75771 55.23012 
1 1 1   13   37   28 o  231.934   28.133   45.565   9.7828   48.366   13.759   42.700   13.913  227.612   41.000  209.975   44.662 17.63683 60.62738 
1 1 1   13   37   29 o  108.604   35.770   10.610   6.8920   8.3550   8.2678   15.746   12.477  101.440   38.553  127.072   47.565 -25.63205 61.22698 
1 1 1   13   37   30 f  201.474   23.510   33.791   7.1138   35.144   8.7298   31.115   12.273  201.361   29.174  174.835   45.444 26.52542 54.00289 
1 1 1   13   37   31 o   56.420   26.455  -4.4367   5.7629   3.0118   8.2540 -11.5211   8.0497   84.671   36.115   57.930   28.214 26.74039 45.82916 
1 1 1   13   37   32 o  232.764   20.535   44.473   7.2412   52.433   9.2317   31.745   11.674  249.413   24.498  176.402   43.508 73.01082 49.93098 
1 1 1   13   37   33 o  160.635   29.051   22.914   6.8800   28.069   9.0432   15.830   10.601  172.660   35.407  123.326   44.214 49.33391 56.64403 
1 1 1   13   37   34 o  164.635   24.348   23.187   5.9506   18.416   8.8010   27.206   8.0764  134.656   39.877  172.635   31.734 -37.97925 50.96283 
1 1 1   13   38    0 o  488.227   17.886  185.126   13.325  185.126   13.325  185.126   13.325  488.227   17.886  488.227   17.886 0.000000 0.000000 
1 1 1   13   38    1 o  152.138   28.464   19.197   6.3848   9.3815   8.8329   29.938   9.2397  110.898   40.278  188.647   33.212 -77.74902 52.20488 
1 1 1   13   38    2 o  188.081   23.012   28.414   6.4866   25.778   9.4255   30.785   8.9407  173.079   36.716  192.183   31.484 -19.10318 48.36677 
1 1 1   13   38    3 o  345.227   14.779   92.572   7.8096   97.222   10.906   87.678   11.189  350.929   20.391  332.303   22.124 18.62546 30.08754 
1 1 1   13   38    4 o  494.730   10.704  188.788   8.1054  202.122   10.254  166.585   13.233  510.907   13.113  461.026   18.752 49.88113 22.88197 
1 1 1   13   38    5 o  227.851   17.250   40.763   5.9713   40.200   7.4326   41.787   10.028  224.546   21.904  225.285   29.814 -0.7385712 36.99554 
1 1 1   13   38    6 o  139.884   26.289   16.135   5.4221   11.267   6.7107   25.289   9.2023  115.454   34.965  171.509   36.192 -56.05457 50.32259 
1 1 1   13   38    7 o  226.553   16.845   40.268   5.7996   35.571   7.1004   49.684   10.053  210.880   22.338  247.317   26.994 -36.43706 35.03819 
1 1 1   13   38    8 o  278.146   14.513   60.250   6.1572   62.242   7.4639   56.008   10.893  281.665   17.398  262.345   27.539 19.32043 32.57381 
1 1 1   13   38    9 o  214.747   17.667   36.313   5.7555   36.814   6.8937   35.162   10.457  214.915   21.234  203.486   34.826 11.42873 40.78887 
1 1 1   13   38   10 o  254.237   15.701   50.542   6.0799   55.504   7.4340   40.517   10.566  265.435   18.411  220.020   32.340 45.41475 37.21364 
1 1 1   13   38   11 o  223.014   23.232   39.966   7.8139   42.983   11.385   37.279   10.744  225.582   34.030  209.421   34.736 16.16130 48.62741 
1 1 1   13   38   12 o  166.339   29.955   23.168   7.3461   24.442   10.421   21.910   10.357  165.326   41.301  156.040   42.303 9.286331 59.12107 
1 1 1   13   38   13 o  311.363   18.313   76.367   8.6890   67.415   12.204   85.570   12.374  286.983   28.145  325.745   25.009 -38.76248 37.65073 
1 1 1   13   38   14 o  274.810   28.140   61.938   11.670   61.938   11.670   0.0000   0.0000  274.810   28.140  ?   ?  0.000000 28.14034 
1 1 1   13   38   15 o  115.793   44.447   10.014   11.057   10.014   11.057   0.0000   0.0000  115.793   44.447  ?   ?  0.000000 44.44653 
1 1 1   13   38   16 o  284.995   16.049   63.695   6.9726   58.541   8.1957   77.203   13.267  271.446   19.864  306.153   28.645 -34.70676 34.85848 
1 1 1   13   38   17 o  329.590   15.043   84.769   7.5891   83.793   8.9514   87.264   14.311  325.875   18.016  324.943   29.081 0.9314575 34.20952 
1 1 1   13   38   18 f  125.631   32.882   13.720   6.3966   13.518   7.3742   14.334   12.856  123.901   36.449  129.237   48.300 -5.335518 60.50980 
1 1 1   13   38   19 o  167.029   27.325   23.296   6.7444   19.529   7.8467   33.948   13.195  148.894   35.018  189.678   45.938 -40.78369 57.76262 
1 1 1   13   38   20 o  379.344   17.421  113.374   10.115  106.916   13.354  122.068   15.493  362.944   24.176  385.822   26.394 -22.87726 35.79276 
1 1 1   13   38   21 o  286.538   21.113   65.944   9.1946   60.686   12.025   73.345   14.267  268.751   29.730  293.408   32.303 -24.65692 43.90153 
1 1 1   13   38   22 o  336.628   19.351   90.342   9.9289   98.257   13.258   80.234   14.983  346.400   25.178  306.388   32.442 40.01227 41.06550 
1 1 1   13   38   23 o  364.894   17.740  105.328   9.9082  107.010   13.191  103.151   15.009  362.369   23.917  351.726   28.114 10.64349 36.91100 
1 1 1   13   38   24 o  129.839   34.300   15.105   6.9185   12.892   8.1411   20.856   13.126  119.341   38.856  144.497   49.388 -25.15601 62.84072 
1 1 1   13   38   25 o  193.821   24.414   31.124   7.0821   30.837   8.4188   31.821   13.098  189.376   30.047  178.520   47.212 10.85638 55.96246 
1 1 1   13   38   26 o  189.230   32.151   31.458   8.9791   52.347   13.681   15.651   11.901  238.656   38.785  127.466   46.682 111.1901 60.69174 
1 1 1   13   38   27 o  177.525   34.056   28.385   8.9172   41.213   13.015   17.035   12.242  206.560   42.580  130.353   47.407 76.20720 63.72174 
1 1 1   13   38   28 o  109.049   35.090   10.870   6.6522   11.477   8.1487   9.6563   11.518  111.464   38.873  109.084   44.245 2.379578 58.89547 
1 1 1   13   38   29 o  301.473   16.827   72.679   7.7338   86.823   9.9089   50.634   12.371  326.831   19.902  234.951   35.506 91.87991 40.70364 
1 1 1   13   38   30 o  112.805   34.661   11.921   6.5628   15.186   8.1730   5.9933   11.011  124.544   38.748   98.168   41.789 26.37587 56.98900 
1 1 1   13   38   31 o   78.056   30.941   4.0427   5.5007   5.5377   8.0202   2.7149   7.5585   89.936   36.751   80.806   34.516 9.129768 50.41825 
1 1 1   13   39    0 o  121.291   47.933   16.404   8.5623   16.404   8.5623   16.404   8.5623  121.291   47.933  121.291   47.933 0.000000 0.000000 
1 1 1   13   39    1 o  104.751   34.370   9.0113   6.3654   16.226   9.0125   1.8306   8.9915  135.657   40.394   88.760   37.773 46.89629 55.30338 
1 1 1   13   39    2 o  273.558   17.519   58.813   7.2968   73.853   10.860   46.437   9.8519  303.582   23.556  238.341   27.511 65.24086 36.21792 
1 1 1   13   39    3 o  108.987   31.332   10.034   5.5052   9.8163   6.7767   10.456   9.4410  108.711   35.453  114.921   41.656 -6.210403 54.70050 
1 1 1   13   39    4 o   53.453   25.071  -4.7941   5.1826  -9.3887   6.3167   4.6681   9.0650   52.891   25.579   96.331   39.185 -43.44026 46.79438 
1 1 1   13   39    5 o  524.590   10.948  212.540   8.7911  216.980   10.934  204.420   14.785  528.789   13.509  509.876   18.945 18.91248 23.26807 
1 1 1   13   39    6 o   68.314   28.839   0.8923   5.1722  -5.4567   6.3042   13.967   9.0466   59.296   27.760  126.772   40.934 -67.47581 49.45971 
1 1 1   13   39    7 o   90.663   31.363   6.3591   5.2992   5.7334   6.5256   7.5707   9.0804   91.416   34.364  104.684   40.256 -13.26800 52.92805 
1 1 1   13   39    8 o  237.285   16.600   44.230   5.9912   48.443   7.3252   35.717   10.413  247.190   19.519  204.573   34.480 42.61668 39.62149 
1 1 1   13   39    9 f  204.062   19.464   33.108   6.0057   33.371   7.3384   32.574   10.451  202.911   24.099  193.820   36.569 9.090454 43.79593 
1 1 1   13   39   10 o  221.470   22.197   39.392   7.4232   39.392   7.4232   0.0000   0.0000  221.470   22.197  ?   ?  0.000000 22.19684 
1 1 1   13   39   11 f   79.265   36.336  -4.5816   9.9796  -4.5816   9.9796   0.0000   0.0000   79.265   36.336  ?   ?  0.000000 36.33580 
1 1 1   13   39   12 o  287.197   28.225   67.923   12.247   67.923   12.247   0.0000   0.0000  287.197   28.225  ?   ?  0.000000 28.22522 
1 1 1   13   39   13 o  260.742   21.758   54.508   8.6044   58.851   11.912   49.768   12.443  265.927   29.775  240.940   34.744 24.98741 45.75699 
1 1 1   13   39   14 o  264.480   33.587   59.585   13.290   0.0000   0.0000   59.585   13.290  ?   ?   264.480   33.587 0.000000 33.58676 
1 1 1   13   39   15 o  305.589   29.659   77.824   13.698   0.0000   0.0000   77.824   13.698  ?   ?   305.589   29.659 0.000000 29.65864 
1 1 1   13   39   16 o  310.550   31.927   81.580   14.960   0.0000   0.0000   81.580   14.960  ?   ?   310.550   31.927 0.000000 31.92746 
1 1 1   13   39   17 o  346.039   18.676   95.017   9.8552   97.316   13.298   92.215   14.679  345.139   25.349  332.617   29.126 12.52203 38.61250 
1 1 1   13   39   18 f   64.171   29.288  -2.9893   6.3899  -0.6296   7.5240  -9.0954   12.103   75.288   33.258   80.167   37.822 -4.878708 50.36419 
1 1 1   13   39   19 o  226.793   20.609   41.380   7.0759   46.043   8.3005   28.978   13.536  237.885   23.087  170.762   49.140 67.12265 54.29294 
1 1 1   13   39   20 o  202.061   23.035   33.355   6.9968   32.528   8.1387   35.698   13.698  196.787   27.794  191.463   47.071 5.323456 54.66403 
1 1 1   13   39   21 o  200.253   23.082   32.845   6.9453   36.920   8.1470   22.004   13.287  210.800   25.787  147.917   49.694 62.88290 55.98604 
1 1 1   13   39   22 o   92.190   34.436   6.4593   6.5331   7.7870   7.6989   3.0437   12.348   99.495   37.340   98.958   43.192 0.5372620 57.09466 
1 1 1   13   39   23 o  248.814   19.463   49.839   7.3532   53.964   8.9755   41.420   12.823  256.422   23.117  209.645   41.431 46.77757 47.44346 
1 1 1   13   39   24 f  193.175   43.947   36.545   12.701   0.0000   0.0000   36.545   12.701  ?   ?   193.175   43.947 0.000000 43.94711 
1 1 1   13   39   25 o  247.773   34.876   55.312   12.861   0.0000   0.0000   55.312   12.861  ?   ?   247.773   34.876 0.000000 34.87582 
1 1 1   13   39   26 o  260.464   18.657   54.749   7.3888   62.210   9.3978   42.672   11.957  274.517   22.566  213.574   37.969 60.94247 44.16827 
1 1 1   13   39   27 o  136.296   32.295   16.960   6.6340   8.3600   8.1573   33.759   11.400   99.787   38.206  185.424   41.235 -85.63678 56.21426 
1 1 1   13   39   28 o  136.241   31.996   16.993   6.5585   24.278   8.2271   4.2936   10.863  161.779   34.289   94.123   40.801 67.65585 53.29593 
1 1 1   13   39   29 o  164.673   27.687   23.743   6.7310   28.775   8.5294   15.435   10.959  177.545   32.587  122.089   44.785 55.45625 55.38591 
1 1 1   13   40    0 o  223.935   31.844   42.098   10.277   42.098   10.277   42.098   10.277  223.935   31.844  223.935   31.844 0.000000 0.000000 
1 1 1   13   40    1 o  103.749   34.351   8.9151   6.3531   9.4041   9.2793   8.4836   8.7164  110.355   41.076  106.245   39.759 4.110435 57.16650 
1 1 1   13   40    2 o  318.979   15.850   79.528   7.7386   74.380   10.904   84.751   10.984  303.852   23.632  325.394   22.186 -21.54175 32.41432 
1 1 1   13   40    3 o  328.332   16.135   84.331   8.1087   90.681   11.908   78.841   11.072  335.845   23.310  313.083   23.271 22.76151 32.93766 
1 1 1   13   40    4 o  224.891   21.665   40.585   7.3654   32.206   10.297   49.364   10.540  192.295   36.315  244.150   28.755 -51.85501 46.32077 
1 1 1   13   40    5 o  204.169   22.791   33.685   7.0009   28.969   9.6873   38.842   10.129  182.252   36.004  214.377   31.835 -32.12555 48.05975 
1 1 1   13   40    6 o  163.577   39.838   24.094   9.8817   24.094   9.8817   0.0000   0.0000  163.577   39.838  ?   ?  0.000000 39.83784 
1 1 1   13   40    7 f  237.989   29.606   47.246   10.552   47.246   10.552   0.0000   0.0000  237.989   29.606  ?   ?  0.000000 29.60641 
1 1 1   13   40    8 o  131.814   40.240   15.623   8.8623   15.623   8.8623   0.0000   0.0000  131.814   40.240  ?   ?  0.000000 40.23968 
1 1 1   13   40    9 o  257.393   20.592   52.968   8.0448   52.677   10.657   53.354   12.266  252.175   28.087  250.499   32.777 1.675720 43.16526 
1 1 1   13   40   10 o  288.703   18.713   66.122   8.2248   72.356   11.166   58.728   12.160  298.262   24.681  264.385   30.616 33.87637 39.32578 
1 1 1   13   40   11 o   98.431   41.491   4.1025   10.679   0.0000   0.0000   4.1025   10.679  ?   ?    98.431   41.491 0.000000 41.49051 
1 1 1   13   40   12 o  371.392   17.614  108.722   10.013   99.480   13.968  118.492   14.362  348.212   26.403  381.734   24.712 -33.52170 36.16403 
1 1 1   13   40   13 o  119.261   38.695   12.594   8.0766   12.677   10.832   12.489   12.120  121.354   44.523  122.231   46.625 -0.8767242 64.46835 
1 1 1   13   40   14 o  161.461   33.964   22.875   8.1278   15.576   10.773   32.517   12.383  130.242   44.738  185.801   44.187 -55.55957 62.88036 
1 1 1   13   40   15 o  264.577   22.852   56.784   9.1635   60.535   12.424   52.310   13.570  267.180   30.953  242.673   37.761 24.50728 48.82604 
1 1 1   13   40   16 o  176.907   32.414   27.166   8.4534   28.376   11.392   25.684   12.610  173.367   43.113  161.441   47.712 11.92592 64.30551 
1 1 1   13   40   17 o  146.335   37.269   19.510   8.3703   16.809   10.957   23.294   12.971  133.229   45.126  152.574   48.988 -19.34514 66.60476 
1 1 1   13   40   18 o  117.001   34.675   12.241   6.6528   11.026   7.9674   15.040   12.091  111.927   38.471  127.353   46.990 -15.42568 60.72958 
1 1 1   13   40   19 o  209.491   21.675   35.760   6.8496   28.598   8.1065   53.637   12.807  182.113   30.136  246.147   34.977 -64.03363 46.16858 
1 1 1   13   40   20 o  185.063   25.219   28.657   6.9575   29.712   8.3698   26.296   12.516  184.941   30.640  160.464   47.562 24.47714 56.57680 
1 1 1   13   40   21 o   58.561   27.649  -5.7505   6.4899  -5.5932   7.8098  -6.1015   11.667   65.695   30.801   80.767   37.797 -15.07134 48.75764 
1 1 1   13   40   22 o  148.095   37.857   20.721   8.6143   28.762   12.228   12.800   12.137  167.523   46.195  118.287   46.245 49.23581 65.36489 
1 1 1   13   40   23 o   91.004   34.728   6.3915   6.7256   8.8171   8.3789   1.9981   11.277  102.274   38.825   91.875   40.644 10.39864 56.20768 
1 1 1   13   40   24 o   77.204   32.456   2.5156   6.5067   8.8003   8.2137  -8.0733   10.662  101.542   38.466   73.488   34.914 28.05450 51.94862 
1 1 1   13   40   25 o  158.101   34.152   23.103   8.0230   27.962   11.274   18.117   11.420  165.064   43.872  131.246   46.004 33.81737 63.56971 
1 1 1   13   40   26 o  142.135   35.644   19.179   7.7406   9.2986   10.774   29.722   11.129  105.385   42.775  171.107   42.644 -65.72197 60.40021 
1 1 1   13   41    1 o   77.162   34.934  -2.7209   8.8657  -2.7209   8.8657   0.0000   0.0000   77.162   34.934  ?   ?  0.000000 34.93407 
1 1 1   13   41    2 o  300.233   24.193   73.232   11.023   73.232   11.023   0.0000   0.0000  300.233   24.193  ?   ?  0.000000 24.19303 
1 1 1   13   41    3 o  232.716   22.369   43.774   7.8697   43.774   7.8697   0.0000   0.0000  232.716   22.369  ?   ?  0.000000 22.36908 
1 1 1   13   41    4 o  178.002   28.384   26.617   7.4736   26.617   7.4736   0.0000   0.0000  178.002   28.384  ?   ?  0.000000 28.38398 
1 1 1   13   41    5 o  286.103   15.488   64.280   6.7572   65.687   8.2913   61.495   11.660  287.430   18.953  271.844   28.445 15.58670 34.18066 
1 1 1   13   41    6 o   74.453   30.822   2.0749   5.7368   5.0661   6.9152  -4.5279   10.274   89.167   34.894   79.781   36.681 9.386124 50.62694 
1 1 1   13   41    7 o  127.123   29.042   13.853   5.5272   10.446   6.6165   21.722   10.055  109.840   34.959  152.879   41.779 -43.03878 54.47580 
1 1 1   13   41    8 o  137.049   28.670   16.024   5.8209   19.335   6.9904   8.5363   10.512  149.423   31.554  108.705   42.873 40.71779 53.23338 
1 1 1   13   41    9 o  310.025   14.710   75.171   6.9805   77.221   8.4243   70.681   12.469  312.279   17.697  291.251   28.328 21.02777 33.40215 
1 1 1   13   41   10 o  221.537   19.679   39.328   6.6035   36.382   7.8641   46.371   12.160  210.217   24.926  229.826   35.726 -19.60912 43.56257 
1 1 1   13   41   11 o  460.126   12.117  164.537   8.5338  157.516   10.111  181.926   15.912  448.574   14.726  475.733   21.852 -27.15967 26.35064 
1 1 1   13   41   12 o   87.219   36.364   3.3419   8.0665   11.303   11.143  -5.4248   11.693  116.592   44.650   83.236   38.575 33.35621 59.00577 
1 1 1   13   41   13 o  330.787   19.966   87.719   10.062   96.845   14.031   78.060   14.436  341.286   27.083  301.846   31.720 39.44031 41.70882 
1 1 1   13   41   14 o  104.105   38.806   8.7975   8.2876   11.849   11.490   5.4879   11.965  117.696   45.277  103.057   43.705 14.63952 62.92961 
1 1 1   13   41   15 o  102.690   38.341   8.5662   8.0969   2.6701   10.849   15.981   12.166   93.781   40.713  129.242   47.219 -35.46078 62.34741 
1 1 1   13   41   16 o  158.005   35.206   22.640   8.2966   9.1434   11.017   40.319   12.610  108.882   43.583  206.837   41.276 -97.95394 60.02672 
1 1 1   13   41   17 o  370.980   18.258  109.825   10.367  101.363   14.185  119.527   15.190  347.447   26.882  377.977   26.421 -30.52933 37.69268 
1 1 1   13   41   18 o   59.013   28.730 -12.0641   8.3244 -20.2820   11.699  -3.6376   11.847   65.344   32.261   84.754   39.120 -19.41026 50.70601 
1 1 1   13   41   19 o  149.763   38.220   21.291   8.7905   28.978   12.832   14.494   12.067  166.213   47.850  122.579   46.578 43.63410 66.77680 
1 1 1   13   41   20 o   84.576   36.355   2.5471   8.4813   11.115   12.588  -4.5769   11.478  113.735   46.210   81.515   37.928 32.21960 59.78171 
1 1 1   13   41   21 o  108.041   35.036   10.729   6.6221   14.656   8.1162   2.9091   11.453  123.296   38.655   93.617   41.209 29.67931 56.50116 
1 1 1   13   41   22 o  114.359   35.143   12.247   6.7465   20.303   8.3284  -3.1294   11.506  145.650   37.219   83.129   38.434 62.52078 53.50176 
1 1 1   13   41   23 o  183.887   25.168   28.794   6.8980   28.838   8.4463   28.705   11.953  178.720   32.054  164.854   45.755 13.86555 55.86556 
1 1 1   13   42    0 o  264.427   26.878   57.138   10.621   57.138   10.621   57.138   10.621  264.427   26.878  264.427   26.878 0.000000 0.000000 
1 1 1   13   42    1 o  100.573   34.071   8.5212   6.2463   17.101   9.3408   1.5811   8.4011  135.316   41.312   83.891   36.123 51.42442 54.87783 
1 1 1   13   42    2 o   87.026   31.558   5.7703   5.4194   9.1213   7.0321   0.8690   8.5045  103.973   36.120   82.572   35.947 21.40135 50.95909 
1 1 1   13   42    3 o   81.381   31.507   4.2816   5.5916   8.5789   6.9834  -3.3957   9.3340  101.699   35.947   77.244   35.310 24.45508 50.38786 
1 1 1   13   42    4 f  134.345   35.868   16.320   7.5141   10.136   11.252   21.298   10.095  113.297   44.460  149.853   42.211 -36.55551 61.30677 
1 1 1   13   42    5 o  210.584   26.295   36.965   8.2908   31.877   11.996   41.618   11.471  182.939   43.482  216.519   35.870 -33.57993 56.36731 
1 1 1   13   42    6 o   97.064   36.749   7.1462   7.4940   6.6455   11.601   7.5048   9.8172  105.015   43.682  103.244   41.205 1.771347 60.04979 
1 1 1   13   42    7 o  186.018   30.191   29.744   8.3014   38.738   12.075   21.684   11.431  205.018   39.916  148.425   45.767 56.59258 60.72824 
1 1 1   13   42    8 o   73.856   33.113  -1.4149   7.7473   1.3948   11.559  -3.7063   10.439   93.554   41.280   80.708   37.058 12.84644 55.47333 
1 1 1   13   42    9 o  182.386   31.475   28.975   8.4691   30.851   12.317   27.294   11.664  177.206   45.252  166.759   44.759 10.44704 63.64865 
1 1 1   13   42   10 o  361.317   17.657  103.698   9.7650  102.398   13.974  104.939   13.651  350.682   26.223  356.107   25.208 -5.425201 36.37449 
1 1 1   13   42   11 o  117.797   38.386   12.771   7.9450  -8.8064   10.943   36.828   11.554   74.763   35.477  199.075   39.314 -124.3118 52.95436 
1 1 1   13   42   12 o  126.988   38.124   15.107   8.0036   18.437   11.510   11.990   11.136  135.710   46.249  116.264   44.611 19.44648 64.25854 
1 1 1   13   42   13 o  112.022   38.650   11.412   8.0452   15.576   11.173   6.9298   11.594  126.462   45.387  103.834   43.469 22.62837 62.84523 
1 1 1   13   42   14 o   79.382   34.496   1.2295   7.8035  -0.4287   10.582   3.2065   11.554   85.810   38.569   95.582   41.747 -9.772179 56.83684 
1 1 1   13   42   15 o  220.633   26.064   41.124   8.6320   37.402   11.570   45.797   12.963  199.024   39.375  220.137   39.944 -21.11238 56.08836 
1 1 1   13   42   16 o   88.836   36.239   4.9120   7.7814  -0.8133   10.143   13.101   12.131   83.182   37.540  118.381   46.246 -35.19889 59.56472 
1 1 1   13   42   17 o  247.960   23.924   51.306   8.9674   66.399   12.449   35.030   12.928  276.153   29.932  184.579   45.941 91.57420 54.83113 
1 1 1   13   42   18 o  173.052   33.998   27.388   8.6842   23.256   12.147   31.708   12.420  147.212   47.423  174.704   45.863 -27.49236 65.97215 
1 1 1   13   42   19 o   82.283   33.097   4.3091   6.3875   8.3232   7.6992  -4.5543   11.441   98.914   37.297   80.804   37.687 18.10990 53.02232 
1 1 1   13   43    0 o   59.710   39.208   0.0875   9.0168   0.0875   9.0168   0.0875   9.0168   59.710   39.208   59.710   39.208 0.000000 0.000000 
1 1 1   13   43    1 o   56.581   26.984  -6.9653   6.4919  -1.6216   9.2466 -12.1598   9.1165   79.207   35.785   62.771   30.446 16.43626 46.98407 
1 1 1   13   43    2 o  220.429   19.496   39.247   6.5099   41.217   8.1529   35.783   10.813  222.794   24.302  197.715   37.093 25.07922 44.34533 
1 1 1   13   43    3 o  268.127   16.592   57.158   6.7761   64.340   8.6121   45.486   10.979  282.135   20.074  227.545   32.441 54.59004 38.14960 
1 1 1   13   43    4 o   78.472   31.791   3.3594   5.9392   7.6677   7.1899  -5.8954   10.538   97.285   36.168   76.963   35.987 20.32150 51.02108 
1 1 1   13   43    5 o  195.104   22.157   31.307   6.4995   24.700   8.1599   42.776   10.750  166.072   33.261  219.973   32.941 -53.90120 46.81218 
1 1 1   13   43    6 o  230.952   19.653   43.154   6.8813   47.899   8.5710   34.550   11.542  240.626   23.574  190.413   40.829 50.21336 47.14562 
1 1 1   13   43    7 o   54.603   26.692 -11.8582   7.3998 -23.0019   11.304  -3.5011   9.7888   61.594   30.635   77.641   35.737 -16.04685 47.07029 
1 1 1   13   43    8 o  380.547   17.389  115.357   10.129  100.986   14.610  128.656   14.055  344.770   27.925  395.189   23.339 -50.41827 36.39359 
1 1 1   13   43    9 o   99.794   36.938   8.3687   7.4830   14.315   11.351   3.7976   9.9519  121.904   45.419   92.293   39.518 29.61078 60.20446 
1 1 1   13   43   10 o  224.108   19.300   40.678   6.5558   40.509   8.1903   40.978   10.937  219.840   24.772  212.723   34.792 7.117050 42.71023 
1 1 1   13   43   11 o   71.438   30.395   1.4795   5.8203   3.8694   7.1068  -3.3882   10.143   83.671   34.440   78.702   36.281 4.968964 50.02403 
1 1 1   13   43   13 o  100.084   37.447   8.5292   7.7318   5.1717   11.013   11.793   10.858   97.258   41.606  113.407   43.905 -16.14883 60.48727 
1 1 1   13   43   14 o  275.054   21.163   62.044   8.8412   56.761   12.272   67.745   12.748  252.068   32.568  277.964   30.463 -25.89642 44.59476 
1 1 1   13   44    0 o  216.968   34.134   41.176   10.498   41.176   10.498   41.176   10.498  216.968   34.134  216.968   34.134 0.000000 0.000000 
1 1 1   13   44    1 o   83.817   33.079   4.7436   6.2615   5.8004   8.8098   3.6649   8.9012   93.905   38.462   88.574   37.635 5.330925 53.81226 
1 1 1   13   44    2 o  336.557   14.416   89.271   7.4262   90.703   9.3761   86.860   12.165  335.858   18.308  322.209   24.858 13.64969 30.87222 
1 1 1   13   44    3 o  175.005   23.782   25.681   6.2053   25.425   7.8786   26.098   10.071  168.748   31.666  163.725   40.428 5.022568 51.35323 
1 1 1   13   44    4 o  235.697   19.467   45.092   6.9601   41.681   8.5834   51.641   11.893  221.936   25.746  240.112   33.253 -18.17578 42.05504 
1 1 1   13   44    6 o  117.849   37.390   13.154   7.5732   14.306   11.574   12.292   10.014  120.818   45.688  114.405   42.655 6.413231 62.50444 
1 1 1   14    0    3 o  263.784   9.7033   53.486   3.9057   53.486   3.9057   53.486   3.9057  263.784   9.7033  263.784   9.7033 0.000000 0.000000 
1 1 1   14    0    4 o  197.919   10.984   30.268   3.3041   30.268   3.3041   30.268   3.3041  197.919   10.984  197.919   10.984 0.000000 0.000000 
1 1 1   14    0    5 o  1194.95   11.518  1093.60   21.062  1093.60   21.062  1093.60   21.062  1194.95   11.518  1194.95   11.518 0.000000 0.000000 
1 1 1   14    0    6 o  879.912   9.2617  592.912   12.471  592.912   12.471  592.912   12.471  879.912   9.2617  879.912   9.2617 0.000000 0.000000 
1 1 1   14    0    7 o  1329.50   12.583  1353.83   25.601  1353.83   25.601  1353.83   25.601  1329.50   12.583  1329.50   12.583 0.000000 0.000000 
1 1 1   14    0    8 f  789.723   8.7190  477.588   10.536  477.588   10.536  477.588   10.536  789.723   8.7190  789.723   8.7190 0.000000 0.000000 
1 1 1   14    0    9 o   60.062   21.582   3.6575   1.8154   3.6575   1.8154   3.6575   1.8154   60.062   21.582   60.062   21.582 0.000000 0.000000 
1 1 1   14    0   10 o  1275.84   8.6398  1246.21   16.870  1246.21   16.870  1246.21   16.870  1275.84   8.6398  1275.84   8.6398 0.000000 0.000000 
1 1 1   14    0   11 o  227.019   5.5965   39.518   1.9420   39.518   1.9420   39.518   1.9420  227.019   5.5965  227.019   5.5965 0.000000 0.000000 
1 1 1   14    0   12 o  1088.89   8.9980  907.811   14.995  907.811   14.995  907.811   14.995  1088.89   8.9980  1088.89   8.9980 0.000000 0.000000 
1 1 1   14    0   13 o  2174.81   15.915  3622.87   52.972  3622.87   52.972  3622.87   52.972  2174.81   15.915  2174.81   15.915 0.000000 0.000000 
1 1 1   14    0   14 o  1099.76   7.8195  925.925   13.161  925.925   13.161  925.925   13.161  1099.76   7.8195  1099.76   7.8195 0.000000 0.000000 
1 1 1   14    0   15 o  153.879   8.2176   18.280   1.9229   18.280   1.9229   18.280   1.9229  153.879   8.2176  153.879   8.2176 0.000000 0.000000 
1 1 1   14    0   16 o  230.436   9.9865   40.878   3.5073   40.878   3.5073   40.878   3.5073  230.436   9.9865  230.436   9.9865 0.000000 0.000000 
1 1 1   14    0   17 o  1031.30   7.6323  814.242   12.046  814.242   12.046  814.242   12.046  1031.30   7.6323  1031.30   7.6323 0.000000 0.000000 
1 1 1   14    0   18 o  1342.69   9.2247  1380.25   18.956  1380.25   18.956  1380.25   18.956  1342.69   9.2247  1342.69   9.2247 0.000000 0.000000 
1 1 1   14    0   19 o  574.774   8.6079  253.059   7.5691  253.059   7.5691  253.059   7.5691  574.774   8.6079  574.774   8.6079 0.000000 0.000000 
1 1 1   14    0   20 o  336.146   7.6433   86.626   3.9280   86.626   3.9280   86.626   3.9280  336.146   7.6433  336.146   7.6433 0.000000 0.000000 
1 1 1   14    0   21 o  348.322   7.0389   92.983   3.7493   92.983   3.7493   92.983   3.7493  348.322   7.0389  348.322   7.0389 0.000000 0.000000 
1 1 1   14    0   22 o   67.910   30.472   5.1172   3.3814   5.1172   3.3814   5.1172   3.3814   67.910   30.472   67.910   30.472 0.000000 0.000000 
1 1 1   14    0   23 o  645.265   6.7613  318.810   6.6762  318.810   6.6762  318.810   6.6762  645.265   6.7613  645.265   6.7613 0.000000 0.000000 
1 1 1   14    0   24 o  399.920   7.4566  122.555   4.5608  122.555   4.5608  122.555   4.5608  399.920   7.4566  399.920   7.4566 0.000000 0.000000 
1 1 1   14    0   25 o  107.103   23.626   9.9730   3.3880   9.9730   3.3880   9.9730   3.3880  107.103   23.626  107.103   23.626 0.000000 0.000000 
1 1 1   14    0   26 o  815.682   7.5071  509.446   9.3709  509.446   9.3709  509.446   9.3709  815.682   7.5071  815.682   7.5071 0.000000 0.000000 
1 1 1   14    0   27 o  361.597   9.8865  100.336   5.4627  100.336   5.4627  100.336   5.4627  361.597   9.8865  361.597   9.8865 0.000000 0.000000 
1 1 1   14    0   28 o  1257.15   10.654  1210.46   20.498  1210.46   20.498  1210.46   20.498  1257.15   10.654  1257.15   10.654 0.000000 0.000000 
1 1 1   14    0   29 o  303.467   11.669   70.843   5.4020   70.843   5.4020   70.843   5.4020  303.467   11.669  303.467   11.669 0.000000 0.000000 
1 1 1   14    0   30 o  123.416   24.891   13.016   4.1664   13.016   4.1664   13.016   4.1664  123.416   24.891  123.416   24.891 0.000000 0.000000 
1 1 1   14    0   31 o  258.098   11.712   51.341   4.6053   51.341   4.6053   51.341   4.6053  258.098   11.712  258.098   11.712 0.000000 0.000000 
1 1 1   14    0   32 o  264.012   11.400   53.693   4.5874   53.693   4.5874   53.693   4.5874  264.012   11.400  264.012   11.400 0.000000 0.000000 
1 1 1   14    0   33 o  720.744   9.0084  398.018   9.9345  398.018   9.9345  398.018   9.9345  720.744   9.0084  720.744   9.0084 0.000000 0.000000 
1 1 1   14    0   34 f  120.991   33.146   13.531   5.3073   13.531   5.3073   13.531   5.3073  120.991   33.146  120.991   33.146 0.000000 0.000000 
1 1 1   14    0   35 o   74.242   33.929   6.1950   4.1981   6.1950   4.1981   6.1950   4.1981   74.242   33.929   74.242   33.929 0.000000 0.000000 
1 1 1   14    0   36 o  386.978   9.3883  114.931   5.5535  114.931   5.5535  114.931   5.5535  386.978   9.3883  386.978   9.3883 0.000000 0.000000 
1 1 1   14    0   37 o  665.978   8.1014  339.889   8.2555  339.889   8.2555  339.889   8.2555  665.978   8.1014  665.978   8.1014 0.000000 0.000000 
1 1 1   14    0   38 o  520.667   9.8994  208.003   7.8828  208.003   7.8828  208.003   7.8828  520.667   9.8994  520.667   9.8994 0.000000 0.000000 
1 1 1   14    0   39 o  207.008   21.888   34.130   6.7580   34.130   6.7580   34.130   6.7580  207.008   21.888  207.008   21.888 0.000000 0.000000 
1 1 1   14    0   40 o  735.901   11.856  415.846   13.347  415.846   13.347  415.846   13.347  735.901   11.856  735.901   11.856 0.000000 0.000000 
1 1 1   14    0   41 o   33.228   23.308  -4.7337   4.5063  -4.7337   4.5063  -4.7337   4.5063   33.228   23.308   33.228   23.308 0.000000 0.000000 
1 1 1   14    0   42 o  607.944   8.2680  283.446   7.6905  283.446   7.6905  283.446   7.6905  607.944   8.2680  607.944   8.2680 0.000000 0.000000 
1 1 1   14    0   43 o  458.922   8.9629  161.686   6.2905  161.686   6.2905  161.686   6.2905  458.922   8.9629  458.922   8.9629 0.000000 0.000000 
1 1 1   14    0   44 o  643.333   8.3386  317.507   8.2079  317.507   8.2079  317.507   8.2079  643.333   8.3386  643.333   8.3386 0.000000 0.000000 
1 1 1   14    0   45 o   43.658   28.764  -0.7914   4.9145  -0.7914   4.9145  -0.7914   4.9145   43.658   28.764   43.658   28.764 0.000000 0.000000 
1 1 1   14    0   46 o   44.087   29.404  -1.5058   5.4014  -1.5058   5.4014  -1.5058   5.4014   44.087   29.404   44.087   29.404 0.000000 0.000000 
1 1 1   14    0   47 o  265.739   13.029   54.752   5.2705   54.752   5.2705   54.752   5.2705  265.739   13.029  265.739   13.029 0.000000 0.000000 
1 1 1   14    0   48 o  126.430   28.581   14.237   4.8242   14.237   4.8242   14.237   4.8242  126.430   28.581  126.430   28.581 0.000000 0.000000 
1 1 1   14    0   49 o   80.409   36.168   7.4603   4.7633   7.4603   4.7633   7.4603   4.7633   80.409   36.168   80.409   36.168 0.000000 0.000000 
1 1 1   14    0   50 o   61.397   34.887   4.0979   5.0950   4.0979   5.0950   4.0979   5.0950   61.397   34.887   61.397   34.887 0.000000 0.000000 
1 1 1   14    0   51 o  155.681   26.663   20.615   5.7941   20.615   5.7941   20.615   5.7941  155.681   26.663  155.681   26.663 0.000000 0.000000 
1 1 1   14    0   52 o   37.710   26.321  -4.9478   5.5451  -4.9478   5.5451  -4.9478   5.5451   37.710   26.321   37.710   26.321 0.000000 0.000000 
1 1 1   14    0   53 o   48.513   31.413   0.2403   5.5064   0.2403   5.5064   0.2403   5.5064   48.513   31.413   48.513   31.413 0.000000 0.000000 
1 1 1   14    0   54 o  182.014   20.967   26.955   5.6401   26.955   5.6401   26.955   5.6401  182.014   20.967  182.014   20.967 0.000000 0.000000 
1 1 1   14    0   55 o  201.014   18.769   32.399   5.6591   32.399   5.6591   32.399   5.6591  201.014   18.769  201.014   18.769 0.000000 0.000000 
1 1 1   14    0   56 o   67.102   37.866   5.3634   5.9475   5.3634   5.9475   5.3634   5.9475   67.102   37.866   67.102   37.866 0.000000 0.000000 
1 1 1   14    0   57 o   38.726   26.609  -3.0027   5.1310  -3.0027   5.1310  -3.0027   5.1310   38.726   26.609   38.726   26.609 0.000000 0.000000 
1 1 1   14    0   58 o   99.932   37.078   11.039   5.2678   11.039   5.2678   11.039   5.2678   99.932   37.078   99.932   37.078 0.000000 0.000000 
1 1 1   14    0   59 o   33.584   23.707  -5.1769   4.8952  -5.1769   4.8952  -5.1769   4.8952   33.584   23.707   33.584   23.707 0.000000 0.000000 
1 1 1   14    0   60 o  144.059   25.604   18.273   5.1141   18.273   5.1141   18.273   5.1141  144.059   25.604  144.059   25.604 0.000000 0.000000 
1 1 1   14    0   61 o   56.982   33.170   3.8927   4.7735   3.8927   4.7735   3.8927   4.7735   56.982   33.170   56.982   33.170 0.000000 0.000000 
1 1 1   14    1    0 o  192.002   9.5728   28.432   2.7973   28.432   2.7973   28.432   2.7973  192.002   9.5728  192.002   9.5728 0.000000 0.000000 
1 1 1   14    1    1 o  387.600   6.3843  115.010   3.7876  109.833   5.3569  120.186   5.3561  378.713   9.2413  396.171   8.8328 -17.45743 12.78356 
1 1 1   14    1    2 o  932.328   13.696  666.152   19.545  666.152   19.545   0.0000   0.0000  932.328   13.696  ?   ?  0.000000 13.69604 
1 1 1   14    1    3 o  906.716   13.432  630.012   18.642   0.0000   0.0000  630.012   18.642  ?   ?   906.716   13.432 0.000000 13.43208 
1 1 1   14    1    4 o  1219.06   11.773  1138.46   21.967  1126.57   30.641  1151.04   31.510  1212.10   16.516  1225.15   16.803 -13.05151 23.56080 
1 1 1   14    1    5 o  1156.37   7.9407  1023.82   14.055  1025.97   19.954  1021.69   19.800  1157.33   11.264  1154.91   11.200 2.414185 15.88520 
1 1 1   14    1    6 o  1041.46   7.3539  830.393   11.723  843.671   16.897  818.073   16.277  1049.55   10.518  1033.52   10.289 16.02856 14.71414 
1 1 1   14    1    7 o  588.724   4.7931  265.295   4.3192  270.294   6.9642  262.170   5.5060  594.175   7.6575  585.218   6.1468 8.957153 9.819381 
1 1 1   14    1    8 o  1099.47   6.8803  925.424   11.579  952.497   18.886  909.118   14.657  1115.17   11.064  1089.64   8.7878 25.53271 14.12953 
1 1 1   14    1    9 o  235.695   5.3254   42.522   1.9212   42.212   2.7771   42.807   2.6606  234.810   7.7269  236.465   7.3510 -1.655518 10.66498 
1 1 1   14    1   10 o  505.230   4.2273  195.373   3.2690  198.606   4.5921  192.051   4.6547  509.367   5.8900  500.888   6.0713 8.479523 8.458908 
1 1 1   14    1   11 o  1290.19   6.6227  1274.25   13.078  1287.25   17.471  1257.67   19.725  1296.62   8.8031  1281.56   10.056 15.06970 13.36448 
1 1 1   14    1   12 o  894.872   4.7920  612.940   6.5637  610.830   9.2426  615.086   9.3230  893.274   6.7599  896.380   6.7950 -3.105774 9.584807 
1 1 1   14    1   13 o  709.209   4.6002  384.980   4.9937  375.399   7.5300  392.503   6.6719  700.274   7.0252  716.073   6.0873 -15.79938 9.295629 
1 1 1   14    1   14 o  232.883   4.8394   41.512   1.7250   42.761   2.7245   40.676   2.2287  236.341   7.5315  230.516   6.3164 5.825531 9.829617 
1 1 1   14    1   15 o  848.079   5.0420  550.518   6.5450  546.706   8.6302  555.678   10.041  845.094   6.6719  851.966   7.7001 -6.871582 10.18848 
1 1 1   14    1   16 o  263.480   5.4823   53.138   2.2109   49.361   2.8279   59.077   3.5461  253.928   7.2758  277.784   8.3402 -23.85532 11.06783 
1 1 1   14    1   17 o  735.808   4.5303  414.399   5.1022  406.583   7.1240  422.630   7.3110  728.795   6.3863  743.037   6.4283 -14.24207 9.061286 
1 1 1   14    1   18 o  730.901   4.8692  408.898   5.4473  408.912   8.3353  408.889   7.1969  730.846   7.4512  730.855   6.4334 -0.8911133E-02 9.844264 
1 1 1   14    1   19 f  454.918   4.6137  158.403   3.2125  161.294   4.9588  156.312   4.2172  459.012   7.0581  451.885   6.0971 7.127380 9.326909 
1 1 1   14    1   20 o  212.040   6.5632   34.419   2.1301   36.960   2.9398   31.610   3.0907  219.706   8.7420  203.169   9.9387 16.53712 13.23633 
1 1 1   14    1   21 o  347.635   5.3735   92.506   2.8592   96.516   4.5306   89.851   3.6859  355.043   8.3369  342.588   7.0292 12.45523 10.90477 
1 1 1   14    1   22 o  191.430   8.0854   28.058   2.3691   27.132   3.1497   29.264   3.5950  187.888   11.000  195.071   12.100 -7.182892 16.35293 
1 1 1   14    1   23 o  565.499   4.7898  244.781   4.1459  248.040   5.9570  241.719   5.7736  569.202   6.8375  561.907   6.7129 7.295471 9.581953 
1 1 1   14    1   24 o  1160.75   6.0756  1031.43   10.794  1010.26   14.962  1054.41   15.588  1148.62   8.5105  1173.43   8.6787 -24.81519 12.15518 
1 1 1   14    1   25 o  130.561   12.281   13.177   2.4255   10.873   3.4804   15.353   3.3820  117.364   20.097  140.587   16.002 -23.22289 25.68957 
1 1 1   14    1   26 o  576.537   5.4892  254.454   4.8440  262.882   6.5973  244.595   7.1352  585.947   7.3560  565.165   8.2482 20.78217 11.05188 
1 1 1   14    1   27 o  894.692   5.8718  612.809   8.0410  607.984   12.325  616.385   10.610  890.967   9.0376  897.193   7.7262 -6.226318 11.89004 
1 1 1   14    1   28 o  554.253   6.2550  235.193   5.3065  246.475   7.8894  225.872   7.1709  567.268   9.0862  543.063   8.6269 24.20496 12.52926 
1 1 1   14    1   29 o  225.192   9.4973   38.848   3.2736   48.024   5.1787   32.741   4.2246  249.884   13.591  206.198   13.459 43.68591 19.12774 
1 1 1   14    1   30 o  539.168   5.5661  222.560   4.5935  216.221   6.5044  228.866   6.4880  531.331   7.9979  546.659   7.7539 -15.32825 11.13955 
1 1 1   14    1   31 o  948.380   5.7807  688.646   8.3913  684.700   11.862  692.600   11.872  945.448   8.1969  950.890   8.1570 -5.442444 11.56399 
1 1 1   14    1   32 o  717.050   5.8562  393.696   6.4274  390.813   9.7960  395.876   8.5169  714.174   8.9613  718.895   7.7401 -4.720886 11.84126 
1 1 1   14    1   33 o  301.317   7.9320   69.559   3.6583   67.236   4.9926   72.251   5.3759  296.098   11.016  306.917   11.443 -10.81940 15.88407 
1 1 1   14    1   34 o  354.637   8.2473   96.377   4.4768   99.592   6.4590   93.404   6.2105  360.266   11.713  348.900   11.629 11.36603 16.50575 
1 1 1   14    1   35 o  360.791   6.7322   99.719   3.7178  101.299   5.3103   98.200   5.2066  363.458   9.5455  357.860   9.5054 5.598785 13.47106 
1 1 1   14    1   36 o   42.265   19.778  -3.1686   3.1940  -7.8515   5.1934  -0.3198   4.0507   48.719   23.469   58.208   25.073 -9.489204 34.34378 
1 1 1   14    1   37 o  790.218   6.1330  478.384   7.4181  481.390   11.562  476.281   9.6711  792.124   9.5359  788.195   8.0162 3.929626 12.45768 
1 1 1   14    1   38 o  128.535   17.588   12.992   3.3695   20.327   5.5102   8.6114   4.2584  160.111   23.157  103.063   26.758 57.04749 35.38721 
1 1 1   14    1   39 o  168.285   12.764   21.914   3.2633   20.383   4.4557   23.686   4.7927  161.285   18.377  174.039   18.264 -12.75429 25.90896 
1 1 1   14    1   40 o  196.592   13.212   29.900   3.9524   32.684   4.9560   25.035   6.5511  205.102   15.911  177.268   24.825 27.83478 29.48640 
1 1 1   14    1   41 o  483.779   7.2068  179.494   5.3366  190.330   7.5817  168.854   7.5129  497.694   9.9525  468.673   10.473 29.02042 14.44765 
1 1 1   14    1   42 o  267.057   9.2410   54.791   3.7774   55.153   4.8382   54.225   6.0452  267.616   11.811  264.442   14.997 3.174866 19.08979 
1 1 1   14    1   43 o  399.507   6.6747  122.418   4.0815  132.105   5.8487  113.222   5.6985  414.599   9.2164  383.739   9.7019 30.85980 13.38170 
1 1 1   14    1   44 o  114.560   20.069   10.545   3.3908   10.381   5.2576   10.662   4.4368  111.790   30.070  113.803   26.035 -2.013695 39.77526 
1 1 1   14    1   45 o   67.737   25.937   2.6204   3.7595   13.133   6.1176  -3.7591   4.7656  124.877   31.892   53.059   24.603 71.81871 40.27922 
1 1 1   14    1   46 o  172.346   14.369   23.195   3.7560   19.889   4.7953   28.442   6.0414  157.882   20.315  188.898   21.265 -31.01599 29.40873 
1 1 1   14    1   47 f  172.375   13.042   23.138   3.4157   20.724   4.9335   25.360   4.7337  161.028   20.480  179.328   17.467 -18.30034 26.91706 
1 1 1   14    1   48 f   85.647   24.076   6.0306   3.2877   8.3713   4.6953   3.7790   4.6051  100.140   28.978   76.685   28.859 23.45507 40.89718 
1 1 1   14    1   49 o   62.555   24.389   2.0853   3.3686   3.1338   4.8028   1.0700   4.7260   74.606   29.112   66.278   27.751 8.328445 40.21968 
1 1 1   14    1   50 o   59.840   24.618   1.1672   3.6290   1.4121   5.0049   0.8957   5.2697   68.884   28.675   68.585   29.040 0.2991867 40.81178 
1 1 1   14    1   51 o   66.726   26.522   2.2239   4.0519  -0.9081   5.3332   6.5000   6.2315   63.358   27.993   92.823   33.813 -29.46505 43.89665 
1 1 1   14    1   52 o  154.207   17.700   18.987   4.1021   20.981   5.9285   17.156   5.6819  159.040   25.193  142.707   27.001 16.33321 36.92931 
1 1 1   14    1   53 o  215.595   12.664   36.300   4.1609   33.123   6.2628   38.810   5.5672  202.665   20.470  221.414   16.547 -18.74892 26.32104 
1 1 1   14    1   54 o  227.759   12.292   40.512   4.2692   45.069   6.6022   37.237   5.5967  237.441   18.307  216.339   17.040 21.10249 25.01027 
1 1 1   14    1   55 o   77.852   26.957   4.8008   3.9152   4.6802   5.9047   4.8954   5.2303   83.119   32.322   81.918   30.770 1.201096 44.62662 
1 1 1   14    1   56 o   56.315   25.324  -1.3446   4.5681  -3.2216   7.4865  -0.2312   5.7659   67.925   31.260   66.211   29.188 1.714462 42.76833 
1 1 1   14    1   57 o   56.364   24.457   0.1174   3.9113   6.9718   4.9671 -11.0691   6.3455   89.758   30.383   49.388   24.261 40.37015 38.88073 
1 1 1   14    1   58 o   58.829   24.122   1.5156   3.4700   1.5916   4.8111   1.4332   5.0095   66.137   27.862   66.543   28.253 -0.4059067 39.67972 
1 1 1   14    1   59 o  147.322   16.451   17.684   3.6463   10.326   5.0669   25.587   5.2514  105.115   30.009  175.178   19.941 -70.06303 36.02996 
1 1 1   14    1   60 o   61.444   24.636   2.2428   3.5266   1.3451   4.9634   3.1581   5.0118   64.682   27.808   71.082   29.050 -6.400490 40.21422 
1 1 1   14    1   61 o  140.450   16.613   16.309   3.5022   15.101   4.9852   17.487   4.9212  128.355   26.260  140.428   23.742 -12.07274 35.40108 
1 1 1   14    2    0 f  249.818   8.9821   47.961   3.4245   47.961   3.4245   47.961   3.4245  249.818   8.9821  249.818   8.9821 0.000000 0.000000 
1 1 1   14    2    1 o  373.384   6.3558  106.728   3.6324  109.927   5.3530  103.998   4.9453  378.877   9.2305  368.529   8.7670 10.34845 12.73041 
1 1 1   14    2    2 o  671.209   7.7294  344.940   7.9410  333.264   11.144  356.982   11.318  659.605   11.038  682.683   10.831 -23.07855 15.46495 
1 1 1   14    2    3 o  950.701   13.379  692.599   19.469   0.0000   0.0000  692.599   19.469  ?   ?   950.701   13.379 0.000000 13.37939 
1 1 1   14    2    5 o  669.034   5.6049  342.633   5.7396  348.229   11.853  340.919   6.5600  674.242   11.485  667.336   6.4223 6.906433 13.15895 
1 1 1   14    2    6 f  716.688   8.3880  393.282   9.2015   0.0000   0.0000  393.282   9.2015  ?   ?   716.688   8.3880 0.000000 8.387995 
1 1 1   14    2    7 o  753.597   5.3670  434.710   6.1907  447.228   10.135  427.259   7.8189  764.256   8.6638  747.068   6.8378 17.18823 11.03708 
1 1 1   14    2    8 o  230.289   4.7439   40.593   1.6721   41.744   2.8016   39.956   2.0840  233.504   7.8388  228.465   5.9596 5.038437 9.847004 
1 1 1   14    2    9 o  521.753   5.2016  208.373   4.1541  210.963   6.0294  206.033   5.7314  524.939   7.5040  518.776   7.2179 6.163086 10.41193 
1 1 1   14    2   10 o  257.567   5.1633   50.780   2.0356   42.771   2.5174   65.907   3.4599  236.371   6.9580  293.408   7.7042 -57.03632 10.38112 
1 1 1   14    2   11 o  895.877   5.0961  614.329   6.9881  635.095   10.964  600.119   9.0691  910.799   7.8643  885.408   6.6920 25.39136 10.32613 
1 1 1   14    2   12 o  278.082   4.1036   59.187   1.7467   58.588   2.6034   59.677   2.3554  276.655   6.1481  279.220   5.5113 -2.565033 8.256698 
1 1 1   14    2   13 o  928.567   5.2573  659.982   7.4721  656.875   11.306  662.390   9.9562  926.289   7.9746  930.206   6.9927 -3.917419 10.60622 
1 1 1   14    2   14 o  138.929   6.6361   14.775   1.4112   12.066   2.2099   16.640   1.8337  124.973   11.688  147.201   8.1707 -22.22716 14.26107 
1 1 1   14    2   15 o  912.939   5.7139  637.969   7.9844  644.602   11.537  631.871   11.061  917.587   8.2143  908.491   7.9547 9.096191 11.43470 
1 1 1   14    2   16 o  984.242   5.5415  741.510   8.3483  734.985   12.587  746.634   11.155  979.796   8.3932  987.573   7.3793 -7.777100 11.17589 
1 1 1   14    2   17 o  403.472   4.4380  124.599   2.7407  123.046   4.2400  125.713   3.5921  400.918   6.9094  405.257   5.7909 -4.338501 9.015192 
1 1 1   14    2   18 o  784.320   5.0038  470.857   6.0070  462.982   9.0729  477.004   8.0155  777.659   7.6223  789.380   6.6340 -11.71997 10.10492 
1 1 1   14    2   19 o  599.695   4.3827  275.265   4.0229  271.295   5.7054  279.190   5.6733  595.319   6.2613  603.922   6.1374 -8.603333 8.767649 
1 1 1   14    2   20 o  518.896   4.4114  206.088   3.5037  204.326   5.0296  207.750   4.8835  516.638   6.3603  520.954   6.1244 -4.316345 8.829598 
1 1 1   14    2   21 o  1336.92   7.5909  1368.41   15.534  1372.51   22.034  1364.36   21.902  1338.66   10.753  1334.69   10.721 3.976440 15.18483 
1 1 1   14    2   22 o  405.622   5.2132  125.940   3.2367  126.981   4.3477  124.646   4.8477  407.264   6.9745  403.483   7.8494 3.781036 10.50032 
1 1 1   14    2   23 o  1104.60   5.8606  934.033   9.9087  937.552   14.142  930.639   13.887  1106.54   8.3497  1102.46   8.2298 4.078735 11.72382 
1 1 1   14    2   24 o  488.835   4.9674  182.914   3.7167  187.520   5.4637  178.947   5.0708  494.899   7.2127  483.463   6.8524 11.43579 9.948834 
1 1 1   14    2   25 o  624.433   5.3759  298.480   5.1382  296.363   6.8756  301.158   7.7327  622.155   7.2201  627.135   8.0556 -4.979980 10.81768 
1 1 1   14    2   26 o  248.899   7.4353   47.435   2.8326   44.921   4.1005   49.729   3.9176  242.142   11.064  254.797   10.045 -12.65500 14.94356 
1 1 1   14    2   27 o  381.482   5.8501  111.410   3.4159  109.166   5.0473  113.308   4.6400  377.545   8.7341  384.666   7.8807 -7.121002 11.76394 
1 1 1   14    2   28 o  322.988   7.4350   79.883   3.6757   78.384   5.4107   81.167   5.0089  319.837   11.052  325.500   10.054 -5.662170 14.94088 
1 1 1   14    2   29 o  380.471   6.6299  110.838   3.8610  113.848   6.1913  108.923   4.9390  385.464   10.494  377.109   8.5566 8.354370 13.54011 
1 1 1   14    2   30 o  451.017   5.8365  155.741   4.0292  164.427   5.9570  148.416   5.4703  463.323   8.3999  440.199   8.1188 23.12396 11.68216 
1 1 1   14    2   31 o  939.107   6.1198  675.285   8.7968  677.504   13.605  673.691   11.532  940.323   9.4523  937.828   8.0335 2.495056 12.40499 
1 1 1   14    2   32 o  399.245   6.5672  122.068   4.0132  120.756   6.1570  123.037   5.2917  396.915   10.135  400.733   8.6273 -3.817871 13.30935 
1 1 1   14    2   33 o  852.208   6.1655  556.178   8.0423  539.290   10.557  579.537   12.415  838.956   8.2208  869.554   9.3280 -30.59772 12.43355 
1 1 1   14    2   34 o  301.400   9.3521   69.640   4.3144   66.071   6.4194   72.581   5.8266  293.242   14.302  307.502   12.379 -14.26062 18.91547 
1 1 1   14    2   35 o  560.648   6.1642  240.758   5.2897  247.167   8.5000  236.706   6.7578  567.705   9.7819  555.759   7.9442 11.94586 12.60145 
1 1 1   14    2   36 o  209.416   11.065   33.757   3.5341   36.692   5.9115   32.124   4.4087  217.385   17.926  203.887   14.216 13.49846 22.87869 
1 1 1   14    2   37 o  468.217   6.0855  167.948   4.3613  157.780   6.1784  178.046   6.1572  453.561   8.8996  481.874   8.3479 -28.31271 12.20208 
1 1 1   14    2   38 o  112.064   18.288   9.9528   3.0287   13.444   4.2447   6.3321   4.3228  129.836   22.154   90.138   28.202 39.69817 35.86335 
1 1 1   14    2   39 o  314.660   7.3577   75.912   3.5437   81.866   5.1674   70.626   4.8689  326.479   10.341  303.224   10.490 23.25558 14.73022 
1 1 1   14    2   40 o  277.741   8.9261   59.211   3.7946   55.972   5.3134   62.582   5.4211  269.610   12.876  285.147   12.421 -15.53726 17.89012 
1 1 1   14    2   41 o  201.610   10.713   31.340   3.2941   28.430   5.1567   33.347   4.2816  190.692   17.876  207.531   13.553 -16.83913 22.43317 
1 1 1   14    2   42 o  569.372   6.2886  248.545   5.4805  246.515   7.2484  251.255   8.3742  566.656   8.3570  571.800   9.5681 -5.143433 12.70391 
1 1 1   14    2   43 o  437.164   6.9673  146.615   4.6621  153.968   6.2347  137.290   7.0215  447.611   9.1001  422.304   10.863 25.30679 14.17068 
1 1 1   14    2   44 o   96.336   24.279   7.6101   3.5787   3.8408   4.8310   12.194   5.3274   78.574   29.561  121.140   29.097 -42.56567 41.47847 
1 1 1   14    2   45 o   92.544   26.506   7.0122   3.9465   3.2500   6.2274   9.5373   5.1019   82.120   32.804  107.089   29.953 -24.96977 44.42135 
1 1 1   14    2   46 o  155.530   15.390   18.977   3.6158   20.714   4.6886   16.429   5.6797  161.461   19.357  140.965   27.310 20.49583 33.47468 
1 1 1   14    2   47 o  278.842   8.7696   59.828   3.7429   59.154   5.3511   60.473   5.2373  276.465   12.645  279.630   12.236 -3.164459 17.59644 
1 1 1   14    2   48 o   95.918   24.372   7.6323   3.5854   6.5669   4.9257   8.8329   5.2289   90.938   30.253  102.790   30.805 -11.85237 43.17630 
1 1 1   14    2   49 o  225.764   11.642   39.537   4.0093   40.147   5.4182   38.799   5.9606  226.263   15.743  221.706   17.713 4.556351 23.69752 
1 1 1   14    2   50 o   64.539   25.115   2.2872   3.5671   3.5570   4.9096   0.8674   5.1913   76.633   29.564   68.055   28.820 8.577919 41.28730 
1 1 1   14    2   51 o  238.358   10.663   43.943   3.8904   37.810   5.5138   50.025   5.4901  218.896   16.580  252.900   14.241 -34.00345 21.85603 
1 1 1   14    2   52 o   78.404   27.455   4.6781   4.0667  -0.0339   5.8475   9.0922   5.6596   68.498   29.814  103.130   32.270 -34.63171 43.93447 
1 1 1   14    2   53 o   82.164   26.521   5.5071   3.7977   7.9367   5.1822   2.6884   5.5817   96.832   30.952   75.514   30.736 21.31763 43.62000 
1 1 1   14    2   54 o  147.058   16.800   17.296   3.7136   20.300   5.4058   14.611   5.1104  156.602   23.259  131.005   26.398 25.59750 35.18292 
1 1 1   14    2   55 o  160.137   15.614   20.418   3.7786   18.566   5.4547   22.126   5.2392  148.355   24.904  164.122   21.362 -15.76680 32.81081 
1 1 1   14    2   56 o   87.721   28.747   6.5661   4.4535   3.8766   9.6401   7.2959   5.0214   91.092   38.946   91.941   30.544 -0.8497314 49.49498 
1 1 1   14    2   57 o   71.551   28.028   3.2930   4.4651   4.8640   5.4845   0.2050   7.6893   81.368   31.287   75.385   33.444 5.983994 45.79715 
1 1 1   14    2   58 o   81.437   26.049   5.7157   3.6701   11.855   5.4392   0.5842   4.9728  113.380   30.622   63.637   27.595 49.74234 41.22143 
1 1 1   14    2   59 o  172.792   14.429   23.947   3.7814   14.127   5.2244   34.752   5.4802  124.501   28.084  206.227   17.527 -81.72540 33.10478 
1 1 1   14    2   60 o  107.199   22.190   10.041   3.5210   11.132   5.0604   9.0164   4.9022  108.184   29.670   97.377   29.962 10.80733 42.16673 
1 1 1   14    2   61 o   85.173   26.483   6.6999   3.8185   8.7652   4.7288   2.8295   6.4734   95.397   29.440   73.910   31.766 21.48643 43.31020 
1 1 1   14    3    0 o   41.914   22.595   1.9087   2.0124   1.9087   2.0124   1.9087   2.0124   41.914   22.595   41.914   22.595 0.000000 0.000000 
1 1 1   14    3    1 o  303.056   6.3301   70.309   2.9363   70.248   4.3230   70.361   4.0009  302.875   9.3252  303.132   8.6229 -0.2569275 12.70092 
1 1 1   14    3    2 o  304.400   6.3273   70.934   2.9480   70.286   4.4898   71.425   3.9086  302.949   9.6825  305.420   8.3610 -2.470032 12.79284 
1 1 1   14    3    3 o  554.645   5.7993  235.490   4.9233  221.831   8.5358  242.299   6.0268  538.182   10.362  562.576   6.9990 -24.39447 12.50435 
1 1 1   14    3    4 o  534.412   10.173  218.725   8.3213   0.0000   0.0000  218.725   8.3213  ?   ?   534.412   10.173 0.000000 10.17286 
1 1 1   14    3    5 o  522.964   7.3376  209.383   5.8735  217.125   8.6060  202.632   8.0360  532.443   10.560  514.378   10.207 18.06543 14.68633 
1 1 1   14    3    6 o  748.291   6.9747  428.665   7.9885  421.442   9.6479  444.415   14.247  741.903   8.4961  761.663   12.220 -19.76050 14.88347 
1 1 1   14    3    7 o  946.134   6.9858  685.299   10.117  676.243   14.072  694.987   14.555  939.722   9.7832  952.645   9.9818 -12.92273 13.97666 
1 1 1   14    3    8 o  866.239   6.6469  574.424   8.8131  592.453   12.781  558.080   12.169  879.603   9.4929  853.714   9.3126 25.88849 13.29815 
1 1 1   14    3    9 o  456.648   5.0826  159.613   3.5525  163.304   5.3098  156.622   4.7800  461.855   7.5111  452.319   6.9042 9.536346 10.20214 
1 1 1   14    3   10 o  408.117   4.3889  127.485   2.7416  126.317   3.5394  129.237   4.3350  406.228   5.6922  410.879   6.8930 -4.650452 8.939522 
1 1 1   14    3   11 o  577.392   4.1105  255.166   3.6328  259.571   5.5671  251.900   4.7941  582.318   6.2460  573.664   5.4598 8.654297 8.295916 
1 1 1   14    3   12 o  551.957   4.1012  233.179   3.4649  232.223   5.2521  233.916   4.6105  550.790   6.2298  552.809   5.4489 -2.018799 8.276515 
1 1 1   14    3   13 o  874.572   5.0781  585.452   6.7977  586.524   10.365  584.643   9.0049  875.291   7.7364  873.921   6.7319 1.370178 10.25525 
1 1 1   14    3   14 o  300.050   4.5358   68.909   2.0831   68.027   3.0023   69.728   2.8928  298.106   6.5798  301.812   6.2619 -3.706146 9.083212 
1 1 1   14    3   15 o  490.320   5.1559  184.018   3.8695  197.484   6.5661  176.854   4.7895  507.881   8.4465  480.659   6.5100 27.22171 10.66411 
1 1 1   14    3   16 o  563.869   4.4200  243.356   3.8148  233.109   5.7979  251.178   5.0658  551.828   6.8644  572.838   5.7776 -21.01025 8.972199 
1 1 1   14    3   17 o   42.878   16.150   1.0183   1.4426   4.9782   2.3114  -1.5086   1.8464   79.002   19.284   33.460   15.444 45.54165 24.70585 
1 1 1   14    3   18 o  539.040   4.2399  222.396   3.4982  219.434   4.9697  225.305   4.9251  535.409   6.0642  542.526   5.9309 -7.117371 8.482353 
1 1 1   14    3   19 o  808.323   4.8228  500.116   5.9669  490.812   8.3529  509.811   8.5268  800.713   6.8154  816.062   6.8264 -15.34955 9.646206 
1 1 1   14    3   20 o  1309.51   6.8964  1312.76   13.823  1301.21   20.982  1321.62   18.374  1303.47   10.517  1313.77   9.1371 -10.29858 13.93161 
1 1 1   14    3   21 o  836.238   5.8002  535.300   7.4241  527.748   10.452  542.990   10.547  830.224   8.2253  842.129   8.1823 -11.90588 11.60195 
1 1 1   14    3   22 o  799.507   5.2812  489.293   6.4629  492.063   8.7078  485.896   9.6435  801.703   7.0962  796.629   7.9088 5.074158 10.62567 
1 1 1   14    3   23 o  537.351   4.7716  221.019   3.9246  223.743   5.7215  218.598   5.3934  540.602   6.9145  534.359   6.5942 6.242859 9.554786 
1 1 1   14    3   24 o  696.631   5.3254  371.485   5.6784  371.981   7.5994  370.858   8.5443  697.035   7.1229  695.944   8.0210 1.090454 10.72719 
1 1 1   14    3   25 f  403.358   5.8225  124.550   3.5947  120.894   4.8483  129.014   5.3572  397.344   7.9717  410.457   8.5270 -13.11258 11.67300 
1 1 1   14    3   26 o  344.520   6.0163   90.867   3.1726   89.822   4.6986   91.743   4.3011  342.466   8.9635  346.130   8.1184 -3.664551 12.09354 
1 1 1   14    3   27 o  578.792   5.2306  256.447   4.6339  254.844   6.7766  257.855   6.3507  576.894   7.6744  580.314   7.1497 -3.419983 10.48881 
1 1 1   14    3   28 o  685.780   6.0865  360.058   6.3888  360.449   9.3979  359.722   8.7115  686.003   8.9503  685.349   8.3044 0.6539917 12.20947 
1 1 1   14    3   29 o  512.809   5.8635  201.333   4.6024  201.837   7.3814  201.013   5.8868  513.298   9.3951  512.339   7.5068 0.9584961 12.02577 
1 1 1   14    3   30 o  616.352   5.4013  290.838   5.0957  294.937   7.4638  287.260   6.9738  620.557   7.8579  612.452   7.4393 8.105408 10.82079 
1 1 1   14    3   31 o  432.168   6.2147  143.012   4.1110  142.340   6.4884  143.462   5.3136  430.982   9.8358  432.772   8.0216 -1.790039 12.69208 
1 1 1   14    3   32 o  674.518   5.9263  348.386   6.1185  355.298   9.9782  344.222   7.7456  680.881   9.5744  670.362   7.5488 10.51868 12.19236 
1 1 1   14    3   33 o  248.861   9.2699   47.468   3.5310   52.397   6.4029   45.314   4.2329  260.572   16.133  243.057   11.378 17.51517 19.74169 
1 1 1   14    3   34 f  221.629   13.071   37.848   4.4145   41.621   6.3501   34.320   6.1413  231.774   18.042  210.127   19.311 21.64670 26.42750 
1 1 1   14    3   35 o  443.677   6.1049  150.776   4.1459  149.850   6.0778  151.581   5.6697  442.101   8.9817  444.703   8.3295 -2.602234 12.24957 
1 1 1   14    3   36 o  144.499   13.465   16.189   2.9438   17.535   4.2912   14.992   4.0459  149.496   19.197  137.946   19.723 11.54984 27.52302 
1 1 1   14    3   37 o  126.354   15.585   12.483   2.9502   15.098   4.3861   10.322   3.9868  138.012   21.460  113.198   23.767 24.81352 32.02202 
1 1 1   14    3   38 o  266.812   8.6091   54.606   3.5159   51.299   4.7932   58.458   5.1729  258.318   12.123  275.740   12.256 -17.42151 17.23902 
1 1 1   14    3   39 o  255.358   8.5054   50.027   3.3244   50.693   4.8489   49.435   4.5667  256.707   12.341  253.562   11.766 3.144897 17.05108 
1 1 1   14    3   40 o  290.397   8.9739   64.734   3.9888   66.873   5.8667   62.895   5.4395  294.670   13.007  285.848   12.432 8.821899 17.99320 
1 1 1   14    3   41 f  266.024   8.7384   54.331   3.5581   58.843   5.7277   51.496   4.5405  276.242   13.546  258.696   11.467 17.54572 17.74805 
1 1 1   14    3   42 o  243.581   8.9666   45.574   3.3430   41.854   4.7955   49.090   4.6628  232.506   13.534  252.430   12.068 -19.92487 18.13279 
1 1 1   14    3   43 o  188.710   11.118   27.517   3.1971   26.123   4.6904   28.727   4.3694  182.683   16.968  192.096   14.979 -9.413055 22.63385 
1 1 1   14    3   44 o  164.504   14.422   21.104   3.5947   17.094   4.9220   25.688   5.2623  145.772   22.807  180.374   19.364 -34.60226 29.91834 
1 1 1   14    3   45 f  145.671   18.793   16.846   4.0924   18.266   6.4624   15.896   5.2879  148.292   29.509  139.342   25.741 8.950012 39.15871 
1 1 1   14    3   46 o  202.629   14.526   32.020   4.4754   35.404   4.8460   12.404   11.669  213.000   14.959  125.495   46.184 87.50439 48.54663 
1 1 1   14    3   47 o   49.757   22.228  -1.2473   3.4574  -4.3291   4.5848   2.8157   5.2644   50.307   23.591   75.805   30.199 -25.49750 38.32124 
1 1 1   14    3   48 o  239.958   9.9713   44.401   3.6623   43.779   5.3414   44.953   5.0311  236.758   14.814  240.258   13.738 -3.499695 20.20363 
1 1 1   14    3   49 o  117.926   19.658   11.242   3.4233   6.6387   4.9138   15.584   4.7719   91.058   30.214  137.982   23.433 -46.92412 38.23546 
1 1 1   14    3   50 o  114.956   25.458   11.056   4.3614  -0.0121   7.4875   16.740   5.3657   77.178   33.661  142.049   25.621 -64.87055 42.30234 
1 1 1   14    3   51 o  295.166   9.8825   67.289   4.4648   74.516   6.0853   58.861   6.5711  309.647   12.839  273.732   15.750 35.91507 20.32008 
1 1 1   14    3   52 o  139.222   19.168   15.633   3.9763   15.673   6.3312   15.608   5.1097  134.271   31.372  136.641   25.365 -2.369507 40.34301 
1 1 1   14    3   53 o   59.467   24.499   1.2136   3.6003  -1.9170   5.0417   4.4714   5.1431   58.520   26.433   80.633   30.464 -22.11259 40.33297 
1 1 1   14    3   54 o   77.147   26.075   4.7334   3.6583   9.7072   5.3923   0.4918   4.9796  105.266   31.222   64.814   27.858 40.45177 41.84417 
1 1 1   14    3   55 o   53.978   23.690  -0.4146   3.7602  -1.1844   5.4969   0.2626   5.1551   62.605   27.993   64.752   28.088 -2.146233 39.65513 
1 1 1   14    3   56 o  146.965   18.120   17.539   3.9898   20.901   6.4792   15.485   5.0638  154.726   28.405  134.291   25.569 20.43568 38.21823 
1 1 1   14    3   57 o   58.737   25.298   0.4338   4.1223  -3.4828   4.8227   11.058   7.9429   52.394   24.447  108.400   38.334 -56.00592 45.46642 
1 1 1   14    3   58 o  173.474   14.731   24.062   3.8744   22.088   5.7170   25.738   5.2689  160.723   23.973  176.484   19.849 -15.76131 31.12360 
1 1 1   14    3   59 o   58.393   24.503   1.2229   3.6976  -1.6550   5.6681   3.3549   4.8786   60.576   27.622   72.058   28.946 -11.48285 40.01070 
1 1 1   14    3   60 f   63.615   25.963   2.2682   3.9962   2.8160   5.5512   1.6789   5.7573   71.669   30.046   68.942   29.794 2.726852 42.31364 
1 1 1   14    3   61 o   91.767   25.015   7.7234   3.6099   0.6749   4.7828   17.054   5.5030   61.142   26.778  135.494   27.474 -74.35198 38.36556 
1 1 1   14    4    0 o  333.875   9.2466   85.533   4.7172   85.533   4.7172   85.533   4.7172  333.875   9.2466  333.875   9.2466 0.000000 0.000000 
1 1 1   14    4    1 o  921.602   7.6503  650.280   10.792  613.259   17.713  672.135   13.609  894.651   12.935  936.860   9.4906 -42.20886 16.04306 
1 1 1   14    4    2 o  403.535   9.6921  124.703   5.9864  124.703   5.9864   0.0000   0.0000  403.535   9.6921  ?   ?  0.000000 9.692072 
1 1 1   14    4    3 o  155.838   8.7270   18.654   2.0733   22.362   3.4010   16.461   2.6155  170.332   13.147  146.115   11.795 24.21626 17.66238 
1 1 1   14    4    4 f  230.359   10.154   40.639   3.5803   0.0000   0.0000   40.639   3.5803  ?   ?   230.359   10.154 0.000000 10.15425 
1 1 1   14    4    5 o  596.146   7.7297  272.090   7.0532  277.077   10.175  267.477   9.7861  601.463   11.052  590.961   10.819 10.50146 15.46596 
1 1 1   14    4    6 o  472.721   6.0568  171.061   4.3824  173.310   5.4322  166.867   7.4168  475.790   7.4591  466.786   10.381 9.003723 12.78272 
1 1 1   14    4    7 o  534.774   6.2743  218.920   5.1357  225.896   6.4438  206.773   8.5031  543.193   7.7503  519.606   10.691 23.58759 13.20508 
1 1 1   14    4    8 o  834.377   7.5332  532.981   9.6209  534.714   11.826  529.590   16.544  835.661   9.2458  831.439   13.000 4.221497 15.95255 
1 1 1   14    4    9 o  944.328   7.0809  682.672   10.235  704.594   14.865  662.912   14.113  959.223   10.124  930.430   9.9098 28.79327 14.16722 
1 1 1   14    4   10 o  661.412   6.8469  334.888   6.9316  331.757   8.4047  341.547   12.257  658.270   8.3416  667.771   11.992 -9.500916 14.60788 
1 1 1   14    4   11 o  1001.84   5.4837  768.257   8.4089  776.757   12.944  762.049   11.061  1007.25   8.3955  997.720   7.2430 9.531799 11.08808 
1 1 1   14    4   12 o  1239.95   6.4287  1176.91   12.201  1168.18   18.440  1183.71   16.272  1235.16   9.7539  1243.41   8.5499 -8.257568 12.97070 
1 1 1   14    4   13 o  605.234   4.5947  280.373   4.2565  277.237   6.0389  283.470   6.0004  601.804   6.5559  608.534   6.4421 -6.730042 9.191303 
1 1 1   14    4   14 o  476.351   4.8259  173.680   3.5186  177.994   5.7695  171.125   4.4398  482.183   7.8174  472.816   6.1349 9.366364 9.937193 
1 1 1   14    4   15 o  554.217   4.6290  235.098   3.9268  231.297   6.8163  236.986   4.8040  549.653   8.1020  556.422   5.6407 -6.769165 9.872128 
1 1 1   14    4   16 o  571.773   4.7898  250.232   4.1919  255.259   7.6704  248.091   5.0055  577.405   8.6790  569.307   5.7443 8.098206 10.40777 
1 1 1   14    4   17 o  634.369   4.8828  308.022   4.7411  304.949   8.1148  309.615   5.8419  631.113   8.4004  635.985   6.0012 -4.871704 10.32385 
1 1 1   14    4   18 o  513.075   4.5383  201.490   3.5640  199.046   5.5596  203.195   4.6437  509.907   7.1233  515.220   5.8885 -5.312378 9.242089 
1 1 1   14    4   19 o  1907.69   8.7271  2786.50   25.483  2793.07   36.179  2780.03   35.899  1909.49   12.378  1905.03   12.312 4.452148 17.45849 
1 1 1   14    4   20 o  437.676   4.7947  146.626   3.2121  148.669   5.2455  145.399   4.0629  440.663   7.7770  435.822   6.0906 4.840546 9.878080 
1 1 1   14    4   21 f  450.314   4.6042  155.215   3.1735  159.335   4.7476  151.887   4.2668  456.213   6.7988  445.434   6.2582 10.77963 9.240603 
1 1 1   14    4   22 o  387.506   5.7577  114.947   3.4150  112.277   4.3575  119.198   5.4981  382.949   7.4341  394.535   9.1045 -11.58646 11.75408 
1 1 1   14    4   23 o  350.165   5.7890   93.863   3.1027   88.483   4.2067  100.282   4.5948  339.940   8.0847  361.892   8.2950 -21.95114 11.58318 
1 1 1   14    4   24 o  798.062   5.4603  487.547   6.6699  492.755   8.9990  481.198   9.9359  802.237   7.3286  792.732   8.1886 9.505371 10.98915 
1 1 1   14    4   25 o  783.685   5.1434  470.132   6.1697  472.426   8.9478  468.053   8.5186  785.498   7.4422  781.870   7.1181 3.627869 10.29822 
1 1 1   14    4   26 o  712.870   5.1307  389.012   5.5984  395.299   8.2043  383.534   7.6584  718.513   7.4600  707.757   7.0694 10.75519 10.27755 
1 1 1   14    4   27 o  482.356   5.7551  178.120   4.2490  175.257   5.8442  181.331   6.1887  478.393   7.9812  486.601   8.3091 -8.207336 11.52134 
1 1 1   14    4   28 o  671.125   5.6062  344.816   5.7589  358.455   9.4942  336.877   7.2436  684.090   9.0672  663.287   7.1349 20.80261 11.53778 
1 1 1   14    4   29 o  796.521   5.7256  485.729   6.9806  496.887   11.178  478.595   8.9377  805.395   9.0674  790.554   7.3862 14.84100 11.69504 
1 1 1   14    4   30 o  697.596   6.1718  372.608   6.5900  375.017   12.142  371.603   7.8463  699.453   11.341  696.584   7.3591 2.868774 13.51933 
1 1 1   14    4   31 o  641.677   5.9153  315.271   5.8098  302.118   9.2677  323.787   7.4571  627.895   9.6430  650.190   7.4931 -22.29517 12.21204 
1 1 1   14    4   32 o  422.567   6.6689  136.752   4.3134  149.127   7.5706  130.804   5.2487  440.991   11.216  413.196   8.2990 27.79498 13.95232 
1 1 1   14    4   33 o  249.433   9.2986   47.689   3.5501   56.355   6.4810   43.974   4.2434  270.311   15.732  239.419   11.579 30.89117 19.53418 
1 1 1   14    4   34 o  507.467   6.7459  197.267   5.2398  194.147   6.4893  203.111   8.8822  503.310   8.4235  514.507   11.279 -11.19705 14.07709 
1 1 1   14    4   35 f  545.917   5.5922  228.244   4.6728  222.853   6.7781  233.127   6.4508  539.211   8.2126  551.557   7.6410 -12.34613 11.21749 
1 1 1   14    4   36 o  403.676   6.3126  124.837   3.9004  124.570   5.7952  125.058   5.2737  402.998   9.3950  403.865   8.5312 -0.8667908 12.69042 
1 1 1   14    4   37 o  242.138   8.8147   44.969   3.2669   49.445   4.6738   40.694   4.5684  253.661   12.038  229.674   13.049 23.98692 17.75334 
1 1 1   14    4   38 o  212.549   9.3961   34.670   3.0569   33.971   4.3818   35.333   4.2666  209.626   13.732  213.900   13.095 -4.273895 18.97497 
1 1 1   14    4   39 o  310.350   7.3882   73.851   3.5096   76.767   5.2263   71.456   4.7365  316.081   10.803  305.023   10.145 11.05817 14.81944 
1 1 1   14    4   40 o   96.364   22.591   7.5272   3.2743   6.7747   4.6286   8.2811   4.6324   92.887   29.203  101.080   28.637 -8.193115 40.90063 
1 1 1   14    4   41 o   80.502   22.935   5.1979   2.9627  -1.7777   4.7885   9.5244   3.7712   58.611   26.173  108.325   23.427 -49.71351 35.12579 
1 1 1   14    4   42 o  214.377   9.6351   35.323   3.1616   32.814   4.7675   37.292   4.2240  205.416   15.272  219.582   12.621 -14.16531 19.81230 
1 1 1   14    4   43 o  325.916   7.6413   81.535   3.8119   86.055   6.0533   78.565   4.9071  334.132   11.836  319.581   10.032 14.55109 15.51529 
1 1 1   14    4   44 o  283.340   8.9664   61.719   3.8886   71.000   5.4393   52.015   5.5615  303.417   11.712  258.890   14.088 44.52643 18.32044 
1 1 1   14    4   45 o   86.138   26.874   5.9347   3.9283  -0.9762   6.5853   9.7522   4.8944   71.244   31.306  108.193   28.975 -36.94918 42.65751 
1 1 1   14    4   46 o   79.254   26.317   4.8440   3.7278   9.5891   4.5251  -5.1782   6.5764  107.250   27.450   61.711   28.712 45.53948 39.72245 
1 1 1   14    4   47 o   92.110   24.513   7.0088   3.5167   5.8785   4.7756   8.3479   5.1980   87.356   29.790  100.501   30.841 -13.14501 42.87942 
1 1 1   14    4   48 o  283.021   9.6599   61.742   4.1847   59.668   5.6590   64.245   6.2163  277.334   13.331  287.538   14.124 -10.20349 19.42191 
1 1 1   14    4   49 o   86.209   25.526   6.1105   3.6064   4.8752   4.9873   7.4643   5.2212   82.823   30.237   95.625   31.116 -12.80167 43.38792 
1 1 1   14    4   50 o  175.028   13.911   23.986   3.6961   26.148   5.5222   22.231   4.9746  180.577   20.333  166.500   19.915 14.07759 28.46117 
1 1 1   14    4   51 o  154.640   16.413   18.961   3.8256   18.253   5.2074   19.791   5.6387  149.013   23.619  154.851   24.614 -5.837372 34.11279 
1 1 1   14    4   52 o  200.154   13.817   31.392   4.2070   35.557   6.8259   28.840   5.3424  209.715   21.572  190.009   18.608 19.70663 28.48914 
1 1 1   14    4   53 o   64.765   25.301   2.3576   3.6308   7.6441   5.2335  -2.5477   5.0413   95.349   31.159   56.908   25.989 38.44072 40.57463 
1 1 1   14    4   54 o  128.026   19.836   13.392   3.7613   12.624   5.4567   14.088   5.1916  120.033   29.831  128.083   27.315 -8.050644 40.44728 
1 1 1   14    4   55 o  195.491   13.528   30.086   4.0231   27.476   5.8498   32.429   5.5417  183.082   21.272  200.772   18.232 -17.69055 28.01563 
1 1 1   14    4   56 o  154.010   17.410   19.169   4.0321   13.027   6.3805   23.252   5.2026  118.748   33.597  168.080   20.657 -49.33192 39.43933 
1 1 1   14    4   57 o  117.697   22.807   11.791   3.9604   13.740   5.1605   8.9982   6.1774  124.526   27.781   99.682   33.882 24.84370 43.81495 
1 1 1   14    4   58 o   89.077   25.015   6.9703   3.5509   9.4464   4.9886   4.4272   5.0556  101.535   30.011   77.681   29.992 23.85350 42.42785 
1 1 1   14    4   59 o   88.954   26.132   7.1148   3.7928   8.3784   4.9068   5.2393   5.9780   94.928   30.094   82.121   32.349 12.80695 44.18298 
1 1 1   14    4   60 o   97.115   24.893   8.5364   3.7175   3.7332   5.5633   12.411   4.9969   74.713   30.579  115.021   28.523 -40.30823 41.81641 
1 1 1   14    4   61 o  190.452   15.476   29.600   4.4724   25.649   7.2033   32.079   5.7053  164.501   29.701  194.977   19.374 -30.47528 35.46138 
1 1 1   14    5    0 o  827.488   8.6810  524.341   10.992  524.341   10.992  524.341   10.992  827.488   8.6810  827.488   8.6810 0.000000 0.000000 
1 1 1   14    5    1 o  241.326   4.5104   44.577   1.6661   46.018   2.3756   43.181   2.3372  245.182   6.3302  237.502   6.4293 7.680435 9.022579 
1 1 1   14    5    2 o  444.007   6.8985  150.922   4.6883  140.515   6.5744  161.691   6.6876  428.351   10.027  459.511   9.5083 -31.15985 13.81869 
1 1 1   14    5    3 o  470.063   7.0809  169.158   5.0946  161.597   7.2201  176.656   7.1898  459.356   10.269  480.297   9.7800 -20.94125 14.18090 
1 1 1   14    5    4 f  298.581   10.037   68.272   4.5871   0.0000   0.0000   68.272   4.5871  ?   ?   298.581   10.037 0.000000 10.03710 
1 1 1   14    5    5 o  560.894   7.6916  240.858   6.6034  233.596   9.2317  248.466   9.4493  552.270   10.921  569.580   10.839 -17.31030 15.38642 
1 1 1   14    5    6 o  612.335   6.5124  287.032   6.1038  289.269   7.5523  282.818   10.365  614.676   8.0272  607.673   11.144 7.003296 13.73372 
1 1 1   14    5    7 o  112.891   11.250   9.8576   1.9180   8.9998   2.4068   11.350   3.1751  107.325   15.066  120.383   17.765 -13.05770 23.29389 
1 1 1   14    5    8 o  942.506   8.1466  680.104   11.753  693.179   14.688  656.835   19.594  951.425   10.086  925.906   13.826 25.51886 17.11362 
1 1 1   14    5    9 o  411.436   6.3449  129.582   3.9957  130.871   4.9428  127.151   6.7881  413.453   7.8104  407.468   10.884 5.985077 13.39641 
1 1 1   14    5   10 o  1257.72   12.338  1211.64   23.753  1195.27   33.037  1229.15   34.175  1248.69   17.286  1266.22   17.633 -17.53186 24.69227 
1 1 1   14    5   11 o  437.719   5.3434  146.655   3.5800  139.512   4.7144  156.386   5.5020  426.898   7.2149  451.964   7.9534 -25.06674 10.73831 
1 1 1   14    5   12 o  839.368   6.4786  539.315   8.3234  552.057   12.098  527.865   11.469  849.123   9.3087  830.321   9.0241 18.80206 12.96484 
1 1 1   14    5   13 o  811.331   5.2640  503.849   6.5371  505.251   9.3346  502.499   9.1577  812.396   7.5069  810.185   7.3847 2.211060 10.53028 
1 1 1   14    5   14 o  1305.92   6.7369  1305.51   13.466  1282.06   20.129  1324.52   18.118  1293.94   10.163  1315.27   8.9997 -21.33313 13.57514 
1 1 1   14    5   15 o  581.497   4.3561  258.809   3.8772  264.399   6.0528  254.919   5.0490  587.701   6.7287  577.089   5.7160 10.61261 8.828801 
1 1 1   14    5   16 o  964.395   6.0038  711.930   8.8625  683.674   15.091  726.805   10.950  944.872   10.435  974.370   7.3418 -29.49799 12.75863 
1 1 1   14    5   17 o  524.520   4.7232  210.581   3.7920  207.853   6.5336  211.966   4.6564  521.044   8.1923  526.225   5.7811 -5.181335 10.02676 
1 1 1   14    5   18 o  1427.70   7.3134  1560.47   15.982  1561.43   24.477  1559.76   21.100  1427.83   11.200  1427.21   9.6590 0.6246338 14.78962 
1 1 1   14    5   19 o  482.495   4.6336  178.190   3.4220  178.457   5.5259  178.023   4.3582  482.804   7.4776  482.249   5.9043 0.5554810 9.527566 
1 1 1   14    5   20 o  550.854   4.7618  232.262   4.0149  235.186   6.4412  230.404   5.1343  554.247   7.5927  548.620   6.1142 5.626404 9.748475 
1 1 1   14    5   21 o  613.914   4.9092  288.487   4.6130  285.190   7.2602  290.720   5.9739  610.318   7.7718  616.251   6.3333 -5.932495 10.02559 
1 1 1   14    5   22 o  586.268   6.0495  263.116   5.4286  266.243   6.1250  251.666   11.722  589.720   6.7856  573.073   13.363 16.64703 14.98758 
1 1 1   14    5   23 o  522.337   5.1090  208.847   4.0846  212.677   5.6471  204.644   5.9154  527.058   6.9999  516.995   7.4752 10.06329 10.24102 
1 1 1   14    5   24 o  1009.14   5.6153  779.572   8.6736  773.201   12.302  785.870   12.231  1004.88   7.9983  1013.09   7.8875 -8.206726 11.23320 
1 1 1   14    5   25 o  141.555   11.049   15.444   2.3749   16.295   3.6596   14.825   3.1216  144.774   16.829  138.240   14.993 6.534256 22.53875 
1 1 1   14    5   26 o  231.245   7.7351   40.947   2.7378   33.994   4.1410   46.346   3.6492  210.200   12.934  245.980   9.6922 -35.77934 16.16219 
1 1 1   14    5   27 o  356.106   6.4667   97.091   3.5248   96.229   4.9479   97.978   5.0224  354.451   9.1201  357.657   9.1744 -3.206177 12.93620 
1 1 1   14    5   28 o  329.043   6.8496   82.901   3.4497   81.877   5.7116   83.489   4.3284  326.861   11.416  330.162   8.5651 -3.301392 14.27218 
1 1 1   14    5   29 o  423.269   7.1225  137.191   4.6144  122.445   11.157  140.234   5.0682  399.224   18.259  427.914   7.7379 -28.69000 19.83081 
1 1 1   14    5   30 o  808.029   6.2946  499.935   7.7851  512.301   14.282  494.708   9.2859  817.487   11.414  803.704   7.5484 13.78302 13.68451 
1 1 1   14    5   31 o  422.432   6.0532  136.641   3.9139  131.799   5.9471  140.341   5.1984  414.727   9.3685  428.032   7.9346 -13.30484 12.27706 
1 1 1   14    5   32 o  232.623   9.4572   41.474   3.3673   45.754   6.3382   39.791   3.9747  243.335   17.126  227.491   11.451 15.84410 20.60220 
1 1 1   14    5   33 o  374.988   6.9352  107.710   3.9806  102.578   6.9457  110.220   4.8574  365.590   12.412  379.255   8.3676 -13.66479 14.96942 
1 1 1   14    5   34 o  288.092   8.9932   63.625   3.9656   68.374   5.1601   56.774   6.1980  298.506   11.294  271.329   14.982 27.17734 18.76189 
1 1 1   14    5   35 o  291.679   7.4095   65.193   3.3080   66.612   4.9995   64.089   4.4118  294.603   11.087  289.049   9.9719 5.554749 14.91191 
1 1 1   14    5   36 o  282.955   8.1814   61.380   3.5433   63.017   5.0677   59.814   4.9562  286.456   11.558  279.078   11.603 7.377258 16.37705 
1 1 1   14    5   37 o  196.240   10.627   29.654   3.1802   28.228   4.5846   30.977   4.4150  190.719   15.849  200.061   14.517 -9.341675 21.49215 
1 1 1   14    5   38 o  121.701   15.606   11.606   2.8400   12.453   4.2050   10.895   3.8510  124.652   22.883  116.502   22.410 8.149750 32.02821 
1 1 1   14    5   39 o  341.236   7.5584   89.293   3.9478   88.182   5.4124   90.556   5.7708  338.799   10.437  343.260   10.984 -4.460846 15.15159 
1 1 1   14    5   40 o  226.499   9.5850   39.401   3.3230   35.674   5.1967   41.980   4.3221  214.273   15.959  233.230   12.149 -18.95775 20.05738 
1 1 1   14    5   41 o   63.589   23.336   2.5676   2.9761   2.5381   4.7166   2.5871   3.8362   72.889   28.727   68.392   26.197 4.496765 38.87861 
1 1 1   14    5   42 o  174.066   13.060   23.502   3.4542   26.365   4.8293   20.504   4.9427  183.517   17.400  160.869   20.542 22.64853 26.92139 
1 1 1   14    5   43 o   71.148   24.106   3.7420   3.1269   7.9101   4.2241  -1.3109   4.6509   98.246   27.175   58.780   26.047 39.46675 37.64198 
1 1 1   14    5   44 o  113.207   17.683   10.208   2.9638   14.358   4.4672   6.9451   3.9613  133.319   22.705   92.264   26.593 41.05470 34.96712 
1 1 1   14    5   45 o  282.660   9.4002   61.487   4.0670   69.285   7.5759   58.329   4.8205  297.839   16.685  274.938   11.455 22.90063 20.23874 
1 1 1   14    5   46 o  202.073   13.082   31.740   4.0245   31.594   4.9084   32.039   7.0301  200.813   16.105  199.711   23.444 1.101639 28.44256 
1 1 1   14    5   47 f  164.347   13.388   21.071   3.3385   16.548   4.8412   25.173   4.6101  142.780   22.928  178.734   17.058 -35.95427 28.57774 
1 1 1   14    5   48 o  110.456   22.216   10.007   3.6258   11.419   5.0112   8.4558   5.2525  116.386   28.385  100.815   31.013 15.57053 42.04178 
1 1 1   14    5   49 o  164.261   15.823   21.260   3.9289   27.412   5.2197   13.218   5.9679  185.755   18.609  124.134   31.390 61.62175 36.49124 
1 1 1   14    5   50 o   97.645   24.729   7.9780   3.6999   6.6382   4.9230   9.7168   5.6086   90.776   30.248  106.736   31.884 -15.95988 43.94925 
1 1 1   14    5   51 o   41.034   19.729  -5.0643   3.6278  -0.7401   4.8181 -10.7248   5.5126   60.619   26.704   45.706   22.484 14.91381 34.90903 
1 1 1   14    5   52 o   45.261   21.170  -3.2434   3.6523  -5.7743   5.6824  -1.4618   4.7675   54.324   25.716   58.096   26.017 -3.772499 36.58101 
1 1 1   14    5   53 o   91.989   25.081   7.1577   3.6286   4.3030   5.2721   9.7271   5.0017   80.290   30.721  105.941   29.666 -25.65111 42.70694 
1 1 1   14    5   54 o  198.131   13.587   30.846   4.0957   31.687   6.2413   30.210   5.4279  197.372   20.981  193.940   18.510 3.432419 27.97888 
1 1 1   14    5   55 o   77.160   25.852   4.8277   3.5959   7.8041   5.0401   1.7419   5.1319   94.926   30.544   69.297   28.958 25.62895 42.08882 
1 1 1   14    5   56 o   45.078   21.573  -5.0972   4.2273  -4.0223   6.1937  -6.0346   5.7838   59.640   27.787   53.578   25.529 6.061890 37.73368 
1 1 1   14    5   57 o   51.698   23.146  -0.9930   3.7715   5.6352   4.8598 -11.0292   5.9801   83.042   29.919   47.281   23.289 35.76182 37.91506 
1 1 1   14    5   58 o   45.001   21.187  -3.3517   3.7629  -2.5003   4.7499  -4.7867   6.1663   53.798   24.810   57.290   27.019 -3.492699 36.68182 
1 1 1   14    5   59 o  182.228   13.521   26.511   3.7443   30.984   5.2056   21.716   5.3898  194.305   17.697  158.950   22.807 35.35454 28.86782 
1 1 1   14    5   60 o   74.083   25.569   4.7291   3.5210   9.1009   4.5654  -1.6885   5.5314   98.174   28.622   59.058   27.065 39.11666 39.39196 
1 1 1   14    5   61 o   82.444   25.873   6.2368   3.6352   7.0639   4.6347   4.9144   5.8602   86.467   29.348   78.656   31.679 7.810318 43.18431 
1 1 1   14    6    0 o  1177.47   11.235  1061.77   20.245  1061.77   20.245  1061.77   20.245  1177.47   11.235  1177.47   11.235 0.000000 0.000000 
1 1 1   14    6    1 o  1316.86   8.7089  1327.78   17.554  1312.37   24.500  1344.03   25.163  1308.90   12.229  1324.57   12.412 -15.67188 17.42386 
1 1 1   14    6    2 f  814.679   8.5697  508.171   10.686   0.0000   0.0000  508.171   10.686  ?   ?   814.679   8.5697 0.000000 8.569694 
1 1 1   14    6    3 o  1240.52   9.6439  1178.41   18.312  1157.49   21.947  1226.33   33.219  1229.30   11.664  1264.71   17.160 -35.41223 20.74917 
1 1 1   14    6    4 o  776.469   12.213  461.827   14.515   0.0000   0.0000  461.827   14.515  ?   ?   776.469   12.213 0.000000 12.21312 
1 1 1   14    6    5 o  473.049   7.4790  171.316   5.4153  161.032   7.4596  182.773   7.8740  458.554   10.628  488.532   10.530 -29.97775 14.96122 
1 1 1   14    6    6 o  524.208   7.7822  210.378   6.2442  212.796   8.9555  208.090   8.7107  527.115   11.100  521.260   10.918 5.854858 15.56921 
1 1 1   14    6    7 o  440.470   7.8486  148.534   5.2915  153.315   7.8051  144.468   7.1983  447.415   11.397  434.330   10.828 13.08487 15.72062 
1 1 1   14    6    8 o  234.908   9.6714   42.254   3.4774   50.710   5.3424   36.037   4.5807  256.915   13.634  216.434   13.901 40.48021 19.47110 
1 1 1   14    6    9 o  1114.64   11.285  951.501   19.253  982.570   28.234  924.500   26.321  1132.26   16.292  1098.35   15.657 33.90613 22.59534 
1 1 1   14    6   10 o  736.025   8.8981  414.774   10.024  414.774   10.024   0.0000   0.0000  736.025   8.8981  ?   ?  0.000000 8.898068 
1 1 1   14    6   11 o  649.335   5.8635  322.744   5.8277  329.817   6.7264  301.453   11.670  656.394   6.6950  627.361   12.153 29.03247 13.87501 
1 1 1   14    6   12 f  265.659   5.3275   54.020   2.1663   53.988   2.7458   54.073   3.5254  265.567   6.7551  265.757   8.6667 -0.1902466 10.98833 
1 1 1   14    6   13 o  232.153   5.3730   41.253   1.9093   38.916   2.6199   43.900   2.7881  225.464   7.5918  239.467   7.6067 -14.00282 10.74690 
1 1 1   14    6   14 o  309.493   4.3283   73.314   2.0504   71.759   3.2645   74.327   2.6350  306.168   6.9661  311.615   5.5245 -5.446411 8.890869 
1 1 1   14    6   15 o  1036.98   5.7424  823.120   9.1145  825.566   13.986  821.314   12.017  1038.40   8.7994  1035.78   7.5797 2.620605 11.61384 
1 1 1   14    6   16 o  755.861   5.7226  437.325   6.6207  421.922   14.503  441.380   7.4414  742.156   12.767  759.339   6.4025 -17.18372 14.28248 
1 1 1   14    6   17 o  877.602   5.6484  589.544   7.5873  581.912   12.937  593.546   9.3674  871.743   9.6959  880.533   6.9503 -8.789551 11.92967 
1 1 1   14    6   18 o  212.710   5.9932   34.635   1.9513   33.017   3.4058   35.425   2.3807  207.354   10.768  215.112   7.2307 -7.757172 12.97039 
1 1 1   14    6   19 o  839.572   5.2553  539.551   6.7535  535.610   10.414  542.411   8.8719  836.397   8.1347  841.740   6.8860 -5.343811 10.65792 
1 1 1   14    6   20 o  814.310   5.2359  507.574   6.5261  531.496   10.530  492.654   8.3158  833.164   8.2569  802.203   6.7725 30.96124 10.67910 
1 1 1   14    6   21 o  812.923   5.7361  505.871   7.1373  507.945   10.297  503.952   9.9017  814.486   8.2598  811.292   7.9737 3.194458 11.48062 
1 1 1   14    6   22 o  709.512   6.1536  385.374   6.6828  395.633   8.9741  372.602   10.013  718.818   8.1565  697.526   9.3784 21.29163 12.42908 
1 1 1   14    6   23 o  766.405   5.3312  449.628   6.2540  446.192   9.8111  451.979   8.1168  763.345   8.3970  768.348   6.9017 -5.003235 10.86937 
1 1 1   14    6   24 o  466.987   5.4164  166.938   3.8715  174.433   6.5998  163.005   4.7805  477.251   9.0346  461.422   6.7687 15.82907 11.28891 
1 1 1   14    6   25 o  1246.11   6.4062  1188.81   12.219  1205.04   17.679  1173.96   16.907  1254.35   9.2081  1238.10   8.9214 16.25281 12.82115 
1 1 1   14    6   26 o  928.675   6.3965  660.289   9.0923  670.947   13.354  651.080   12.414  935.938   9.3219  922.018   8.7964 13.91992 12.81692 
1 1 1   14    6   27 o  383.456   6.2600  112.575   3.6742  118.563   6.4651  109.719   4.4654  393.372   10.738  378.522   7.7072 14.85049 13.21721 
1 1 1   14    6   28 o  401.737   7.2063  123.586   4.4312  111.998   12.144  125.365   4.7594  381.078   20.900  404.603   7.6851 -23.52499 22.26812 
1 1 1   14    6   29 o  733.786   6.1537  412.263   6.9115  378.639   12.150  428.347   8.4035  702.850   11.294  747.891   7.3410 -45.04114 13.47040 
1 1 1   14    6   30 o  412.278   5.8403  130.142   3.6855  135.296   5.6697  126.371   4.8499  420.241   8.8144  406.189   7.8008 14.05261 11.77055 
1 1 1   14    6   31 o  360.133   6.4132   99.319   3.5352   98.287   5.4183  100.084   4.6648  358.105   9.8852  361.437   8.4320 -3.332214 12.99290 
1 1 1   14    6   32 o  512.307   6.1128  200.990   4.7933  207.124   8.2559  197.871   5.8872  519.756   10.378  508.230   7.5680 11.52573 12.84403 
1 1 1   14    6   33 o  366.137   6.3938  102.675   3.5832  101.290   5.5778  103.649   4.6756  363.453   10.026  367.770   8.3060 -4.317352 13.01997 
1 1 1   14    6   34 o  130.896   16.573   13.396   3.2461   13.891   4.1914   12.655   5.1311  132.443   21.406  125.212   27.523 7.231461 34.86757 
1 1 1   14    6   35 o  211.371   9.0757   34.260   2.9363   38.901   4.5488   30.944   3.8446  224.594   13.291  200.308   12.604 24.28563 18.31688 
1 1 1   14    6   36 o  323.834   7.2095   80.369   3.5735   83.058   5.1191   77.813   4.9908  328.981   10.166  318.418   10.240 10.56311 14.42939 
1 1 1   14    6   37 o  349.826   6.6731   93.781   3.5731   96.873   5.4754   91.489   4.7156  355.245   10.070  345.344   8.9210 9.901276 13.45307 
1 1 1   14    6   38 o  134.314   13.863   14.038   2.8091   14.621   4.3256   13.613   3.6940  135.600   21.563  131.302   18.927 4.298492 28.69138 
1 1 1   14    6   39 o  387.486   6.9803  115.110   4.1400  120.364   5.7116  109.294   6.0093  395.946   9.4244  377.167   10.409 18.77881 14.04184 
1 1 1   14    6   40 o  284.291   8.9977   62.052   3.9153   68.029   5.7909   57.019   5.3139  297.191   12.730  272.078   12.760 25.11328 18.02450 
1 1 1   14    6   41 o  165.965   14.248   21.419   3.5845   21.274   5.4265   21.531   4.7743  163.571   22.252  165.345   19.223 -1.774460 29.40544 
1 1 1   14    6   42 o   94.767   20.664   7.2758   2.9129   5.4552   4.4335   8.6587   3.8639   85.114   28.705  102.862   24.826 -17.74746 37.95108 
1 1 1   14    6   43 o  252.396   8.6437   48.947   3.3393   46.771   5.0071   50.689   4.4814  245.696   13.365  256.474   11.416 -10.77734 17.57639 
1 1 1   14    6   44 o  303.905   8.5402   70.985   3.9726   73.425   7.3816   69.990   4.7134  307.132   15.755  301.493   10.214 5.639313 18.77619 
1 1 1   14    6   45 o   69.765   23.278   3.6788   2.9154   3.9622   4.3460   3.4469   3.9312   76.828   28.199   72.550   26.789 4.278839 38.89532 
1 1 1   14    6   46 o  459.159   7.7364  162.011   5.4372  160.645   6.7150  164.612   9.2652  456.714   9.6057  461.063   13.129 -4.348999 16.26765 
1 1 1   14    6   47 o   56.810   22.984   1.2302   3.0996   5.5000   4.4509  -2.7907   4.3191   84.555   28.760   51.952   23.848 32.60269 37.36120 
1 1 1   14    6   48 o  195.158   12.206   29.599   3.6277   26.896   5.0614   32.454   5.2021  184.273   18.182  203.017   16.894 -18.74486 24.81940 
1 1 1   14    6   49 o  377.805   7.6171  109.771   4.4048  109.934   6.4626  109.630   6.0197  377.024   11.199  376.760   10.439 0.2640991 15.30932 
1 1 1   14    6   50 o  198.788   12.973   30.825   3.9258   34.149   5.4159   27.145   5.6986  207.838   17.178  183.836   20.607 24.00266 26.82795 
1 1 1   14    6   51 o  290.526   10.579   65.295   4.7045   67.910   5.9004   60.732   7.7945  295.465   13.047  276.600   18.518 18.86481 22.65223 
1 1 1   14    6   52 o   69.348   26.660   2.9378   3.9820  -3.1013   6.0298   7.6084   5.3027   61.797   28.297   95.504   31.372 -33.70715 42.24851 
1 1 1   14    6   53 o  142.472   17.487   16.279   3.7333   19.266   5.5275   13.774   5.0625  152.051   24.590  127.104   26.862 24.94723 36.41755 
1 1 1   14    6   54 o  195.053   13.234   29.871   3.9276   39.622   6.2564   23.528   5.0458  222.202   18.565  170.346   19.716 51.85526 27.08154 
1 1 1   14    6   55 o  180.357   13.679   25.663   3.7481   24.355   5.3962   26.882   5.2101  172.322   20.885  182.175   18.963 -9.853058 28.20935 
1 1 1   14    6   56 o  147.609   19.728   17.907   4.3457   18.663   5.1886   16.129   7.9541  148.654   23.592  129.247   37.808 19.40622 44.56451 
1 1 1   14    6   57 o  201.147   13.264   31.987   4.0608   31.712   5.1592   32.435   6.5834  198.165   17.179  197.080   22.212 1.084824 28.07993 
1 1 1   14    6   58 o   42.101   19.932  -3.4137   3.4150  -2.7853   4.7289  -4.0988   4.9370   52.922   24.528   51.382   24.215 1.540520 34.46745 
1 1 1   14    6   59 o  196.673   12.399   30.681   3.7133   28.219   5.0800   33.506   5.4415  184.911   18.184  201.910   17.789 -16.99907 25.43813 
1 1 1   14    6   60 o  145.588   16.364   17.424   3.5835   16.485   4.6087   18.859   5.6988  137.416   22.704  143.778   26.884 -6.362671 35.18817 
1 1 1   14    7    0 o  1205.64   11.471  1113.18   21.165  1113.18   21.165  1113.18   21.165  1205.64   11.471  1205.64   11.471 0.000000 0.000000 
1 1 1   14    7    1 o  1426.39   9.3279  1557.90   20.365  1549.09   28.600  1566.96   29.006  1421.99   13.140  1430.16   13.251 -8.166626 18.66126 
1 1 1   14    7    2 o  1532.43   9.9385  1798.26   23.311  1780.20   32.558  1817.27   33.393  1524.28   13.955  1540.05   14.166 -15.76074 19.88494 
1 1 1   14    7    3 o  1216.51   11.693  1133.49   21.773  1125.63   30.543  1141.63   31.047  1211.81   16.467  1220.37   16.621 -8.563599 23.39703 
1 1 1   14    7    4 o  1103.82   10.805  933.099   18.256  892.125   24.285  986.334   27.681  1079.00   14.705  1134.42   15.942 -55.41846 21.68815 
1 1 1   14    7    5 o   80.607   10.313   5.0569   1.2432   6.0166   1.3283  -1.7233   3.5306   88.071   10.033   49.666   22.305 38.40539 24.45709 
1 1 1   14    7    6 o  1162.81   9.4004  1035.32   16.731  1038.72   20.581  1028.69   28.730  1164.57   11.546  1158.51   16.202 6.060059 19.89509 
1 1 1   14    7    7 o  1134.98   9.2645  986.324   16.094  987.746   19.749  983.511   27.773  1135.66   11.361  1132.82   16.017 2.836060 19.63737 
1 1 1   14    7    8 o  845.844   6.6149  547.676   8.5641  565.877   10.090  500.791   16.195  859.750   7.6677  808.549   13.086 51.20062 15.16684 
1 1 1   14    7    9 o  984.570   10.379  742.310   15.641  742.310   15.641   0.0000   0.0000  984.570   10.379  ?   ?  0.000000 10.37854 
1 1 1   14    7   10 o  540.484   6.7887  223.621   5.6162  234.851   6.9265  202.067   9.5958  553.859   8.1704  513.635   12.205 40.22394 14.68772 
1 1 1   14    7   11 o  812.634   6.5086  505.508   8.0957  506.558   9.2622  502.108   16.664  813.450   7.4390  809.598   13.448 3.851685 15.36799 
1 1 1   14    7   12 o   66.310   14.975   3.5037   1.4840   2.7674   1.7962   5.0871   2.6342   59.902   18.078   80.021   21.177 -20.11941 27.84355 
1 1 1   14    7   13 o  520.503   5.0965  207.370   4.0604  208.405   5.1737  205.712   6.5517  521.776   6.4781  518.358   8.2576 3.418457 10.49543 
1 1 1   14    7   14 o  1206.15   6.9217  1113.67   12.779  1111.93   17.933  1115.46   18.214  1205.05   9.7222  1206.96   9.8594 -1.902100 13.84668 
1 1 1   14    7   15 o  581.061   4.8853  258.429   4.3449  258.981   6.0930  257.858   6.1976  581.644   6.8440  580.378   6.9766 1.265442 9.773061 
1 1 1   14    7   16 o  525.765   6.0180  211.599   4.8430  213.737   9.5482  210.859   5.6195  528.255   11.809  524.825   6.9954 3.430542 13.72537 
1 1 1   14    7   17 o  1179.17   6.3369  1064.38   11.437  1077.12   17.733  1055.30   14.966  1186.01   9.7683  1174.02   8.3285 11.98230 12.83678 
1 1 1   14    7   18 o  895.035   5.3771  613.195   7.3664  636.835   11.725  597.781   9.4682  912.005   8.3996  883.658   7.0002 28.34662 10.93420 
1 1 1   14    7   19 f  451.834   5.0957  156.269   3.5241  153.964   5.1992  158.227   4.7932  448.443   7.5746  454.624   6.8881 -6.180847 10.23822 
1 1 1   14    7   20 o  585.684   5.1873  262.571   4.6503  267.683   6.8905  258.296   6.3018  591.293   7.6134  580.849   7.0881 10.44452 10.40215 
1 1 1   14    7   21 o  586.822   4.9130  263.590   4.4128  265.753   7.1242  262.244   5.6210  589.143   7.9003  585.289   6.2744 3.853516 10.08879 
1 1 1   14    7   22 o  525.530   6.0412  211.425   4.8595  212.654   6.5486  209.918   7.2495  526.997   8.1184  523.563   9.0462 3.433716 12.15494 
1 1 1   14    7   23 o  510.128   5.1258  199.200   4.0023  203.411   6.6490  196.807   5.0120  515.398   8.4284  507.023   6.4583 8.374664 10.61822 
1 1 1   14    7   24 o  670.287   5.2817  343.926   5.4188  347.204   8.7356  341.875   6.9086  673.348   8.4758  668.235   6.7545 5.112915 10.83801 
1 1 1   14    7   25 o  1126.29   6.9692  971.246   12.014  957.476   17.010  984.953   16.972  1118.02   9.9402  1133.97   9.7781 -15.94519 13.94337 
1 1 1   14    7   26 o  377.153   6.8098  108.910   3.9312  117.054   6.2486  103.576   5.0574  390.880   10.444  367.739   8.9851 23.14148 13.77712 
1 1 1   14    7   27 f  620.410   5.8754  294.681   5.5794  301.743   10.427  291.849   6.6043  627.528   10.856  617.375   6.9889 10.15332 12.91121 
1 1 1   14    7   28 o  552.477   5.6073  233.680   4.7417  238.736   7.9343  230.872   5.9140  558.249   9.2857  549.091   7.0367 9.157593 11.65069 
1 1 1   14    7   29 o  916.774   5.9761  643.513   8.3858  644.232   13.105  643.014   10.912  916.992   9.3372  916.277   7.7807 0.7156982 12.15411 
1 1 1   14    7   30 o  290.456   7.1521   64.612   3.1797   59.914   4.7479   68.432   4.2816  279.558   11.096  298.843   9.3604 -19.28516 14.51673 
1 1 1   14    7   31 o   77.286   23.658   4.6178   3.0608   7.1935   5.7818   3.6149   3.6078   98.620   32.776   73.170   25.840 25.44975 41.73690 
1 1 1   14    7   32 o  376.020   6.8633  108.299   3.9502  106.117   7.0691  109.289   4.7632  371.861   12.420  377.666   8.2399 -5.804901 14.90459 
1 1 1   14    7   33 o  570.128   5.4516  248.909   4.7574  247.228   7.0469  250.316   6.4487  567.997   8.1056  571.597   7.3707 -3.600708 10.95574 
1 1 1   14    7   34 o  256.583   9.2407   50.480   3.6291   51.221   4.6479   49.324   5.8089  258.306   11.756  252.786   15.082 5.520676 19.12209 
1 1 1   14    7   35 f  508.441   6.0357  198.022   4.6972  191.633   6.3941  205.511   6.9231  499.965   8.3554  517.710   8.7366 -17.74509 12.08894 
1 1 1   14    7   36 o  299.514   7.1010   68.751   3.2554   70.669   4.9564   67.296   4.3172  303.397   10.673  296.163   9.5237 7.233673 14.30429 
1 1 1   14    7   37 o  369.128   6.3755  104.408   3.6021  109.888   5.4819  100.244   4.7786  378.408   9.4645  361.505   8.6361 16.90256 12.81245 
1 1 1   14    7   38 o   99.796   19.682   7.9822   2.8996   10.624   4.0497   5.2027   4.1537  114.693   23.846   83.417   27.783 31.27545 36.61334 
1 1 1   14    7   39 o   70.527   23.373   3.7059   2.9410   6.1188   4.0365   0.9752   4.2939   88.152   27.199   64.369   26.658 23.78366 38.08479 
1 1 1   14    7   40 o  341.028   7.2367   89.196   3.7775   92.876   6.0921   86.898   4.8148  347.435   11.456  336.366   9.3519 11.06888 14.78824 
1 1 1   14    7   41 o  332.986   7.6555   85.080   3.9019   93.213   6.9376   81.317   4.7189  347.674   13.037  325.313   9.4771 22.36197 16.11732 
1 1 1   14    7   42 o  133.150   14.324   13.859   2.8733   11.917   4.2682   15.468   3.8857  121.123   23.871  139.810   18.621 -18.68746 30.27464 
1 1 1   14    7   43 o  436.647   6.3550  146.236   4.2473  146.378   6.3297  146.119   5.7284  436.274   9.4788  436.080   8.5822 0.1941528 12.78678 
1 1 1   14    7   44 o   68.037   24.527   3.1459   3.2664   5.2378   6.6502   2.4807   3.7499   90.931   34.572   67.022   25.843 23.90982 43.16376 
1 1 1   14    7   45 o  376.760   7.3597  109.019   4.2442  114.478   6.0081  103.582   5.9963  385.457   10.183  366.529   10.688 18.92764 14.76273 
1 1 1   14    7   46 o   75.767   25.025   4.4276   3.3725   3.0852   4.4591   6.2218   5.1552   73.140   28.187   90.033   30.946 -16.89285 41.85865 
1 1 1   14    7   47 o  243.130   9.4990   45.544   3.5350   42.724   5.2864   47.825   4.7543  233.912   14.842  248.221   12.554 -14.30843 19.43938 
1 1 1   14    7   48 o  109.625   20.894   9.8021   3.3779   13.420   4.8107   6.2835   4.7441  127.148   25.605   89.012   29.694 38.13615 39.20915 
1 1 1   14    7   49 o   56.192   23.298   0.8507   3.2850   3.1075   4.8211  -1.1050   4.4881   74.437   29.134   57.605   25.554 16.83208 38.75301 
1 1 1   14    7   50 o  448.228   7.6241  154.576   5.2306  147.361   7.0403  163.465   7.8146  436.593   10.535  459.572   11.109 -22.97879 15.31038 
1 1 1   14    7   51 o   95.141   23.530   7.5741   3.4075   9.4413   5.0037   5.9594   4.6532  104.968   29.771   86.522   29.406 18.44604 41.84529 
1 1 1   14    7   52 o  346.461   9.2080   92.680   4.8830  103.183   8.4644   87.441   5.9781  362.801   15.243  335.647   11.636 27.15424 19.17645 
1 1 1   14    7   53 o   71.629   26.613   3.5443   3.8917   2.7928   5.6399   4.2275   5.3769   75.878   30.891   80.207   30.940 -4.328957 43.72153 
1 1 1   14    7   54 o  301.728   9.8185   70.517   4.5345   66.275   6.2628   75.191   6.5740  290.684   14.076  309.731   13.867 -19.04718 19.75909 
1 1 1   14    7   55 o   81.709   28.789   5.3568   4.4757   13.270   6.6322  -1.2601   6.0649  119.988   34.359   65.257   29.275 54.73145 45.13947 
1 1 1   14    7   56 o  261.778   13.458   54.036   5.3741   52.311   6.7987   56.908   8.7739  254.967   17.527  262.326   22.056 -7.358826 28.17243 
1 1 1   14    7   57 o  186.618   14.643   27.763   4.1492   25.958   5.3014   30.618   6.6661  177.502   19.853  190.452   23.357 -12.95018 30.65401 
1 1 1   14    7   58 o   95.668   24.230   8.0668   3.5520   8.7903   4.9160   7.2765   5.1378   97.619   29.999   89.989   30.896 7.629913 43.06391 
1 1 1   14    7   59 o   83.482   25.742   6.2431   3.6162   0.6567   4.6310   14.972   5.7888   61.096   26.562  125.742   30.410 -64.64566 40.37712 
1 1 1   14    7   60 o   74.908   25.058   4.9250   3.3783   6.1930   4.5090   3.3024   5.1009   82.559   28.909   71.421   29.262 11.13853 41.13372 
1 1 1   14    8    0 o  380.022   6.6208  110.638   3.8485  110.638   3.8485  110.638   3.8485  380.022   6.6208  380.022   6.6208 0.000000 0.000000 
1 1 1   14    8    1 o  764.827   5.9138  447.767   6.9230  433.807   9.5185  463.446   10.088  752.740   8.2614  778.022   8.4708 -25.28192 11.83238 
1 1 1   14    8    2 o  689.815   7.9166  364.299   8.3587   0.0000   0.0000  364.299   8.3587  ?   ?   689.815   7.9166 0.000000 7.916572 
1 1 1   14    8    3 f  932.881   9.5758  666.369   13.673  658.905   18.817  674.717   19.902  927.425   13.256  938.444   13.855 -11.01904 19.17519 
1 1 1   14    8    4 o  1202.96   9.4504  1108.05   17.401  1077.77   20.544  1184.92   32.733  1186.29   11.314  1243.28   17.201 -56.99487 20.58829 
1 1 1   14    8    5 o  531.670   7.7572  216.404   6.3127  212.419   8.6329  220.984   9.2545  526.673   10.709  537.168   11.256 -10.49493 15.53616 
1 1 1   14    8    6 o  189.129   10.936   27.484   3.1524   33.006   4.3431   21.336   4.5828  207.110   13.779  165.808   18.366 41.30170 22.96004 
1 1 1   14    8    7 o  768.692   7.3815  452.346   8.6850  448.988   10.534  459.474   15.347  765.779   8.9871  774.489   12.946 -8.709961 15.75972 
1 1 1   14    8    8 o  1265.01   10.093  1225.35   19.542  1224.86   23.915  1226.33   33.903  1264.58   12.355  1264.82   17.512 -0.2381592 21.43218 
1 1 1   14    8    9 o  681.561   8.6363  355.649   9.0095  355.649   9.0095   0.0000   0.0000  681.561   8.6363  ?   ?  0.000000 8.636292 
1 1 1   14    8   10 o  1167.60   8.1654  1043.71   14.593  1042.52   16.732  1047.51   29.829  1166.86   9.3681  1169.07   16.670 -2.203857 19.12161 
1 1 1   14    8   11 o  636.084   5.8752  309.705   5.7202  312.912   6.5347  299.194   11.831  639.352   6.6776  625.000   12.367 14.35126 14.05478 
1 1 1   14    8   12 o  1095.96   7.8649  919.544   13.193  928.227   15.287  894.195   26.120  1101.06   9.0706  1080.20   15.798 20.85986 18.21691 
1 1 1   14    8   13 o  364.730   5.1494  101.823   2.8747  101.415   3.5727  102.572   4.8416  363.985   6.4127  366.021   8.6420 -2.035919 10.76137 
1 1 1   14    8   14 o  495.200   5.1863  187.701   3.9310  181.708   4.8852  198.710   6.6211  487.209   6.5508  509.451   8.4910 -22.24182 10.72431 
1 1 1   14    8   15 o  410.159   5.5470  128.772   3.4824  125.433   5.5553  130.934   4.4696  404.748   8.9671  413.565   7.0609 -8.816803 11.41332 
1 1 1   14    8   16 o  822.300   6.8563  517.634   8.6295  507.943   16.698  521.165   10.080  814.244   13.398  825.059   7.9819 -10.81500 15.59539 
1 1 1   14    8   17 o  677.197   5.7713  351.043   5.9822  343.933   7.5021  363.456   9.9132  670.262   7.3125  688.948   9.4007 -18.68561 11.90990 
1 1 1   14    8   18 o  217.468   7.7843   36.208   2.5911   42.389   3.3766   27.355   4.0410  235.278   9.3762  188.412   14.115 46.86615 16.94537 
1 1 1   14    8   19 o  1129.79   6.7873  977.168   11.737  983.678   16.632  970.710   16.566  1133.37   9.5876  1125.87   9.6129 7.497681 13.57677 
1 1 1   14    8   20 o  1289.64   6.8544  1273.28   13.530  1284.17   20.926  1265.46   17.736  1294.85   10.559  1285.52   9.0140 9.327148 13.88286 
1 1 1   14    8   21 o  478.636   4.9205  175.359   3.6048  187.798   6.0088  168.365   4.5057  495.249   7.9267  468.967   6.2769 26.28259 10.11101 
1 1 1   14    8   22 o  382.620   8.9082  112.110   5.2171  112.110   5.2171   0.0000   0.0000  382.620   8.9082  ?   ?  0.000000 8.908214 
1 1 1   14    8   23 o  196.844   7.8536   29.669   2.3662   26.227   4.1618   31.314   2.8764  184.354   14.876  202.204   9.2937 -17.85080 17.54013 
1 1 1   14    8   24 o  487.549   5.2656  181.962   3.9295  177.684   6.3813  184.576   4.9872  481.682   8.6553  491.002   6.6360 -9.319366 10.90642 
1 1 1   14    8   25 o  277.250   7.5150   58.859   3.1891   64.299   5.1891   55.557   4.0427  289.671   11.704  269.311   9.8073 20.35950 15.26943 
1 1 1   14    8   26 o  713.316   5.8695  389.541   6.4085  374.346   11.197  396.944   7.8150  699.003   10.465  720.005   7.0913 -21.00146 12.64164 
1 1 1   14    8   27 o  907.898   5.8956  631.069   8.1928  652.811   13.228  617.539   10.435  923.142   9.3617  898.002   7.5920 25.14038 12.05322 
1 1 1   14    8   28 o  517.828   6.6550  205.323   5.2748  202.067   14.611  205.811   5.6562  512.792   18.615  518.423   7.1281 -5.631348 19.93349 
1 1 1   14    8   29 o  698.670   5.7156  373.740   6.1123  371.191   9.8810  375.319   7.7792  696.040   9.2746  700.053   7.2600 -4.012634 11.77821 
1 1 1   14    8   30 o  461.142   6.0833  162.834   4.2938  166.805   7.3529  160.779   5.2894  466.494   10.298  458.156   7.5426 8.338409 12.76460 
1 1 1   14    8   31 o  295.068   7.7006   66.698   3.4779   60.144   6.3812   69.467   4.1482  279.419   14.975  301.078   9.0013 -21.65851 17.47186 
1 1 1   14    8   32 o  460.543   5.7331  162.422   4.0414  164.434   6.1611  160.902   5.3542  463.203   8.6900  458.276   7.6330 4.927582 11.56625 
1 1 1   14    8   33 o  258.297   7.5893   51.121   3.0005   58.417   4.7161   46.160   3.8891  275.922   11.167  245.317   10.358 30.60500 15.23065 
1 1 1   14    8   34 f  316.979   8.7907   77.033   4.2650   78.064   5.0037   74.295   8.1558  318.990   10.248  310.032   17.255 8.957825 20.06898 
1 1 1   14    8   35 o  425.264   5.9024  138.531   3.8420  149.381   5.8516  130.310   5.0937  441.374   8.6616  412.291   8.0715 29.08334 11.83950 
1 1 1   14    8   36 o  186.473   10.801   26.789   3.0697   30.062   4.3487   23.539   4.3337  197.072   14.519  173.942   16.474 23.12981 21.95856 
1 1 1   14    8   37 o  230.829   9.0443   40.883   3.1955   40.870   4.4204   40.897   4.6246  230.175   12.595  230.166   13.182 0.9048462E-02 18.23144 
1 1 1   14    8   38 o   52.580   21.455   0.8220   2.7283  -6.1222   3.6534   9.5779   4.1024   39.713   19.264  108.581   25.174 -68.86818 31.69940 
1 1 1   14    8   39 o  362.226   6.4018  100.572   3.5494  101.422   5.3957   99.924   4.7125  363.385   9.7009  360.838   8.5324 2.546600 12.91935 
1 1 1   14    8   40 o  598.438   6.6929  274.596   6.1306  274.254   12.766  274.699   6.9892  596.181   13.990  598.381   7.6310 -2.200134 15.93560 
1 1 1   14    8   41 o  327.500   7.4454   82.295   3.7322   84.245   6.4252   81.302   4.5851  330.554   12.699  325.298   9.2086 5.256134 15.68649 
1 1 1   14    8   42 o  143.682   12.854   16.056   2.7969   15.516   4.1639   16.501   3.7756  139.626   20.059  144.736   17.391 -5.109726 26.54820 
1 1 1   14    8   43 o  159.598   14.021   19.855   3.3905   18.099   6.6043   20.483   3.9508  147.658   30.239  161.644   16.186 -13.98573 34.29807 
1 1 1   14    8   44 o  190.636   10.802   28.101   3.1389   25.074   4.8739   30.246   4.1032  178.353   18.104  197.207   13.678 -18.85385 22.69052 
1 1 1   14    8   45 o  264.557   8.8775   53.845   3.5948   56.918   5.0980   50.805   5.0698  271.359   12.274  255.905   12.986 15.45450 17.86851 
1 1 1   14    8   46 o  188.423   12.550   27.590   3.5987   27.182   4.7484   28.140   5.5163  185.890   16.872  188.352   19.412 -2.461899 25.72001 
1 1 1   14    8   47 o  292.237   8.8184   65.745   3.9445   68.009   5.8108   63.810   5.3719  296.262   12.814  287.130   12.223 9.131989 17.70884 
1 1 1   14    8   48 o  353.546   7.6255   96.110   4.1265   91.915   6.1137   99.621   5.5926  344.688   11.588  359.291   10.170 -14.60303 15.41756 
1 1 1   14    8   49 o  194.500   11.720   29.398   3.4728   26.000   5.1798   32.173   4.6806  180.610   19.023  202.480   15.214 -21.86923 24.35844 
1 1 1   14    8   50 o   51.018   22.532  -0.7730   3.4519  -0.8466   4.7062  -0.6874   5.0785   59.653   26.329   62.450   27.466 -2.796661 38.04759 
1 1 1   14    8   51 o  167.167   14.289   21.969   3.6211   22.813   5.7343   21.409   4.6701  166.987   23.049  163.360   19.034 3.627350 29.89263 
1 1 1   14    8   52 o   52.523   23.142  -0.6518   3.6203  -2.1388   5.7535   0.3229   4.6581   62.319   28.185   62.697   26.946 -0.3776131 38.99341 
1 1 1   14    8   53 o  242.659   10.885   45.686   4.0430   48.781   6.7446   43.950   5.0511  247.298   17.940  236.565   14.012 10.73303 22.76390 
1 1 1   14    8   54 o  108.724   24.323   10.061   3.9465   5.9940   5.2373   15.406   6.0033   86.756   31.080  132.093   30.332 -45.33694 43.42834 
1 1 1   14    8   55 o  222.715   13.951   39.157   4.7318   29.015   6.9612   47.868   6.4514  185.253   25.204  244.343   17.363 -59.08994 30.60576 
1 1 1   14    8   56 o   92.534   25.677   7.4695   3.7650   9.5512   5.1243   5.0276   5.5501  102.872   30.419   82.285   31.512 20.58717 43.79869 
1 1 1   14    8   57 o   96.747   25.625   8.2545   3.8549   8.9660   4.8067   6.9721   6.4532   99.452   29.474   91.030   34.181 8.422058 45.13401 
1 1 1   14    8   58 o  190.958   13.094   28.973   3.8042   31.090   5.3975   26.883   5.3625  194.499   18.347  179.742   19.821 14.75609 27.00916 
1 1 1   14    8   59 o  210.341   13.267   35.309   4.2494   27.670   5.8609   43.775   6.1700  180.050   21.704  230.798   17.598 -50.74812 27.94233 
1 1 1   14    8   60 o   66.462   24.803   3.4461   3.3877  -1.2726   4.5396   9.3767   5.0893   54.476   24.794   98.113   30.585 -43.63644 39.37271 
1 1 1   14    9    0 o  263.833   7.0422   53.393   2.8393   53.393   2.8393   53.393   2.8393  263.833   7.0422  263.833   7.0422 0.000000 0.000000 
1 1 1   14    9    1 o  613.767   5.3391  288.345   5.0158  291.262   7.1330  285.492   7.0545  616.815   7.5552  610.676   7.5472 6.139404 10.67902 
1 1 1   14    9    2 o  1070.72   8.6157  877.733   14.120  846.949   23.420  895.313   17.698  1051.39   14.553  1081.27   10.694 -29.88464 18.05959 
1 1 1   14    9    3 o  850.616   9.0858  553.986   11.830  549.919   16.244  558.578   17.261  847.320   12.525  853.925   13.206 -6.604797 18.20115 
1 1 1   14    9    4 o  1065.90   8.6471  869.848   14.108  852.216   16.743  913.018   26.198  1054.95   10.369  1091.53   15.680 -36.58240 18.79855 
1 1 1   14    9    5 o  1001.42   8.3051  767.778   12.730  765.376   15.351  773.068   22.778  999.773   10.032  1004.47   14.815 -4.694214 17.89231 
1 1 1   14    9    6 o   83.295   12.296   5.4288   1.5206   5.4487   1.6178   5.2780   4.4529   83.331   13.118   85.688   28.768 -2.356865 31.61782 
1 1 1   14    9    7 o  499.986   5.4048  191.347   4.1362  189.863   4.5980  197.643   9.4701  498.034   6.0317  507.985   12.180 -9.951324 13.59129 
1 1 1   14    9    8 o  1071.20   8.8417  878.537   14.497  878.537   14.497   0.0000   0.0000  1071.20   8.8417  ?   ?  0.000000 8.841655 
1 1 1   14    9    9 o  1067.38   11.000  872.482   17.971  872.482   17.971   0.0000   0.0000  1067.38   11.000  ?   ?  0.000000 10.99958 
1 1 1   14    9   10 o  447.974   5.4633  153.608   3.7461  153.997   4.1512  151.903   8.6941  448.532   6.0465  445.323   12.755 3.209137 14.11558 
1 1 1   14    9   11 o  1050.62   7.6340  845.024   12.276  846.382   14.087  840.737   25.028  1051.41   8.7537  1047.43   15.611 3.985107 17.89767 
1 1 1   14    9   12 o  810.567   6.6028  502.946   8.1919  503.309   9.3382  501.732   17.065  810.831   7.5243  809.263   13.777 1.567200 15.69784 
1 1 1   14    9   13 o  536.583   5.2316  220.384   4.2967  222.428   5.4077  216.883   7.0764  539.042   6.5543  532.232   8.6864 6.810669 10.88174 
1 1 1   14    9   14 o  311.905   6.2287   74.470   2.9737   72.209   3.2359   86.747   7.5404  307.126   6.8835  336.463   14.641 -29.33615 16.17887 
1 1 1   14    9   15 o  989.628   8.8880  749.875   13.463  742.854   16.248  765.256   24.048  984.875   10.778  999.224   15.723 -14.34937 19.06300 
1 1 1   14    9   16 o  1209.68   9.8377  1120.57   18.215  1108.77   21.756  1148.21   33.310  1203.13   11.814  1223.67   17.785 -20.54053 21.35088 
1 1 1   14    9   17 o  1204.94   7.0317  1111.50   12.969  1109.70   18.175  1113.37   18.510  1203.78   9.8643  1205.76   10.030 -1.979614 14.06762 
1 1 1   14    9   18 o  982.243   6.2329  738.570   9.3709  745.161   13.277  732.028   13.228  986.488   8.7932  977.753   8.8387 8.735046 12.46765 
1 1 1   14    9   19 o  489.855   5.3439  183.680   4.0068  183.829   5.5945  183.523   5.7413  490.007   7.4591  489.593   7.6614 0.4135742 10.69274 
1 1 1   14    9   20 o  513.474   5.3992  201.823   4.2435  212.161   6.1489  192.423   5.8636  526.404   7.6314  501.319   7.6415 25.08450 10.79961 
1 1 1   14    9   21 o  589.609   5.9607  266.126   5.3794  267.231   7.0726  264.610   8.2859  590.773   7.8215  587.815   9.2094 2.957947 12.08256 
1 1 1   14    9   22 o  1027.44   6.5491  808.166   10.299  819.095   14.735  797.726   14.401  1034.17   9.3086  1020.60   9.2189 13.57269 13.10114 
1 1 1   14    9   23 o  419.705   5.3163  134.845   3.4153  130.585   5.5591  137.427   4.3284  412.935   8.7954  423.675   6.6746 -10.74039 11.04125 
1 1 1   14    9   24 o  340.698   6.9223   88.873   3.6098   82.342   6.1152   92.365   4.4722  327.791   12.188  347.292   8.4130 -19.50070 14.80997 
1 1 1   14    9   25 o  852.052   6.6711  555.853   8.7003  544.009   13.810  563.648   11.203  842.639   10.707  857.888   8.5319 -15.24890 13.69081 
1 1 1   14    9   26 o  361.461   6.1292  100.031   3.3911   88.462   5.7285  106.271   4.2075  339.768   11.015  372.533   7.3788 -32.76459 13.25823 
1 1 1   14    9   27 o  644.168   5.5129  317.679   5.4356  316.355   8.8084  318.493   6.9077  642.644   8.9548  644.925   6.9977 -2.281738 11.36470 
1 1 1   14    9   28 o  178.288   11.760   24.474   3.1912   8.3293   9.8928   26.349   3.3714  115.314   42.512  185.002   11.970 -69.68799 44.16528 
1 1 1   14    9   29 o  574.673   5.6575  252.857   4.9764  254.523   8.2507  251.905   6.2390  576.341   9.3528  573.516   7.1072 2.824646 11.74677 
1 1 1   14    9   30 o   76.052   22.134   4.5452   2.7324   1.3434   5.4081   5.6426   3.1662   73.087   30.058   84.323   23.600 -11.23591 38.21617 
1 1 1   14    9   31 o  208.261   9.6047   33.247   3.0617   32.289   5.7606   33.625   3.6145  203.944   18.661  209.067   11.337 -5.123001 21.83487 
1 1 1   14    9   32 o  665.536   5.7342  339.206   5.8414  352.365   9.7274  331.784   7.3052  677.957   9.3740  658.088   7.2523 19.86969 11.85193 
1 1 1   14    9   33 o  388.446   7.5108  115.621   4.4657  115.639   6.7033  115.607   5.9879  388.175   11.282  388.231   10.077 -0.5563354E-01 15.12699 
1 1 1   14    9   34 o  361.721   9.0666  100.336   5.0198   99.452   6.6581  101.501   7.6412  359.844   12.088  363.344   13.740 -3.500183 18.30035 
1 1 1   14    9   35 o  117.358   16.173   10.811   2.8280   9.6957   4.0271   11.896   3.9722  109.554   24.616  122.060   22.074 -12.50627 33.06353 
1 1 1   14    9   36 o  335.962   7.0349   86.509   3.6176   83.091   4.9939   90.283   5.2475  329.017   9.9164  342.953   9.9964 -13.93665 14.08062 
1 1 1   14    9   37 o  232.728   8.3568   41.546   2.9769   46.236   4.4685   37.804   3.9915  245.224   11.905  221.436   11.819 23.78853 16.77588 
1 1 1   14    9   38 o  280.569   7.9528   60.382   3.4153   64.755   4.7520   55.710   4.9119  290.285   10.695  269.114   11.924 21.17068 16.01810 
1 1 1   14    9   39 o  243.456   8.1660   45.481   3.0430   46.603   4.8500   44.752   3.9079  245.619   12.946  241.281   10.582 4.337769 16.72049 
1 1 1   14    9   40 o  321.157   7.8316   79.146   3.8498   89.043   7.6798   75.824   4.4492  339.492   14.779  314.180   9.2519 25.31210 17.43624 
1 1 1   14    9   41 o  177.143   10.523   24.226   2.8404   20.963   4.2659   26.825   3.8071  163.462   17.314  185.939   13.468 -22.47728 21.93516 
1 1 1   14    9   42 o  126.839   14.271   12.596   2.7226   11.659   4.1433   13.308   3.6117  119.786   23.437  129.404   18.783 -9.618553 30.03556 
1 1 1   14    9   43 o   65.311   23.912   2.7802   3.1221   3.0745   6.4470   2.6900   3.5684   82.623   33.245   67.132   25.373 15.49134 41.82099 
1 1 1   14    9   44 o   71.333   22.320   4.0008   2.7075   12.151   4.2514  -1.5604   3.5117  121.974   23.625   49.286   22.180 72.68761 32.40491 
1 1 1   14    9   45 o  149.193   13.877   17.399   3.1326   17.398   4.3539   17.400   4.5106  147.638   19.763  147.403   20.551 0.2347260 28.51153 
1 1 1   14    9   46 o  202.418   12.133   31.799   3.7418   32.185   4.6817   31.117   6.2259  202.854   15.189  197.558   20.907 5.296310 25.84161 
1 1 1   14    9   47 o  348.157   7.5327   93.172   4.0141  101.341   6.0291   86.667   5.3799  362.246   10.874  335.099   10.489 27.14615 15.10816 
1 1 1   14    9   48 o  295.749   8.4299   67.333   3.8161   60.381   5.5592   73.527   5.2477  278.942   13.021  308.391   11.117 -29.44962 17.12103 
1 1 1   14    9   49 o  196.412   11.661   29.979   3.4900   26.378   5.1952   32.942   4.7115  181.909   18.936  204.883   15.131 -22.97461 24.23880 
1 1 1   14    9   50 o  213.669   11.774   35.501   3.8359   41.104   5.2363   29.012   5.6354  228.856   15.032  190.368   19.621 38.48796 24.71744 
1 1 1   14    9   51 o  163.950   14.161   21.134   3.5188   25.622   5.4681   17.961   4.5971  178.249   20.410  148.753   20.756 29.49585 29.10984 
1 1 1   14    9   52 o   56.909   23.846   0.7725   3.4935   4.9978   5.7460  -1.7054   4.4002   84.702   32.152   54.836   24.738 29.86604 40.56780 
1 1 1   14    9   53 o  151.446   17.322   18.388   3.9432   17.607   5.2754   19.377   5.9359  144.920   24.666  151.153   26.629 -6.233582 36.29783 
1 1 1   14    9   54 o  186.446   13.208   27.342   3.7448   25.359   5.5250   29.027   5.0932  176.005   20.918  190.141   17.704 -14.13612 27.40448 
1 1 1   14    9   55 o   96.803   25.461   8.1336   3.8230   14.123   6.6815   5.2184   4.6614  123.310   34.203   81.199   29.295 42.11082 45.03363 
1 1 1   14    9   56 o  152.371   16.202   18.692   3.7208   18.317   5.1174   19.112   5.4195  146.985   23.541  149.608   24.516 -2.622665 33.98817 
1 1 1   14    9   57 o  113.281   24.503   11.192   4.1249   8.4711   4.7461   19.595   8.3399   96.640   29.436  140.247   37.935 -43.60768 48.01545 
1 1 1   14    9   58 f   77.666   26.570   5.1722   3.7991   0.2933   4.6909   14.472   6.4765   60.581   26.527  121.703   33.643 -61.12172 42.84276 
1 1 1   14    9   59 o   78.254   24.653   5.4261   3.2967   5.3030   4.4229   5.5801   4.9454   78.526   28.504   80.602   29.990 -2.075691 41.37488 
1 1 1   14    9   60 o   82.870   25.215   6.2596   3.4841   5.0500   4.5420   7.9888   5.4308   76.868   28.713   90.855   31.732 -13.98723 42.79426 
1 1 1   14   10    0 o  270.776   7.1417   56.237   2.9553   56.237   2.9553   56.237   2.9553  270.776   7.1417  270.776   7.1417 0.000000 0.000000 
1 1 1   14   10    1 o  433.523   5.7594  143.860   3.8217  139.386   6.5868  146.130   4.6923  426.651   10.086  436.912   7.0165 -10.26117 12.28678 
1 1 1   14   10    2 o  680.163   8.1160  354.173   8.4494  348.699   11.555  360.464   12.387  674.781   11.188  686.044   11.796 -11.26324 16.25766 
1 1 1   14   10    3 o  1145.08   9.1357  1003.93   16.012  989.200   19.155  1038.10   29.173  1136.54   11.011  1163.84   16.376 -27.30249 19.73399 
1 1 1   14   10    4 o  605.251   6.3699  280.416   5.9012  277.498   6.9452  287.995   11.191  602.067   7.5365  613.211   11.923 -11.14410 14.10548 
1 1 1   14   10    5 o  1881.82   13.880  2712.92   39.979  2728.09   49.150  2683.24   68.727  1886.60   17.021  1869.62   24.016 16.97693 29.43598 
1 1 1   14   10    6 o  877.811   7.7268  589.899   10.382  589.600   12.460  590.577   18.776  877.528   9.2763  878.005   13.971 -0.4765015 16.77024 
1 1 1   14   10    7 o  1641.74   10.723  2064.02   26.947  2088.75   31.479  1996.20   52.126  1651.38   12.454  1613.15   21.111 38.23145 24.51092 
1 1 1   14   10    8 o  1165.70   11.693  1040.71   20.863  1040.71   20.863   0.0000   0.0000  1165.70   11.693  ?   ?  0.000000 11.69293 
1 1 1   14   10    9 o  458.113   6.9065  160.656   4.8428  165.918   5.8333  148.985   8.6873  465.531   8.1865  441.021   12.869 24.51022 15.25253 
1 1 1   14   10   10 o  871.463   8.0942  581.423   10.797  578.625   13.090  587.377   19.095  869.290   9.8381  875.587   14.248 -6.296997 17.31437 
1 1 1   14   10   11 o  1552.17   10.285  1844.90   24.436  1852.59   28.259  1822.08   48.654  1555.25   11.871  1541.18   20.625 14.06982 23.79712 
1 1 1   14   10   12 f  191.028   7.2327   27.936   2.1148   28.396   2.2545   24.564   6.1015  192.592   7.6480  177.419   23.010 15.17230 24.24766 
1 1 1   14   10   13 o  519.931   5.8507  206.928   4.6561  204.614   5.1618  217.031   10.786  517.004   6.5228  532.255   13.240 -15.25104 14.75939 
1 1 1   14   10   14 o  275.343   7.4069   58.041   3.1216   61.386   4.4306   54.743   4.3989  283.126   10.224  267.358   10.749 15.76834 14.83487 
1 1 1   14   10   15 o  650.463   6.2103  323.884   6.1831  309.261   8.0836  344.504   9.5989  635.549   8.3097  670.748   9.3496 -35.19855 12.50864 
1 1 1   14   10   16 o  353.514   5.8393   95.664   3.1596   96.215   3.9000   94.613   5.3899  354.509   7.1873  351.492   10.018 3.017944 12.32986 
1 1 1   14   10   17 o  282.533   6.6597   61.109   2.8800   62.447   3.5478   58.523   4.9317  285.589   8.1162  276.405   11.657 9.183655 14.20411 
1 1 1   14   10   18 o  223.352   7.5852   38.194   2.5931   41.854   3.9340   35.382   3.4483  233.757   10.995  214.934   10.482 18.82266 15.19077 
1 1 1   14   10   19 f  820.662   5.7915  515.556   7.2749  516.016   10.183  515.077   10.397  820.931   8.1040  820.176   8.2818 0.7554932 11.58717 
1 1 1   14   10   20 o  653.968   5.4935  327.380   5.4989  329.493   7.7224  325.207   7.8321  656.001   7.6909  651.715   7.8515 4.286560 10.99071 
1 1 1   14   10   21 o  398.549   6.2575  121.602   3.8173  119.370   5.0198  124.663   5.8782  394.827   8.3064  403.450   9.5188 -8.623352 12.63343 
1 1 1   14   10   22 o  402.592   6.0021  124.080   3.6986  126.555   5.2809  121.698   5.1817  406.524   8.4869  398.648   8.4921 7.876709 12.00596 
1 1 1   14   10   23 o  199.173   11.588   30.499   3.5174   34.721   4.9001   26.012   5.0521  212.238   15.184  183.184   18.262 29.05342 23.74972 
1 1 1   14   10   24 o  207.739   9.4423   33.056   3.0024   31.871   4.4587   34.038   4.0611  203.360   14.418  210.353   12.672 -6.992447 19.19537 
1 1 1   14   10   25 o  332.837   7.0446   84.825   3.5889   83.119   5.2937   86.275   4.8821  329.372   10.500  335.602   9.5041 -6.230194 14.16289 
1 1 1   14   10   26 o  223.654   8.0628   38.309   2.7601   37.805   5.0468   38.524   3.2969  221.481   14.975  224.248   9.6052 -2.767090 17.79074 
1 1 1   14   10   27 o  435.659   5.7281  145.313   3.8197  146.288   6.4549  144.788   4.7383  436.960   9.6512  434.825   7.1193 2.135376 11.99289 
1 1 1   14   10   28 o  412.523   6.8252  130.318   4.3096  167.056   13.399  126.079   4.5514  466.115   18.781  405.739   7.3287 60.37592 20.16005 
1 1 1   14   10   29 o  563.168   5.6039  242.839   4.8306  245.881   8.0482  241.126   6.0394  566.454   9.2825  561.103   7.0320 5.351074 11.64538 
1 1 1   14   10   30 o  232.204   8.2401   41.312   2.9287   48.778   5.4903   38.342   3.4624  251.626   14.314  223.639   10.115 27.98753 17.52745 
1 1 1   14   10   31 o  539.489   5.7911  222.883   4.7821  223.589   7.9656  222.484   5.9795  540.045   9.6365  538.911   7.2490 1.133606 12.05859 
1 1 1   14   10   32 o  196.455   12.034   29.736   3.6011   24.747   5.3977   33.739   4.8343  177.956   20.173  208.913   15.223 -30.95692 25.27211 
1 1 1   14   10   33 o  205.194   11.118   32.409   3.4789   36.666   5.3550   29.301   4.5762  217.633   16.191  194.521   15.498 23.11261 22.41347 
1 1 1   14   10   34 o  295.353   10.021   66.933   4.5302   63.309   5.8991   72.143   7.0727  286.953   13.431  306.133   15.094 -19.18030 20.20451 
1 1 1   14   10   35 o  781.887   5.9868  468.350   7.1649  479.441   11.726  461.742   9.0508  790.440   9.6923  776.108   7.6190 14.33173 12.32841 
1 1 1   14   10   36 o  132.436   14.240   13.661   2.8413   19.287   5.6717   11.776   3.2829  155.484   24.655  122.138   18.109 33.34634 30.59080 
1 1 1   14   10   37 o  340.506   8.0229   88.929   4.1814   94.494   7.0495   85.908   5.1937  350.352   13.146  334.453   10.146 15.89935 16.60546 
1 1 1   14   10   38 o  313.649   7.6128   75.452   3.6547   74.964   7.2085   75.621   4.2401  311.641   15.112  313.883   8.8255 -2.241760 17.50022 
1 1 1   14   10   39 o  179.910   11.303   24.998   3.0968   26.656   6.5688   24.525   3.5115  183.014   24.030  177.931   12.983 5.082687 27.31342 
1 1 1   14   10   40 o  472.602   6.6301  171.274   4.7961  187.033   9.2476  165.476   5.6095  492.686   12.263  464.341   7.8925 28.34427 14.58307 
1 1 1   14   10   41 o  362.245   6.5817  100.642   3.6493  106.761   5.6076   96.148   4.8063  372.600   9.8325  353.752   8.8765 18.84784 13.24652 
1 1 1   14   10   42 o  185.136   11.536   26.522   3.2528   32.335   6.6236   24.674   3.7341  201.875   21.781  178.115   13.805 23.75943 25.78703 
1 1 1   14   10   43 f  168.441   13.074   22.064   3.3445   13.868   6.8046   24.675   3.8403  127.925   34.123  177.935   14.219 -50.00988 36.96712 
1 1 1   14   10   44 o  336.065   7.0554   86.714   3.6292   89.418   5.5702   84.719   4.7840  340.557   10.686  331.760   9.4211 8.797302 14.24591 
1 1 1   14   10   45 o   60.253   22.910   2.1095   2.9205   6.0248   4.2074  -1.5311   4.0572   86.953   27.899   53.560   23.992 33.39250 36.79639 
1 1 1   14   10   46 o  351.441   8.6582   95.048   4.6574  100.053   6.0378   87.696   7.3187  359.977   10.958  336.001   14.231 23.97531 17.96080 
1 1 1   14   10   47 o  267.906   8.7871   55.263   3.6033   52.301   5.5447   57.428   4.7408  259.056   14.036  272.551   11.364 -13.49472 18.05950 
1 1 1   14   10   48 o   68.730   23.721   3.5068   3.0305   8.3714   4.4609  -0.6626   4.1298   99.788   28.043   56.526   24.817 43.26178 37.44676 
1 1 1   14   10   49 o  180.713   13.389   25.529   3.6770   26.665   4.8350   23.971   5.6626  183.402   17.433  172.053   22.007 11.34956 28.07505 
1 1 1   14   10   50 o  231.218   10.148   41.321   3.5914   41.769   5.3083   40.942   4.8770  230.632   15.121  228.742   13.997 1.889633 20.60480 
1 1 1   14   10   51 o  239.894   11.925   44.688   4.3789   49.838   6.2500   39.722   6.1370  251.272   16.339  223.428   18.101 27.84430 24.38460 
1 1 1   14   10   52 o  238.126   12.294   44.242   4.4655   45.260   6.3205   43.228   6.3099  238.587   17.428  232.940   17.833 5.646423 24.93477 
1 1 1   14   10   53 o  144.689   16.155   16.718   3.5167   18.871   5.1585   14.848   4.8068  150.783   23.086  132.758   24.559 18.02510 33.70670 
1 1 1   14   10   54 o  131.479   19.994   14.208   3.8969   30.961   7.2585   7.4232   4.6191  191.706   25.359   92.677   29.178 99.02853 38.65837 
1 1 1   14   10   55 o  103.239   21.882   9.0200   3.3504   7.1661   4.8425   10.722   4.6403   90.927   29.985  110.225   27.573 -19.29853 40.73554 
1 1 1   14   10   56 o   86.818   25.125   6.5490   3.5296   6.7357   4.7746   6.3241   5.2412   88.199   29.789   86.832   31.093 1.367607 43.05989 
1 1 1   14   10   57 o  200.962   13.221   32.033   4.0439   31.722   5.1005   32.560   6.6357  197.734   17.018  196.343   22.486 1.390457 28.19963 
1 1 1   14   10   58 o  114.317   20.842   11.167   3.5124   19.160   4.7275   1.3188   5.2478  150.246   21.142   66.254   28.539 83.99181 35.51699 
1 1 1   14   10   59 o   42.860   20.180  -2.9129   3.4142  -3.0438   4.4755  -2.7306   5.2805   49.973   23.394   55.407   25.762 -5.433861 34.79854 
1 1 1   14   11    0 o  1266.48   17.121  1229.15   33.176  1229.15   33.176  1229.15   33.176  1266.48   17.121  1266.48   17.121 0.000000 0.000000 
1 1 1   14   11    1 o  707.733   5.8343  383.403   6.3201  379.334   8.8447  387.647   9.0343  703.906   8.2092  711.575   8.2947 -7.668945 11.67018 
1 1 1   14   11    2 o  998.958   8.2911  763.994   12.677  761.888   15.381  768.456   22.387  997.495   10.074  1001.49   14.604 -3.998779 17.74164 
1 1 1   14   11    3 o  841.199   7.4562  541.706   9.6003  534.698   11.460  558.201   17.581  835.686   8.9589  853.631   13.456 -17.94427 16.16550 
1 1 1   14   11    4 o  752.486   7.0524  433.461   8.1228  439.010   9.8589  421.733   14.333  757.242   8.5060  742.023   12.620 15.21930 15.21875 
1 1 1   14   11    5 o  300.695   6.3762   69.213   2.9347   69.807   3.3115   67.039   6.3345  301.974   7.1644  295.814   13.990 6.160309 15.71795 
1 1 1   14   11    6 o  1005.12   8.4563  773.459   13.010  774.678   15.722  770.809   23.171  1005.82   10.212  1002.98   15.093 2.844604 18.22315 
1 1 1   14   11    7 o  626.063   6.6161  300.039   6.3400  300.039   6.3400   0.0000   0.0000  626.063   6.6161  ?   ?  0.000000 6.616086 
1 1 1   14   11    8 o  655.451   7.1765  328.883   7.1999  327.804   8.6651  331.288   12.940  654.333   8.6518  657.641   12.855 -3.307129 15.49520 
1 1 1   14   11    9 o  805.520   7.7745  496.748   9.5855  491.735   11.519  508.038   17.285  801.383   9.3909  814.326   13.868 -12.94281 16.74821 
1 1 1   14   11   10 f  242.396   8.9018   44.987   3.3027   47.048   3.8404   39.133   6.4721  247.870   10.122  225.106   18.960 22.76428 21.49330 
1 1 1   14   11   11 o  610.189   7.3067  285.037   6.8243  286.533   8.2450  281.783   12.160  611.745   8.8055  606.489   13.099 5.255981 15.78375 
1 1 1   14   11   12 o  627.818   7.4681  301.752   7.1765  295.025   8.4705  318.865   13.509  620.737   8.9152  645.125   13.681 -24.38800 16.32952 
1 1 1   14   11   13 o  1046.11   9.1461  837.945   14.645  835.892   17.801  842.243   25.763  1044.70   11.132  1048.23   16.057 -3.534668 19.53825 
1 1 1   14   11   14 o  333.083   5.7259   84.925   2.9192   83.688   3.5155   87.671   5.2391  330.633   6.9467  338.351   10.116 -7.718201 12.27164 
1 1 1   14   11   15 o  1149.83   8.3020  1012.28   14.611  1028.06   20.613  996.344   20.714  1158.51   11.625  1140.47   11.866 18.03113 16.61115 
1 1 1   14   11   16 o  902.106   7.2939  623.034   10.071  587.030   13.151  674.100   15.662  875.525   9.8134  938.140   10.907 -62.61438 14.67206 
1 1 1   14   11   17 o  1455.25   8.8844  1621.64   19.789  1615.42   25.290  1631.47   31.783  1452.19   11.378  1459.02   14.232 -6.820679 18.22075 
1 1 1   14   11   18 o  1186.78   7.7083  1078.37   14.002  1079.39   17.936  1076.77   22.406  1187.17   9.8705  1185.49   12.348 1.677856 15.80836 
1 1 1   14   11   19 o  1057.97   7.2119  856.960   11.679  870.846   15.170  836.758   18.298  1066.37   9.2943  1045.11   11.439 21.25671 14.73866 
1 1 1   14   11   20 o  579.110   5.8541  256.733   5.1891  256.353   6.7055  257.301   8.1928  578.627   7.5711  579.632   9.2345 -1.004395 11.94144 
1 1 1   14   11   21 o  249.019   8.3981   47.486   3.2010   50.504   4.5599   44.553   4.4945  256.742   11.604  240.817   12.234 15.92525 16.86132 
1 1 1   14   11   22 o  490.504   7.1200  184.213   5.3455  198.720   7.3423  167.852   7.7977  509.366   9.4175  468.074   10.884 41.29105 14.39257 
1 1 1   14   11   23 o  666.907   5.8007  340.493   5.9212  338.011   8.2724  343.100   8.4793  664.371   8.1349  669.346   8.2763 -4.975342 11.60489 
1 1 1   14   11   24 o  997.465   6.6088  761.771   10.090  757.590   14.137  766.113   14.406  994.512   9.2868  1000.08   9.4109 -5.567322 13.22161 
1 1 1   14   11   25 o  465.255   6.3010  165.732   4.4872  163.288   6.4441  168.033   6.2518  461.704   9.1187  468.381   8.7204 -6.677063 12.61728 
1 1 1   14   11   26 o  746.242   6.1401  426.375   7.0133  430.933   10.066  422.074   9.7772  750.049   8.7677  742.312   8.6052 7.737244 12.28504 
1 1 1   14   11   27 o  299.046   9.8163   68.526   4.4932   62.333   10.365   69.959   4.9860  283.324   24.132  302.118   10.782 -18.79410 26.43089 
1 1 1   14   11   28 o  558.487   7.0648  238.878   6.0392  239.109   10.812  238.774   7.2808  558.316   12.652  558.274   8.5205 0.4211426E-01 15.25367 
1 1 1   14   11   29 o  487.871   5.6971  182.253   4.2543  191.064   7.2728  177.670   5.2454  499.292   9.5165  481.627   7.1154 17.66479 11.88243 
1 1 1   14   11   30 o  399.909   7.3745  122.513   4.5140  122.755   6.4382  122.280   6.3307  400.101   10.513  399.339   10.357 0.7621460 14.75785 
1 1 1   14   11   31 o  411.465   7.4293  129.713   4.6790  136.241   6.7087  123.530   6.5291  421.469   10.399  401.307   10.629 20.16183 14.87040 
1 1 1   14   11   32 o  429.618   6.6423  141.393   4.3679  132.554   6.6158  148.224   5.8155  415.678   10.398  439.724   8.6405 -24.04614 13.51955 
1 1 1   14   11   33 o  199.257   11.864   30.598   3.6020   32.385   5.2029   28.953   4.9917  204.327   16.784  193.075   17.067 11.25249 23.93692 
1 1 1   14   11   34 o  331.759   6.7733   84.339   3.4395   89.060   5.9780   82.003   4.2052  340.523   11.469  327.022   8.4012 13.50024 14.21720 
1 1 1   14   11   35 o  304.716   7.1369   71.169   3.3287   68.233   5.9225   72.525   4.0245  297.840   12.991  307.503   8.5505 -9.663177 15.55264 
1 1 1   14   11   36 f  110.024   18.596   9.6183   3.0201   15.885   5.2770   6.5662   3.6828  140.546   25.468   90.433   25.503 50.11327 36.04184 
1 1 1   14   11   37 o  311.235   7.6161   74.288   3.6282   78.728   7.0610   72.695   4.2292  319.545   14.437  307.756   8.9781 11.78928 17.00067 
1 1 1   14   11   38 o  128.131   14.775   12.836   2.8446   10.281   5.9485   13.593   3.2389  112.287   32.653  131.587   16.440 -19.30032 36.55750 
1 1 1   14   11   39 o  138.274   14.183   14.909   2.9593   11.095   6.8852   15.774   3.2775  116.583   35.441  142.052   15.316 -25.46874 38.60905 
1 1 1   14   11   40 o  235.425   9.8450   42.612   3.5476   43.417   10.102   42.498   3.7889  232.010   29.087  235.035   10.532 -3.024124 30.93509 
1 1 1   14   11   41 o   50.256   21.325   0.1535   2.8514   4.2858   5.9842  -1.0602   3.2432   85.282   32.707   48.846   21.693 36.43616 39.24708 
1 1 1   14   11   42 o  145.581   13.881   16.541   3.0555   27.429   6.1825   13.022   3.5148  185.520   22.214  127.968   18.480 57.55190 28.89579 
1 1 1   14   11   43 o  334.314   7.6979   85.851   3.9391   88.004   7.2120   84.936   4.7025  337.062   13.979  332.257   9.2467 4.805237 16.76049 
1 1 1   14   11   44 o  133.875   13.933   14.037   2.8133   12.503   4.1293   15.366   3.8433  123.981   22.592  138.982   18.528 -15.00071 29.21767 
1 1 1   14   11   45 o  368.617   7.3537  104.386   4.1491  111.418   6.0173   98.013   5.7286  380.125   10.342  356.484   10.499 23.64023 14.73714 
1 1 1   14   11   46 o  113.544   20.014   10.437   3.3512   6.8764   4.5203   14.783   4.9937   91.879   28.855  133.858   25.300 -41.97922 38.37549 
1 1 1   14   11   47 o  333.004   7.4421   85.246   3.7933   88.031   5.8766   83.257   4.9665  337.398   11.379  328.541   9.8762 8.856842 15.06749 
1 1 1   14   11   48 o  288.694   8.2287   64.156   3.6361   62.166   5.5607   65.643   4.8060  283.008   12.837  291.418   10.774 -8.409668 16.75928 
1 1 1   14   11   49 o  242.327   10.273   45.379   3.8106   50.112   5.2882   40.268   5.4956  253.355   13.688  226.208   15.975 27.14676 21.03681 
1 1 1   14   11   50 o  134.949   17.771   14.592   3.5814   12.256   4.7593   17.641   5.4380  120.377   26.544  145.570   25.326 -25.19356 36.68760 
1 1 1   14   11   51 o   78.661   27.129   4.8100   3.9634   3.3624   5.1152   6.9848   6.2696   76.073   29.938   94.225   33.978 -18.15152 45.28533 
1 1 1   14   11   52 o  196.754   12.638   30.289   3.7859   40.413   6.4370   24.935   4.6811  224.518   18.907  176.620   17.548 47.89841 25.79557 
1 1 1   14   11   53 o  187.247   12.666   27.497   3.6088   32.981   5.3755   22.997   4.8692  203.031   17.468  168.500   19.224 34.53117 25.97427 
1 1 1   14   11   54 o   95.705   25.293   7.9131   3.7611  -3.8104   6.6835   13.346   4.5499   62.894   29.154  125.064   24.645 -62.16996 38.17469 
1 1 1   14   11   55 o  102.272   22.590   8.9183   3.4418   13.373   4.8361   4.3465   4.8995  123.877   26.317   77.696   29.643 46.18046 39.63963 
1 1 1   14   11   56 o   51.208   22.199   0.0453   3.2160   0.3988   4.5500  -0.3075   4.5461   60.905   26.403   58.676   25.889 2.228836 36.97804 
1 1 1   14   11   57 f  117.062   22.479   11.797   3.8814   11.557   4.5604   12.427   7.3932  113.402   26.713  111.463   37.064 1.938713 45.68710 
1 1 1   14   11   58 o  227.595   13.669   41.388   4.7398   15.561   8.0995   54.839   5.8452  120.846   38.702  261.259   14.677 -140.4120 41.39168 
1 1 1   14   11   59 o  147.273   16.252   17.822   3.6024   23.833   5.4475   13.151   4.8025  166.163   21.957  119.345   26.930 46.81754 34.74628 
1 1 1   14   12    0 o   91.991   17.306   7.1277   2.1847   7.1277   2.1847   7.1277   2.1847   91.991   17.306   91.991   17.306 0.000000 0.000000 
1 1 1   14   12    1 o  722.596   6.8983  399.707   7.6297  393.617   9.1369  413.733   13.867  717.030   8.3251  734.962   12.327 -17.93250 14.87495 
1 1 1   14   12    2 o  831.889   7.4533  529.784   9.4903  536.657   11.664  516.320   16.326  837.207   9.1018  821.002   12.991 16.20465 15.86248 
1 1 1   14   12    3 o  342.566   6.2704   89.829   3.2878   86.747   3.7636   99.763   6.7560  336.624   7.3044  360.903   12.230 -24.27927 14.24535 
1 1 1   14   12    4 o  925.061   7.9821  655.133   11.302  649.829   13.578  667.093   20.392  921.237   9.6296  933.116   14.278 -11.87866 17.22143 
1 1 1   14   12    5 f  1060.24   8.7786  860.663   14.246  842.859   16.875  904.830   26.579  1049.13   10.509  1086.59   15.981 -37.45862 19.12676 
1 1 1   14   12    6 o  1358.31   12.857  1413.29   26.730  1413.29   26.730   0.0000   0.0000  1358.31   12.857  ?   ?  0.000000 12.85653 
1 1 1   14   12    7 o  464.027   5.6227  164.817   3.9935  168.438   4.5014  151.432   8.6545  469.086   6.2694  444.626   12.717 24.46008 14.17815 
1 1 1   14   12    8 o  171.716   10.636   22.667   2.7818   22.373   3.2051   23.567   5.6004  170.457   12.369  173.944   21.492 -3.486832 24.79721 
1 1 1   14   12    9 o  1617.85   12.380  2004.93   30.656  2047.62   38.438  1930.32   50.819  1634.59   15.363  1586.16   20.932 48.43054 25.96467 
1 1 1   14   12   10 o  908.083   8.3427  631.347   11.596  642.079   14.343  611.094   19.703  915.674   10.234  893.038   14.414 22.63666 17.67766 
1 1 1   14   12   11 f  295.567   8.2729   66.885   3.7427   64.523   4.2565   74.935   7.8579  290.281   9.5800  312.222   16.501 -21.94135 19.08053 
1 1 1   14   12   12 o  454.922   7.4816  158.440   5.2096  153.862   6.0971  170.820   10.027  448.270   8.8861  472.162   13.874 -23.89185 16.47591 
1 1 1   14   12   13 o  698.553   7.8042  373.601   8.3445  377.772   10.129  364.793   14.720  702.379   9.4220  689.976   13.938 12.40308 16.82359 
1 1 1   14   12   14 o  312.258   6.5452   74.643   3.1283   76.941   3.9028   70.513   5.2318  317.006   8.0434  303.413   11.266 13.59308 13.84224 
1 1 1   14   12   15 o   50.820   21.116   0.4305   2.7069  -1.9200   3.7624   2.9528   3.8975   50.996   22.952   71.360   26.609 -20.36403 35.14061 
1 1 1   14   12   16 o  897.035   6.5347  616.013   8.9723  610.910   11.303  624.708   14.754  893.231   8.2669  903.115   10.673 -9.884644 13.50027 
1 1 1   14   12   17 o  689.145   5.9855  363.560   6.3136  362.927   7.9179  364.664   10.462  688.493   7.5135  690.033   9.9057 -1.540039 12.43284 
1 1 1   14   12   18 o  620.051   6.6263  294.335   6.2888  293.371   8.4597  295.525   9.4022  618.950   8.9296  621.176   9.8889 -2.225891 13.32393 
1 1 1   14   12   19 o  682.995   10.077  357.297   10.534   0.0000   0.0000  357.297   10.534  ?   ?   682.995   10.077 0.000000 10.07685 
1 1 1   14   12   20 o  535.508   7.4828  219.572   6.1334  217.971   7.3794  223.149   11.031  533.494   9.0369  539.574   13.356 -6.079834 16.12603 
1 1 1   14   12   21 o  664.799   6.2102  338.352   6.3192  332.374   7.8499  349.358   10.652  658.836   7.7842  675.323   10.305 -16.48737 12.91441 
1 1 1   14   12   22 o  636.332   5.7074  309.984   5.5589  306.945   7.6570  313.371   8.0833  633.117   7.9014  639.693   8.2555 -6.575439 11.42743 
1 1 1   14   12   23 o  1066.94   6.8186  871.613   11.135  880.749   15.792  862.578   15.704  1072.28   9.6219  1061.15   9.6687 11.12317 13.64055 
1 1 1   14   12   24 o  676.948   5.9444  350.843   6.1593  350.982   8.6869  350.703   8.7344  676.956   8.3837  676.684   8.4329 0.2718506 11.89119 
1 1 1   14   12   25 o  988.086   6.6619  747.569   10.075  756.937   14.366  738.501   14.134  994.002   9.4424  981.826   9.4053 12.17578 13.32735 
1 1 1   14   12   26 o  607.842   6.0550  282.893   5.6335  288.218   8.0787  277.852   7.8597  613.392   8.6047  602.265   8.5261 11.12628 12.11341 
1 1 1   14   12   27 o  257.180   10.799   50.702   4.2510   42.926   10.209   52.333   4.6756  233.698   29.176  261.247   11.693 -27.54939 31.43159 
1 1 1   14   12   28 o  412.829   6.7442  130.524   4.2616  131.398   6.1899  129.735   5.8760  414.050   9.7670  411.448   9.3304 2.602264 13.50739 
1 1 1   14   12   29 o  443.403   8.7006  150.663   5.9049  153.097   6.6191  141.174   13.069  446.900   9.6764  428.018   19.949 18.88251 22.17217 
1 1 1   14   12   30 o  251.474   12.465   48.543   4.7978   46.125   5.2826   59.933   11.465  244.619   14.169  276.539   27.450 -31.92001 30.89094 
1 1 1   14   12   31 o  282.663   8.3902   61.239   3.6300   69.286   5.5503   55.225   4.7986  300.418   12.070  268.234   11.688 32.18362 16.80177 
1 1 1   14   12   32 o  375.531   7.6726  108.078   4.4102  110.307   6.1733  105.754   6.3027  379.141   10.638  371.191   11.093 7.949280 15.36939 
1 1 1   14   12   33 o  219.501   10.196   36.974   3.4255   33.856   5.1692   39.415   4.5741  208.985   16.288  226.033   13.279 -17.04741 21.01560 
1 1 1   14   12   34 o  543.302   5.7923  226.122   4.8168  233.874   8.0525  221.802   6.0107  552.082   9.5292  537.935   7.3001 14.14697 12.00407 
1 1 1   14   12   35 o  238.238   8.2388   43.530   3.0043   49.151   5.6855   41.352   3.5387  252.132   14.797  232.089   9.9614 20.04326 17.83772 
1 1 1   14   12   36 o  332.673   7.9765   84.884   4.0616   87.546   7.2227   83.652   4.9119  337.086   13.999  330.077   9.7222 7.009094 17.04358 
1 1 1   14   12   37 o  194.205   10.035   29.050   2.9729   22.833   6.2279   30.885   3.3832  169.124   24.795  200.122   11.088 -30.99791 27.16114 
1 1 1   14   12   38 o  118.951   14.978   11.096   2.6666   7.5548   5.1626   12.385   3.1141   97.778   30.855  125.441   16.629 -27.66312 35.05082 
1 1 1   14   12   39 o   75.760   21.960   4.5844   2.6945   2.5125   5.8094   5.1523   3.0414   78.272   31.536   80.234   23.353 -1.961533 39.24099 
1 1 1   14   12   40 o  356.278   7.7432   97.433   4.2226   96.191   11.316   97.634   4.5514  350.043   21.220  356.561   8.3395 -6.517578 22.79961 
1 1 1   14   12   41 o  318.102   7.4913   77.676   3.6475   66.912   6.5603   82.493   4.3883  294.001   14.578  327.635   8.7505 -33.63409 17.00287 
1 1 1   14   12   42 o  321.365   7.5727   79.307   3.7249   84.557   6.9070   77.155   4.4233  330.570   13.651  316.730   9.1241 13.84015 16.41932 
1 1 1   14   12   43 o  348.497   7.6546   93.296   4.0831   98.263   7.5272   91.226   4.8604  356.156   13.808  344.317   9.2224 11.83868 16.60439 
1 1 1   14   12   44 o  242.515   11.040   45.383   4.0981   41.923   7.0454   47.152   5.0381  230.072   20.212  246.367   13.411 -16.29579 24.25607 
1 1 1   14   12   45 o  134.937   19.755   14.604   3.9594   15.149   6.7160   14.314   4.9019  133.016   33.115  131.798   25.218 1.218445 41.62368 
1 1 1   14   12   46 o   92.836   22.872   7.1223   3.2288   8.5220   6.4116   6.6467   3.7373  102.537   34.520   89.735   25.820 12.80260 43.10831 
1 1 1   14   12   47 o   73.736   24.975   4.1462   3.3563   7.5662   6.5498   2.9284   3.9084   98.452   34.811   69.461   26.481 28.99125 43.73904 
1 1 1   14   12   48 o  257.052   11.875   51.200   4.6720   49.667   7.8411   52.043   5.8175  249.289   20.738  257.885   14.800 -8.596161 25.47735 
1 1 1   14   12   49 o  173.747   17.121   23.950   4.4941   24.885   7.4352   23.412   5.6412  171.633   29.357  169.750   22.247 1.883041 36.83463 
1 1 1   14   12   50 o  292.039   8.8084   65.782   3.9374   71.218   6.3514   62.388   5.0179  302.194   13.731  283.614   11.559 18.58081 17.94897 
1 1 1   14   12   51 o   79.028   24.003   5.1506   3.1592   8.2550   4.9096   2.9568   4.1272   98.223   29.943   69.964   27.074 28.25859 40.36791 
1 1 1   14   12   52 o   51.398   22.599  -0.5256   3.4356  -4.6619   5.9114   1.5841   4.2219   57.481   26.901   64.406   26.531 -6.925236 37.78354 
1 1 1   14   12   53 o   55.569   23.902   0.2162   3.6702   3.1810   6.8831  -0.9616   4.3384   81.311   33.720   56.151   25.005 25.16050 41.97950 
1 1 1   14   12   54 o  107.780   20.856   9.7198   3.3163   10.259   4.8726   9.2544   4.5264  107.421   28.971  102.407   28.051 5.014503 40.32544 
1 1 1   14   12   55 o  147.351   16.329   17.500   3.6210   11.283   4.9972   24.373   5.2543  112.158   28.922  171.946   20.360 -59.78816 35.36945 
1 1 1   14   12   56 o  144.967   15.916   16.977   3.4734   12.554   4.6864   22.368   5.1741  119.074   26.405  163.559   21.164 -44.48527 33.83973 
1 1 1   14   12   57 o  148.699   18.486   18.307   4.1167   13.110   5.4625   25.138   6.2631  118.348   30.089  169.821   24.829 -51.47356 39.01023 
1 1 1   14   12   58 o  146.887   15.060   17.509   3.3381   21.788   4.7590   13.364   4.6835  160.917   19.735  121.565   25.960 39.35210 32.60962 
1 1 1   14   12   59 o   83.143   24.945   6.2780   3.4274   8.3428   4.4145   3.1445   5.4381   93.837   28.346   71.808   29.891 22.02961 41.19426 
1 1 1   14   13    0 o  103.876   16.674   8.8761   2.4462   8.8761   2.4462   8.8761   2.4462  103.876   16.674  103.876   16.674 0.000000 0.000000 
1 1 1   14   13    1 o  1045.24   8.6457  836.470   13.832  848.255   17.142  814.479   23.417  1052.46   10.641  1030.99   14.839 21.47046 18.26004 
1 1 1   14   13    2 o  859.937   7.6702  566.127   10.096  568.282   12.302  561.684   17.669  861.504   9.3292  856.264   13.481 5.240234 16.39451 
1 1 1   14   13    3 o  706.565   6.9538  382.174   7.5204  383.787   9.1099  378.722   13.325  708.011   8.4063  703.162   12.381 4.848877 14.96494 
1 1 1   14   13    4 o  234.991   7.3444   42.274   2.6417   41.964   3.0370   43.237   5.3544  234.117   8.4751  237.079   14.830 -2.961990 17.08079 
1 1 1   14   13    5 o  296.995   7.7019   67.528   3.5012   67.528   3.5012   0.0000   0.0000  296.995   7.7019  ?   ?  0.000000 7.701888 
1 1 1   14   13    6 o  1037.09   8.6871  823.495   13.790  829.506   16.844  811.279   24.013  1040.76   10.574  1028.91   15.248 11.85413 18.55534 
1 1 1   14   13    7 o  1316.88   9.0215  1327.82   18.184  1327.46   20.932  1328.92   36.716  1316.60   10.387  1316.47   18.221 0.1340332 20.97370 
1 1 1   14   13    8 o  1090.64   9.2133  910.786   15.380  917.800   18.962  897.301   26.295  1094.69   11.317  1081.99   15.877 12.69067 19.49780 
1 1 1   14   13    9 o  219.734   9.4834   36.972   3.1896   37.794   3.7369   34.766   6.1216  222.142   10.990  212.053   19.064 10.08858 22.00504 
1 1 1   14   13   10 o   85.909   21.223   5.8889   2.7744   4.7649   3.1375   9.9198   5.9417   78.646   23.928  112.379   32.621 -33.73248 40.45587 
1 1 1   14   13   11 o  300.144   8.5423   68.976   3.9244   71.004   4.5833   63.406   7.5970  304.500   9.8337  287.037   17.373 17.46259 19.96335 
1 1 1   14   13   12 o  578.703   7.4876  256.396   6.6323  255.418   7.9021  258.724   12.200  577.555   8.9388  581.075   13.717 -3.520630 16.37214 
1 1 1   14   13   13 o  730.555   9.7627  408.719   10.917  414.204   15.163  402.816   15.729  735.227   13.474  725.003   14.174 10.22467 19.55682 
1 1 1   14   13   14 o  281.483   9.8014   60.679   4.2229   57.146   4.8041   72.686   8.8568  273.132   11.491  307.219   18.927 -34.08640 22.14219 
1 1 1   14   13   15 o  565.762   6.8647  245.050   5.9446  235.375   8.2500  255.498   8.5733  554.386   9.7223  577.600   9.6973 -23.21375 13.73178 
1 1 1   14   13   16 o  893.888   7.3180  611.757   10.013  593.664   13.355  634.982   15.131  880.424   9.9100  910.479   10.857 -30.05566 14.69991 
1 1 1   14   13   17 o  949.975   7.5751  690.967   11.015  680.123   14.927  703.930   16.320  942.309   10.349  958.598   11.123 -16.28833 15.19294 
1 1 1   14   13   18 o  585.231   5.9614  262.192   5.3401  260.596   6.5803  265.270   9.1388  583.403   7.3690  588.495   10.146 -5.092163 12.53934 
1 1 1   14   13   19 o  1034.60   7.9202  819.633   12.542  822.605   14.501  810.808   24.989  1036.39   9.1414  1028.20   15.878 8.190918 18.32172 
1 1 1   14   13   20 o  414.264   6.4220  131.387   4.0721  130.834   4.9833  132.499   7.0642  413.353   7.8764  415.861   11.098 -2.508087 13.60895 
1 1 1   14   13   21 o  996.750   7.1568  760.712   10.919  761.885   13.867  758.798   17.712  997.373   9.0837  995.105   11.629 2.268066 14.75591 
1 1 1   14   13   22 o  924.756   6.9783  654.792   9.8775  651.855   12.491  659.694   16.137  922.545   8.8457  927.841   11.363 -5.296631 14.40008 
1 1 1   14   13   23 o  489.292   5.9529  183.290   4.4582  185.089   6.1908  181.352   6.4256  491.603   8.2274  486.598   8.6272 5.005798 11.92138 
1 1 1   14   13   24 o  320.142   7.0865   78.483   3.4725   75.190   4.7780   82.170   5.0555  313.266   9.9648  327.478   10.086 -14.21249 14.17817 
1 1 1   14   13   25 o  408.718   6.4652  127.913   4.0446  126.620   5.6362  129.286   5.8074  406.545   9.0575  410.794   9.2361 -4.248566 12.93621 
1 1 1   14   13   26 o  868.038   9.3330  577.349   12.400  580.507   21.571  575.791   15.154  869.355   16.211  866.606   11.425 2.749268 19.83241 
1 1 1   14   13   27 o  588.288   7.5575  265.094   6.8051  277.597   9.3252  250.848   9.9534  601.794   10.124  571.948   11.370 29.84534 15.22356 
1 1 1   14   13   28 o  179.680   15.382   24.987   4.1896   23.185   4.5279   35.717   11.047  172.755   17.359  211.099   35.444 -38.34410 39.46688 
1 1 1   14   13   29 o  176.493   11.355   23.996   3.0512   22.161   4.4843   25.577   4.1636  168.774   17.619  181.803   15.099 -13.02873 23.20328 
1 1 1   14   13   30 o  152.784   12.960   18.055   3.0021   17.828   4.5418   18.230   4.0007  150.680   20.201  152.888   17.406 -2.207809 26.66586 
1 1 1   14   13   31 o  115.843   17.047   10.556   2.9323   11.286   4.5164   10.023   3.8555  118.325   25.675  111.721   23.300 6.604195 34.67134 
1 1 1   14   13   32 o  514.065   6.8013  202.482   5.3515  213.763   7.4183  190.240   7.7276  527.938   9.1802  497.927   10.139 30.01093 13.67774 
1 1 1   14   13   33 o  256.316   9.0621   50.395   3.5553   48.847   5.2749   51.683   4.8127  251.607   13.749  259.337   12.124 -7.729828 18.33109 
1 1 1   14   13   34 o  331.153   7.7974   84.081   3.9523   81.552   5.8539   86.200   5.3578  325.753   11.741  335.054   10.447 -9.301056 15.71571 
1 1 1   14   13   35 o  148.264   17.718   17.232   3.9412   22.106   5.2174   10.755   6.0146  167.533   20.793  114.967   32.651 52.56623 38.71019 
1 1 1   14   13   36 o  449.092   7.2863  154.648   5.0086  149.336   7.8354  158.319   6.5129  440.659   11.617  454.105   9.3702 -13.44614 14.92482 
1 1 1   14   13   37 o  477.890   6.1081  175.040   4.4679  166.110   7.5093  179.934   5.5589  464.859   10.554  484.343   7.4984 -19.48373 12.94636 
1 1 1   14   13   38 o  385.914   7.1382  114.229   4.2164  106.205   6.8506  119.122   5.3498  371.359   12.052  393.857   8.8742 -22.49854 14.96681 
1 1 1   14   13   39 o  422.432   7.4241  136.926   4.8003  160.374   17.100  134.921   5.0014  450.569   24.892  419.271   7.7934 31.29803 26.08372 
1 1 1   14   13   40 o  267.583   8.1698   54.987   3.3461   45.393   6.2919   58.770   3.9512  241.127   17.160  276.489   9.3364 -35.36159 19.53509 
1 1 1   14   13   41 o  215.104   9.6292   35.598   3.1704   33.175   5.9149   36.574   3.7554  205.270   19.042  217.529   11.318 -12.25961 22.15201 
1 1 1   14   13   42 o  370.756   7.0448  105.523   3.9979  103.398   7.1189  106.502   4.8317  365.741   12.717  372.216   8.4808 -6.474426 15.28512 
1 1 1   14   13   43 f  178.903   12.305   24.852   3.3491   19.934   6.0247   27.051   4.0289  156.088   26.142  186.246   14.241 -30.15851 29.76883 
1 1 1   14   13   44 o   91.546   22.375   6.8918   3.1088   4.8453   6.1323   7.5997   3.6066   87.156   33.184   95.862   24.491 -8.706383 41.24286 
1 1 1   14   13   45 o  224.237   12.498   39.047   4.2725   40.166   6.7210   38.287   5.5347  225.068   19.708  220.862   16.491 4.205399 25.69770 
1 1 1   14   13   46 o  147.111   14.613   17.001   3.2470   11.540   6.8254   18.598   3.6914  116.022   35.291  153.568   15.936 -37.54665 38.72199 
1 1 1   14   13   47 f  422.859   8.8279  137.750   5.7138  138.895   9.0204  136.983   7.3840  422.542   13.947  420.731   11.466 1.811005 18.05533 
1 1 1   14   13   48 o  165.153   22.514   22.174   5.5429   31.607   7.2970   9.3067   8.5225  196.515   24.813  108.131   39.519 88.38383 46.66298 
1 1 1   14   13   49 o  310.073   9.1737   74.181   4.3539   63.747   8.5644   77.817   5.0560  282.608   19.927  317.213   10.413 -34.60513 22.48354 
1 1 1   14   13   50 o  211.152   12.693   34.810   4.0833   36.998   8.5639   34.166   4.6453  210.615   27.201  208.503   14.649 2.112122 30.89447 
1 1 1   14   13   51 o  168.968   16.385   22.702   4.1843   1.2427   12.925   25.214   4.4224   97.540   43.313  178.139   16.404 -80.59861 46.31527 
1 1 1   14   13   52 o  198.511   13.240   30.942   3.9999   27.176   7.5238   32.426   4.7225  178.066   28.571  202.362   15.361 -24.29663 32.43873 
1 1 1   14   13   53 o  129.371   19.704   13.745   3.7785   7.2734   6.7361   16.716   4.5643   94.526   35.034  141.960   21.694 -47.43419 41.20740 
1 1 1   14   13   54 o   75.354   26.281   4.5292   3.7245  -3.3810   6.6763   8.1034   4.4877   63.440   29.312   95.860   28.495 -32.41976 40.87968 
1 1 1   14   13   55 o  132.270   20.345   14.557   3.9870   8.4573   6.5798   18.096   5.0119   97.436   34.844  146.125   23.182 -48.68843 41.85120 
1 1 1   14   13   56 o  161.199   15.357   20.925   3.7434   20.843   5.4530   20.998   5.1481  155.909   23.587  157.604   21.935 -1.695145 32.21067 
1 1 1   14   13   57 o   63.725   24.824   2.7046   3.4877   5.4220   4.4095  -1.8362   5.7000   79.619   28.519   60.110   27.520 19.50848 39.63200 
1 1 1   14   13   58 o   75.358   24.369   4.9863   3.2052   3.8301   4.5448   6.1302   4.5208   71.993   28.255   82.521   28.944 -10.52760 40.44891 
1 1 1   14   14    0 o  802.011   9.0803  492.574   11.144  492.574   11.144  492.574   11.144  802.011   9.0803  802.011   9.0803 0.000000 0.000000 
1 1 1   14   14    1 o  523.148   6.4261  209.504   5.1457  209.281   6.2541  209.973   9.0536  522.839   7.8149  523.601   11.297 -0.7619629 13.73634 
1 1 1   14   14    2 o  899.008   7.9299  618.765   10.912  628.274   13.487  600.742   18.567  905.806   9.7276  885.496   13.699 20.30994 16.80151 
1 1 1   14   14    3 o   58.577   20.966   2.2226   2.3826   2.2226   2.3826   0.0000   0.0000   58.577   20.966  ?   ?  0.000000 20.96557 
1 1 1   14   14    4 o  1001.13   10.343  767.527   15.849  767.527   15.849   0.0000   0.0000  1001.13   10.343  ?   ?  0.000000 10.34307 
1 1 1   14   14    5 o  510.406   6.5118  199.426   5.0873  198.721   6.0508  201.126   9.3963  509.476   7.7592  512.422   11.980 -2.946075 14.27333 
1 1 1   14   14    6 o  1362.53   10.653  1421.77   22.218  1428.16   27.188  1408.92   38.546  1365.36   13.010  1355.40   18.580 9.953857 22.68160 
1 1 1   14   14    7 o  782.729   6.5729  469.006   7.8748  469.540   9.0144  467.285   16.180  783.142   7.5202  780.955   13.536 2.187256 15.48483 
1 1 1   14   14    8 o  176.979   11.127   24.084   2.9988   22.062   3.5232   29.402   5.7129  169.130   13.728  194.814   19.417 -25.68478 23.78017 
1 1 1   14   14    9 o  656.091   7.4337  329.550   7.4651  326.676   8.9184  336.276   13.644  653.173   8.9205  662.485   13.455 -9.312439 16.14385 
1 1 1   14   14   10 o  634.608   7.4375  308.325   7.2244  308.928   8.7208  307.006   12.898  635.176   8.9700  632.996   13.312 2.179871 16.05230 
1 1 1   14   14   11 o  537.707   9.2224  221.401   7.5903  220.514   10.227  222.490   11.326  536.502   12.454  538.840   13.732 -2.338318 18.53832 
1 1 1   14   14   12 o  674.088   14.052  348.229   14.499   0.0000   0.0000  348.229   14.499  ?   ?   674.088   14.052 0.000000 14.05229 
1 1 1   14   14   13 o  1294.97   18.602  1286.56   36.871   0.0000   0.0000  1286.56   36.871  ?   ?   1294.97   18.602 0.000000 18.60196 
1 1 1   14   14   14 o  1203.22   12.496  1109.24   23.013  1132.21   32.828  1087.04   32.271  1214.92   17.653  1190.43   17.711 24.49341 25.00597 
1 1 1   14   14   15 o  781.506   7.1962  467.600   8.6081  474.670   12.152  460.480   12.196  787.242   10.085  775.373   10.276 11.86829 14.39784 
1 1 1   14   14   16 o  835.137   7.4190  534.004   9.4836  533.162   13.337  534.865   13.488  834.301   10.444  835.625   10.546 -1.324341 14.84197 
1 1 1   14   14   17 o  645.810   6.0675  319.286   5.9977  319.423   7.4720  319.038   10.057  645.894   7.5580  645.381   10.180 0.5131836 12.67917 
1 1 1   14   14   18 o  723.940   6.7575  401.249   7.4879  408.273   8.7155  381.452   14.633  730.201   7.7979  705.437   13.552 24.76343 15.63505 
1 1 1   14   14   19 o  167.983   10.913   21.710   2.7908   25.515   3.1627   8.3283   5.9312  182.128   11.403  104.605   33.079 77.52345 34.98896 
1 1 1   14   14   20 o  696.278   6.3569  371.168   6.7748  369.903   8.3807  373.554   11.509  695.019   7.8780  698.264   10.768 -3.244751 13.34226 
1 1 1   14   14   21 o   60.882   21.734   2.4240   2.5589   4.8064   2.9542  -4.7330   5.1204   78.426   23.070   54.349   25.303 24.07692 34.24121 
1 1 1   14   14   22 o  385.322   6.9599  113.687   4.1049  111.796   4.9439  117.885   7.3653  382.056   8.4541  392.159   12.270 -10.10309 14.90090 
1 1 1   14   14   23 o   75.777   22.496   4.4768   2.7984   7.5811   3.2773  -3.8775   5.3763   97.321   22.458   58.062   26.636 39.25852 34.83977 
1 1 1   14   14   24 f  206.247   9.0620   32.588   2.8608   31.080   3.8722   34.401   4.2450  200.925   12.655  211.375   13.186 -10.44974 18.27670 
1 1 1   14   14   25 f  958.671   8.3720  704.041   12.285  722.903   17.863  687.115   16.922  970.932   12.020  946.646   11.678 24.28552 16.75910 
1 1 1   14   14   26 o  996.286   12.323  761.393   18.791  762.245   25.966  760.456   27.229  995.800   17.036  994.406   17.890 1.393066 24.70339 
1 1 1   14   14   27 o  420.727   7.1282  135.585   4.5904  142.598   5.9546  125.313   7.2066  431.359   9.0187  404.188   11.649 27.17160 14.73195 
1 1 1   14   14   28 o  325.087   7.2437   80.959   3.6044   79.806   5.1441   82.070   5.0518  322.598   10.418  327.161   10.088 -4.563751 14.50187 
1 1 1   14   14   29 o  367.492   6.9683  103.459   3.9196  106.677   5.7047  100.581   5.3947  372.967   9.9929  362.174   9.7315 10.79318 13.94848 
1 1 1   14   14   30 o  584.731   6.2497  261.899   5.5935  272.846   8.1757  252.265   7.6695  596.550   8.9538  573.635   8.7350 22.91504 12.50880 
1 1 1   14   14   31 o   76.098   22.343   4.5633   2.7733   2.8394   3.8921   6.3413   3.9528   70.330   26.518   89.666   26.763 -19.33619 37.67610 
1 1 1   14   14   32 o  123.508   15.315   11.925   2.8332   7.2251   4.0362   16.490   3.9778   94.923   26.674  145.008   18.331 -50.08536 32.36576 
1 1 1   14   14   33 o  102.116   18.917   8.3158   2.8479   8.3835   4.2291   8.2596   3.8523  101.753   26.787  100.991   25.044 0.7620773 36.67044 
1 1 1   14   14   34 o  318.835   9.6137   78.031   4.6917   81.166   6.3586   74.284   6.9509  324.806   12.790  310.481   14.626 14.32584 19.42970 
1 1 1   14   14   35 o  362.923   7.4040  100.996   4.1129  100.716   6.1530  101.223   5.5299  361.983   11.105  363.048   9.9514 -1.064972 14.91156 
1 1 1   14   14   36 f   74.247   23.390   4.2646   2.9677  -3.8057   4.5326   10.320   3.9263   51.599   23.950  112.936   23.479 -61.33663 33.53916 
1 1 1   14   14   37 f  718.479   6.6778  395.801   7.3438  391.922   10.613  399.365   10.172  714.209   9.7083  721.099   9.2163 -6.889954 13.38618 
1 1 1   14   14   38 o  362.732   8.2396  101.008   4.5747  110.115   7.4799   95.567   5.7822  377.876   12.932  352.449   10.718 25.42761 16.79670 
1 1 1   14   14   39 o  386.053   8.9637  114.519   5.2967  108.988   10.539  116.387   6.1266  374.216   18.400  388.942   10.291 -14.72638 21.08258 
1 1 1   14   14   40 o  159.681   14.287   19.884   3.4550   24.544   5.5671   16.964   4.4062  175.788   21.113  145.955   20.270 29.83298 29.26844 
1 1 1   14   14   41 o  151.462   15.110   17.965   3.4563   16.560   5.4447   18.913   4.4731  142.290   25.956  154.363   19.358 -12.07280 32.37945 
1 1 1   14   14   42 o  185.817   11.375   26.740   3.2195   19.337   5.6510   30.298   3.9175  154.257   24.772  197.484   13.033 -43.22752 27.99161 
1 1 1   14   14   43 f   41.084   18.999  -2.2063   2.8137  -3.8250   5.4135  -1.6072   3.2935   57.228   26.425   47.270   21.356 9.957844 33.97606 
1 1 1   14   14   44 o  153.207   13.666   18.344   3.1710   16.697   6.0953   18.956   3.7130  141.167   29.174  155.213   15.851 -14.04584 33.20218 
1 1 1   14   14   45 o  235.013   11.931   42.837   4.2778   48.639   6.5458   38.512   5.6516  248.697   17.304  221.341   16.807 27.35558 24.12268 
1 1 1   14   14   46 o   60.231   24.957   1.0272   3.7658   1.7576   6.2540   0.6117   4.7166   76.476   31.964   64.602   27.421 11.87374 42.11375 
1 1 1   14   14   47 o  110.353   28.890   10.359   4.9370   10.474   6.1989   10.160   8.1638  110.539   33.634  110.884   38.895 -0.3448486 51.42070 
1 1 1   14   14   48 o  178.759   13.273   24.987   3.6056   24.150   7.4588   25.242   4.1189  168.772   29.971  179.099   15.168 -10.32733 33.59068 
1 1 1   14   14   49 o   47.916   21.497  -1.2371   3.2709   4.6878   6.7751  -3.0377   3.7349   87.346   34.429   46.478   21.629 40.86834 40.65881 
1 1 1   14   14   50 o  117.246   20.505   11.272   3.5458   18.092   8.1102   9.6605   3.9425  141.046   37.078  106.990   24.590 34.05649 44.49079 
1 1 1   14   14   51 o   69.462   26.574   3.0697   3.9442  -0.6591   11.428   3.5739   4.2024   89.326   40.121   72.909   27.540 16.41730 48.66368 
1 1 1   14   14   52 o   52.731   23.048  -0.3014   3.5273  -0.5346   6.7480  -0.2138   4.1375   70.745   31.361   57.218   24.987 13.52686 40.09796 
1 1 1   14   14   53 o   78.473   25.657   5.1047   3.5483   8.6188   6.5417   3.6398   4.2236   99.268   34.818   72.600   27.564 26.66837 44.40773 
1 1 1   14   14   54 o   76.793   27.624   4.6293   4.1413   4.2007   8.9783   4.7452   4.6675   89.331   37.870   78.746   29.168 10.58554 47.80023 
1 1 1   14   14   55 o   60.774   25.481   1.2690   3.9929  -1.2916   8.7924   1.9343   4.4817   75.835   34.512   65.813   27.244 10.02169 43.96916 
1 1 1   14   14   56 o   91.672   27.666   7.6095   4.2067   12.879   5.9707   2.4151   5.9278  115.971   32.391   72.821   30.815 43.15076 44.70739 
1 1 1   14   14   57 o  173.454   13.916   24.140   3.6634   21.411   5.9598   25.796   4.6445  154.849   26.071  177.137   17.353 -22.28798 31.31818 
1 1 1   14   14   58 o  109.690   24.106   10.788   3.9368   12.016   5.8989   9.8026   5.2863  109.576   32.692  100.137   31.164 9.439156 45.16597 
1 1 1   14   15    0 f  421.587   11.359  136.374   7.3180  136.374   7.3180  136.374   7.3180  421.587   11.359  421.587   11.359 0.000000 0.000000 
1 1 1   14   15    1 o  1014.99   10.516  788.977   16.338  788.977   16.338   0.0000   0.0000  1014.99   10.516  ?   ?  0.000000 10.51631 
1 1 1   14   15    2 o  845.588   9.4247  547.516   12.198  547.516   12.198   0.0000   0.0000  845.588   9.4247  ?   ?  0.000000 9.424678 
1 1 1   14   15    3 o  122.077   12.664   11.539   2.3319   11.625   2.7228   11.303   4.5165  122.268   14.854  119.028   25.554 3.240120 29.55792 
1 1 1   14   15    4 o  461.831   6.5554  163.276   4.6339  163.104   5.5630  163.667   8.3753  461.559   7.8743  462.242   11.838 -0.6831055 14.21729 
1 1 1   14   15    5 o  1098.35   9.1127  923.740   15.320  935.616   18.898  900.971   26.166  1105.24   11.171  1084.16   15.768 21.08276 19.32409 
1 1 1   14   15    6 o  212.254   8.7900   34.496   2.8557   32.571   3.2582   40.875   5.9317  205.968   10.368  230.270   16.949 -24.30188 19.86840 
1 1 1   14   15    7 o  1276.53   10.212  1247.96   19.952  1271.90   24.773  1203.74   33.662  1288.49   12.561  1252.88   17.553 35.61755 21.58470 
1 1 1   14   15    8 o  767.769   9.5167  451.402   11.184  436.415   15.060  469.827   16.699  754.717   13.037  783.011   13.933 -28.29407 19.08119 
1 1 1   14   15    9 o  576.755   8.9498  254.717   7.9009  261.736   10.936  247.054   11.427  584.509   12.224  567.833   13.148 16.67584 17.95211 
1 1 1   14   15   10 o  711.060   7.7755  387.111   8.4626  384.894   10.205  391.993   15.143  708.952   9.4041  715.204   13.833 -6.251587 16.72678 
1 1 1   14   15   11 o  764.041   10.019  447.079   11.717  435.757   15.985  460.227   17.225  754.058   13.849  774.888   14.523 -20.83026 20.06818 
1 1 1   14   15   12 o  348.612   11.157   93.094   5.9533  101.739   7.9700   82.182   8.9541  364.334   14.292  326.816   17.969 37.51779 22.95947 
1 1 1   14   15   13 o  609.764   7.9155  284.688   7.3877  284.401   8.8241  285.359   13.509  609.395   9.4603  610.145   14.465 -0.7503052 17.28406 
1 1 1   14   15   14 o  1722.38   13.256  2273.49   34.947  2265.63   42.531  2289.84   61.314  1718.83   16.166  1726.12   23.207 -7.296387 28.28267 
1 1 1   14   15   15 o  710.234   8.4052  386.270   9.1373  391.104   10.958  375.240   16.552  714.578   10.019  699.544   15.459 15.03381 18.42153 
1 1 1   14   15   16 o   90.887   23.391   6.5909   3.2730   1.1844   4.6193   12.042   4.6383   67.948   27.843  122.855   25.501 -54.90722 37.75609 
1 1 1   14   15   17 o  991.402   8.0813  752.640   12.263  779.733   17.739  727.841   16.972  1008.79   11.488  974.659   11.376 34.13519 16.16801 
1 1 1   14   15   18 o  567.621   8.1957  246.731   7.1206  250.186   8.8935  240.560   11.885  571.488   10.167  560.159   13.862 11.32861 17.19046 
1 1 1   14   15   19 o  498.039   6.2732  189.902   4.7821  185.809   5.7631  198.951   8.5690  492.598   7.6435  509.569   10.986 -16.97070 13.38377 
1 1 1   14   15   20 o  347.401   6.8985   92.408   3.6682   95.012   4.4090   86.553   6.6117  352.227   8.1781  336.015   12.855 16.21188 15.23623 
1 1 1   14   15   21 o  524.530   6.3987  210.656   5.1373  207.721   6.2413  216.821   9.0463  520.806   7.8295  531.914   11.111 -11.10773 13.59256 
1 1 1   14   15   22 o  494.624   6.5520  187.330   4.9605  188.345   6.0666  185.281   8.6166  495.902   7.9924  491.659   11.450 4.243073 13.96349 
1 1 1   14   15   23 o  341.521   7.4485   89.327   3.8936   90.261   4.6834   87.235   7.0066  343.251   8.9141  337.225   13.574 6.026337 16.23954 
1 1 1   14   15   24 o  957.160   9.7560  702.073   14.293  690.449   16.979  730.339   26.478  948.931   11.690  974.756   17.747 -25.82458 21.25117 
1 1 1   14   15   25 o  693.688   11.831  369.058   12.562  360.746   16.561  380.322   19.279  685.261   15.789  703.226   17.911 -17.96509 23.87642 
1 1 1   14   15   26 o  196.865   9.4901   29.705   2.8596   33.283   4.0169   26.029   4.0719  207.874   12.685  183.516   14.618 24.35812 19.35433 
1 1 1   14   15   27 o  221.193   8.8262   37.498   2.9882   35.909   4.2241   39.090   4.2279  215.905   12.840  225.352   12.304 -9.447739 17.78336 
1 1 1   14   15   28 o  610.976   6.1129  285.903   5.7166  294.109   8.2024  278.152   7.9716  619.447   8.6510  602.409   8.6454 17.03772 12.23044 
1 1 1   14   15   29 o  628.569   6.1311  302.628   5.8987  319.783   8.6321  287.600   8.0794  645.861   8.7319  612.513   8.6178 33.34741 12.26835 
1 1 1   14   15   30 o  279.981   7.7422   60.080   3.3179   59.458   4.7139   60.692   4.6708  278.314   11.066  281.204   10.852 -2.890411 15.49873 
1 1 1   14   15   31 o  388.463   7.1234  115.646   4.2355  119.685   5.7439  110.832   6.2705  394.980   9.5008  379.960   10.782 15.02069 14.37064 
1 1 1   14   15   32 o  274.628   8.5916   57.845   3.6115   59.565   5.5106   56.550   4.7815  278.303   12.936  271.304   11.514 6.999146 17.31838 
1 1 1   14   15   33 o  687.173   7.7611  362.075   8.1632  363.876   11.025  359.889   12.145  688.346   10.464  684.295   11.595 4.050598 15.61882 
1 1 1   14   15   34 o  261.679   8.4900   52.536   3.4005   52.006   5.0540   52.974   4.5967  259.958   12.702  262.502   11.440 -2.543854 17.09424 
1 1 1   14   15   35 o  281.274   8.3396   60.706   3.5904   55.877   5.3828   64.576   4.8190  269.347   13.056  289.839   10.863 -20.49237 16.98426 
1 1 1   14   15   36 o  507.848   6.7276  197.746   5.2295  210.005   7.7811  187.648   7.0624  522.828   9.7233  494.290   9.3347 28.53818 13.47881 
1 1 1   14   15   37 f   79.746   22.746   5.1045   2.9124   5.4155   4.5264   4.8849   3.8046   85.304   29.003   80.307   26.583 4.996552 39.34227 
1 1 1   14   15   38 o  195.429   14.291   29.672   4.2453   34.908   13.948   29.137   4.4567  199.902   46.469  193.468   15.172 6.434555 48.88285 
1 1 1   14   15   39 o   45.610   21.076  -2.6818   3.4533  -9.9431   8.8283  -1.3701   3.7523   66.783   31.741   51.964   23.189 14.81966 39.30949 
1 1 1   14   15   40 o  135.573   16.176   14.472   3.2904   5.3045   5.0671   21.155   4.3267   85.958   30.594  163.932   17.514 -77.97401 35.25305 
1 1 1   14   15   41 o  214.727   12.079   35.717   3.9539   35.031   5.4185   36.497   5.7824  211.442   16.883  215.613   17.677 -4.170822 24.44400 
1 1 1   14   15   42 o  413.194   7.9062  131.199   5.0002  121.827   7.4191  138.999   6.7684  397.040   12.208  424.661   10.413 -27.62122 16.04577 
1 1 1   14   15   43 o   68.736   25.397   3.0829   3.5345   4.8360   5.4840   1.8373   4.6227   84.816   31.576   68.814   27.986 16.00134 42.19334 
1 1 1   14   15   44 o  169.554   15.121   22.543   3.8831   32.360   6.3352   16.636   4.9145  201.426   20.850  142.972   23.257 58.45439 31.23446 
1 1 1   14   15   45 o   91.361   25.925   6.9191   3.7934   3.0196   6.2325   9.2137   4.7810   80.557   32.591  104.582   28.904 -24.02458 43.56153 
1 1 1   14   15   46 o  189.122   17.685   28.321   5.0598   29.110   6.2429   26.809   8.6384  190.136   21.848  176.950   33.111 13.18576 39.66986 
1 1 1   14   15   47 o  125.022   17.830   12.529   3.3153   29.618   6.9598   7.5131   3.7706  190.351   24.453   94.686   25.464 95.66448 35.30374 
1 1 1   14   15   48 o   91.840   23.681   7.0517   3.3503   1.8103   6.5040   8.9449   3.9088   77.215   32.454  103.114   25.021 -25.89878 40.97953 
1 1 1   14   15   49 o  116.353   20.599   11.092   3.5343   5.5845   7.2215   12.826   4.0529   91.591   35.709  124.791   22.023 -33.19977 41.95456 
1 1 1   14   15   50 o   74.126   24.780   4.3427   3.3037   6.9221   6.4076   3.4087   3.8557   93.935   34.277   70.863   26.458 23.07249 43.30008 
1 1 1   14   15   51 o  209.343   13.286   34.396   4.2353   46.928   10.797   32.117   4.6043  232.874   31.066  201.559   15.032 31.31493 34.51180 
1 1 1   14   15   52 o  102.805   23.079   8.9697   3.5426   8.2700   6.4973   9.2658   4.2261   98.200   34.677  103.270   26.580 -5.069801 43.69193 
1 1 1   14   15   53 o  165.522   16.138   21.958   4.0366   24.137   8.9828   21.407   4.5185  159.361   37.459  162.276   18.523 -2.914124 41.78825 
1 1 1   14   15   54 o  193.140   14.376   29.650   4.2196   20.321   6.9093   35.198   5.3287  149.692   31.168  209.152   16.787 -59.45975 35.40145 
1 1 1   14   15   55 o   74.023   25.282   4.5437   3.4395   5.7050   6.2045   4.0284   4.1326   85.260   33.139   73.029   27.367 12.23150 42.97837 
1 1 1   14   15   56 o  158.386   17.580   20.626   4.1901   18.298   5.7657   23.232   6.0998  142.382   27.451  162.566   25.340 -20.18423 37.35871 
1 1 1   14   15   57 o   87.735   24.272   6.9157   3.3695   5.4739   5.6314   7.7198   4.2054   81.322   31.582   91.258   27.689 -9.936440 42.00056 
1 1 1   14   16    1 o  242.624   9.6805   45.079   3.5950   57.561   5.2806   34.296   4.9081  274.106   12.586  210.975   15.303 63.13113 19.81396 
1 1 1   14   16    2 o  536.441   8.2591  220.333   6.7815  221.172   9.5482  219.478   9.6333  537.343   11.609  535.275   11.758 2.067993 16.52329 
1 1 1   14   16    3 o  809.050   7.7113  501.145   9.5493  505.480   11.792  492.885   16.276  812.460   9.4825  802.045   13.258 10.41541 16.29997 
1 1 1   14   16    4 o  1183.19   9.6474  1072.06   17.472  1085.00   21.590  1047.51   29.742  1190.12   11.852  1168.84   16.624 21.27319 20.41631 
1 1 1   14   16    5 o  854.134   7.8941  558.567   10.320  563.921   12.638  547.849   17.882  858.130   9.6215  845.530   13.817 12.59967 16.83684 
1 1 1   14   16    6 o  363.252   7.1051  101.020   3.9505  102.093   4.6551   98.257   7.4681  365.154   8.3288  358.084   13.626 7.069824 15.96953 
1 1 1   14   16    7 o  629.262   6.2998  303.126   6.0678  301.387   6.8973  309.077   12.762  627.429   7.1820  635.114   13.127 -7.685425 14.96367 
1 1 1   14   16    8 o  459.846   7.5165  161.897   5.2905  165.312   6.4279  154.727   9.3151  464.629   9.0384  449.344   13.544 15.28445 16.28265 
1 1 1   14   16    9 o  586.897   7.5656  263.720   6.7963  268.052   8.2381  254.489   12.026  591.642   9.0970  576.266   13.634 15.37683 16.39025 
1 1 1   14   16   10 o  1060.69   11.575  861.891   18.792  874.431   26.967  850.055   26.201  1067.84   16.499  1052.88   16.258 14.95813 23.16327 
1 1 1   14   16   11 o  825.108   8.3453  521.304   10.540  524.938   12.808  513.684   18.549  827.876   10.108  818.590   14.804 9.285889 17.92534 
1 1 1   14   16   12 o  197.229   12.947   29.937   3.8868   28.353   4.3812   35.792   8.4222  191.718   15.051  214.106   26.250 -22.38777 30.25845 
1 1 1   14   16   13 o  924.343   8.9025  654.310   12.596  646.498   15.041  672.646   23.044  918.679   10.697  936.529   16.076 -17.85065 19.30919 
1 1 1   14   16   14 o  718.412   8.3655  395.221   9.1989  396.883   11.032  391.428   16.663  719.831   10.013  714.474   15.237 5.356201 18.23262 
1 1 1   14   16   15 o  1028.95   9.4640  810.891   14.905  817.550   18.226  797.444   25.900  1032.97   11.527  1019.56   16.597 13.40765 20.20704 
1 1 1   14   16   16 o  516.823   7.3059  204.518   5.7794  211.285   8.0004  197.132   8.3581  525.196   9.9522  507.263   10.765 17.93338 14.66036 
1 1 1   14   16   17 o  885.960   8.8556  601.156   12.009  614.352   14.957  577.213   20.146  895.462   10.912  867.523   15.172 27.93872 18.68863 
1 1 1   14   16   18 o  654.271   7.4004  327.785   7.4111  326.704   10.261  328.964   10.716  653.029   10.266  655.256   10.684 -2.226746 14.81661 
1 1 1   14   16   19 o  726.538   7.5162  404.214   8.3585  414.608   11.753  393.575   11.890  735.620   10.438  716.686   10.839 18.93402 15.04759 
1 1 1   14   16   20 o  1032.90   7.3414  816.988   11.607  821.889   14.752  809.025   18.804  1035.81   9.3050  1027.35   11.958 8.458862 15.15178 
1 1 1   14   16   21 o  318.377   7.4101   77.626   3.6110   81.767   4.3291   68.155   6.5469  326.720   8.6567  298.053   14.351 28.66629 16.75949 
1 1 1   14   16   22 o  498.223   7.3046  190.102   5.5705  187.918   6.0434  202.443   14.365  495.319   7.9712  513.208   18.287 -17.88882 19.94860 
1 1 1   14   16   23 o  249.853   14.884   48.094   5.6663   45.457   6.4862   56.592   11.643  242.555   17.590  268.891   28.734 -26.33629 33.69069 
1 1 1   14   16   24 f  873.103   9.4337  584.211   12.607  607.612   22.280  573.189   15.291  889.188   16.370  864.530   11.555 24.65741 20.03771 
1 1 1   14   16   25 f  428.211   7.6677  140.471   5.0257  141.964   6.4592  138.181   8.0003  430.344   9.8060  424.371   12.317 5.972351 15.74344 
1 1 1   14   16   26 o  508.307   6.8013  197.909   5.2916  194.519   6.4469  204.911   9.2639  503.824   8.3599  516.784   11.712 -12.96014 14.38922 
1 1 1   14   16   27 o  323.521   6.9851   80.182   3.4589   80.177   4.7108   80.187   5.0951  323.375   9.5175  323.343   10.295 0.3198242E-01 14.02021 
1 1 1   14   16   28 o  479.376   6.2083  176.021   4.5553  177.407   6.3696  174.569   6.5173  481.066   8.6504  477.177   8.9231 3.888550 12.42789 
1 1 1   14   16   29 o  275.274   7.8053   58.078   3.2887   63.881   4.7199   52.603   4.5849  288.511   10.688  261.756   11.444 26.75552 15.65853 
1 1 1   14   16   30 o  150.111   12.500   17.435   2.8460   16.636   3.9839   18.268   4.0671  145.682   18.268  152.865   17.710 -7.183502 25.44333 
1 1 1   14   16   31 o  689.223   6.7521  364.025   7.1230  367.954   11.016  361.201   9.3378  692.310   10.396  686.214   8.8903 6.095947 13.67867 
1 1 1   14   16   32 f   90.681   22.857   6.6417   3.1716   8.4348   3.7546   2.1752   5.9257  102.043   24.374   78.217   31.732 23.82597 40.01213 
1 1 1   14   16   33 o  304.241   7.8257   70.986   3.6442   69.428   5.3182   72.366   5.0037  300.516   11.562  306.912   10.651 -6.396088 15.72029 
1 1 1   14   16   34 o  480.099   6.5269  176.677   4.7963  187.441   7.1056  167.668   6.5007  494.093   9.3956  467.355   9.0875 26.73831 13.07131 
1 1 1   14   16   35 o  539.331   6.6026  223.001   5.4505  241.652   8.1744  208.070   7.3137  560.906   9.5213  520.541   9.1793 40.36462 13.22555 
1 1 1   14   16   36 o  491.672   6.7067  185.369   5.0473  189.894   7.4354  181.503   6.8734  497.092   9.7724  486.092   9.2382 10.99991 13.44778 
1 1 1   14   16   37 o   82.003   23.150   5.4214   3.0329   7.5316   5.0944   4.2629   3.7746   97.274   30.646   76.645   26.472 20.62967 40.49627 
1 1 1   14   16   38 o   79.398   25.791   4.8647   3.5877   1.4442   8.3346   5.6427   3.9748   86.523   36.572   84.865   27.105 1.658638 45.52180 
1 1 1   14   16   39 o  117.813   17.810   11.040   3.1115   12.537   4.7934   9.9504   4.0903  123.482   26.174  110.067   24.865 13.41427 36.10199 
1 1 1   14   16   40 o  397.990   8.2943  121.730   5.0527  123.933   6.9565  119.269   7.3510  400.852   11.338  392.991   12.221 7.861023 16.67009 
1 1 1   14   16   41 o  157.473   14.568   19.394   3.4717   15.656   5.1590   22.488   4.6934  138.282   25.307  168.633   18.486 -30.35133 31.33965 
1 1 1   14   16   42 o  154.030   15.735   18.645   3.6576   16.182   5.3359   20.827   5.0234  140.322   25.794  161.389   20.821 -21.06688 33.14896 
1 1 1   14   16   43 o  229.718   11.286   40.759   3.9685   49.713   6.2506   34.713   5.1365  251.957   16.295  210.431   16.069 41.52635 22.88535 
1 1 1   14   16   44 o  157.262   15.698   19.467   3.7283   21.685   5.8102   17.914   4.8611  163.254   23.965  148.823   22.003 14.43114 32.53407 
1 1 1   14   16   45 o  232.423   11.931   41.931   4.2301   39.613   6.5949   43.551   5.5138  223.288   19.492  235.810   15.360 -12.52176 24.81659 
1 1 1   14   16   46 o   98.749   30.402   8.1685   5.0464   11.199   6.4907   3.5373   8.0242  113.926   34.361   88.800   36.578 25.12597 50.18613 
1 1 1   14   16   47 o   58.109   24.889   0.2117   3.9497   1.5543   6.1272  -0.7428   5.1663   74.819   31.477   62.816   27.663 12.00324 41.90487 
1 1 1   14   16   48 o  365.889   9.5448  103.381   5.3455  103.032   8.1640  103.643   7.0723  363.054   14.691  365.118   12.655 -2.063477 19.39019 
1 1 1   14   16   49 o  124.864   23.604   12.992   4.3460   17.937   7.4634   10.455   5.3458  141.685   34.692  109.616   30.661 32.06945 46.29961 
1 1 1   14   16   50 o  211.648   17.006   35.648   5.4626   20.301   11.201   40.437   6.2572  143.611   45.462  224.809   18.344 -81.19775 49.02311 
1 1 1   14   16   51 o  157.799   19.008   20.187   4.4986   18.457   6.9791   21.417   5.8841  143.543   32.518  159.578   24.903 -16.03484 40.95876 
1 1 1   14   16   52 o  141.460   24.180   16.932   5.0474   9.9935   9.2439   19.880   6.0248  107.035   40.745  151.916   26.895 -44.88056 48.82069 
1 1 1   14   16   53 o   98.025   24.776   8.3355   3.7192   9.1518   6.2405   7.8859   4.6317  100.765   34.056   94.494   29.132 6.270569 44.81572 
1 1 1   14   16   54 o   91.820   25.405   7.4099   3.6911   8.3229   6.3631   6.9468   4.5314   96.302   34.284   88.818   28.992 7.483696 44.89904 
1 1 1   14   16   55 o   41.997   19.890  -3.3954   3.4070  -1.5383   5.8923  -4.3282   4.1759   62.160   28.274   45.715   21.757 16.44491 35.67655 
1 1 1   14   16   56 o   54.179   24.108  -0.4594   4.0244   2.3667   5.7129  -3.2432   5.6700   71.186   30.195   56.798   26.504 14.38800 40.17694 
1 1 1   14   16   57 o  137.202   24.721   16.785   5.0005   24.239   6.1665   2.4710   8.5456  164.918   25.231   79.471   35.257 85.44662 43.35551 
1 1 1   14   17    0 o  497.766   11.578  190.020   8.8101  190.020   8.8101  190.020   8.8101  497.766   11.578  497.766   11.578 0.000000 0.000000 
1 1 1   14   17    1 o  670.738   8.7134  344.491   8.9456  346.535   12.568  342.394   12.735  672.551   12.209  668.506   12.446 4.044312 17.43462 
1 1 1   14   17    2 o  697.992   7.2338  372.994   7.7283  371.601   9.4011  375.899   13.573  696.625   8.8167  700.437   12.660 -3.812622 15.42766 
1 1 1   14   17    3 o  516.176   6.8525  203.977   5.4140  202.723   6.5158  206.773   9.7301  514.548   8.2732  519.511   12.236 -4.963501 14.77073 
1 1 1   14   17    4 o  558.378   7.0948  238.700   6.0637  240.368   7.3997  235.290   10.580  560.277   8.6286  554.165   12.473 6.111694 15.16647 
1 1 1   14   17    5 o  1011.70   10.856  783.995   16.811  770.809   23.272  798.385   24.311  1002.75   15.163  1020.48   15.564 -17.73352 21.72901 
1 1 1   14   17    6 o  400.387   9.0283  122.761   5.5329  124.798   7.6035  120.468   8.0665  403.591   12.308  396.492   13.292 7.098907 18.11543 
1 1 1   14   17    7 o  786.600   8.0608  473.761   9.7052  467.144   11.810  487.520   17.031  780.993   9.8798  797.555   13.951 -16.56244 17.09523 
1 1 1   14   17    8 o  592.030   7.7794  268.366   7.0495  265.291   8.5865  274.724   12.348  588.560   9.5313  598.727   13.474 -10.16669 16.50416 
1 1 1   14   17    9 o  463.721   9.9131  164.697   7.0362  169.503   10.007  159.997   9.8954  470.265   13.902  456.876   14.150 13.38879 19.83686 
1 1 1   14   17   10 o  965.863   8.9673  714.411   13.257  718.908   16.203  705.304   23.058  968.747   10.927  959.053   15.708 9.694458 19.13468 
1 1 1   14   17   11 o  684.912   8.0664  359.203   8.4564  352.091   9.9655  377.499   15.983  678.023   9.6025  701.691   14.881 -23.66895 17.71039 
1 1 1   14   17   12 o  627.217   8.1064  301.241   7.7824  296.653   9.2260  312.559   14.490  622.349   9.6853  638.479   14.827 -16.12927 17.71005 
1 1 1   14   17   13 o  1021.17   9.3962  798.671   14.687  804.755   17.881  786.056   25.747  1024.87   11.399  1012.25   16.617 12.61584 20.15106 
1 1 1   14   17   14 o  112.853   24.057   10.169   4.0285   10.281   4.5270   9.7410   8.8309  113.296   26.566  117.432   40.495 -4.136131 48.43106 
1 1 1   14   17   15 o  1421.60   11.571  1548.58   25.179  1551.53   30.714  1542.56   43.964  1422.52   14.106  1417.02   20.270 5.506226 24.69539 
1 1 1   14   17   16 o  616.986   10.053  291.620   9.4936  291.620   9.4936   0.0000   0.0000  616.986   10.053  ?   ?  0.000000 10.05273 
1 1 1   14   17   17 o  139.130   17.565   15.095   3.6571   17.373   5.0148   12.506   5.3450  148.589   22.775  124.857   28.585 23.73237 36.54871 
1 1 1   14   17   18 o  115.614   21.791   10.616   3.7147   11.736   5.1403   9.3922   5.3743  120.922   28.278  108.831   30.849 12.09078 41.84816 
1 1 1   14   17   19 f  628.783   8.8615  302.854   8.5286  296.887   9.9168  319.806   16.714  622.451   10.409  645.370   16.920 -22.91913 19.86558 
1 1 1   14   17   20 o  659.520   9.0016  333.220   9.0869  332.309   10.735  335.523   17.068  658.486   10.651  660.964   16.871 -2.478271 19.95155 
1 1 1   14   17   21 o  579.918   6.4317  257.522   5.7090  257.657   7.0129  257.256   9.8302  579.989   7.8997  579.303   11.086 0.6857300 13.61294 
1 1 1   14   17   22 o  724.536   7.8067  402.110   8.6576  402.574   12.186  401.637   12.302  724.639   10.987  723.782   11.105 0.8574219 15.62118 
1 1 1   14   17   23 o  333.706   9.5703   85.350   4.8883   80.739   6.9862   89.773   6.8423  324.293   14.075  342.028   13.070 -17.73587 19.20718 
1 1 1   14   17   24 o  200.729   10.647   30.983   3.2594   32.020   3.9204   28.663   5.8653  203.876   12.625  191.796   20.287 12.08047 23.89508 
1 1 1   14   17   25 o  525.344   6.7384  211.398   5.4184  210.453   6.6225  213.310   9.4240  524.057   8.2561  527.263   11.677 -3.206970 14.30105 
1 1 1   14   17   26 o  179.466   11.206   24.808   3.0629   28.499   3.5763   14.648   5.9336  192.294   12.214  134.598   29.606 57.69548 32.02633 
1 1 1   14   17   27 o  199.130   10.513   30.506   3.1930   30.436   3.7515   30.691   6.0826  198.698   12.397  198.332   20.324 0.3657837 23.80631 
1 1 1   14   17   28 o  362.092   7.3536  100.473   4.0756   92.178   5.0564  115.858   6.8859  346.668   9.5292  388.449   11.581 -41.78098 14.99775 
1 1 1   14   17   29 o  349.166   7.2285   93.434   3.8632   87.805   5.5235   98.825   5.4053  338.208   10.670  358.885   9.8400 -20.67752 14.51453 
1 1 1   14   17   30 o  220.567   9.3777   37.327   3.1660   37.161   4.5081   37.488   4.4473  219.373   13.491  220.376   13.246 -1.002274 18.90672 
1 1 1   14   17   31 o  181.540   12.117   25.448   3.3475   25.043   4.0213   26.364   6.0412  179.695   14.750  182.979   22.012 -3.283127 26.49706 
1 1 1   14   17   32 o  208.411   9.2975   33.338   2.9659   32.978   4.3192   33.659   4.0799  206.481   13.745  208.753   12.831 -2.271362 18.80296 
1 1 1   14   17   33 o  340.246   7.2180   88.766   3.7590   94.446   5.5052   83.805   5.1452  350.625   10.258  330.293   10.177 20.33115 14.45005 
1 1 1   14   17   34 o  248.073   8.7894   47.241   3.3374   42.996   4.8109   51.178   4.6337  235.823   13.383  257.898   11.738 -22.07491 17.80166 
1 1 1   14   17   35 o  333.681   7.5367   85.419   3.8493   91.585   5.6729   80.157   5.2402  345.085   10.740  322.858   10.604 22.22644 15.09289 
1 1 1   14   17   36 o  113.757   16.720   10.237   2.8245   11.043   4.1624   9.5497   3.8453  116.530   24.131  108.269   23.848 8.260979 33.92665 
1 1 1   14   17   37 o  128.821   19.719   13.228   3.7644   11.510   13.274   13.378   3.9256  128.174   48.818  129.365   20.509 -1.190872 52.95106 
1 1 1   14   17   38 o  272.906   9.8990   57.306   4.1350   51.203   5.5803   64.738   6.1578  256.847   14.250  289.309   13.906 -32.46210 19.91078 
1 1 1   14   17   39 o  131.770   16.360   13.696   3.2286   17.283   4.6325   10.307   4.5022  146.936   21.212  111.583   26.715 35.35350 34.11206 
1 1 1   14   17   40 o   79.080   23.503   5.0335   3.0533   7.9263   4.5640   2.6900   4.1078   98.119   28.621   69.820   27.013 28.29907 39.35549 
1 1 1   14   17   41 f  175.043   12.887   23.832   3.4285   22.188   5.1177   25.171   4.6180  166.822   20.472  178.863   17.075 -12.04143 26.65847 
1 1 1   14   17   42 o  306.559   9.6973   72.403   4.5503   69.902   6.3947   74.968   6.4762  300.165   13.918  310.945   13.607 -10.78021 19.46470 
1 1 1   14   17   43 o  169.679   14.076   22.508   3.6229   25.872   5.7432   20.285   4.6690  179.703   21.294  159.449   19.540 20.25395 28.90039 
1 1 1   14   17   44 o  130.363   18.133   13.581   3.5201   20.263   5.4094   8.6720   4.6361  157.960   23.052  101.614   28.599 56.34582 36.73316 
1 1 1   14   17   45 o   65.767   27.745   0.8626   4.7819   7.2245   5.9922 -10.2941   7.9352   95.727   33.337   60.590   29.143 35.13681 44.27998 
1 1 1   14   17   46 o  183.662   14.278   26.440   3.9822   25.120   6.1176   27.412   5.2457  175.591   23.340  185.479   18.734 -9.888443 29.92870 
1 1 1   14   17   47 o  121.166   21.588   12.043   3.8570   12.106   5.8766   11.996   5.1121  118.029   31.809  118.464   28.533 -0.4352417 42.73099 
1 1 1   14   17   48 o  113.281   25.141   10.821   4.2454   12.520   6.5452   9.5874   5.5779  118.956   34.153  105.342   31.872 13.61425 46.71477 
1 1 1   14   17   49 o  255.730   12.176   50.885   4.7659   61.033   7.5083   44.038   6.1677  276.987   17.804  235.407   17.237 41.57945 24.78105 
1 1 1   14   17   50 o  191.178   18.439   29.379   5.3288   30.243   10.718   29.096   6.1417  179.363   40.052  188.563   21.674 -9.199753 45.54062 
1 1 1   14   17   51 o   91.098   30.079   7.0924   4.8724   6.1313   9.4005   7.4454   5.6974   96.626   39.672   93.677   32.513 2.948990 51.29295 
1 1 1   14   17   52 o  122.419   25.527   12.937   4.6282   17.515   6.3691   7.8150   6.7370  139.831   30.607   96.007   35.129 43.82335 46.59264 
1 1 1   14   17   53 o   54.833   24.844  -1.5872   4.4934   4.7580   6.2608  -8.3278   6.4529   82.999   32.975   53.552   25.887 29.44677 41.92256 
1 1 1   14   17   54 o   59.302   25.683   0.4421   4.2964   1.7294   6.1099  -0.8169   6.0426   71.943   30.889   64.905   29.162 7.037300 42.47984 
1 1 1   14   17   55 o  105.697   25.532   10.021   4.0843   8.2973   5.8667   11.642   5.6896   94.191   32.976  110.098   31.910 -15.90732 45.88797 
1 1 1   14   17   56 f   57.135   24.871   0.4237   4.0704   1.0086   5.7885  -0.1485   5.7248   67.219   29.449   63.882   28.565 3.337204 41.02729 
1 1 1   14   18    0 o  289.190   13.700   64.479   6.0332   64.479   6.0332   64.479   6.0332  289.190   13.700  289.190   13.700 0.000000 0.000000 
1 1 1   14   18    1 o  832.572   9.6325  530.872   12.275  520.743   17.030  541.825   17.710  824.312   13.497  840.810   13.761 -16.49738 19.27540 
1 1 1   14   18    2 o  593.960   7.1480  270.099   6.4985  261.402   7.7807  290.159   11.817  584.265   8.7004  615.372   12.546 -31.10760 15.26721 
1 1 1   14   18    3 o  464.813   12.651  165.550   9.0005   0.0000   0.0000  165.550   9.0005  ?   ?   464.813   12.651 0.000000 12.65083 
1 1 1   14   18    4 o  497.592   7.0665  189.563   5.3821  187.945   6.4156  193.408   9.8885  495.422   8.4604  502.389   12.859 -6.966766 15.39295 
1 1 1   14   18    5 o  584.666   7.1723  261.716   6.4185  256.307   7.6373  274.724   11.843  578.541   8.6246  598.750   12.923 -20.20892 15.53661 
1 1 1   14   18    6 o  461.137   7.2251  162.809   5.0997  163.573   6.0518  160.938   9.4717  462.180   8.5547  458.243   13.504 3.936066 15.98557 
1 1 1   14   18    7 o  266.493   9.1784   54.388   3.7439   59.102   4.3949   41.919   7.1483  277.775   10.337  232.780   20.265 44.99510 22.74884 
1 1 1   14   18    8 o  445.992   10.123  152.356   6.9103  162.632   10.108  143.339   9.4686  460.594   14.338  432.412   14.306 28.18173 20.25408 
1 1 1   14   18    9 o  359.494   8.8556   98.971   4.8728  102.711   5.8226   90.229   8.9018  366.179   10.389  342.951   16.958 23.22861 19.88722 
1 1 1   14   18   10 o  472.205   8.1363  170.745   5.8807  167.365   6.9805  179.008   10.915  467.450   9.7562  483.184   14.758 -15.73392 17.69161 
1 1 1   14   18   11 o  857.821   8.6445  563.532   11.350  578.556   13.996  534.672   19.398  869.044   10.522  834.997   15.178 34.04675 18.46831 
1 1 1   14   18   12 o  741.867   8.4141  421.473   9.5544  416.154   11.334  434.533   17.760  737.070   10.046  752.705   15.415 -15.63513 18.40007 
1 1 1   14   18   13 o  856.266   8.7995  561.528   11.533  554.889   13.771  577.119   21.104  851.053   10.572  867.361   15.896 -16.30853 19.09034 
1 1 1   14   18   14 o  563.207   8.4602  242.928   7.2932  249.378   8.7068  227.760   13.352  570.557   9.9699  544.851   16.011 25.70605 18.86107 
1 1 1   14   18   15 o  517.898   10.036  205.481   7.9553  205.481   7.9553   0.0000   0.0000  517.898   10.036  ?   ?  0.000000 10.03554 
1 1 1   14   18   16 o  293.251   11.219   65.903   5.0358   64.074   5.6446   73.034   11.147  289.097   12.756  307.068   23.906 -17.97070 27.09607 
1 1 1   14   18   17 o  126.085   23.396   12.629   4.3490   13.684   4.9003   8.7161   9.4377  131.055   25.345  115.326   41.672 15.72814 48.77478 
1 1 1   14   18   18 o  579.042   7.5748  256.780   6.7135  261.452   9.3068  251.711   9.6936  584.106   10.410  573.074   11.051 11.03149 15.18186 
1 1 1   14   18   19 o  746.135   7.6286  426.386   8.7123  421.322   12.056  431.922   12.604  741.428   10.623  750.661   10.970 -9.232544 15.27080 
1 1 1   14   18   20 f  245.677   11.390   46.276   4.2831   49.950   5.9636   42.363   6.1554  254.592   15.376  234.151   17.297 20.44122 23.14320 
1 1 1   14   18   21 o  259.644   11.369   51.695   4.5181   52.641   6.3658   50.735   6.4136  261.274   15.995  256.429   16.427 4.844696 22.92757 
1 1 1   14   18   22 o  174.784   15.860   23.667   4.1967   31.422   6.0963   16.682   5.7861  200.978   20.086  144.483   27.161 56.49461 33.78109 
1 1 1   14   18   23 o  276.170   8.6711   58.449   3.6654   61.013   4.5346   53.615   6.2255  282.074   10.503  263.668   15.494 18.40665 18.71827 
1 1 1   14   18   24 o  258.422   8.4572   51.180   3.3452   54.058   3.9620   44.034   6.2432  265.528   9.7484  238.576   17.212 26.95233 19.78114 
1 1 1   14   18   25 o  466.004   6.7937  166.356   4.8458  164.745   5.8198  169.997   8.7501  463.639   8.2008  470.576   12.148 -6.936737 14.65711 
1 1 1   14   18   26 f  404.468   7.1082  125.345   4.4006  124.686   5.2795  126.846   7.9653  403.299   8.5526  406.360   12.806 -3.060669 15.39951 
1 1 1   14   18   27 o   66.195   22.552   3.1346   2.7367   0.8564   3.1529   10.095   5.5112   56.173   23.009  111.844   31.077 -55.67163 38.66804 
1 1 1   14   18   28 o  452.405   7.6376  156.881   5.2888  156.033   6.7182  158.264   8.5764  450.961   9.7329  453.825   12.347 -2.864014 15.72163 
1 1 1   14   18   29 o  305.382   7.5228   71.488   3.5163   74.822   4.7259   67.353   5.2631  312.237   9.8885  296.085   11.613 16.15170 15.25286 
1 1 1   14   18   30 f  342.426   8.0625   89.918   4.2258   93.717   5.1650   82.226   7.3492  349.433   9.6569  326.691   14.697 22.74194 17.58581 
1 1 1   14   18   31 o  226.713   8.5856   39.433   2.9793   41.033   4.2555   37.896   4.1725  230.674   12.095  221.618   12.349 9.055847 17.28571 
1 1 1   14   18   32 o  267.737   7.9016   54.984   3.2381   54.968   4.6728   54.999   4.4913  267.370   11.418  267.494   10.970 -0.1237793 15.83371 
1 1 1   14   18   33 o  503.619   6.4511  194.424   4.9728  203.325   7.2040  186.322   6.8730  514.596   9.1462  492.615   9.1152 21.98047 12.91276 
1 1 1   14   18   34 o   58.686   21.416   2.2015   2.5014  -2.0393   3.7052   5.7528   3.3907   49.681   22.530   84.726   24.656 -35.04561 33.39944 
1 1 1   14   18   35 o  149.485   13.277   17.372   3.0063   14.157   4.3066   20.428   4.1985  132.910   21.934  161.398   17.263 -28.48746 27.91285 
1 1 1   14   18   36 o  118.566   16.684   11.112   2.9440   11.588   4.6878   10.802   3.7832  118.806   26.458  115.575   22.192 3.231094 34.53286 
1 1 1   14   18   37 o  351.326   18.117   96.379   9.7094   96.379   9.7094   0.0000   0.0000  351.326   18.117  ?   ?  0.000000 18.11728 
1 1 1   14   18   38 o  334.295   7.8392   85.833   4.0112   86.798   5.8995   85.004   5.4701  335.480   11.489  332.151   10.760 3.329193 15.74049 
1 1 1   14   18   39 o  179.667   11.611   25.012   3.1760   25.560   4.7316   24.562   4.2846  180.291   17.361  177.066   15.981 3.224625 23.59669 
1 1 1   14   18   40 o   56.585   22.508   1.4122   2.9202   0.7133   4.3658   1.9780   3.9284   63.205   26.579   65.602   26.102 -2.397186 37.25290 
1 1 1   14   18   41 o  463.483   7.7980  165.098   5.5321  163.776   7.7345  166.483   7.9158  460.674   10.969  464.406   11.136 -3.731964 15.63101 
1 1 1   14   18   42 o  198.043   12.073   30.447   3.6423   29.844   5.4599   30.931   4.8891  194.198   18.596  198.498   16.234 -4.299942 24.68471 
1 1 1   14   18   43 o  286.992   9.6528   63.494   4.2403   64.541   6.4881   62.713   5.6023  287.591   14.789  284.424   12.868 3.167206 19.60401 
1 1 1   14   18   44 f  144.936   22.295   17.076   4.7876   20.480   5.9525   10.839   8.0567  157.678   25.537  113.671   38.694 44.00716 46.36114 
1 1 1   14   18   45 o   98.059   23.841   8.0177   3.5436   4.5831   5.5887   10.327   4.5826   83.394   31.697  110.517   27.260 -27.12332 41.80629 
1 1 1   14   18   46 o  144.634   17.210   16.665   3.7351   20.137   5.6462   13.963   4.9807  156.358   24.388  129.015   26.118 27.34303 35.73420 
1 1 1   14   18   47 o  209.190   13.217   34.206   4.2104   39.425   6.6504   30.715   5.4392  221.871   19.791  196.288   18.316 25.58267 26.96543 
1 1 1   14   18   48 o  198.251   14.791   30.953   4.4561   31.764   7.3852   30.488   5.5879  195.794   25.230  195.005   18.961 0.7884216 31.56049 
1 1 1   14   18   49 o  287.608   13.214   64.623   5.8170   41.187   11.366   72.941   6.7711  214.464   35.892  304.920   14.508 -90.45615 38.71325 
1 1 1   14   18   50 o  127.386   26.519   13.958   5.0025  -0.9200   9.6917   19.361   5.8407   81.998   36.878  150.745   26.268 -68.74734 45.27745 
1 1 1   14   18   51 o   60.923   26.379   0.2600   4.5302  -3.7823   6.2336   4.7845   6.5950   60.496   28.082   84.950   33.814 -24.45460 43.95449 
1 1 1   14   18   52 o  138.581   21.846   16.074   4.4805   18.539   6.4793   13.815   6.2024  143.729   30.401  122.393   32.545 21.33669 44.53569 
1 1 1   14   18   53 o  179.784   17.427   26.249   4.7354   22.995   6.2379   30.674   7.2749  162.746   25.910  188.327   25.925 -25.58038 36.65252 
1 1 1   14   18   54 o   72.575   27.441   3.9788   4.1750   10.355   6.0814  -1.7052   5.7418  103.809   33.566   60.978   27.804 42.83070 43.58634 
1 1 1   14   18   55 o  148.657   19.228   18.493   4.2726   14.220   6.0420   22.766   6.0427  121.120   32.081  160.373   25.468 -39.25291 40.96132 
1 1 1   14   18   56 o   68.942   28.370   2.8326   4.8211   6.3114   5.9817  -3.6160   8.1442   84.822   32.658   66.794   31.360 18.02790 45.27713 
1 1 1   14   19    0 o   59.729   34.363   3.4371   5.0306   3.4371   5.0306   3.4371   5.0306   59.729   34.363   59.729   34.363 0.000000 0.000000 
1 1 1   14   19    1 o  114.083   20.544   10.299   3.4554   11.529   5.0183   9.1904   4.7648  119.979   27.861  107.347   28.516 12.63139 39.86734 
1 1 1   14   19    2 o  524.778   8.7115  210.893   6.9975  217.972   9.9784  204.043   9.8155  533.352   12.223  516.019   12.427 17.33344 17.43093 
1 1 1   14   19    3 f  1158.07   9.6376  1027.18   17.083  1020.21   20.741  1041.86   30.124  1153.92   11.743  1165.39   16.888 -11.46997 20.56950 
1 1 1   14   19    4 o  538.828   7.2883  222.297   6.0110  214.751   7.1565  240.372   11.076  529.549   8.8293  560.040   12.921 -30.49121 15.64960 
1 1 1   14   19    5 o  1215.23   12.207  1131.63   22.706  1119.04   31.423  1145.39   32.847  1207.74   16.998  1221.78   17.564 -14.03711 24.44279 
1 1 1   14   19    6 f  901.093   10.204  621.966   14.074  636.129   19.937  607.894   19.872  910.904   14.299  890.428   14.580 20.47571 20.42194 
1 1 1   14   19    7 o  518.174   6.5818  205.568   5.2203  205.465   5.9239  205.926   11.043  518.016   7.4713  518.286   13.921 -0.2693481 15.79882 
1 1 1   14   19    8 o  746.500   8.1514  426.732   9.3138  428.417   11.391  423.333   16.177  747.864   9.9512  743.073   14.224 4.790588 17.35903 
1 1 1   14   19    9 o  802.901   8.4284  493.678   10.358  489.367   12.577  502.767   18.262  799.262   10.280  809.723   14.735 -10.46021 17.96671 
1 1 1   14   19   10 o  206.026   13.242   32.672   4.1537   32.300   4.8230   33.741   8.1734  204.625   15.514  207.680   26.302 -3.054352 30.53638 
1 1 1   14   19   11 o  550.984   8.2483  232.489   6.9563  233.873   8.3549  229.360   12.559  552.544   9.8788  546.852   15.004 5.691528 17.96446 
1 1 1   14   19   12 o  343.848   9.5540   90.566   5.0283   91.358   5.9517   88.591   9.3989  345.287   11.261  339.195   18.169 6.092041 21.37624 
1 1 1   14   19   13 o  347.826   11.497   92.716   6.1212   92.716   6.1212   0.0000   0.0000  347.826   11.497  ?   ?  0.000000 11.49747 
1 1 1   14   19   14 o  867.895   10.681  577.179   14.189  577.179   14.189   0.0000   0.0000  867.895   10.681  ?   ?  0.000000 10.68137 
1 1 1   14   19   15 o  656.762   8.6054  330.387   8.6506  330.403   10.256  330.347   16.105  656.666   10.204  656.038   16.038 0.6274414 19.00873 
1 1 1   14   19   16 o  545.362   8.8867  227.837   7.4181  223.701   8.6406  239.431   14.467  540.292   10.448  558.367   16.927 -18.07568 19.89192 
1 1 1   14   19   17 o  493.480   9.0289  186.567   6.8199  180.583   7.9017  204.043   13.503  485.403   10.635  515.375   17.118 -29.97162 20.15259 
1 1 1   14   19   18 o  348.190   8.8230   92.883   4.7022   91.431   6.5156   94.462   6.7929  345.280   12.329  350.939   12.646 -5.658478 17.66124 
1 1 1   14   19   19 o  525.141   7.7523  211.241   6.2313  205.751   8.6308  217.219   9.0058  518.047   10.885  532.275   11.054 -14.22729 15.51340 
1 1 1   14   19   20 o  212.820   12.942   34.883   4.1958   31.352   5.8679   38.577   6.0020  200.893   19.321  223.265   17.708 -22.37201 26.20893 
1 1 1   14   19   21 o  588.509   7.8203  265.340   7.0444  266.137   9.8628  264.510   10.065  589.097   10.938  587.264   11.197 1.832764 15.65302 
1 1 1   14   19   22 o  390.198   10.441  116.758   6.2360  119.245   10.587  115.437   7.7169  393.605   17.572  387.768   13.002 5.836304 21.85939 
1 1 1   14   19   23 o  153.817   17.369   18.444   4.0177   18.769   5.8057   18.145   5.5656  153.623   25.591  151.123   24.930 2.500427 35.72673 
1 1 1   14   19   24 o  585.884   6.6119  262.950   5.9293  266.678   7.3831  256.177   9.9510  589.876   8.1773  577.774   11.252 12.10144 13.90977 
1 1 1   14   19   25 o  175.698   11.739   23.806   3.1387   21.475   3.6901   29.903   5.9686  166.466   14.631  195.726   20.214 -29.25961 24.95362 
1 1 1   14   19   26 o  276.796   8.8193   58.750   3.7365   57.664   4.4728   61.259   6.7977  274.102   10.661  281.596   15.835 -7.493927 19.08974 
1 1 1   14   19   27 o  607.741   6.8167  283.025   6.3411  295.962   7.9834  260.912   10.437  621.274   8.3953  582.804   11.700 38.47040 14.40054 
1 1 1   14   19   28 o  488.548   7.4830  182.962   5.5957  184.812   6.4097  177.032   11.473  490.893   8.5306  479.256   15.640 11.63702 17.81557 
1 1 1   14   19   29 o  702.393   6.9380  378.139   7.4591  378.211   9.2679  378.006   12.568  702.173   8.6232  701.298   11.708 0.8748169 14.54103 
1 1 1   14   19   30 o  245.706   7.9932   46.302   3.0061   43.380   4.1467   49.539   4.3641  237.562   11.404  253.884   11.230 -16.32150 16.00539 
1 1 1   14   19   31 o  256.166   7.9470   50.336   3.1160   48.043   4.3522   52.747   4.4632  249.965   11.375  261.943   11.132 -11.97781 15.91589 
1 1 1   14   19   32 o  369.189   6.8554  104.504   3.8739  107.255   5.5107  101.817   5.4470  373.681   9.6347  364.067   9.7748 9.613770 13.72490 
1 1 1   14   19   33 o  448.998   6.5623  154.567   4.5099  155.780   6.4044  153.373   6.3520  450.348   9.2909  446.855   9.2869 3.492584 13.13653 
1 1 1   14   19   34 o  225.854   9.1401   39.188   3.1597   37.816   4.5519   40.463   4.3895  220.964   13.524  228.771   12.584 -7.806778 18.47298 
1 1 1   14   19   35 o  193.535   11.466   28.950   3.3815   27.189   4.9035   30.547   4.6693  186.328   17.394  198.026   15.530 -11.69815 23.31800 
1 1 1   14   19   36 o   69.423   26.435   2.7931   3.8916  -5.3580   7.8596   5.4407   4.4793   69.055   31.870   84.989   28.852 -15.93439 42.98975 
1 1 1   14   19   37 o  187.155   11.776   27.125   3.3563   20.818   4.4832   35.167   5.0625  162.388   18.359  212.305   15.690 -49.91690 24.15046 
1 1 1   14   19   38 o  236.154   9.2978   42.906   3.3608   41.098   4.8564   44.568   4.6558  229.983   13.861  239.806   12.730 -9.823288 18.81925 
1 1 1   14   19   39 o  204.090   10.619   32.193   3.3059   34.139   4.8277   30.475   4.5363  209.136   15.185  197.553   15.117 11.58310 21.42654 
1 1 1   14   19   40 o  188.169   11.358   27.434   3.2558   29.981   4.9037   25.427   4.3540  195.439   16.548  180.038   15.966 15.40154 22.99418 
1 1 1   14   19   41 o  120.923   17.896   11.678   3.2124   11.319   4.6750   11.998   4.4216  116.489   26.780  120.570   24.787 -4.081398 36.49033 
1 1 1   14   19   42 o  227.908   10.563   40.092   3.6848   44.146   5.6240   37.043   4.8775  237.498   15.557  217.730   14.722 19.76793 21.41850 
1 1 1   14   19   43 o  148.624   19.414   17.688   4.3109   20.268   5.2639   12.433   7.5124  158.182   22.365  119.880   37.125 38.30249 43.34090 
1 1 1   14   19   44 o   66.220   24.438   2.9095   3.2704   6.7878   4.7434  -0.6046   4.5152   91.322   29.655   59.277   25.988 32.04446 39.43153 
1 1 1   14   19   45 o  216.314   12.088   36.399   3.9862   37.225   5.9286   35.717   5.3852  216.651   18.042  212.733   16.672 3.917496 24.56581 
1 1 1   14   19   46 o  215.726   12.552   36.280   4.1266   40.542   6.4107   33.265   5.3924  225.633   18.732  204.821   17.364 20.81194 25.54174 
1 1 1   14   19   47 o  179.283   19.250   25.816   5.1999   36.216   18.115   24.883   5.4283  182.185   57.831  175.382   20.615 6.803223 61.39537 
1 1 1   14   19   48 o   82.090   30.070   5.0122   4.9381   24.134   11.705   0.8720   5.4465  156.276   45.907   68.604   29.301 87.67168 54.46140 
1 1 1   14   19   49 o  142.068   23.660   16.880   4.9640   7.5896   10.051   19.877   5.7088  102.771   41.454  153.611   25.151 -50.84001 48.48735 
1 1 1   14   19   50 o  406.396   14.526  130.092   9.0360  130.092   9.0360   0.0000   0.0000  406.396   14.526  ?   ?  0.000000 14.52631 
1 1 1   14   19   51 o  233.365   13.828   43.003   4.9171   48.653   7.3306   38.382   6.6298  244.457   19.760  216.664   20.225 27.79283 28.27615 
1 1 1   14   19   52 o   64.563   26.892   1.6548   4.4053  -0.2661   5.6844   4.5431   6.9704   65.071   28.818   84.115   34.305 -19.04379 44.80253 
1 1 1   14   19   53 o   67.481   26.543   2.9354   4.0190   2.3482   5.5844   3.5663   5.7886   71.611   30.084   76.394   31.221 -4.782921 43.35670 
1 1 1   14   19   54 o   99.746   27.288   9.1062   4.2867   10.056   6.0525   8.1504   6.0721  101.845   33.520   93.517   33.470 8.327675 47.36842 
1 1 1   14   19   55 f   53.896   24.795  -2.0126   4.7039  -1.6054   5.8083  -2.7886   8.0184   60.782   27.810   67.982   31.654 -7.199772 42.13575 
1 1 1   14   20    0 f  238.423   17.064   44.225   6.1539   44.225   6.1539   44.225   6.1539  238.423   17.064  238.423   17.064 0.000000 0.000000 
1 1 1   14   20    1 o  608.103   8.9810  283.209   8.3593  295.053   12.013  272.089   11.640  620.469   12.649  595.826   12.763 24.64252 17.96920 
1 1 1   14   20    2 o  417.054   9.0212  133.212   5.7587  134.962   8.0597  131.386   8.2311  419.643   12.548  414.024   12.989 5.618317 18.05970 
1 1 1   14   20    3 o  880.424   10.076  593.774   13.578  599.989   19.207  587.565   19.198  884.621   14.185  875.399   14.328 9.222290 20.16186 
1 1 1   14   20    4 o  1333.74   10.722  1362.81   21.889  1364.72   26.843  1359.03   37.815  1334.32   13.143  1330.50   18.569 3.824707 22.74953 
1 1 1   14   20    5 o  933.863   8.5749  667.883   12.257  673.697   15.015  656.270   21.221  937.763   10.460  925.063   14.988 12.70007 18.27702 
1 1 1   14   20    6 o  435.176   7.6552  145.013   5.0991  147.386   6.0649  139.292   9.4181  438.674   9.0325  426.204   14.437 12.47006 17.02969 
1 1 1   14   20    7 o  631.042   6.7228  304.890   6.4935  295.217   7.2962  341.735   14.240  620.910   7.6772  667.608   13.935 -46.69763 15.91024 
1 1 1   14   20    8 o  611.026   8.0037  285.911   7.4855  282.793   9.0624  292.606   13.280  607.593   9.7445  617.736   14.045 -10.14343 17.09444 
1 1 1   14   20    9 o  425.789   8.4408  138.848   5.5011  133.437   6.4963  152.562   10.342  417.343   10.170  445.967   15.151 -28.62451 18.24768 
1 1 1   14   20   10 o  743.268   8.3490  423.102   9.4984  421.458   11.551  426.533   16.691  741.693   10.175  745.720   14.623 -4.026733 17.81448 
1 1 1   14   20   11 o  250.904   11.734   48.250   4.5061   49.956   5.3642   44.159   8.3061  254.857   13.802  238.438   23.046 16.41968 26.86326 
1 1 1   14   20   12 o  235.588   14.809   42.748   5.3130   42.748   5.3130   0.0000   0.0000  235.588   14.809  ?   ?  0.000000 14.80936 
1 1 1   14   20   13 o  387.710   9.4538  115.162   5.6103  115.113   6.5776  115.292   10.748  387.552   11.088  387.387   18.126 0.1649780 21.24845 
1 1 1   14   20   14 o  255.329   12.058   49.982   4.7124   48.388   5.4323   54.832   9.4728  250.735   14.213  265.741   23.532 -15.00609 27.49146 
1 1 1   14   20   15 o  289.975   11.381   64.461   5.0513   67.095   5.7830   55.980   10.375  295.776   12.774  268.122   25.592 27.65433 28.60259 
1 1 1   14   20   16 o  686.695   8.7222  361.264   9.1676  356.874   10.862  372.134   17.092  682.357   10.400  696.076   16.042 -13.71814 19.11834 
1 1 1   14   20   17 o  636.396   8.8059  310.308   8.5777  310.478   10.299  309.924   15.497  636.409   10.573  635.173   15.939 1.235779 19.12740 
1 1 1   14   20   18 o  203.652   12.885   31.951   3.9958   34.432   5.5717   29.323   5.7336  210.894   17.416  194.191   19.556 16.70335 26.18707 
1 1 1   14   20   19 o  484.644   8.0337  179.953   5.9595  180.569   8.2295  179.274   8.6417  485.234   11.080  483.436   11.679 1.798248 16.09848 
1 1 1   14   20   20 o  232.840   11.832   41.703   4.2028   43.270   5.9550   40.148   5.9324  236.623   16.546  227.799   17.140 8.823364 23.82311 
1 1 1   14   20   21 f  135.665   22.421   14.589   4.4932   4.6343   7.8357   19.466   5.4844   95.698   37.228  156.958   23.556 -61.25978 44.05479 
1 1 1   14   20   22 o  847.704   11.454  551.459   14.862   0.0000   0.0000  551.459   14.862  ?   ?   847.704   11.454 0.000000 11.45426 
1 1 1   14   20   23 o  640.111   9.1267  314.165   8.9421  340.323   15.770  301.770   10.856  665.064   15.492  627.043   11.311 38.02069 19.18164 
1 1 1   14   20   24 o  354.285   10.667   96.324   5.7843  108.422   10.117   90.448   7.0505  374.992   17.626  343.036   13.428 31.95596 22.15780 
1 1 1   14   20   25 o  100.687   18.179   8.0602   2.6986   7.5330   3.0542   9.9369   5.7624   96.808   21.199  111.189   32.082 -14.38107 38.45284 
1 1 1   14   20   26 o  580.180   6.8006  257.941   6.0392  259.197   7.4343  255.503   10.356  581.401   8.3540  576.704   11.732 4.697876 14.40217 
1 1 1   14   20   27 o  281.104   8.8268   60.614   3.7978   60.447   4.2291   61.307   8.6324  280.639   9.8454  280.639   20.232 0.6408691E-03 22.50031 
1 1 1   14   20   28 o  441.811   7.2293  149.634   4.8888  149.838   5.8943  149.185   8.7514  441.947   8.7134  440.339   12.984 1.608093 15.63706 
1 1 1   14   20   29 o  203.207   10.387   31.800   3.2199   33.703   3.7154   26.056   6.4540  209.051   11.658  181.312   23.833 27.73943 26.53166 
1 1 1   14   20   30 o   79.834   21.706   5.1240   2.7223   7.4660   3.0616  -3.7184   5.9490   96.140   21.360   61.668   28.189 34.47269 35.36814 
1 1 1   14   20   31 o  174.043   10.059   23.351   2.6682   18.958   3.6723   28.263   3.8833  155.889   15.600  191.048   13.364 -35.15793 20.54149 
1 1 1   14   20   32 o  256.555   7.9762   50.509   3.1322   53.659   4.3637   47.161   4.4985  264.140   10.793  247.505   11.874 16.63573 16.04670 
1 1 1   14   20   33 o  211.225   9.3148   34.281   3.0115   35.823   4.3046   32.802   4.2148  215.112   13.137  205.750   13.457 9.362213 18.80622 
1 1 1   14   20   34 o  212.261   10.308   34.661   3.3489   32.333   4.6050   37.275   4.8789  203.915   14.856  219.070   14.634 -15.15518 20.85373 
1 1 1   14   20   35 o  251.344   10.979   48.658   4.2237   70.229   13.360   46.263   4.4521  294.621   30.047  244.947   11.875 49.67461 32.30841 
1 1 1   14   20   36 o   73.844   21.289   4.3808   2.5385   9.0041   3.7431   0.4437   3.4542  104.792   23.870   56.129   23.625 48.66331 33.58421 
1 1 1   14   20   37 o  241.096   9.0175   44.705   3.3277   48.412   4.7718   41.194   4.6431  250.339   12.453  230.422   13.220 19.91672 18.16187 
1 1 1   14   20   38 o   45.755   20.068  -0.5641   2.6948  -6.6182   3.8239   5.4087   3.7981   39.996   19.472   82.788   26.502 -42.79124 32.88616 
1 1 1   14   20   39 o  246.515   9.3498   46.783   3.5279   50.058   5.1848   43.959   4.8142  253.874   13.390  237.893   13.274 15.98097 18.85460 
1 1 1   14   20   40 f  163.868   13.330   20.943   3.3144   16.049   4.6561   25.969   4.7190  140.786   22.354  181.549   17.187 -40.76311 28.19714 
1 1 1   14   20   41 o  537.047   8.9251  222.060   7.3366  237.062   9.7067  202.070   11.205  553.822   11.451  509.887   14.357 43.93478 18.36407 
1 1 1   14   20   42 o  259.085   12.306   51.995   4.8801   51.058   6.0017   53.823   8.3835  255.432   15.423  259.757   21.272 -4.324631 26.27525 
1 1 1   14   20   43 o  320.087   11.069   79.228   5.4229   66.419   11.367   83.002   6.1704  285.308   26.326  327.220   12.320 -41.91187 29.06630 
1 1 1   14   20   44 o  118.817   20.437   11.490   3.5827   16.631   5.3716   7.3699   4.8085  141.402   25.768   94.298   29.780 47.10457 39.38092 
1 1 1   14   20   45 o  143.811   17.489   16.505   3.7704   15.251   5.7078   17.476   5.0221  133.827   28.724  145.865   23.276 -12.03839 36.97097 
1 1 1   14   20   46 o  233.576   14.210   42.770   5.0561   26.950   11.577   46.499   5.6205  168.208   44.337  243.180   15.176 -74.97232 46.86193 
1 1 1   14   20   47 o   74.316   27.325   3.9287   4.0832   9.0652   6.8383   1.0825   5.0903  103.299   35.634   67.507   28.561 35.79165 45.66681 
1 1 1   14   20   48 o   82.589   29.215   5.3562   4.6135   7.9741   10.321   4.7024   5.1575  104.685   42.084   81.127   30.539 23.55790 51.99689 
1 1 1   14   20   49 o  234.626   13.540   43.302   4.8419   43.174   6.6635   43.446   7.0475  231.298   18.989  231.319   20.105 -0.2052307E-01 27.65478 
1 1 1   14   20   50 f  202.216   19.169   33.205   5.8622   6.0848   10.334   46.072   7.1184   97.939   41.024  238.061   19.713 -140.1222 45.51438 
1 1 1   14   20   51 o   94.312   27.395   7.8462   4.1891   4.6882   5.9564   10.937   5.8927   82.029   32.298  108.852   32.720 -26.82236 45.97529 
1 1 1   14   20   52 o   53.137   24.216  -1.7572   4.3478  -4.2578   5.6690   1.8145   6.7752   55.557   26.110   74.921   32.349 -19.36357 41.57183 
1 1 1   14   20   53 o   66.080   26.320   2.7035   3.9980  -1.4467   5.4284   7.6234   5.9103   59.863   27.194   91.603   32.996 -31.74068 42.75791 
1 1 1   14   20   54 o   55.245   24.324  -0.0499   3.9928   0.7660   5.4724  -0.9785   5.8386   65.393   28.642   62.569   28.337 2.823788 40.29048 
1 1 1   14   21    0 o  527.565   12.736  213.549   10.271  213.549   10.271  213.549   10.271  527.565   12.736  527.565   12.736 0.000000 0.000000 
1 1 1   14   21    1 o  162.059   16.368   20.357   4.0044   28.009   5.5820   12.244   5.7476  189.964   19.473  123.500   30.570 66.46368 36.24491 
1 1 1   14   21    2 o  153.394   16.963   18.278   3.9160   13.120   5.2526   24.734   5.8758  128.020   27.617  178.004   22.037 -49.98485 35.33167 
1 1 1   14   21    3 o  633.174   9.1790  307.081   8.8959  305.500   12.182  308.888   13.022  631.304   12.606  634.729   13.403 -3.424927 18.40033 
1 1 1   14   21    4 o  629.379   7.5719  303.332   7.2944  302.159   8.7676  305.971   13.148  628.078   9.1200  631.701   13.598 -3.622437 16.37283 
1 1 1   14   21    5 o  891.695   8.4363  608.964   11.514  615.772   14.123  595.471   19.884  896.503   10.292  881.094   14.744 15.40918 17.98113 
1 1 1   14   21    6 o  194.142   11.773   28.994   3.4820   28.720   4.0321   29.797   6.9052  193.040   13.736  195.357   23.569 -2.316162 27.27947 
1 1 1   14   21    7 o  670.414   6.8446  344.148   7.0236  343.011   8.0291  347.852   14.495  669.253   7.8381  673.465   14.062 -4.211609 16.09865 
1 1 1   14   21    8 o  691.729   8.1898  366.466   8.6712  362.146   10.539  375.522   15.257  687.512   10.015  699.697   14.246 -12.18433 17.41400 
1 1 1   14   21    9 o  122.120   21.250   11.800   3.8278   9.5129   4.5109   17.684   7.2346  108.912   27.154  148.266   32.753 -39.35442 42.54478 
1 1 1   14   21   10 o  412.988   10.562  130.704   6.6766  130.704   6.6766   0.0000   0.0000  412.988   10.562  ?   ?  0.000000 10.56209 
1 1 1   14   21   11 o  512.336   10.119  201.140   7.9350  201.140   7.9350   0.0000   0.0000  512.336   10.119  ?   ?  0.000000 10.11865 
1 1 1   14   21   12 o  584.063   8.4653  261.313   7.5678  269.725   9.2286  244.042   13.223  593.269   10.163  563.839   15.322 29.42938 18.38606 
1 1 1   14   21   13 o  345.247   10.053   91.347   5.3125   91.685   6.2965   90.511   9.8974  345.791   11.896  342.550   18.950 3.240295 22.37504 
1 1 1   14   21   14 o  739.405   8.7829  418.874   9.9400  420.743   12.036  414.863   17.630  740.865   10.613  734.973   15.671 5.892761 18.92695 
1 1 1   14   21   15 o  454.453   9.2062  158.261   6.4038  162.574   7.6914  148.515   11.562  460.484   10.912  439.537   17.185 20.94693 20.35710 
1 1 1   14   21   16 o  287.626   11.682   63.452   5.1429   65.263   6.0249   58.587   9.8729  291.596   13.499  274.450   23.736 17.14624 27.30597 
1 1 1   14   21   17 o  471.148   9.4293  170.141   6.8000  176.070   8.0658  155.574   12.643  479.156   10.998  449.579   18.373 29.57733 21.41339 
1 1 1   14   21   18 o  286.554   12.087   63.008   5.3013   65.822   6.2687   55.942   9.9332  292.753   13.990  267.834   24.501 24.91846 28.21404 
1 1 1   14   21   19 o  464.134   8.1421  165.074   5.7843  158.248   8.1547  171.986   8.2059  454.125   11.732  473.469   11.323 -19.34454 16.30482 
1 1 1   14   21   20 o  424.340   11.807  138.199   7.6687   0.0000   0.0000  138.199   7.6687  ?   ?   424.340   11.807 0.000000 11.80692 
1 1 1   14   21   21 o  401.999   9.9348  123.944   6.1130  115.010   9.8940  129.460   7.7744  386.476   16.726  410.604   12.370 -24.12753 20.80299 
1 1 1   14   21   22 o  340.995   9.3509   89.171   4.8806   93.416   6.9387   85.014   6.8662  348.687   13.001  332.585   13.488 16.10129 18.73361 
1 1 1   14   21   23 o  366.768   9.3317  103.173   5.2387   96.567   7.2118  110.552   7.6225  354.437   13.293  379.254   13.131 -24.81778 18.68515 
1 1 1   14   21   24 f  247.149   11.959   46.926   4.5240   52.435   6.5156   41.798   6.2864  260.306   16.437  232.049   17.836 28.25722 24.25489 
1 1 1   14   21   25 o  255.958   11.811   50.338   4.6274   46.683   6.4424   54.233   6.6509  245.352   17.265  264.680   16.499 -19.32727 23.88092 
1 1 1   14   21   26 o  174.508   11.055   23.485   2.9375   23.214   3.2187   24.837   7.1868  173.348   12.209  176.180   27.554 -2.831818 30.13727 
1 1 1   14   21   27 o  428.007   7.2293  140.435   4.7361  139.044   5.6280  143.809   8.7668  425.729   8.6367  432.258   13.250 -6.528473 15.81660 
1 1 1   14   21   28 o  231.611   9.2670   41.176   3.2853   47.247   3.8546   25.058   6.2808  248.025   10.153  177.763   23.672 70.26167 25.75766 
1 1 1   14   21   29 o  115.424   16.367   10.496   2.8105   10.314   3.1575   11.189   6.1674  113.910   18.763  116.904   33.015 -2.994476 37.97436 
1 1 1   14   21   30 o  311.713   8.4922   74.575   4.0518   81.182   4.8696   59.709   7.3044  325.077   9.7868  277.154   17.305 47.92245 19.88070 
1 1 1   14   21   31 o  370.926   8.4880  105.621   4.8190  101.161   5.8640  114.899   8.4578  362.706   10.563  385.784   14.323 -23.07822 17.79683 
1 1 1   14   21   32 o   81.044   23.946   5.2469   3.1766   5.2017   3.2953   5.8408   11.940   80.953   24.499  111.117   45.055 -30.16422 51.28482 
1 1 1   14   21   33 o  329.707   7.8036   83.445   3.9382   80.936   5.0607   87.298   6.2708  324.369   10.193  336.511   12.175 -12.14145 15.87809 
1 1 1   14   21   34 o  201.358   12.492   31.405   3.8310   21.233   11.611   32.648   4.0582  155.842   45.705  205.220   12.987 -49.37852 47.51409 
1 1 1   14   21   35 o  124.493   13.764   12.131   2.5789   9.5764   3.6206   14.762   3.6744  108.409   22.554  136.506   18.027 -28.09686 28.87278 
1 1 1   14   21   36 o  369.359   7.1199  104.727   4.0252  102.404   5.5854  107.238   5.8061  364.698   10.006  373.171   10.165 -8.472351 14.26324 
1 1 1   14   21   37 o  333.510   7.5511   85.431   3.8547   81.794   5.4267   89.135   5.4763  325.705   10.885  340.091   10.520 -14.38571 15.13820 
1 1 1   14   21   38 o  107.784   17.659   9.2976   2.8124   8.1373   3.9969   10.436   3.9581   99.088   26.020  112.717   23.694 -13.62939 35.19162 
1 1 1   14   21   39 o  137.173   15.109   14.800   3.1197   21.772   4.4889   8.2856   4.3389  165.888   17.966   99.795   27.516 66.09290 32.86224 
1 1 1   14   21   40 o  219.782   10.711   37.285   3.6032   40.412   5.4589   34.870   4.7965  227.166   15.798  211.202   14.934 15.96428 21.73917 
1 1 1   14   21   41 o  121.874   21.598   12.097   3.8814   11.630   4.6235   13.212   7.1435  117.996   26.274  123.464   35.748 -5.467850 44.36469 
1 1 1   14   21   42 o   36.407   17.624  -4.7797   3.0176  -1.2288   4.3672  -8.0239   4.1744   56.428   25.111   40.283   19.766 16.14496 31.95727 
1 1 1   14   21   43 o   74.741   24.139   4.4240   3.1458   5.2457   4.6024   3.7035   4.3097   83.160   29.202   74.748   27.960 8.412331 40.42920 
1 1 1   14   21   44 o  279.467   12.105   60.593   5.1780   57.727   11.074   61.395   5.8578  264.100   27.812  280.802   13.629 -16.70160 30.97230 
1 1 1   14   21   45 o   91.636   27.568   7.0489   4.1818   8.4657   10.381   6.7744   4.5690  108.144   42.620   90.476   29.078 17.66855 51.59425 
1 1 1   14   21   46 o  109.141   24.031   10.021   3.9059   11.539   6.2414   9.0429   5.0076  114.248   33.511  102.363   30.014 11.88530 44.98742 
1 1 1   14   21   47 f  262.574   11.284   53.567   4.5352   48.912   6.6343   57.650   6.2138  247.706   17.613  270.432   15.072 -22.72542 23.18119 
1 1 1   14   21   48 o  263.823   26.931   58.766   10.723   58.766   10.723   0.0000   0.0000  263.823   26.931  ?   ?  0.000000 26.93064 
1 1 1   14   21   49 o  177.385   15.973   25.127   4.2905   27.344   6.2445   23.145   5.9049  181.232   23.031  166.033   23.926 15.19812 33.20990 
1 1 1   14   21   50 o  150.022   18.808   18.393   4.2239   20.052   6.2038   16.960   5.7671  151.473   27.782  138.827   28.105 12.64603 39.51841 
1 1 1   14   21   51 o  159.898   19.491   21.096   4.6717   19.632   6.1220   23.136   7.2284  148.827   27.900  159.668   30.692 -10.84171 41.47780 
1 1 1   14   21   52 f   96.610   25.857   8.3522   3.8992   9.9080   5.3641   6.6092   5.6777  102.692   31.297   87.422   32.210 15.26992 44.91038 
1 1 1   14   21   53 o  168.008   15.925   22.936   4.0464   22.123   5.4508   23.933   6.0393  160.269   22.868  165.398   24.605 -5.128967 33.59104 
1 1 1   14   22    0 o  383.645   14.069  113.221   8.2366  113.221   8.2366  113.221   8.2366  383.645   14.069  383.645   14.069 0.000000 0.000000 
1 1 1   14   22    1 f  439.391   9.3408  147.902   6.2821  151.903   8.9388  143.997   8.8307  445.079   13.121  433.330   13.314 11.74927 18.69294 
1 1 1   14   22    2 o  323.972   10.502   80.427   5.2078   82.869   7.1651   77.693   7.5825  328.679   14.242  318.176   15.570 10.50293 21.10099 
1 1 1   14   22    3 o  451.589   9.3444  156.230   6.4590  157.173   8.9332  155.197   9.3498  452.744   12.891  449.841   13.579 2.902924 18.72350 
1 1 1   14   22    4 o  720.204   7.8644  397.252   8.6694  387.967   10.336  419.286   15.922  711.620   9.4891  739.318   14.070 -27.69836 16.97120 
1 1 1   14   22    5 o  817.231   8.2001  511.538   10.257  504.034   12.302  528.649   18.578  811.065   9.9098  830.061   14.622 -18.99634 17.66382 
1 1 1   14   22    6 o  509.283   7.6598  198.641   5.9710  192.919   7.0365  213.361   11.286  501.817   9.1609  527.375   13.981 -25.55789 16.71509 
1 1 1   14   22    7 o  418.553   7.1844  134.159   4.6027  133.025   5.2143  138.162   9.7943  416.740   8.1746  424.285   15.082 -7.545166 17.15451 
1 1 1   14   22    8 f  338.336   11.473   87.755   5.9417   87.755   5.9417   0.0000   0.0000  338.336   11.473  ?   ?  0.000000 11.47334 
1 1 1   14   22    9 o  456.577   10.453  159.771   7.3048  159.771   7.3048   0.0000   0.0000  456.577   10.453  ?   ?  0.000000 10.45254 
1 1 1   14   22   10 o  453.629   8.6487  157.649   6.0051  157.300   7.1408  158.491   11.098  453.030   10.298  454.276   15.961 -1.246277 18.99476 
1 1 1   14   22   11 o  691.236   8.4425  366.048   8.9324  367.232   10.857  363.570   15.714  692.185   10.248  688.143   14.919 4.041199 18.09931 
1 1 1   14   22   12 o  341.609   9.9803   89.443   5.2185   90.529   6.2285   86.888   9.5589  343.569   11.844  335.550   18.686 8.018921 22.12319 
1 1 1   14   22   13 o  106.111   26.545   9.0519   4.3007   11.976   5.0813   1.6687   8.0748  121.967   27.833   88.044   36.518 33.92300 45.91544 
1 1 1   14   22   14 o  300.951   11.029   69.455   5.0803   68.267   6.0009   72.460   9.5447  298.240   13.146  305.966   20.499 -7.726227 24.35224 
1 1 1   14   22   15 o  461.899   16.381  164.044   11.581   0.0000   0.0000  164.044   11.581  ?   ?   461.899   16.381 0.000000 16.38086 
1 1 1   14   22   16 o  156.475   23.187   19.321   5.3853   23.124   7.0878   14.127   8.2829  170.436   28.152  132.628   38.520 37.80879 47.71113 
1 1 1   14   22   17 o  146.489   25.710   17.104   5.5544   15.087   7.0854   20.320   8.9464  136.253   34.065  157.736   37.589 -21.48291 50.72813 
1 1 1   14   22   18 o  347.448   21.298   93.589   11.272   0.0000   0.0000   93.589   11.272  ?   ?   347.448   21.298 0.000000 21.29760 
1 1 1   14   22   19 o  207.709   20.808   33.652   6.5263   29.618   8.4508   39.613   10.273  192.800   29.581  223.224   30.895 -30.42352 42.77298 
1 1 1   14   22   20 o  465.567   8.1919  166.141   5.8376  175.050   8.2423  157.175   8.2691  477.555   11.276  452.435   11.941 25.11972 16.42346 
1 1 1   14   22   21 o  571.883   7.9464  250.684   6.9558  257.203   9.7866  244.029   9.8883  578.853   11.046  563.769   11.459 15.08441 15.91597 
1 1 1   14   22   22 o  286.989   10.647   63.220   4.6768   60.281   6.4331   66.514   6.8111  279.422   15.098  293.534   15.212 -14.11172 21.43212 
1 1 1   14   22   23 o  779.310   8.1517  465.647   9.7236  467.922   13.561  463.240   13.950  780.539   11.351  776.529   11.737 4.010010 16.32750 
1 1 1   14   22   24 o  375.981   9.4936  108.472   5.4634  113.452   7.5737  103.069   7.8888  384.090   12.883  365.920   14.085 18.16919 19.08797 
1 1 1   14   22   25 o  142.466   21.288   16.083   4.4998   13.827   5.7233   19.736   7.2818  130.200   29.413  155.555   31.660 -25.35448 43.21420 
1 1 1   14   22   26 o   93.209   27.258   6.9462   4.1350   6.9153   5.6108   6.9828   6.1176   96.032   32.293   97.683   33.703 -1.650841 46.67665 
1 1 1   14   22   27 o  512.248   8.5990  201.343   6.7421  200.484   9.3747  202.263   9.7034  510.523   11.997  512.702   12.365 -2.179077 17.22843 
1 1 1   14   22   28 o  315.465   8.1093   76.352   3.9157   81.374   4.6090   63.323   7.4235  325.553   9.2494  285.586   17.060 39.96735 19.40648 
1 1 1   14   22   29 o   93.834   18.851   7.0714   2.6135   6.3934   2.9248   9.7575   5.8218   88.824   21.698  109.577   32.429 -20.75311 39.01845 
1 1 1   14   22   30 o  410.026   8.3228  129.052   5.2234  129.664   5.5861  124.798   14.735  410.910   8.8817  398.061   24.301 12.84906 25.87348 
1 1 1   14   22   31 o  149.826   14.932   17.524   3.3786   17.027   3.5067   23.962   12.616  147.495   15.777  165.859   47.353 -18.36427 49.91245 
1 1 1   14   22   32 o  248.424   10.609   47.497   4.0340   53.140   4.9017   35.652   7.1014  262.532   12.198  212.170   22.196 50.36237 25.32668 
1 1 1   14   22   33 o  173.950   22.144   24.115   5.7622   26.230   11.252   23.363   6.7087  173.681   42.639  169.684   26.713 3.996628 50.31580 
1 1 1   14   22   34 o  525.945   6.5627  212.220   5.2832  219.013   7.4715  205.427   7.4715  533.679   9.1466  516.779   9.4456 16.89948 13.14841 
1 1 1   14   22   35 f  113.580   14.996   10.172   2.5433   12.733   3.5640   7.5138   3.6306  126.312   19.024   95.581   24.654 30.73071 31.14084 
1 1 1   14   22   36 o   52.652   20.666   1.3258   2.4316   0.7629   3.4058   1.9111   3.4728   57.021   23.689   62.655   24.664 -5.634018 34.19790 
1 1 1   14   22   37 o   93.795   19.340   7.1395   2.6843   7.7016   3.7036   6.5174   3.8960   96.545   24.900   89.383   26.545 7.162193 36.39597 
1 1 1   14   22   38 o  169.322   11.930   22.266   3.0721   23.557   4.3749   21.011   4.3149  172.999   16.730  163.059   17.566 9.940414 24.25806 
1 1 1   14   22   39 o  210.128   10.928   34.180   3.5025   35.628   5.0790   32.867   4.8365  213.289   15.667  204.852   15.541 8.437256 22.06724 
1 1 1   14   22   40 o  260.095   11.431   52.302   4.5507   54.990   5.3735   45.486   8.5576  266.249   13.186  237.527   23.861 28.72264 27.26152 
1 1 1   14   22   41 o  115.818   18.881   10.816   3.2318   12.160   4.6941   9.6041   4.4560  120.589   26.182  106.801   27.188 13.78822 37.74508 
1 1 1   14   22   42 o  186.689   12.679   27.167   3.6016   22.068   5.2611   31.665   4.9407  165.372   21.278  200.497   16.239 -35.12447 26.76699 
1 1 1   14   22   43 o  269.881   12.196   56.509   5.0380   49.473   11.008   58.373   5.6661  242.787   30.281  273.873   13.517 -31.08595 33.16084 
1 1 1   14   22   44 o  129.648   18.935   13.569   3.6467   13.904   5.3574   13.279   4.9780  127.685   28.168  125.278   26.772 2.407333 38.86124 
1 1 1   14   22   45 o  213.561   16.629   36.136   5.3927   0.0000   0.0000   36.136   5.3927  ?   ?   213.561   16.629 0.000000 16.62854 
1 1 1   14   22   46 o  153.124   16.916   18.745   3.8984   22.984   5.5879   14.725   5.4414  167.249   22.390  130.772   28.027 36.47664 35.87251 
1 1 1   14   22   47 o  172.075   42.139   28.661   11.010   28.661   11.010   0.0000   0.0000  172.075   42.139  ?   ?  0.000000 42.13913 
1 1 1   14   22   48 o  141.600   18.925   16.342   3.9992   13.921   5.6960   18.695   5.6164  125.066   30.115  148.082   25.712 -23.01598 39.59810 
1 1 1   14   22   49 o  206.508   13.783   33.702   4.3316   33.914   6.2270   33.503   6.0294  203.521   20.259  202.637   19.688 0.8840942 28.24969 
1 1 1   14   22   50 o   65.185   26.618   2.0877   4.2035   0.4857   5.6768   4.0320   6.2542   67.023   29.268   80.234   32.582 -13.21052 43.79754 
1 1 1   14   22   51 f  168.689   15.853   22.977   4.0452   21.870   5.5205   24.261   5.9446  159.971   23.225  168.221   23.748 -8.250214 33.21671 
1 1 1   14   22   52 o  211.823   16.343   36.412   5.2577   47.471   6.8749   20.830   8.1603  239.787   18.884  143.387   36.950 96.39966 41.49632 
1 1 1   14   22   53 o  119.751   27.961   13.264   5.0320   10.777   6.4040   17.277   8.1355  103.837   34.494  127.263   38.489 -23.42582 51.68351 
1 1 1   14   23    0 f  897.158   14.812  617.400   20.328  617.400   20.328  617.400   20.328  897.158   14.812  897.158   14.812 0.000000 0.000000 
1 1 1   14   23    1 o  554.583   9.3479  235.657   7.9351  239.807   11.300  231.619   11.145  559.121   13.204  549.488   13.251 9.632935 18.70682 
1 1 1   14   23    2 o  587.755   9.3833  264.695   8.4415  271.336   11.861  257.878   12.017  594.756   13.029  579.765   13.542 14.99091 18.79171 
1 1 1   14   23    3 o  312.801   10.754   74.999   5.1489   79.067   7.0814   70.436   7.5000  320.971   14.414  302.398   16.263 18.57242 21.73150 
1 1 1   14   23    4 o  467.645   9.4739  167.575   6.7814  162.068   9.2040  174.114   10.030  459.639   13.082  476.357   13.756 -16.71768 18.98349 
1 1 1   14   23    5 o  965.191   8.9680  713.766   13.249  722.478   16.187  696.081   23.061  970.804   10.893  952.025   15.826 18.77814 19.21243 
1 1 1   14   23    6 o   99.563   24.638   7.9535   3.7342   7.9535   3.7342   0.0000   0.0000   99.563   24.638  ?   ?  0.000000 24.63767 
1 1 1   14   23    7 o  489.999   8.1050  183.929   6.0788  183.929   6.0788   0.0000   0.0000  489.999   8.1050  ?   ?  0.000000 8.105042 
1 1 1   14   23    8 o  305.237   10.359   71.420   4.8399   69.706   5.7334   75.669   9.0282  301.446   12.426  313.030   18.932 -11.58463 22.64563 
1 1 1   14   23    9 o  831.646   8.9117  529.973   11.344  506.581   13.475  586.907   21.021  812.845   10.830  874.039   15.713 -61.19397 19.08368 
1 1 1   14   23   10 o  627.519   10.145  301.866   9.7442  295.524   13.166  309.547   14.490  620.447   13.864  634.843   14.912 -14.39636 20.36073 
1 1 1   14   23   11 o  478.523   10.510  175.570   7.6981  166.679   10.156  187.573   11.801  465.891   14.242  494.061   15.606 -28.17068 21.12782 
1 1 1   14   23   12 o  443.827   10.921  151.067   7.4190  150.680   10.071  151.527   10.971  442.867   14.857  443.956   16.145 -1.089050 21.94049 
1 1 1   14   23   13 o  833.885   10.841  533.309   13.837  544.555   19.486  521.873   19.651  841.781   15.123  823.959   15.582 17.82251 21.71420 
1 1 1   14   23   14 o  543.571   10.548  226.606   8.7762  213.925   11.615  243.478   13.398  527.664   14.381  562.745   15.554 -35.08063 21.18393 
1 1 1   14   23   15 o  314.286   10.734   75.768   5.1636   74.061   6.1373   79.904   9.5531  310.566   12.911  321.324   19.516 -10.75806 23.40022 
1 1 1   14   23   16 o  293.291   11.470   66.014   5.1492   67.862   6.1630   61.740   9.3707  297.208   13.548  281.792   21.898 15.41583 25.74965 
1 1 1   14   23   17 o  473.358   11.820  172.011   8.5640  182.961   12.295  161.691   11.936  487.486   16.478  458.184   17.019 29.30283 23.68893 
1 1 1   14   23   18 o  592.730   9.0741  269.393   8.2325  264.338   9.7578  281.877   15.335  586.900   10.862  604.961   16.561 -18.06146 19.80535 
1 1 1   14   23   19 o  236.153   14.059   43.037   5.0589   39.743   5.7490   54.343   10.649  226.503   16.700  262.859   26.845 -36.35634 31.61611 
1 1 1   14   23   20 o  484.803   8.3147  180.198   6.1700  187.011   8.5549  172.812   8.9070  493.505   11.325  474.263   12.270 19.24213 16.69785 
1 1 1   14   23   21 o   86.302   26.667   5.8060   3.8785   3.0443   5.1987   9.2725   5.8244   77.897   30.318  107.935   32.549 -30.03767 44.48167 
1 1 1   14   23   22 o  116.088   23.483   10.841   4.0293   14.321   5.5339   6.9150   5.8784  132.902   28.083   96.955   33.051 35.94642 43.37127 
1 1 1   14   23   23 o  408.780   8.9340  128.196   5.5899  129.213   7.7802  127.110   8.0366  409.938   12.399  406.508   12.916 3.430542 17.90461 
1 1 1   14   23   24 f  277.593   12.053   59.251   5.1212   59.180   6.4736   59.368   8.3721  276.610   15.350  276.059   19.948 0.5513306 25.17041 
1 1 1   14   23   25 o  475.501   8.5914  173.477   6.2529  172.118   8.5569  175.035   9.1598  473.100   11.817  476.947   12.547 -3.846375 17.23553 
1 1 1   14   23   26 o  167.486   17.151   21.918   4.3348   17.542   5.8366   27.300   6.4733  147.337   26.871  185.675   23.290 -38.33742 35.55919 
1 1 1   14   23   27 o  317.662   10.774   77.575   5.2387   80.748   7.3142   74.234   7.5069  323.454   14.773  309.533   15.898 13.92090 21.70285 
1 1 1   14   23   28 o  483.008   10.806  179.409   7.9890  172.427   9.2238  200.373   15.983  473.073   12.738  507.247   20.586 -34.17413 24.20876 
1 1 1   14   23   29 o  159.220   13.568   19.698   3.2751   20.812   3.4039   5.8079   12.024  163.662   13.714  111.473   45.209 52.18855 47.24310 
1 1 1   14   23   30 o  297.881   8.4344   68.137   3.8456   67.852   4.4697   68.950   7.5453  297.078   9.8297  297.771   16.621 -0.6927185 19.31032 
1 1 1   14   23   31 o  220.953   15.050   37.961   5.0594   40.848   7.3251   35.328   6.9964  227.501   21.283  211.227   21.961 16.27455 30.58185 
1 1 1   14   23   32 o  231.856   18.023   42.104   6.3457   39.811   12.170   42.960   7.4367  217.268   37.977  233.257   21.056 -15.98930 43.42384 
1 1 1   14   23   33 f  465.995   7.6719  166.750   5.4721  171.652   6.6281  156.256   9.6976  472.456   9.1656  449.302   14.101 23.15378 16.81825 
1 1 1   14   23   34 o  318.357   8.7768   77.923   4.2768   87.371   5.1270   56.307   7.7549  336.885   9.9428  267.718   19.049 69.16705 21.48773 
1 1 1   14   23   35 f  238.166   8.8026   43.623   3.2089   44.410   4.4397   42.762   4.6433  239.479   12.152  234.792   12.971 4.686432 17.77377 
1 1 1   14   23   36 o  302.484   7.9808   70.320   3.6950   66.992   5.1661   73.806   5.2871  294.582   11.457  309.266   11.169 -14.68362 16.00065 
1 1 1   14   23   37 o  315.065   8.2610   76.331   3.9838   75.447   5.8580   77.092   5.4339  312.347   12.253  315.995   11.235 -3.648651 16.62386 
1 1 1   14   23   38 o  190.238   11.390   28.059   3.3014   27.699   4.4911   28.482   4.8696  187.907   15.761  190.222   16.901 -2.314499 23.10933 
1 1 1   14   23   39 o  408.637   8.8112  128.568   5.5112  130.771   6.6386  123.681   9.8854  411.593   10.538  397.947   16.229 13.64539 19.35017 
1 1 1   14   23   40 o   76.235   23.034   4.6997   2.9148   7.1331   4.1472   2.3242   4.0976   92.709   27.352   67.665   26.742 25.04380 38.25231 
1 1 1   14   23   41 o  349.271   10.435   94.242   5.5784   90.737   11.211   95.396   6.4310  336.795   21.867  350.882   11.974 -14.08725 24.93045 
1 1 1   14   23   42 o  171.613   17.045   23.345   4.4182   15.474   9.8182   25.344   4.9474  130.891   42.673  178.387   18.383 -47.49530 46.46429 
1 1 1   14   23   43 f  315.478   9.3778   76.828   4.5284   76.820   6.5749   76.835   6.2460  313.945   13.682  314.259   12.985 -0.3138123 18.86313 
1 1 1   14   23   44 o  118.511   19.950   11.466   3.4903   12.512   5.1516   10.579   4.7455  120.663   28.370  111.003   27.948 9.660362 39.82436 
1 1 1   14   23   45 o  171.186   16.464   23.319   4.2608   17.611   6.3335   28.038   5.7588  142.357   30.012  185.955   20.578 -43.59799 36.38914 
1 1 1   14   23   46 f  277.047   14.111   60.363   5.9640   35.432   10.640   71.784   7.2016  197.322   36.577  301.251   15.672 -103.9288 39.79298 
1 1 1   14   23   47 o  221.649   15.222   38.947   5.1329   43.191   6.3574   30.999   8.6996  231.868   18.055  187.489   31.427 44.37926 36.24436 
1 1 1   14   23   48 o  293.128   10.723   66.869   4.8113   66.539   7.1610   67.141   6.4959  288.900   16.260  291.694   14.549 -2.794403 21.81922 
1 1 1   14   23   49 o  147.362   18.494   17.773   4.0796   19.382   5.7598   16.154   5.7791  149.488   26.124  134.420   28.944 15.06793 38.99018 
1 1 1   14   23   50 o   62.914   26.292   1.5591   4.2307  -0.3804   5.6309   4.0733   6.4110   64.008   28.497   80.190   32.824 -16.18182 43.46809 
1 1 1   14   23   51 o  190.716   15.282   29.306   4.4237   30.215   6.6005   28.564   5.9605  187.550   23.509  183.841   21.593 3.708221 31.92119 
1 1 1   14   23   52 o  200.108   17.417   32.864   5.2814   39.612   6.8820   23.198   8.2374  216.585   21.024  151.870   35.988 64.71542 41.67894 
1 1 1   14   24    0 o  750.836   13.966  432.557   16.038  432.557   16.038  432.557   16.038  750.836   13.966  750.836   13.966 0.000000 0.000000 
1 1 1   14   24    1 o  236.934   12.733   43.196   4.6009   39.312   6.3297   47.547   6.6994  225.288   18.520  248.013   17.766 -22.72461 25.66326 
1 1 1   14   24    2 o  735.101   13.617  414.769   15.321  414.769   15.321   0.0000   0.0000  735.101   13.617  ?   ?  0.000000 13.61683 
1 1 1   14   24    3 o  191.245   21.129   28.527   6.0816   28.527   6.0816   0.0000   0.0000  191.245   21.129  ?   ?  0.000000 21.12868 
1 1 1   14   24    4 o  125.988   27.809   12.772   5.2191   12.772   5.2191   0.0000   0.0000  125.988   27.809  ?   ?  0.000000 27.80899 
1 1 1   14   24    5 o  148.140   16.199   17.066   3.6133   22.763   4.3456   4.3058   6.5036  171.257   16.794   89.201   34.124 82.05638 38.03245 
1 1 1   14   24    6 o  625.522   7.9028  299.764   7.5665  289.551   8.9266  325.829   14.261  614.632   9.4886  651.376   14.304 -36.74390 17.16463 
1 1 1   14   24    7 o  569.080   7.0322  248.059   6.1254  237.798   6.9020  286.112   13.292  557.110   8.0940  610.374   14.227 -53.26434 16.36866 
1 1 1   14   24    8 o  342.348   8.1187   89.801   4.2543   89.638   4.7994   90.398   9.1902  341.983   9.1689  342.309   17.600 -0.3257141 19.84501 
1 1 1   14   24    9 o  208.895   13.470   33.644   4.2840   29.368   5.0610   44.451   8.0460  194.630   17.164  238.926   22.257 -44.29617 28.10701 
1 1 1   14   24   10 o  180.902   15.300   25.332   4.1967   25.253   5.0679   25.505   7.4865  180.120   18.653  179.148   28.237 0.9715271 33.84142 
1 1 1   14   24   11 o  491.519   8.8039  185.170   6.6234  194.690   8.1449  166.585   11.381  503.829   10.562  465.402   15.976 38.42719 19.15171 
1 1 1   14   24   12 o  565.873   8.6804  245.434   7.5184  244.689   9.0838  247.054   13.397  564.816   10.507  566.813   15.442 -1.997620 18.67754 
1 1 1   14   24   13 o  300.197   10.663   69.132   4.8995   71.560   5.9307   63.914   8.6949  305.271   12.692  287.130   19.907 18.14124 23.60915 
1 1 1   14   24   14 o  484.231   9.0194  179.769   6.6850  181.319   8.0683  176.373   11.939  486.124   10.843  478.679   16.295 7.444733 19.57327 
1 1 1   14   24   15 o  468.416   11.469  168.423   8.2231  157.173   11.206  181.549   12.105  451.832   16.203  485.592   16.286 -33.76001 22.97321 
1 1 1   14   24   16 o  441.316   12.339  149.594   8.3352  146.256   11.413  153.409   12.202  435.638   17.116  446.024   17.874 -10.38565 24.74695 
1 1 1   14   24   17 o  331.044   11.062   84.127   5.6051   84.180   6.5948   83.989   10.637  330.955   13.019  328.766   21.253 2.188995 24.92309 
1 1 1   14   24   18 o  256.259   13.101   50.613   5.1216   53.189   6.0396   44.018   9.6635  262.419   15.100  236.070   27.244 26.34888 31.14865 
1 1 1   14   24   19 o  270.004   12.751   56.042   5.2698   50.584   6.0773   72.582   10.580  255.773   15.598  304.973   22.831 -49.19957 27.65047 
1 1 1   14   24   20 o  425.921   10.109  139.243   6.5903  138.981   7.7131  139.950   12.684  425.288   11.849  425.315   19.484 -0.2642822E-01 22.80379 
1 1 1   14   24   21 o  403.413   8.9855  124.853   5.5483  123.831   7.5785  126.034   8.1451  401.325   12.337  404.754   13.147 -3.428589 18.02939 
1 1 1   14   24   22 o  173.304   16.235   23.377   4.2563   25.727   5.6850   20.380   6.4204  180.935   20.913  159.207   27.331 21.72816 34.41436 
1 1 1   14   24   23 o  512.468   9.4667  201.598   7.4256  199.481   8.9697  206.208   13.238  509.404   11.504  516.637   16.740 -7.233704 20.31194 
1 1 1   14   24   24 o  178.001   15.850   24.654   4.2732   30.986   5.8937   17.636   6.2047  198.930   19.611  147.350   28.542 51.58023 34.62970 
1 1 1   14   24   25 o  139.043   24.314   15.538   4.9862   14.586   5.5878   19.256   11.047  133.698   28.193  151.238   44.647 -17.53996 52.80346 
1 1 1   14   24   26 o  483.858   10.461  179.962   7.7472  179.207   8.9545  182.208   15.449  482.479   12.125  483.726   20.865 -1.246582 24.13251 
1 1 1   14   24   27 o  106.817   26.921   9.3444   4.4000   1.0215   5.8800   19.935   6.6328   73.737   30.918  156.414   28.764 -82.67737 42.22955 
1 1 1   14   24   28 o  126.316   24.463   12.940   4.5589   10.781   6.2647   15.369   6.6467  114.514   33.569  135.929   32.404 -21.41443 46.65757 
1 1 1   14   24   29 o  188.740   17.097   27.865   4.8855   23.226   6.8250   32.741   6.9966  169.275   27.268  203.078   22.909 -33.80304 35.61396 
1 1 1   14   24   30 o   96.502   29.318   7.5251   4.7126   11.486   6.7701   3.8020   6.5640  117.637   35.006   85.887   33.877 31.74924 48.71432 
1 1 1   14   24   31 o  111.275   18.222   9.8862   2.9961   9.6702   3.3139   10.853   7.0108  109.472   20.532  114.794   35.916 -5.322044 41.37041 
1 1 1   14   24   32 o  248.815   9.7282   47.638   3.7049   50.192   4.2499   39.554   7.5621  255.223   10.879  223.096   22.450 32.12700 24.94727 
1 1 1   14   24   33 o  152.606   13.652   18.161   3.1551   17.886   3.4958   19.370   7.3279  151.070   15.330  151.801   32.517 -0.7312927 35.94994 
1 1 1   14   24   34 o  103.032   20.216   8.6038   3.0743   10.337   3.4017   0.8818   7.1811  113.131   20.395   79.143   33.720 33.98804 39.40805 
1 1 1   14   24   35 o  155.170   14.878   18.861   3.4902   19.853   3.9205   15.071   7.6630  158.862   16.357  132.311   36.603 26.55103 40.09190 
1 1 1   14   24   36 o  258.233   8.7042   51.305   3.4404   51.945   4.6759   50.549   5.0802  259.272   11.782  255.163   13.051 4.108826 17.58285 
1 1 1   14   24   37 o  426.637   7.4540  139.871   4.8676  136.665   6.5228  143.900   7.3124  420.997   10.122  431.683   11.067 -10.68552 14.99797 
1 1 1   14   24   38 o   86.582   24.479   6.1746   3.3886   6.9473   3.7756   2.9736   7.6841   91.579   25.821   86.474   35.725 5.105164 44.07950 
1 1 1   14   24   39 f  201.609   10.877   31.497   3.3441   29.538   4.8129   33.326   4.6500  193.695   16.387  206.323   14.823 -12.62888 22.09686 
1 1 1   14   24   40 o  444.001   9.2390  151.982   6.2789  137.087   11.838  157.814   7.4066  417.095   18.542  451.873   10.709 -34.77750 21.41220 
1 1 1   14   24   41 o   98.660   21.176   8.0231   3.1022   7.1350   4.3439   8.9473   4.4317   92.567   28.153  102.804   27.588 -10.23705 39.41710 
1 1 1   14   24   42 o  283.427   9.4056   62.010   4.0803   57.660   5.7089   66.553   5.8340  271.647   13.775  292.476   13.032 -20.82898 18.96298 
1 1 1   14   24   43 o  246.704   10.925   47.164   4.1255   51.232   5.7733   42.919   5.8974  255.395   14.833  232.898   16.653 22.49683 22.30109 
1 1 1   14   24   44 f  111.234   24.196   10.437   4.0024   9.0202   5.8216   11.707   5.5116  102.142   32.822  115.522   30.661 -13.38030 44.91521 
1 1 1   14   24   45 o  110.450   27.211   10.561   4.5703  -5.1947   10.114   14.604   5.1232   76.611   35.632  130.614   26.531 -54.00253 44.42452 
1 1 1   14   24   46 o  224.709   13.520   39.723   4.6286   34.993   6.4416   44.772   6.6552  207.178   20.586  235.837   18.587 -28.65900 27.73570 
1 1 1   14   24   47 o  250.195   14.149   49.436   5.3962   28.777   11.191   55.694   6.1596  169.581   43.042  264.949   15.253 -95.36732 45.66457 
1 1 1   14   24   48 o  216.935   13.873   37.268   4.5825   29.621   6.1178   47.042   6.9166  188.860   21.549  240.460   18.946 -51.60008 28.69349 
1 1 1   14   24   49 o  111.829   25.368   11.014   4.2424   7.3642   5.5424   16.177   6.5927   91.160   32.044  130.868   32.937 -39.70840 45.95288 
1 1 1   14   24   50 o  230.146   14.902   42.466   5.2213   55.107   6.7511   23.650   8.2367  260.520   17.024  155.589   35.385 104.9307 39.26749 
1 1 1   14   24   51 o   79.315   28.971   5.3166   4.5793   6.5375   5.8244   3.3400   7.4108   86.456   32.471   79.598   34.093 6.857681 47.08197 
1 1 1   14   25    2 o  612.359   13.840  287.995   12.972   0.0000   0.0000  287.995   12.972  ?   ?   612.359   13.840 0.000000 13.83967 
1 1 1   14   25    3 o  578.689   13.960  257.219   12.365   0.0000   0.0000  257.219   12.365  ?   ?   578.689   13.960 0.000000 13.96022 
1 1 1   14   25    4 o  359.270   10.514   98.988   5.7819   97.975   7.7880  100.233   8.6303  357.115   14.248  361.069   15.616 -3.954681 21.13896 
1 1 1   14   25    5 o  635.690   9.6260  309.812   9.3662  302.771   12.669  318.300   13.909  627.939   13.181  643.684   14.118 -15.74548 19.31454 
1 1 1   14   25    6 o  170.598   13.712   22.498   3.5503   26.429   4.2264   13.073   6.5439  184.818   15.072  127.028   33.263 57.79066 36.51862 
1 1 1   14   25    7 o  111.633   18.670   9.8580   3.0774   11.837   3.4456   2.0545   6.8422  122.518   18.988   82.958   33.928 39.56017 38.88001 
1 1 1   14   25    8 o  307.206   8.4638   72.332   3.9798   74.090   4.5025   66.051   8.5104  310.861   9.4627  292.080   19.142 18.78168 21.35318 
1 1 1   14   25    9 o   70.505   26.201   2.9817   3.7724   8.2179   4.4983  -9.4304   6.9256  101.269   28.055   57.734   27.626 43.53494 39.37334 
1 1 1   14   25   10 f  562.899   8.6476  242.883   7.4507  245.524   9.1099  237.548   12.948  565.732   10.520  555.747   15.222 9.985229 18.50372 
1 1 1   14   25   11 o  270.401   11.391   56.119   4.7145   56.999   5.7555   54.324   8.2187  271.976   13.872  264.428   20.465 7.548126 24.72363 
1 1 1   14   25   12 o  385.959   9.6783  114.250   5.7175  107.704   6.8289  129.598   10.456  374.531   11.912  410.203   16.654 -35.67136 20.47537 
1 1 1   14   25   13 o  517.201   16.327  206.020   12.925   0.0000   0.0000  206.020   12.925  ?   ?   517.201   16.327 0.000000 16.32745 
1 1 1   14   25   14 o  302.259   14.200   70.269   6.5696   67.848   9.3218   72.657   9.2601  295.475   20.743  306.000   19.879 -10.52527 28.73019 
1 1 1   14   25   15 o  200.325   15.139   31.066   4.6076   27.024   5.4338   41.411   8.6927  186.039   19.366  229.446   25.165 -43.40752 31.75372 
1 1 1   14   25   16 o  280.380   12.023   60.396   5.1597   65.684   6.1250   47.472   9.5755  292.230   13.693  245.588   25.862 46.64183 29.26344 
1 1 1   14   25   17 o  377.680   10.426  109.496   6.0271  109.332   7.0796  109.927   11.488  377.179   12.263  376.386   20.013 0.7926025 23.47114 
1 1 1   14   25   18 o  570.260   9.2095  249.491   8.0385  246.325   9.5614  257.125   14.846  566.327   11.030  577.266   16.802 -10.93927 20.09932 
1 1 1   14   25   19 o  530.729   9.3992  216.150   7.6354  220.664   9.1673  205.926   13.797  535.944   11.175  516.327   17.457 19.61761 20.72787 
1 1 1   14   25   20 o  597.680   9.3459  274.151   8.5499  277.425   10.283  266.819   15.388  600.878   11.181  587.713   17.106 13.16522 20.43555 
1 1 1   14   25   21 o  374.034   12.590  107.640   7.2079  107.640   7.2079   0.0000   0.0000  374.034   12.590  ?   ?  0.000000 12.58997 
1 1 1   14   25   22 o  550.165   11.304  232.695   9.5193  232.695   9.5193   0.0000   0.0000  550.165   11.304  ?   ?  0.000000 11.30421 
1 1 1   14   25   23 o   93.037   29.607   6.7537   4.7456   7.4714   5.4005   4.3209   9.9430   97.990   31.626  101.496   41.129 -3.506012 51.88224 
1 1 1   14   25   24 o  122.494   27.783   12.278   5.0893   15.776   5.7969   0.5175   10.630  139.076   28.197   94.817   40.727 44.25936 49.53535 
1 1 1   14   25   25 o  369.591   10.146  104.991   5.7397  105.369   7.8906  104.565   8.3645  369.551   13.950  367.941   14.852 1.610291 20.37614 
1 1 1   14   25   26 o  208.316   14.719   33.692   4.6629   37.242   6.4924   29.911   6.7012  217.889   19.679  194.176   22.994 23.71324 30.26520 
1 1 1   14   25   27 o  166.152   18.905   21.744   4.7222   24.500   6.5304   18.725   6.8364  174.721   25.143  150.655   30.689 24.06532 39.67322 
1 1 1   14   25   28 o  172.265   18.339   23.340   4.7612   20.269   6.5932   26.686   6.8827  157.444   28.404  182.248   25.361 -24.80399 38.07832 
1 1 1   14   25   29 o  155.998   20.535   19.344   4.7840   18.441   6.6827   20.293   6.8517  149.235   30.290  156.963   29.604 -7.727417 42.35485 
1 1 1   14   25   30 o  345.319   13.681   92.212   7.2310  106.916   13.612   86.432   8.5347  367.010   24.371  333.048   16.796 33.96274 29.59800 
1 1 1   14   25   31 f   75.205   22.488   4.5163   2.7888   4.2841   3.0653   5.6322   6.7197   74.260   23.812   92.732   34.868 -18.47170 42.22340 
1 1 1   14   25   32 o  100.527   19.410   8.1626   2.8785   8.5180   3.1824   6.5634   6.7501  102.376   21.013   96.222   35.170 6.153717 40.96931 
1 1 1   14   25   33 o  358.744   8.9689   99.000   4.9249   99.897   5.8381   96.788   9.1711  360.001   10.595  352.383   17.003 7.617554 20.03413 
1 1 1   14   25   34 o  332.322   8.9428   84.971   4.5488   83.475   5.2553   89.439   9.0832  329.069   10.434  337.942   17.621 -8.872467 20.47853 
1 1 1   14   25   35 o  309.620   9.5067   73.832   4.5054   77.079   5.2592   64.879   8.7333  316.047   10.872  286.506   20.041 29.54102 22.79982 
1 1 1   14   25   36 o  321.821   9.8597   79.830   4.8568   84.746   5.4480   60.799   10.720  331.361   10.742  274.156   25.851 57.20468 27.99386 
1 1 1   14   25   37 o  184.850   13.459   26.653   3.7819   24.590   4.2020   35.450   8.6769  176.911   15.680  207.448   28.045 -30.53690 32.13133 
1 1 1   14   25   38 o  380.091   12.646  112.009   7.3572  118.398   10.751  106.382   10.089  388.170   18.096  368.042   17.910 20.12741 25.46025 
1 1 1   14   25   39 o  223.054   13.098   38.765   4.4523   33.535   9.6678   40.173   5.0158  198.313   33.010  226.620   14.537 -28.30737 36.06915 
1 1 1   14   25   40 o  397.167   8.0228  121.428   4.8772  130.651   7.0026  112.740   6.7967  410.868   11.135  381.469   11.640 29.39941 16.10855 
1 1 1   14   25   41 o  213.369   11.484   35.387   3.7367   34.991   5.2920   35.782   5.2771  210.431   16.564  212.908   16.317 -2.477051 23.25134 
1 1 1   14   25   42 o   40.415   19.154  -3.5457   3.1701  -6.5092   4.2280   0.2597   4.7911   42.963   20.813   63.324   27.273 -20.36149 34.30771 
1 1 1   14   25   43 o  251.516   16.008   50.005   6.1305   50.005   6.1305   0.0000   0.0000  251.516   16.008  ?   ?  0.000000 16.00755 
1 1 1   14   25   44 o  197.163   15.658   30.829   4.6865   25.107   10.246   32.343   5.2702  161.952   41.226  201.221   17.279 -39.26947 44.70033 
1 1 1   14   25   45 o  197.879   22.155   32.230   6.5951   37.135   11.158   29.597   8.1761  200.335   37.774  184.393   30.000 15.94215 48.23806 
1 1 1   14   25   46 o  236.322   19.387   45.288   6.9511   39.518   10.784   49.389   9.0917  208.175   35.093  242.629   24.831 -34.45380 42.98937 
1 1 1   14   25   47 o  155.133   17.107   19.472   3.9945   13.129   5.7599   25.349   5.5444  119.861   31.121  174.893   21.141 -55.03142 37.62212 
1 1 1   14   25   48 o  233.113   13.186   42.995   4.6855   37.283   6.1356   50.986   7.2575  213.313   18.991  249.525   19.148 -36.21187 26.96840 
1 1 1   14   25   49 o  133.969   20.234   15.072   4.0198   18.114   6.1264   12.772   5.3269  140.740   29.388  117.451   29.633 23.28931 41.73411 
1 1 1   14   25   50 o   78.956   27.952   5.3358   4.2241   3.7878   5.1983   8.3452   7.2478   74.523   29.899   94.852   36.085 -20.32912 46.86268 
1 1 1   14   26    0 o  772.090   14.335  457.685   16.928  457.685   16.928  457.685   16.928  772.090   14.335  772.090   14.335 0.000000 0.000000 
1 1 1   14   26    1 o  520.558   9.7554  207.804   7.7729  199.714   10.727  216.749   11.279  509.817   13.747  531.095   13.875 -21.27817 19.53147 
1 1 1   14   26    2 o  916.259   10.864  644.123   15.236  639.612   21.317  648.835   21.784  911.927   15.272  918.411   15.497 -6.484253 21.75717 
1 1 1   14   26    3 o  510.513   9.8161  199.872   7.6703  194.632   10.555  205.737   11.166  503.283   13.701  517.381   14.100 -14.09805 19.66060 
1 1 1   14   26    4 o  452.571   9.8888  157.085   6.8501  150.680   9.3755  164.420   10.033  442.799   13.833  462.501   14.172 -19.70212 19.80437 
1 1 1   14   26    5 o  332.106   11.170   84.642   5.6779   79.048   7.6393   91.547   8.4872  320.530   15.571  344.880   16.078 -24.35004 22.38183 
1 1 1   14   26    6 o  629.981   8.5486  304.232   8.2431  313.216   10.409  289.124   13.499  638.927   10.644  613.222   14.382 25.70477 17.89203 
1 1 1   14   26    7 o  567.628   8.5979  247.002   7.4701  244.447   9.1990  251.948   12.801  564.431   10.648  572.373   14.611 -7.941650 18.07925 
1 1 1   14   26    8 f  589.371   8.6320  266.300   7.7870  272.219   9.7870  256.089   12.855  595.602   10.736  577.039   14.554 18.56342 18.08536 
1 1 1   14   26    9 o  473.253   8.9357  171.734   6.4728  170.765   8.0143  173.550   10.977  471.673   11.101  474.910   15.101 -3.236847 18.74232 
1 1 1   14   26   10 f  122.298   22.696   11.950   4.0920   10.015   4.9105   16.348   7.4025  111.202   28.667  141.365   34.512 -30.16355 44.86535 
1 1 1   14   26   11 o  188.233   19.927   27.685   5.6539   32.752   8.1247   22.927   7.8728  203.392   26.746  168.382   31.710 35.01001 41.48373 
1 1 1   14   26   12 o  325.427   13.348   81.424   6.6485   75.810   9.5919   86.615   9.2237  312.459   20.163  334.522   18.081 -22.06277 27.08311 
1 1 1   14   26   13 o  345.848   10.751   91.823   5.6910   92.786   6.8117   89.598   10.356  347.431   12.809  339.773   20.001 7.658020 23.75099 
1 1 1   14   26   14 o  162.158   18.534   20.572   4.5175   16.059   5.3508   31.774   8.4296  141.495   25.651  199.688   28.378 -58.19354 38.25271 
1 1 1   14   26   15 o  130.314   22.228   13.534   4.2745   12.676   5.0177   15.802   8.1617  125.087   26.999  138.566   37.547 -13.47904 46.24621 
1 1 1   14   26   16 o   76.648   27.908   3.8060   4.2446   6.7955   4.8599  -5.8098   8.7160   93.788   29.973   73.765   33.867 20.02248 45.22573 
1 1 1   14   26   17 o  270.624   12.426   56.319   5.1472   50.391   5.9939   72.968   10.045  255.202   15.417  305.836   21.598 -50.63391 26.53587 
1 1 1   14   26   18 o  380.263   10.572  111.067   6.1531  105.665   7.1170  127.056   12.245  370.627   12.545  404.892   19.758 -34.26428 23.40438 
1 1 1   14   26   19 o  223.782   14.823   38.777   5.0484   40.328   5.9257   34.672   9.6411  227.797   17.120  207.323   31.361 20.47354 35.73011 
1 1 1   14   26   20 o  392.090   12.046  118.263   7.2294  118.263   7.2294   0.0000   0.0000  392.090   12.046  ?   ?  0.000000 12.04605 
1 1 1   14   26   21 o  474.145   10.005  172.696   7.2613  173.235   8.5423  171.291   13.786  474.548   11.761  469.883   19.168 4.664673 22.48845 
1 1 1   14   26   22 o  378.079   9.5747  109.791   5.5409  110.715   7.5977  108.742   8.0981  379.074   13.095  375.484   14.090 3.590363 19.23552 
1 1 1   14   26   23 o   77.680   27.826   4.1212   4.1979   9.9889   5.7016  -2.8252   6.2036  110.568   31.914   65.182   29.392 45.38676 43.38708 
1 1 1   14   26   24 o  471.906   9.1794  171.060   6.6304  164.677   8.9379  178.871   9.8875  462.260   12.632  481.557   13.414 -19.29660 18.42600 
1 1 1   14   26   25 o  301.557   11.404   70.013   5.2640   67.726   7.2000   72.639   7.7154  295.325   15.988  305.722   16.549 -10.39700 23.01066 
1 1 1   14   26   26 o   88.051   28.862   5.9941   4.4890   5.7754   6.2847   6.2218   6.4140   92.334   33.908   94.532   34.324 -2.197533 48.24814 
1 1 1   14   26   27 o  298.364   11.860   68.625   5.4164   71.433   7.4142   65.410   7.9320  303.095   16.038  289.405   17.995 13.69080 24.10533 
1 1 1   14   26   28 o  119.306   26.228   11.708   4.6591   8.6789   6.5480   14.814   6.6309  104.797   34.882  132.796   32.813 -27.99925 47.89004 
1 1 1   14   26   29 o  270.453   15.924   56.969   6.5629   62.804   12.011   54.485   7.8361  278.867   28.541  263.302   19.584 15.56531 34.61348 
1 1 1   14   26   30 o  226.018   15.799   39.852   5.4314   42.538   7.7467   37.256   7.6172  231.491   22.133  216.048   23.409 15.44258 32.21530 
1 1 1   14   26   31 o  343.728   13.405   91.423   7.0526   77.288   11.159  100.825   9.1007  311.698   23.563  359.949   16.518 -48.25159 28.77635 
1 1 1   14   26   32 f  102.638   19.672   8.5214   2.9779   6.9319   3.2322   17.446   7.6592   91.861   23.031  142.728   35.264 -50.86672 42.11900 
1 1 1   14   26   33 o  314.958   9.1864   76.350   4.4286   74.466   5.0975   82.149   8.9429  310.730   10.718  323.587   18.129 -12.85699 21.06006 
1 1 1   14   26   34 o  228.184   10.844   40.180   3.7874   39.287   4.2472   43.647   8.3687  225.024   12.379  233.134   23.785 -8.110382 26.81374 
1 1 1   14   26   35 o  134.419   16.666   14.314   3.3554   12.564   3.6083   25.496   9.1220  125.020   19.492  171.949   35.822 -46.92944 40.78166 
1 1 1   14   26   36 o  373.028   9.1958  107.197   5.2505  101.370   6.0473  125.040   10.582  362.265   10.906  399.561   17.303 -37.29666 20.45342 
1 1 1   14   26   37 o  355.921   12.797   98.250   6.9714   96.153   9.9894  100.241   9.7337  348.995   18.769  357.306   17.798 -8.311340 25.86604 
1 1 1   14   26   38 o  143.988   14.136   16.286   3.0754   14.295   4.2237   18.533   4.4866  132.542   21.561  151.942   19.759 -19.40033 29.24540 
1 1 1   14   26   39 o  241.200   10.159   44.944   3.7508   39.100   5.1117   51.760   5.5206  223.261   15.046  257.384   14.066 -34.12331 20.59731 
1 1 1   14   26   40 o  227.294   10.698   39.980   3.7219   42.599   5.3566   37.534   5.1753  232.893   15.108  218.372   15.586 14.52069 21.70662 
1 1 1   14   26   41 o  169.619   14.251   22.636   3.6656   22.894   4.9750   22.329   5.4214  168.574   19.650  165.458   21.949 3.115372 29.45965 
1 1 1   14   26   42 o  151.853   16.199   18.359   3.7070   20.612   5.6668   16.673   4.9011  157.455   24.295  141.729   23.410 15.72594 33.73810 
1 1 1   14   26   43 f  196.766   16.007   30.751   4.7791   10.215   10.029   36.784   5.4360  110.349   42.336  214.999   16.648 -104.6504 45.49221 
1 1 1   14   26   44 o  152.327   20.677   19.036   4.6963   21.338   10.545   18.467   5.2452  146.314   43.722  148.388   23.906 -2.073685 49.83075 
1 1 1   14   26   45 o  189.867   13.650   28.454   3.9405   31.449   5.7325   25.772   5.4255  196.782   19.280  177.402   20.349 19.38008 28.03205 
1 1 1   14   26   46 f   63.243   25.153   2.2267   3.6465   1.3456   5.2546   3.0452   5.0645   67.868   28.878   72.935   29.424 -5.067108 41.22766 
1 1 1   14   26   47 o   65.196   26.043   2.4486   3.9249   3.7428   5.3098   0.8896   5.8276   75.859   30.295   68.624   29.816 7.234634 42.50581 
1 1 1   14   26   48 o   85.119   27.076   6.4142   3.9695   17.588   6.4727  -0.3213   5.0254  137.065   31.512   60.835   27.011 76.22923 41.50410 
1 1 1   14   26   49 o  120.811   24.530   12.877   4.3812   11.769   5.5189   14.764   7.2045  111.131   31.177  120.723   36.154 -9.591232 47.74048 
1 1 1   14   27    0 o  416.840   14.803  133.833   9.4175  133.833   9.4175  133.833   9.4175  416.840   14.803  416.840   14.803 0.000000 0.000000 
1 1 1   14   27    1 o  335.397   11.401   86.364   5.8532   91.735   8.2357   80.883   8.3202  345.194   15.587  323.544   16.859 21.65091 22.96065 
1 1 1   14   27    2 o  291.635   12.134   65.326   5.4164   65.938   7.6603   64.714   7.6595  291.970   17.217  289.211   17.383 2.759308 24.46675 
1 1 1   14   27    3 o  274.810   12.632   58.024   5.3136   61.721   7.3740   54.032   7.6634  282.457   17.137  263.852   19.105 18.60526 25.66463 
1 1 1   14   27    4 o  299.039   12.389   68.699   5.6709   69.250   7.8961   68.112   8.1496  299.206   17.315  296.593   18.037 2.612793 25.00341 
1 1 1   14   27    5 o  267.279   13.062   54.907   5.3437   58.597   7.3682   50.813   7.7615  275.087   17.591  255.633   19.996 19.45459 26.63235 
1 1 1   14   27    6 o  386.579   9.3438  114.626   5.5288  116.042   6.8586  111.998   9.3429  388.734   11.527  381.304   16.008 7.430115 19.72641 
1 1 1   14   27    7 o  441.204   7.7386  149.208   5.2260  151.464   6.0737  142.774   10.256  444.413   8.9289  430.573   15.562 13.84003 17.94139 
1 1 1   14   27    8 f  608.956   7.4135  284.211   6.9100  290.856   8.1056  266.536   13.219  615.880   8.5984  588.475   14.676 27.40515 17.00930 
1 1 1   14   27    9 o  361.476   12.816  100.442   7.0908   95.810   10.606  104.186   9.5353  351.431   19.797  367.546   16.949 -16.11447 26.06147 
1 1 1   14   27   10 o  725.592   11.143  404.306   12.376  417.404   18.406  393.499   16.719  735.808   16.343  714.755   15.282 21.05267 22.37470 
1 1 1   14   27   11 o  226.754   13.716   39.703   4.7380   38.578   5.7966   41.966   8.2244  222.954   17.117  231.216   23.568 -8.261887 29.12815 
1 1 1   14   27   12 o  203.670   14.736   32.111   4.5629   33.891   5.5400   28.357   8.0458  208.792   17.496  188.213   28.849 20.57942 33.73969 
1 1 1   14   27   13 o  549.194   9.0055  231.393   7.5701  229.581   9.1631  235.290   13.436  546.721   10.950  552.379   15.891 -5.657898 19.29823 
1 1 1   14   27   14 o  194.835   15.659   29.458   4.6304   29.622   5.4719   29.044   8.6899  194.838   18.573  189.759   30.989 5.079239 36.12839 
1 1 1   14   27   15 o  212.339   14.610   34.905   4.7196   33.288   5.5458   39.152   8.9872  206.780   17.692  222.072   26.995 -15.29202 32.27643 
1 1 1   14   27   16 o  160.125   18.445   20.099   4.4382   18.070   5.1914   25.609   8.5551  150.637   23.265  177.231   32.743 -26.59346 40.16664 
1 1 1   14   27   17 o  399.451   10.155  122.553   6.2087  125.303   7.3449  115.668   11.621  403.640   11.888  385.668   19.753 17.97247 23.05430 
1 1 1   14   27   18 o  262.424   15.187   53.318   6.0740   53.318   6.0740   0.0000   0.0000  262.424   15.187  ?   ?  0.000000 15.18666 
1 1 1   14   27   19 o  304.171   14.048   71.336   6.5405   71.336   6.5405   0.0000   0.0000  304.171   14.048  ?   ?  0.000000 14.04834 
1 1 1   14   27   20 o  376.754   11.001  109.153   6.3439  103.171   7.3891  125.927   12.373  365.901   13.193  402.431   20.087 -36.53030 24.03201 
1 1 1   14   27   21 o  171.990   19.928   23.304   5.1490   32.127   5.9713  -2.2785   10.168  202.394   19.517   86.877   38.505 115.5165 43.16901 
1 1 1   14   27   22 o  585.825   10.009  263.798   8.9748  271.116   10.877  248.184   15.887  593.337   11.976  565.317   18.360 28.01996 21.92093 
1 1 1   14   27   23 o  161.117   18.833   20.450   4.5568   19.288   6.2345   21.782   6.6769  154.026   27.451  163.852   27.604 -9.826324 38.92994 
1 1 1   14   27   24 o   85.685   29.073   5.5050   4.5483   5.4212   6.0222   5.6163   6.9394   90.048   33.173   93.942   35.412 -3.894028 48.52283 
1 1 1   14   27   25 o  257.850   12.642   51.298   4.9894   50.497   6.7654   52.252   7.3878  254.322   17.486  258.328   18.813 -4.005966 25.68466 
1 1 1   14   27   26 o  264.763   12.869   54.122   5.2153   59.861   7.0999   47.397   7.6861  277.103   16.819  245.270   20.666 31.83255 26.64518 
1 1 1   14   27   27 o  327.459   13.488   82.892   6.7607   84.045   11.797   82.327   8.2499  325.510   23.843  325.094   16.635 0.4167480 29.07235 
1 1 1   14   27   28 o  243.024   20.602   46.605   7.5913   0.0000   0.0000   46.605   7.5913  ?   ?   243.024   20.602 0.000000 20.60188 
1 1 1   14   27   29 o  522.056   11.203  210.151   8.9517  209.973   14.704  210.256   11.284  518.484   18.528  521.029   14.149 -2.544922 23.31248 
1 1 1   14   27   30 o   92.851   30.656   6.7891   5.0610   13.473   7.1750   0.1703   7.1398  125.818   35.637   77.070   33.243 48.74867 48.73512 
1 1 1   14   27   31 o  400.480   11.398  123.785   6.9866  121.115   9.6793  126.689   10.095  394.520   16.029  403.361   16.351 -8.840546 22.89695 
1 1 1   14   27   32 o  284.148   13.801   62.596   6.0024   50.922   8.1086   76.747   8.9276  253.324   21.104  312.418   18.756 -59.09331 28.23457 
1 1 1   14   27   33 o  227.766   10.875   40.037   3.7914   40.972   4.2575   36.459   8.3338  229.860   12.144  211.736   26.280 18.12424 28.95000 
1 1 1   14   27   34 f  188.082   12.936   27.537   3.7014   25.580   4.0088   38.851   9.6375  180.817   14.609  216.561   29.870 -35.74370 33.25099 
1 1 1   14   27   35 o  290.184   15.032   65.755   6.6537   70.816   9.5057   60.893   9.3165  298.432   20.943  275.967   22.245 22.46469 30.55195 
1 1 1   14   27   36 o  124.008   31.611   13.197   6.0181   17.638   8.8675   9.4043   8.1941  140.565   39.550  108.599   38.879 31.96581 55.45959 
1 1 1   14   27   37 o   71.416   26.052   3.5216   3.7012   6.8593   4.2020  -8.0293   7.8170   91.052   27.689   63.216   29.994 27.83640 40.82034 
1 1 1   14   27   38 o   53.369   23.416  -0.5792   3.6714  -1.2136   4.0965   2.0103   8.2762   54.423   24.262   85.372   36.283 -30.94902 43.64730 
1 1 1   14   27   39 f  102.753   21.358   8.7215   3.2495   9.7593   4.3834   7.4553   4.8416  107.210   26.788   94.457   29.888 12.75290 40.13603 
1 1 1   14   27   40 o   94.944   22.360   7.5314   3.1958   8.6434   4.4369   6.3325   4.6070  100.535   27.866   88.046   29.257 12.48877 40.40433 
1 1 1   14   27   41 o  164.301   14.599   21.317   3.6331   18.134   5.4233   23.908   4.8935  147.148   24.972  172.376   18.854 -25.22856 31.29008 
1 1 1   14   27   42 o   59.352   25.334   0.5048   4.0671  -4.3986   10.256   1.4197   4.4303   78.491   36.289   64.826   26.982 13.66510 45.22047 
1 1 1   14   27   43 o  113.767   25.723   11.126   4.3742   6.0188   10.061   12.316   4.8573   98.280   40.764  119.142   27.230 -20.86228 49.02173 
1 1 1   14   27   44 o  142.408   17.118   16.367   3.6565   22.173   5.4390   11.579   4.9392  163.329   22.342  114.558   28.327 48.77004 36.07795 
1 1 1   14   27   45 o  165.887   14.715   21.935   3.6976   18.822   5.1982   25.123   5.2606  149.057   23.568  174.794   20.024 -25.73778 30.92546 
1 1 1   14   27   46 o  169.128   17.679   23.295   4.5090   20.765   6.1928   26.149   6.5778  153.459   27.369  174.034   25.445 -20.57417 37.36963 
1 1 1   14   27   47 o  217.664   14.116   37.777   4.6776   36.261   6.6453   39.265   6.5853  208.164   21.150  217.644   19.991 -9.479965 29.10288 
1 1 1   14   27   48 o  118.263   24.707   12.362   4.3282   16.337   5.3601   4.9130   7.3370  134.847   26.913   84.204   34.858 50.64217 44.03835 
1 1 1   14   28    0 o  249.921   19.418   48.903   7.3248   48.903   7.3248   48.903   7.3248  249.921   19.418  249.921   19.418 0.000000 0.000000 
1 1 1   14   28    1 o  555.575   10.194  236.900   8.6686  226.631   11.933  248.372   12.613  542.639   14.368  568.040   14.507 -25.40051 20.41785 
1 1 1   14   28    2 o  322.229   11.768   79.767   5.8040   69.043   7.9541   91.979   8.4882  298.605   17.479  345.452   16.053 -46.84689 23.73232 
1 1 1   14   28    3 o  195.687   16.573   29.736   4.9174   31.190   6.7795   28.122   7.1433  199.240   22.632  188.402   25.420 10.83781 34.03525 
1 1 1   14   28    4 f  136.700   22.671   14.876   4.5774   16.433   6.2329   13.054   6.7441  142.298   29.582  126.404   34.080 15.89333 45.12835 
1 1 1   14   28    5 o  149.786   20.715   17.696   4.6222   16.357   6.2909   19.266   6.8138  141.877   29.911  154.246   29.940 -12.36934 42.32141 
1 1 1   14   28    6 o  194.377   14.807   29.263   4.3723   31.825   5.4750   24.752   7.2644  202.230   17.872  175.866   27.919 26.36333 33.14958 
1 1 1   14   28    7 o  706.459   8.7491  382.811   9.4606  373.266   11.534  402.440   16.540  697.187   10.808  722.796   14.950 -25.60944 18.44796 
1 1 1   14   28    8 o  452.739   9.0283  157.249   6.2564  157.095   7.6872  157.550   10.767  452.237   11.105  452.095   15.560 0.1417236 19.11643 
1 1 1   14   28    9 o  304.082   11.106   71.030   5.1689   68.085   6.3965   76.573   8.7748  297.377   14.053  314.195   18.325 -16.81827 23.09345 
1 1 1   14   28   10 o  729.461   9.0416  408.270   10.095  408.668   12.497  407.522   17.126  729.324   11.195  727.046   15.389 2.277954 19.03069 
1 1 1   14   28   11 o  305.432   11.379   71.690   5.3195   62.441   6.2469   96.092   10.146  284.338   14.400  351.848   18.909 -67.50974 23.76851 
1 1 1   14   28   12 o  391.032   9.9371  117.401   5.9476  115.339   7.2113  121.786   10.518  387.272   12.165  396.966   17.310 -9.694183 21.15763 
1 1 1   14   28   13 o   69.993   27.361   2.3942   4.2483  -0.2636   5.0077   9.2187   8.0242   64.767   27.889  111.426   38.591 -46.65889 47.61336 
1 1 1   14   28   14 o  431.204   9.9537  142.792   6.5696  140.072   7.9189  148.797   11.766  426.722   12.124  438.595   17.526 -11.87241 21.31125 
1 1 1   14   28   15 o  164.855   18.337   21.301   4.5486   20.833   5.3431   22.531   8.6691  162.155   22.103  165.023   35.383 -2.868118 41.71961 
1 1 1   14   28   16 o  430.309   12.020  142.477   7.9172  142.477   7.9172   0.0000   0.0000  430.309   12.020  ?   ?  0.000000 12.02040 
1 1 1   14   28   17 o  248.085   15.864   47.752   5.9923   47.752   5.9923   0.0000   0.0000  248.085   15.864  ?   ?  0.000000 15.86361 
1 1 1   14   28   18 o  261.286   13.589   52.779   5.4159   53.180   6.3634   51.726   10.316  261.784   15.957  254.993   26.835 6.790955 31.22061 
1 1 1   14   28   19 o  278.441   13.252   59.775   5.6480   63.539   6.6056   49.543   10.891  286.367   15.124  248.476   29.194 37.89102 32.87855 
1 1 1   14   28   20 o  140.919   24.037   15.986   4.9986   17.050   5.8091   12.950   9.8114  144.749   27.218  127.223   42.703 17.52563 50.63976 
1 1 1   14   28   21 o  343.250   12.060   90.778   6.3364   86.534   7.4199  102.210   12.178  334.635   14.486  360.733   22.163 -26.09778 26.47737 
1 1 1   14   28   22 o   68.194   28.667   0.7791   5.0759   2.5235   5.8462  -4.5627   10.230   78.349   31.611   82.428   37.402 -4.078720 48.97126 
1 1 1   14   28   23 o  400.300   11.500  123.458   7.0460  122.163   8.2764  126.868   13.431  397.667   13.597  401.718   21.925 -4.051117 25.79942 
1 1 1   14   28   24 o  318.649   11.282   78.231   5.5024   80.352   7.3900   75.592   8.2430  322.118   14.989  311.346   17.366 10.77197 22.93994 
1 1 1   14   28   25 o  144.576   24.248   16.913   5.1759   14.974   7.7916   18.444   6.9246  132.829   36.967  148.789   31.393 -15.96043 48.49835 
1 1 1   14   28   26 o   92.119   34.602   5.5395   6.6140   0.0000   0.0000   5.5395   6.6140  ?   ?    92.119   34.602 0.000000 34.60185 
1 1 1   14   28   27 o  380.769   12.474  111.975   7.2703  103.716   11.451  117.553   9.4103  363.038   20.693  389.071   15.802 -26.03329 26.03645 
1 1 1   14   28   28 o  499.557   9.6978  192.093   7.4153  190.240   10.156  194.209   10.852  495.857   13.381  500.676   14.161 -4.819458 19.48303 
1 1 1   14   28   29 o  319.632   12.127   78.920   5.9331   76.998   8.0317   81.228   8.8025  313.967   16.774  322.039   17.929 -8.070953 24.55190 
1 1 1   14   28   30 o  331.182   12.431   84.804   6.3017   85.649   8.3951   83.714   9.5377  331.528   16.544  326.238   19.185 5.289734 25.33272 
1 1 1   14   28   31 o   75.973   29.917   3.0309   5.1110   9.2379   7.0362  -3.9023   7.4364  107.017   36.162   68.991   31.529 38.02581 47.97651 
1 1 1   14   28   32 o  314.581   14.197   76.845   6.8359   75.107   8.7701   79.537   10.912  308.876   18.638  315.781   22.728 -6.904114 29.39286 
1 1 1   14   28   33 o  236.428   17.741   44.030   6.3734   44.387   8.2767   43.510   9.9899  235.012   23.317  229.716   29.062 5.296280 37.25944 
1 1 1   14   28   34 o  121.887   29.592   12.602   5.4653   15.544   7.8646   9.8546   7.6004  133.113   37.173  109.597   37.580 23.51601 52.85976 
1 1 1   14   28   35 f  191.539   13.217   28.614   3.8513   33.233   4.4062   13.662   7.9274  206.247   14.041  124.874   38.044 81.37267 40.55227 
1 1 1   14   28   36 o   92.002   23.901   7.0491   3.3962   7.7283   3.7366   3.8219   8.1451   96.109   25.120   90.052   36.945 6.057076 44.67597 
1 1 1   14   28   37 o  245.983   12.899   47.148   4.8397   45.539   5.0184   68.535   18.299  241.487   13.633  272.437   45.487 -30.94987 47.48629 
1 1 1   14   28   38 o   64.173   25.894   1.8273   3.9230   1.7387   4.0608   3.0672   15.190   64.572   26.242  107.945   47.488 -43.37342 54.25621 
1 1 1   14   28   39 o  131.471   20.836   14.130   4.0531   13.611   4.7177   15.592   7.9198  127.268   25.110  130.877   37.567 -3.609093 45.18609 
1 1 1   14   28   40 o  239.120   11.821   44.468   4.3266   46.405   6.0684   42.466   6.1703  241.952   16.484  230.854   17.595 11.09753 24.11031 
1 1 1   14   28   41 o   69.028   27.354   2.6488   4.2982   0.8290   9.7981   3.0825   4.7830   86.279   38.041   72.982   28.876 13.29712 47.75903 
1 1 1   14   28   42 o  128.194   17.724   13.310   3.3847   13.746   4.7995   12.878   4.7739  126.816   25.608  122.337   26.278 4.479073 36.69235 
1 1 1   14   28   43 o   33.407   16.544  -6.9722   3.1622 -10.4396   4.5372  -3.6971   4.4096   39.096   19.439   49.388   23.152 -10.29199 30.23060 
1 1 1   14   28   44 o   51.778   22.695  -0.2752   3.4414   2.9833   5.1935  -2.8259   4.5949   73.165   29.698   52.410   24.251 20.75498 38.34190 
1 1 1   14   28   45 o  290.018   12.699   66.193   5.6370   92.170   7.6092   34.594   8.3922  340.730   14.590  197.777   28.549 142.9537 32.06108 
1 1 1   14   28   46 o   83.975   25.851   6.2082   3.6487   4.5988   4.7482   8.5289   5.7018   77.169   29.243   96.015   32.552 -18.84563 43.75849 
1 1 1   14   28   47 o   99.236   26.969   8.9556   4.2034   14.652   5.2165  -1.5912   7.0978  127.087   27.607   67.360   30.791 59.72704 41.35493 
1 1 1   14   29    0 o  335.535   16.303   87.123   8.3279   87.123   8.3279   87.123   8.3279  335.535   16.303  335.535   16.303 0.000000 0.000000 
1 1 1   14   29    1 o  110.795   27.056   9.9821   4.5487   6.4262   6.3849   13.647   6.4818   96.238   34.334  128.957   32.770 -32.71917 47.46256 
1 1 1   14   29    2 o  396.757   10.870  120.918   6.6014  119.245   9.1591  122.727   9.5231  393.309   15.214  398.938   15.596 -5.628754 21.78757 
1 1 1   14   29    3 o  254.505   13.953   50.022   5.4146   51.528   7.4726   48.357   7.8567  257.322   19.109  248.842   20.819 8.479614 28.25894 
1 1 1   14   29    4 o  498.759   10.412  191.035   7.9485  177.032   10.611  208.937   11.998  479.370   14.462  520.635   15.056 -41.26462 20.87626 
1 1 1   14   29    5 o  117.863   26.543   11.285   4.6733   13.280   6.3852   8.9843   6.8583  127.192   32.636  108.099   35.686 19.09330 48.35922 
1 1 1   14   29    6 o  347.475   10.190   92.715   5.4198   94.323   6.6535   89.542   9.3440  350.192   12.413  339.801   18.030 10.39108 21.88967 
1 1 1   14   29    7 o   59.655   25.110   0.4117   3.9025   0.8546   4.7247  -0.5390   6.9230   66.749   27.830   75.343   32.616 -8.594604 42.87537 
1 1 1   14   29    8 o  216.608   13.908   36.287   4.5868   35.903   5.5346   37.129   8.1963  214.907   16.963  216.600   25.193 -1.692657 30.37167 
1 1 1   14   29    9 o  520.263   9.2515  207.758   7.3672  195.322   8.8396  236.043   13.331  504.059   11.457  553.018   15.749 -48.95880 19.47600 
1 1 1   14   29   10 o  784.836   9.3089  472.837   11.183  465.101   13.688  488.367   19.392  777.771   11.498  795.306   15.930 -17.53485 19.64630 
1 1 1   14   29   11 o  282.949   12.280   61.603   5.3182   58.703   6.3730   68.253   9.6513  275.412   15.176  295.456   21.489 -20.04370 26.30752 
1 1 1   14   29   12 o  117.420   25.511   11.203   4.4539   10.028   5.3279   13.929   8.1157  110.811   30.466  130.031   38.234 -19.22033 48.88751 
1 1 1   14   29   13 o  235.308   13.656   42.816   4.8974   37.054   5.7668   57.721   9.2751  218.112   17.419  271.142   22.553 -53.02927 28.49704 
1 1 1   14   29   14 o   52.625   24.793  -5.4733   5.1680  -5.4733   5.1680   0.0000   0.0000   52.625   24.793  ?   ?  0.000000 24.79329 
1 1 1   14   29   15 o  486.330   11.839  182.040   8.8125  182.040   8.8125   0.0000   0.0000  486.330   11.839  ?   ?  0.000000 11.83850 
1 1 1   14   29   16 o  283.687   12.759   62.012   5.5402   61.064   6.5289   64.451   10.471  280.700   15.253  285.771   24.166 -5.071136 28.57730 
1 1 1   14   29   17 o  688.083   9.6327  363.807   10.145  359.114   12.312  373.734   17.906  682.951   11.778  694.541   16.844 -11.58997 20.55306 
1 1 1   14   29   18 o  168.461   19.273   22.356   4.8801   22.996   5.7095   20.621   9.4015  170.033   22.490  155.845   39.393 14.18758 45.36046 
1 1 1   14   29   19 o  182.526   18.837   26.185   5.1871   27.473   6.0750   22.720   9.9651  186.226   21.721  163.152   40.172 23.07397 45.66790 
1 1 1   14   29   20 o  691.288   9.8917  367.488   10.466  356.530   12.438  394.063   19.371  680.156   11.948  712.056   17.773 -31.89978 21.41578 
1 1 1   14   29   21 o   85.894   30.548   5.2463   5.0509   3.7717   5.8104   9.8069   10.218   82.636   32.083  116.798   43.177 -34.16273 53.79213 
1 1 1   14   29   22 o  446.868   12.843  154.157   8.7846  149.362   11.265  161.597   14.033  438.527   16.783  454.661   20.164 -16.13348 26.23466 
1 1 1   14   29   23 o  227.023   19.822   40.570   6.8187   38.475   8.3767   44.686   11.739  219.081   25.455  232.479   33.995 -13.39880 42.46898 
1 1 1   14   29   24 o  208.005   22.676   34.429   7.1025   33.421   8.8844   36.216   11.823  202.272   29.569  206.333   38.861 -4.060486 48.83149 
1 1 1   14   29   25 o  218.731   18.249   37.568   6.0540   50.681   10.950   31.795   7.2654  249.772   29.192  199.094   24.349 50.67853 38.01377 
1 1 1   14   29   26 o  184.350   18.001   26.755   5.0147   25.661   6.8099   28.052   7.4120  177.965   25.748  185.786   26.843 -7.820908 37.19557 
1 1 1   14   29   27 o   67.256   28.450   0.6623   5.0497   3.4882   6.9051  -2.5863   7.4036   85.709   34.434   71.819   32.273 13.88994 47.19396 
1 1 1   14   29   28 o   71.238   28.747   2.1322   4.8356  -1.7011   6.5445   6.7415   7.1764   69.099   30.745   97.811   36.179 -28.71240 47.47858 
1 1 1   14   29   29 o  170.803   20.546   23.264   5.2636   29.907   7.0164   14.714   7.9603  192.508   24.357  130.555   37.717 61.95250 44.89832 
1 1 1   14   29   30 f  134.243   26.089   14.886   5.1675   16.821   7.0296   12.610   7.6222  140.314   33.241  121.483   37.358 18.83128 50.00612 
1 1 1   14   29   31 o  202.796   19.345   32.612   5.9321   36.374   7.7313   27.228   9.2499  212.255   24.231  178.205   35.161 34.05083 42.70161 
1 1 1   14   29   32 o  148.749   27.939   18.435   6.1276   24.381   8.0647   10.315   9.4250  169.577   32.249  114.278   41.590 55.29907 52.62878 
1 1 1   14   29   33 o  275.661   14.976   59.370   6.2954   55.067   9.0542   63.397   8.7591  261.944   22.810  282.463   20.397 -20.51913 30.59944 
1 1 1   14   29   34 o  250.949   16.634   49.517   6.3532   52.099   9.4432   47.382   8.5873  253.506   24.648  242.310   23.447 11.19676 34.01888 
1 1 1   14   29   35 f  460.283   9.7553  163.519   6.8729  168.515   7.4122  132.892   18.353  467.006   10.369  399.851   30.210 67.15479 31.94048 
1 1 1   14   29   36 o  272.437   12.022   57.580   5.0131   58.363   5.2713   50.173   16.218  274.112   12.564  230.130   47.613 43.98137 49.24242 
1 1 1   14   29   37 o   68.014   25.948   2.8719   3.7541   1.0938   4.2603   9.0489   7.9404   63.145   26.386  105.425   38.204 -42.27957 46.43010 
1 1 1   14   29   38 o  201.043   14.086   31.745   4.3071   35.498   5.0243   21.342   8.3651  212.052   15.589  153.858   36.136 58.19394 39.35523 
1 1 1   14   29   39 o   86.393   27.504   6.2306   4.0952   6.0764   4.8985   6.5883   7.4629   86.865   30.148   94.741   36.478 -7.876503 47.32393 
1 1 1   14   29   40 o  101.587   33.227   9.0094   5.9508   11.801   9.8703   7.4153   7.4589  114.906   42.444   97.144   36.691 17.76141 56.10461 
1 1 1   14   29   41 o  126.083   17.950   12.905   3.3663   11.207   4.7139   14.673   4.8089  113.405   27.452  131.467   24.808 -18.06229 37.00006 
1 1 1   14   29   42 o  121.474   19.120   12.133   3.4376   12.986   4.9831   11.358   4.7484  121.764   27.399  113.639   27.578 8.125015 38.87513 
1 1 1   14   29   43 o  199.837   12.779   31.486   3.8883   36.217   6.0324   28.123   5.0858  210.843   18.893  186.105   18.082 24.73819 26.15123 
1 1 1   14   29   44 o  161.315   18.836   21.387   4.5634   5.0156   9.4659   26.344   5.2086   91.091   38.760  178.902   19.328 -87.81004 43.31207 
1 1 1   14   29   45 o   97.768   24.289   8.4205   3.6186   4.0615   4.9101   13.602   5.3535   75.345   29.426  121.828   29.107 -46.48274 41.38985 
1 1 1   14   29   46 o  102.931   26.239   9.5573   4.1464   8.5912   5.0443   11.570   7.2809   96.031   30.520  107.511   36.783 -11.48013 47.79616 
1 1 1   14   30    0 o  724.210   14.952  403.475   16.558  403.475   16.558  403.475   16.558  724.210   14.952  724.210   14.952 0.000000 0.000000 
1 1 1   14   30    1 o  402.057   11.100  124.248   6.8312  134.303   9.7227  114.445   9.6001  417.219   15.225  384.914   16.294 32.30460 22.30034 
1 1 1   14   30    2 o  719.056   10.591  397.263   11.656  369.122   15.573  433.121   17.579  691.858   14.705  749.194   15.329 -57.33594 21.24215 
1 1 1   14   30    3 o  714.289   10.554  392.011   11.539  380.699   15.842  404.792   16.840  702.600   14.731  724.318   15.189 -21.71765 21.15928 
1 1 1   14   30    4 o  257.002   14.456   51.084   5.6636   52.677   7.6130   49.110   8.4753  259.950   19.271  250.145   22.372 9.804138 29.52732 
1 1 1   14   30    5 o  442.213   10.911  150.303   7.3851  143.056   9.7626  159.997   11.292  430.645   14.811  455.076   16.211 -24.43140 21.95795 
1 1 1   14   30    6 o  306.568   10.946   72.243   5.1364   68.668   6.2941   79.368   8.8869  298.508   13.776  319.592   18.243 -21.08411 22.85967 
1 1 1   14   30    7 o   94.344   27.496   7.1487   4.2140   7.6829   5.1994   6.1260   7.1939   98.665   30.940   97.351   36.181 1.313316 47.60597 
1 1 1   14   30    8 o  154.508   18.959   18.784   4.3896   21.730   5.2344   11.802   8.0581  165.848   21.097  121.224   38.580 44.62445 43.97191 
1 1 1   14   30    9 o  150.194   16.846   17.664   3.8061   18.080   4.3347   16.263   7.9531  151.491   19.120  139.645   36.720 11.84557 41.39985 
1 1 1   14   30   10 o  299.831   12.207   69.206   5.6020   67.597   6.8013   72.601   9.8791  295.493   15.088  304.567   21.326 -9.073730 26.12372 
1 1 1   14   30   11 o  169.145   18.589   22.456   4.7332   19.225   5.6995   29.637   8.4962  154.765   24.905  191.291   30.005 -36.52643 38.99383 
1 1 1   14   30   12 o  255.965   16.195   50.883   6.3124   50.883   6.3124   0.0000   0.0000  255.965   16.195  ?   ?  0.000000 16.19543 
1 1 1   14   30   13 o  219.038   18.626   37.516   6.1854   37.516   6.1854   0.0000   0.0000  219.038   18.626  ?   ?  0.000000 18.62609 
1 1 1   14   30   14 o  268.232   12.992   55.472   5.3341   55.549   6.4354   55.302   9.5346  267.499   15.788  264.549   23.801 2.949768 28.56129 
1 1 1   14   30   15 o   61.012   26.312  -0.2433   4.4713  -2.7987   5.3335   5.8004   8.2022   59.574   27.022   99.053   38.213 -39.47903 46.80162 
1 1 1   14   30   16 o   62.789   27.039  -0.1698   4.7076  -1.8434   5.5198   4.2954   9.0161   63.183   28.166   97.273   39.253 -34.08960 48.31272 
1 1 1   14   30   17 o  445.301   10.371  152.550   7.0690  147.518   8.3873  164.891   13.134  437.372   12.529  460.298   18.642 -22.92593 22.46099 
1 1 1   14   30   18 o  361.787   13.680  101.115   7.5757   92.111   9.9233  113.692   11.729  343.343   18.956  381.047   20.182 -37.70392 27.68801 
1 1 1   14   30   19 o  343.547   14.289   91.278   7.5137   85.420   9.8616   99.386   11.601  330.281   19.595  355.581   21.415 -25.29916 29.02695 
1 1 1   14   30   20 o  243.569   18.380   46.463   6.8018   46.973   8.5796   45.599   11.160  243.243   23.330  236.143   31.673 7.099503 39.33789 
1 1 1   14   30   21 o  265.719   14.586   54.820   5.9096   55.441   6.8423   52.997   11.724  266.591   16.855  255.182   30.629 11.40854 34.96005 
1 1 1   14   30   22 o  417.959   11.581  134.700   7.4087  144.823   8.6695  107.292   14.265  432.932   13.083  366.957   25.557 65.97528 28.71129 
1 1 1   14   30   23 o  223.628   24.136   39.980   8.1306   33.929   10.735   48.121   12.452  200.531   36.312  240.433   34.851 -39.90251 50.33009 
1 1 1   14   30   24 o  378.424   12.904  110.695   7.4744  105.778   8.7185  124.327   14.518  369.139   15.431  395.547   24.095 -26.40811 28.61241 
1 1 1   14   30   25 o  320.740   11.874   79.421   5.8291   91.437   8.3077   67.770   8.1810  342.993   15.824  294.007   18.270 48.98560 24.17012 
1 1 1   14   30   26 o   52.950   24.564  -3.7546   4.7587  -1.5277   6.5154  -6.3010   6.9670   69.392   30.786   62.002   29.077 7.390831 42.34644 
1 1 1   14   30   27 o   43.128   21.170  -9.3355   4.8031  -6.5706   6.3681 -12.9839   7.3151   57.901   27.353   54.200   26.505 3.700661 38.08768 
1 1 1   14   30   28 f  136.654   25.667   15.370   5.1715   23.801   7.1205   5.9592   7.5234  169.725   28.414   95.776   36.687 73.94875 46.40302 
1 1 1   14   30   29 o  355.044   11.961   97.474   6.5003   93.248   8.9486  102.196   9.4581  345.489   16.922  361.613   17.088 -16.12424 24.04893 
1 1 1   14   30   30 o  120.283   30.182   12.265   5.5477   5.5241   7.1575   22.409   8.7801   92.782   35.724  160.516   36.554 -67.73457 51.11180 
1 1 1   14   30   31 o  129.183   28.196   14.026   5.4187   27.566   7.9584   2.3236   7.3985  181.760   29.627   83.405   34.804 98.35571 45.70643 
1 1 1   14   30   32 o  156.659   24.637   20.111   5.7126   31.756   8.4682   10.387   7.7387  195.308   29.225  111.686   37.923 83.62218 47.87777 
1 1 1   14   30   33 o  420.510   14.602  137.821   9.3986  144.559   10.950  118.963   18.319  429.499   16.656  376.886   32.060 52.61261 36.12815 
1 1 1   14   30   34 o  166.291   32.061   23.730   7.8647   19.881   9.0168   35.971   16.080  148.385   39.137  189.615   53.226 -41.22983 66.06650 
1 1 1   14   30   35 o  149.731   27.692   18.895   6.1129   19.656   8.8170   18.190   8.4825  147.208   38.641  141.803   38.217 5.405197 54.34738 
1 1 1   14   30   36 o  168.474   15.790   22.464   4.0244   22.829   4.6336   21.342   8.1193  168.951   18.206  154.917   35.059 14.03413 39.50439 
1 1 1   14   30   37 o   66.401   25.513   2.6951   3.6454   3.7358   4.1662  -0.7037   7.5292   73.688   27.505   74.652   33.108 -0.9636459 43.04246 
1 1 1   14   30   38 o  154.574   29.758   20.701   6.7852   51.472   15.312   13.182   7.5689  231.268   44.875  120.069   37.278 111.1982 58.33820 
1 1 1   14   30   39 o  244.684   17.434   47.787   6.4869   63.781   11.081   39.450   8.0010  275.711   26.588  217.950   24.403 57.76129 36.08900 
1 1 1   14   30   40 o  237.896   12.205   44.297   4.4292   50.241   5.4333   32.522   7.6475  252.460   14.117  196.013   26.141 56.44695 29.70955 
1 1 1   14   30   41 f  145.724   20.706   17.565   4.4885   24.653   5.6084   4.9338   7.4862  172.421   21.734   87.592   35.618 84.82851 41.72507 
1 1 1   14   30   42 o  143.985   16.675   16.779   3.6069   18.616   5.3993   15.298   4.8472  147.233   24.843  133.300   24.666 13.93307 35.00803 
1 1 1   14   30   43 o   42.545   19.939  -2.7794   3.2669  -4.4759   4.6529  -1.1299   4.5880   48.909   23.187   56.381   25.364 -7.472324 34.36499 
1 1 1   14   30   44 o  103.619   27.527   9.7379   4.4400   6.7882   4.7822   28.159   11.951   87.443   29.811  157.430   46.427 -69.98689 55.17406 
1 1 1   14   31    0 o   37.010   26.208  -7.6836   6.1412  -7.6836   6.1412  -7.6836   6.1412   37.010   26.208   37.010   26.208 0.000000 0.000000 
1 1 1   14   31    1 o  335.241   12.393   86.536   6.3594   89.081   9.0079   84.008   8.9792  338.697   17.435  328.754   17.912 9.943451 24.99602 
1 1 1   14   31    2 o  414.835   11.538  132.401   7.3263  126.868   10.031  138.727   10.726  405.042   16.180  423.448   16.549 -18.40625 23.14406 
1 1 1   14   31    3 o  328.383   12.590   83.053   6.3283   85.787   8.7502   80.055   9.1633  332.392   17.258  320.646   18.752 11.74533 25.48511 
1 1 1   14   31    4 o  291.356   13.590   65.451   6.0607   65.062   8.3230   65.891   8.8428  288.895   18.927  290.423   20.015 -1.528107 27.54653 
1 1 1   14   31    5 o  631.430   10.771  306.579   10.410  300.888   14.283  313.029   15.205  624.180   14.950  636.389   15.610 -12.20874 21.61433 
1 1 1   14   31    6 o  420.125   10.142  135.656   6.5220  130.189   7.9494  146.915   11.408  411.093   12.634  435.514   17.113 -24.42148 21.27097 
1 1 1   14   31    7 o  668.807   9.2339  343.549   9.4527  326.153   11.324  383.522   17.166  651.057   11.364  704.175   15.926 -53.11768 19.56478 
1 1 1   14   31    8 o  136.172   21.826   14.818   4.3956   10.729   5.1937   25.138   8.2520  114.184   29.505  175.049   31.977 -60.86570 43.50949 
1 1 1   14   31    9 o  175.842   20.749   24.420   5.4771   24.420   5.4771   0.0000   0.0000  175.842   20.749  ?   ?  0.000000 20.74949 
1 1 1   14   31   10 o  209.750   19.383   34.508   6.1526   34.508   6.1526   0.0000   0.0000  209.750   19.383  ?   ?  0.000000 19.38319 
1 1 1   14   31   11 o  360.647   11.137  100.104   6.1479  100.050   7.3318  100.233   11.283  360.118   13.301  357.863   20.687 2.254517 24.59440 
1 1 1   14   31   12 o  317.927   12.534   77.923   6.0994   77.340   7.4743   79.086   10.553  316.139   15.446  317.238   21.866 -1.099091 26.77173 
1 1 1   14   31   13 o  424.531   12.331  138.933   8.0126  129.315   10.421  152.844   12.533  408.355   16.672  443.293   18.470 -34.93802 24.88191 
1 1 1   14   31   14 o  241.237   16.914   45.375   6.2061   47.623   8.3288   42.569   9.3057  245.498   22.412  230.398   26.894 15.10033 35.00799 
1 1 1   14   31   15 f  208.454   19.711   34.186   6.2145   31.030   8.0333   38.889   9.8068  195.978   27.540  218.753   30.085 -22.77505 40.78714 
1 1 1   14   31   16 o  311.242   14.923   74.984   7.1094   87.895   9.8862   61.157   10.231  335.162   19.353  277.538   24.329 57.62405 31.08817 
1 1 1   14   31   17 o  143.246   23.106   16.514   4.8938   14.810   5.6930   21.336   9.5776  133.926   28.639  157.657   39.710 -23.73053 48.96032 
1 1 1   14   31   18 o  161.149   21.131   20.669   5.0865   16.772   5.8684   32.442   10.199  142.899   27.831  197.073   35.099 -54.17392 44.79367 
1 1 1   14   31   19 o  297.006   13.469   68.185   6.1233   69.255   7.1878   65.354   11.692  298.375   15.795  285.386   27.091 12.98886 31.35939 
1 1 1   14   31   20 o  183.562   20.025   26.664   5.5352   23.706   6.4124   35.312   10.964  171.305   25.210  204.850   36.295 -33.54517 44.19092 
1 1 1   14   31   21 o  270.282   20.429   57.574   8.3893   53.100   11.546   62.578   12.211  255.230   30.135  277.831   29.148 -22.60101 41.92552 
1 1 1   14   31   22 o  367.981   16.471  105.322   9.2773   88.958   12.131  128.374   14.398  334.500   23.850  402.324   23.483 -67.82367 33.47065 
1 1 1   14   31   23 o  482.884   11.430  179.904   8.4479  180.271   9.8908  178.914   16.244  482.652   13.388  476.204   22.285 6.447784 25.99771 
1 1 1   14   31   24 o  354.142   13.176   97.055   7.1424   96.750   8.2432   97.975   14.307  352.920   15.260  348.806   27.008 4.113525 31.02051 
1 1 1   14   31   25 o  209.934   19.828   34.891   6.2958   39.826   7.2189   19.209   12.867  223.842   21.328  147.081   48.896 76.76149 53.34521 
1 1 1   14   31   26 o   78.247   29.447   3.9080   4.7948   7.3883   6.5745  -0.0463   7.0079   98.557   34.874   75.576   32.766 22.98103 47.85164 
1 1 1   14   31   27 o  151.376   22.662   18.534   5.0893   19.102   7.1685   17.956   7.2266  150.055   32.177  144.972   33.272 5.083481 46.28582 
1 1 1   14   31   28 o  308.637   14.255   74.001   6.7344   74.546   8.6168   73.147   10.795  307.756   18.376  302.209   23.522 5.546600 29.84918 
1 1 1   14   31   29 o  163.770   24.999   21.928   6.0678   20.029   7.7062   25.025   9.8433  152.616   33.873  168.411   38.960 -15.79521 51.62623 
1 1 1   14   31   30 o   76.027   32.375   1.0021   6.6130  -0.4450   7.5906   5.5594   13.471   76.938   33.715  110.741   46.635 -33.80276 57.54541 
1 1 1   14   31   31 o  118.444   35.163   12.152   6.8369   7.3179   7.7605   28.912   14.450  100.161   37.509  172.808   51.075 -72.64703 63.36828 
1 1 1   14   31   32 o  264.355   16.253   54.928   6.5444   61.123   9.3040   48.863   9.2071  275.842   22.225  244.969   24.901 30.87294 33.37690 
1 1 1   14   31   33 o  198.611   20.935   31.733   6.2682   26.719   8.8195   36.850   8.9104  175.288   34.099  210.128   28.434 -34.83968 44.39893 
1 1 1   14   31   34 o  288.536   15.111   65.339   6.6506   69.521   9.7185   61.657   9.1207  293.802   21.766  276.639   21.714 17.16293 30.74531 
1 1 1   14   31   35 o  124.294   31.297   13.528   5.9505   1.7407   8.7453   23.689   8.1200   85.597   36.857  164.149   33.454 -78.55199 49.77491 
1 1 1   14   31   36 o  131.482   31.767   15.261   6.3216   13.833   9.7595   16.294   8.2976  122.599   42.554  132.641   38.563 -10.04247 57.42749 
1 1 1   14   31   37 o   58.694   27.775  -6.2033   6.6174 -16.2444   13.983  -3.3054   7.5118   77.712   37.696   68.688   31.501 9.024338 49.12487 
1 1 1   14   31   38 o  289.035   25.046   69.481   10.971   69.481   10.971   0.0000   0.0000  289.035   25.046  ?   ?  0.000000 25.04648 
1 1 1   14   31   39 o   80.488   27.139   5.3225   3.9629   6.1341   4.6419   3.1407   7.6108   85.870   29.370   83.321   35.069 2.549507 45.74263 
1 1 1   14   31   40 o  173.531   16.779   24.237   4.4012   31.752   5.4834   10.627   7.3787  197.930   18.307  107.101   37.011 90.82937 41.29110 
1 1 1   14   31   41 o  162.177   17.305   21.338   4.2293   23.879   4.9977   14.927   7.9377  170.392   19.514  122.924   38.177 47.46838 42.87537 
1 1 1   14   31   42 o  221.661   15.974   39.507   5.3832   17.223   9.0394   51.753   6.7011  128.645   40.853  252.702   17.431 -124.0578 44.41662 
1 1 1   14   31   43 o  104.812   28.547   10.065   4.7038   15.751   5.1719 -17.1385   11.314  133.276   26.287   64.412   31.786 68.86419 41.24787 
1 1 1   14   32    0 o  225.316   22.487   40.423   7.5779   40.423   7.5779   40.423   7.5779  225.316   22.487  225.316   22.487 0.000000 0.000000 
1 1 1   14   32    1 o  345.152   12.336   91.795   6.5172  100.045   9.1705   83.377   9.2636  359.320   16.674  327.036   18.583 32.28400 24.96696 
1 1 1   14   32    2 o  355.095   12.340   97.163   6.7068   95.622   9.1942   98.916   9.8048  351.165   17.105  356.471   18.028 -5.306274 24.85203 
1 1 1   14   32    3 o   89.740   30.456   6.0461   4.9913   5.5039   6.7415   6.7039   7.4253   93.030   34.936   99.669   36.814 -6.638481 50.75244 
1 1 1   14   32    4 o  271.438   14.584   57.094   6.0370   57.853   8.3048   56.244   8.7911  271.743   20.109  267.421   21.663 4.321442 29.55801 
1 1 1   14   32    5 o  489.212   11.412  184.261   8.5455  198.302   12.033  169.973   12.138  506.226   15.530  468.187   16.938 38.03918 22.97947 
1 1 1   14   32    6 o   73.578   31.693  -0.0808   6.4719  -0.0808   6.4719   0.0000   0.0000   73.578   31.693  ?   ?  0.000000 31.69347 
1 1 1   14   32    7 o   57.495   27.080  -6.3171   6.1578  -6.3171   6.1578   0.0000   0.0000   57.495   27.080  ?   ?  0.000000 27.08040 
1 1 1   14   32    8 o  308.533   18.729   74.333   8.8031   74.333   8.8031   0.0000   0.0000  308.533   18.729  ?   ?  0.000000 18.72948 
1 1 1   14   32    9 o  154.247   23.763   19.103   5.4301   28.112   7.2635   7.6883   8.1759  186.977   26.091  105.092   38.662 81.88522 46.64195 
1 1 1   14   32   10 o  154.501   28.390   19.522   6.4663   25.882   9.9846   14.927   8.4864  174.702   38.387  133.097   39.086 41.60495 54.78416 
1 1 1   14   32   11 o  402.294   10.671  124.564   6.5710  123.795   8.0360  126.115   11.415  400.473   13.110  402.503   18.528 -2.029999 22.69728 
1 1 1   14   32   12 o  209.912   16.064   34.355   5.1221   31.044   6.0147   43.096   9.7714  198.431   20.080  231.181   28.199 -32.74997 34.61744 
1 1 1   14   32   13 o  170.115   19.512   22.858   4.9886   19.120   5.8761   32.508   9.4404  153.526   25.929  198.755   32.128 -45.22894 41.28552 
1 1 1   14   32   14 o  159.073   21.175   20.142   5.0277   19.322   5.8736   22.390   9.7247  154.365   25.767  161.534   39.630 -7.169144 47.27054 
1 1 1   14   32   15 o  286.625   13.484   63.486   5.9157   65.464   7.1589   59.227   10.504  290.008   16.192  272.427   25.487 17.58109 30.19596 
1 1 1   14   32   16 o  251.669   14.740   49.213   5.6534   53.129   6.7580   40.084   10.318  260.883   17.017  221.132   31.364 39.75096 35.68342 
1 1 1   14   32   17 o  366.613   11.953  103.692   6.7071   99.326   7.9737  114.257   12.402  358.121   14.547  380.955   21.356 -22.83344 25.83935 
1 1 1   14   32   18 o  307.526   13.475   73.136   6.3427   76.583   7.5149   64.601   11.827  314.126   15.630  283.193   27.636 30.93277 31.74962 
1 1 1   14   32   19 o  207.278   24.191   34.425   7.5306   38.352   10.385   30.070   10.936  215.278   32.531  186.928   39.461 28.34959 51.14138 
1 1 1   14   32   20 o  258.650   20.652   52.834   8.1078   51.792   11.087   54.032   11.887  252.233   29.261  256.859   30.852 -4.625946 42.52139 
1 1 1   14   32   21 o  244.653   16.573   46.799   6.1693   43.221   7.1533   57.185   12.189  233.874   20.180  264.190   30.715 -30.31567 36.75122 
1 1 1   14   32   22 o  329.616   13.663   84.150   6.8931   83.759   8.0359   85.241   13.411  328.123   16.000  325.091   27.201 3.032928 31.55819 
1 1 1   14   32   23 o  179.305   22.313   25.768   5.9912   23.566   6.7942   33.468   12.704  169.583   27.086  193.982   43.822 -24.39836 51.51714 
1 1 1   14   32   24 o   85.262   32.374   4.6323   5.8263   7.2882   6.6309  -4.3623   12.203   98.289   34.997   89.551   40.717 8.737465 53.69026 
1 1 1   14   32   25 o   64.570   28.835  -1.7543   5.8132  -0.1946   6.6530  -6.7886   11.953   73.288   31.850   84.671   39.156 -11.38239 50.47364 
1 1 1   14   32   26 o  277.544   16.416   60.321   6.9426   58.446   8.1229   65.401   13.374  271.857   19.653  280.750   31.675 -8.893585 37.27700 
1 1 1   14   32   27 o  122.018   30.954   12.673   5.7901   12.501   7.2780   12.969   9.5564  120.526   36.393  123.537   42.141 -3.011032 55.68066 
1 1 1   14   32   28 o  134.233   32.913   15.506   6.7104   17.615   7.6276   8.2850   14.115  142.288   35.213  118.115   48.567 24.17389 59.98898 
1 1 1   14   32   29 o  133.811   33.477   15.513   6.8394   19.807   7.8109   1.3995   14.161  150.994   34.545  104.382   45.887 46.61194 57.43695 
1 1 1   14   32   30 o   75.401   30.626   2.5273   5.5273   2.6153   7.5058   2.4232   8.1698   84.225   35.094   86.318   36.332 -2.092751 50.51326 
1 1 1   14   32   31 o  374.638   12.669  109.002   7.2647  103.170   10.034  115.427   10.531  361.271   18.205  382.706   17.978 -21.43445 25.58570 
1 1 1   14   32   32 o  324.969   14.045   82.380   6.9862   93.082   10.275   73.178   9.5274  341.803   19.723  302.323   20.714 39.47964 28.60203 
1 1 1   14   32   33 o  142.280   27.937   17.206   5.8670   22.376   8.8672   13.180   7.8246  157.292   37.381  121.157   37.949 36.13539 53.26841 
1 1 1   14   32   34 o  132.099   31.000   15.277   6.1603   19.998   9.2100   11.455   8.2869  146.348   39.981  113.861   39.230 32.48659 56.01334 
1 1 1   14   32   35 o   83.314   32.697   4.4388   6.0858   9.1239   9.0484   0.5686   8.2238  106.197   40.339   80.298   35.142 25.89914 53.49953 
1 1 1   14   32   36 f   84.847   34.448   4.0848   6.9896   30.475   14.685  -3.6451   7.9476  168.809   51.844   70.020   32.219 98.78867 61.03946 
1 1 1   14   32   37 o  259.281   18.843   54.118   7.4270   65.458   13.787   49.482   8.8154  271.269   33.948  244.281   23.882 26.98721 41.50707 
1 1 1   14   32   38 o  193.822   15.211   29.883   4.4763   28.686   5.1987   33.315   8.8020  188.321   18.265  194.379   30.596 -6.058258 35.63313 
1 1 1   14   32   39 o  156.970   17.173   19.939   4.0588   17.318   4.6847   27.831   8.1281  143.732   21.994  175.908   31.337 -32.17589 38.28461 
1 1 1   14   32   40 o  110.614   25.280   10.721   4.1867   16.570   4.9267  -4.4808   7.9427  139.002   24.025   66.766   31.226 72.23595 39.39903 
1 1 1   14   32   41 o  114.022   24.647   11.380   4.1761   11.732   4.4989   9.1914   11.228  114.961   26.156  103.342   42.979 11.61880 50.31215 
1 1 1   14   33    0 o   85.724   43.424   8.6521   7.0981   8.6521   7.0981   8.6521   7.0981   85.724   43.424   85.724   43.424 0.000000 0.000000 
1 1 1   14   33    1 f  745.181   15.794  430.204   18.014  430.204   18.014   0.0000   0.0000  745.181   15.794  ?   ?  0.000000 15.79372 
1 1 1   14   33    2 o  477.031   16.057  176.373   11.724  176.373   11.724   0.0000   0.0000  477.031   16.057  ?   ?  0.000000 16.05734 
1 1 1   14   33    3 o  517.993   15.840  207.902   12.559  207.902   12.559   0.0000   0.0000  517.993   15.840  ?   ?  0.000000 15.84018 
1 1 1   14   33    4 o  335.826   17.938   87.932   9.1870   87.932   9.1870   0.0000   0.0000  335.826   17.938  ?   ?  0.000000 17.93765 
1 1 1   14   33    5 o  448.448   9.9905  154.679   6.8576  159.564   8.6197  146.256   11.319  454.869   12.380  434.011   17.038 20.85785 21.06137 
1 1 1   14   33    6 o  469.368   9.9889  169.452   7.1763  172.833   8.9069  163.197   12.115  473.418   12.292  458.345   17.269 15.07294 21.19713 
1 1 1   14   33    7 o  408.704   12.260  128.815   7.6698  137.221   10.586  119.527   11.128  420.554   16.445  391.779   18.556 28.77539 24.79482 
1 1 1   14   33    8 o  166.058   21.562   21.940   5.3511   20.084   7.0961   24.385   8.1477  155.825   30.843  171.583   32.207 -15.75803 44.59349 
1 1 1   14   33    9 o  225.584   15.198   39.584   5.2170   40.661   6.4178   37.486   8.9576  227.752   18.572  215.473   27.809 12.27899 33.44036 
1 1 1   14   33   10 o  373.969   14.549  108.225   8.3277  105.033   12.042  111.151   11.529  365.392   21.628  376.619   20.072 -11.22723 29.50661 
1 1 1   14   33   11 o  233.344   19.689   42.819   6.9665   45.194   10.514   40.959   9.3015  235.872   29.786  225.342   27.541 10.52989 40.56705 
1 1 1   14   33   12 o  288.757   13.164   64.417   5.8182   60.619   7.0136   72.799   10.419  278.903   16.503  303.444   22.594 -24.54102 27.97921 
1 1 1   14   33   13 o  148.990   23.072   17.862   5.0915   15.429   6.0370   23.858   9.4762  136.251   29.779  167.086   37.921 -30.83519 48.21617 
1 1 1   14   33   14 o  306.566   13.103   72.626   6.1482   69.319   7.3334   80.450   11.280  298.354   16.118  318.589   23.293 -20.23486 28.32569 
1 1 1   14   33   15 o  198.936   18.249   31.112   5.4948   32.975   6.5204   26.550   10.206  203.932   21.199  175.788   38.956 28.14380 44.35091 
1 1 1   14   33   16 o   64.142   27.786  -0.3066   5.0312   3.0420   5.9338  -8.8714   9.4899   80.163   32.022   71.414   33.631 8.748779 46.43708 
1 1 1   14   33   17 o  326.576   16.847   83.233   8.3926   85.975   11.825   80.450   11.914  328.885   23.647  317.555   24.705 11.33047 34.19867 
1 1 1   14   33   18 o  118.269   37.223   11.691   7.5177   3.5086   10.107   21.825   11.248   97.934   40.757  156.799   44.692 -58.86541 60.48582 
1 1 1   14   33   19 o   95.480   32.123   7.1345   5.5522   6.8991   6.4642   7.7966   10.841   96.611   34.538  111.138   43.633 -14.52712 55.64788 
1 1 1   14   33   20 o  302.707   14.197   71.052   6.5779   77.878   7.7794   53.928   12.321  315.925   16.141  255.319   32.246 60.60661 36.06024 
1 1 1   14   33   21 o  417.711   11.913  134.813   7.6168  135.082   8.9668  134.115   14.435  417.361   14.036  410.742   23.053 6.619110 26.99007 
1 1 1   14   33   22 o  110.309   32.327   10.229   5.8104   6.6285   6.6440   21.938   11.981   95.678   34.904  155.579   46.630 -59.90101 58.24696 
1 1 1   14   33   23 o  237.510   18.193   44.431   6.5636   46.792   7.5700   37.279   13.175  242.840   20.559  204.493   43.432 38.34622 48.05202 
1 1 1   14   33   24 o   94.731   33.358   6.8510   6.0083   5.9893   6.8257   9.8163   12.662   93.519   35.147  119.360   47.060 -25.84122 58.73601 
1 1 1   14   33   25 o   68.424   30.898  -2.6421   6.8840  -2.6421   6.8840   0.0000   0.0000   68.424   30.898  ?   ?  0.000000 30.89835 
1 1 1   14   33   26 o   57.492   27.464  -8.1446   6.7837  -8.1446   6.7837   0.0000   0.0000   57.492   27.464  ?   ?  0.000000 27.46360 
1 1 1   14   33   27 o  189.588   24.142   29.221   6.8468   28.193   7.9351   32.216   13.546  183.787   29.183  185.226   47.539 -1.439468 55.78204 
1 1 1   14   33   28 o  101.462   32.117   8.6168   5.5903   12.471   7.5262   3.8733   8.3495  119.645   37.177   90.977   37.374 28.66813 52.71579 
1 1 1   14   33   29 o  109.790   31.723   10.355   5.6308   8.6920   7.8228   12.143   8.1114  104.709   37.924  118.116   38.801 -13.40691 54.25609 
1 1 1   14   33   30 o  220.920   18.611   38.841   6.2347   40.784   8.7656   36.853   8.8698  222.347   26.263  210.038   28.311 12.30940 38.61700 
1 1 1   14   33   31 o   57.419   26.804  -4.5666   5.8076  -5.4629   8.3671  -3.7333   8.0675   69.597   32.383   71.263   32.668 -1.665947 45.99847 
1 1 1   14   33   32 o   84.980   32.560   4.9237   5.9271   5.7973   8.2137   3.9745   8.5614   94.692   37.722   90.523   37.579 4.168892 53.24601 
1 1 1   14   33   33 o   63.825   28.683  -1.6572   5.8499  -0.8147   8.7234  -2.3456   7.8859   79.420   35.406   72.630   32.909 6.790070 48.33793 
1 1 1   14   33   34 o  111.130   36.484   11.041   7.1720   5.7006   14.244   12.855   8.3011  107.899   46.746  118.427   39.269 -10.52776 61.05118 
1 1 1   14   33   35 o   88.102   36.667   3.9694   8.1809   0.0000   0.0000   3.9694   8.1809  ?   ?    88.102   36.667 0.000000 36.66739 
1 1 1   14   33   36 o  105.296   35.495   9.9807   6.7791   1.0541   12.501   13.699   8.0684   93.620   42.013  120.144   38.644 -26.52345 57.08230 
1 1 1   14   33   37 o   93.743   33.183   7.5592   5.9529   15.140   8.9151   1.4601   7.9968  123.801   40.678   79.761   34.787 44.03992 53.52423 
1 1 1   14   33   38 o   98.076   33.218   8.6852   5.9374   6.4356   8.8246   10.546   8.0256   94.233   38.534  106.228   38.422 -11.99464 54.41602 
1 1 1   14   33   39 o  120.584   22.742   12.433   4.0435   12.478   4.7304   12.311   7.7918  118.604   26.701  112.010   38.053 6.593880 46.48593 
1 1 1   14   33   40 o  262.194   13.260   54.452   5.3043   59.801   5.8860   31.331   12.237  274.224   14.071  167.973   46.167 106.2509 48.26394 
1 1 1   14   34    0 o  155.999   39.571   22.437   8.1699   22.437   8.1699   22.437   8.1699  155.999   39.571  155.999   39.571 0.000000 0.000000 
1 1 1   14   34    1 o  211.098   26.859   35.905   8.4820   0.0000   0.0000   35.905   8.4820  ?   ?   211.098   26.859 0.000000 26.85933 
1 1 1   14   34    2 o  419.975   17.629  137.221   11.332   0.0000   0.0000  137.221   11.332  ?   ?   419.975   17.629 0.000000 17.62911 
1 1 1   14   34    3 o  464.367   17.436  167.714   12.393   0.0000   0.0000  167.714   12.393  ?   ?   464.367   17.436 0.000000 17.43649 
1 1 1   14   34    4 o  253.106   24.649   51.058   9.4282   0.0000   0.0000   51.058   9.4282  ?   ?   253.106   24.649 0.000000 24.64904 
1 1 1   14   34    5 o   99.619   32.832   7.8208   5.8061   6.5872   8.8355   8.7584   7.7027  102.903   39.671  107.404   37.775 -4.500519 54.77915 
1 1 1   14   34    6 o  151.770   27.851   18.881   6.2315   18.993   9.7906   18.804   8.0794  148.247   41.503  148.844   35.882 -0.5975189 54.86423 
1 1 1   14   34    7 o  497.516   12.741  191.127   9.7027  186.161   14.367  195.290   13.156  488.255   19.224  501.104   17.153 -12.84952 25.76416 
1 1 1   14   34    8 o  216.471   20.449   36.997   6.6952   42.314   10.550   33.411   8.6632  227.335   31.138  202.618   28.739 24.71721 42.37363 
1 1 1   14   34    9 o  315.529   21.226   78.446   10.191   0.0000   0.0000   78.446   10.191  ?   ?   315.529   21.226 0.000000 21.22550 
1 1 1   14   34   10 o   93.474   38.348   3.5049   8.7753   0.0000   0.0000   3.5049   8.7753  ?   ?    93.474   38.348 0.000000 38.34807 
1 1 1   14   34   11 o   74.232   31.549   0.7005   6.2577   3.0390   9.4501  -1.1256   8.3509   94.716   39.414   80.024   35.207 14.69170 52.84884 
1 1 1   14   34   12 o  178.737   19.406   25.263   5.2237   23.810   6.2442   28.649   9.5348  171.870   24.423  184.429   35.058 -12.55894 42.72606 
1 1 1   14   34   13 o  297.711   13.371   68.558   6.0928   68.026   7.4564   69.627   10.569  295.277   16.565  295.917   23.529 -0.6393127 28.77538 
1 1 1   14   34   14 o  457.797   11.124  161.604   7.7944  155.368   9.4725  174.679   13.716  447.968   13.815  472.594   18.962 -24.62671 23.46067 
1 1 1   14   34   15 o   65.364   29.873  -3.7269   6.6768  -9.7975   9.2208   2.9646   9.6809   68.628   32.566   95.048   39.750 -26.41924 51.38713 
1 1 1   14   34   16 o  507.293   13.588  199.262   10.550  185.408   14.623  214.302   15.237  486.274   19.647  523.183   19.027 -36.90814 27.35020 
1 1 1   14   34   17 o  139.725   26.260   16.057   5.4100   15.755   6.3297   16.875   10.421  136.822   30.949  139.041   43.834 -2.218842 53.65864 
1 1 1   14   34   18 o  190.320   20.193   28.767   5.7925   23.204   6.6655   45.929   11.708  168.367   26.760  234.474   33.581 -66.10707 42.93925 
1 1 1   14   34   19 o  239.395   16.740   44.907   6.0953   45.049   7.1402   44.526   11.703  238.707   19.719  230.236   34.252 8.471786 39.52259 
1 1 1   14   34   20 o   59.934   27.367  -3.1005   5.5873  -3.4896   6.4771  -1.9689   11.045   64.470   29.448   89.120   39.777 -24.64996 49.49157 
1 1 1   14   34   21 o  104.794   32.664   9.1193   5.8048   5.0489   6.8300   19.708   11.016   90.217   34.852  148.020   44.791 -57.80288 56.75294 
1 1 1   14   34   22 o  115.835   32.282   11.415   5.9374   19.536   7.0249  -8.8930   11.110  152.012   31.237   78.004   36.625 74.00779 48.13600 
1 1 1   14   34   23 o  247.340   18.302   48.259   6.8795   40.959   7.7009   77.109   15.309  225.994   22.564  303.277   33.541 -77.28287 40.42461 
1 1 1   14   34   24 o  471.918   14.212  173.183   10.265  173.183   10.265   0.0000   0.0000  471.918   14.212  ?   ?  0.000000 14.21159 
1 1 1   14   34   25 f  156.827   29.109   20.659   6.7302   23.004   7.7985   13.816   13.322  164.199   32.180  129.346   48.991 34.85219 58.61448 
1 1 1   14   34   26 o  205.923   22.863   34.274   7.0845   37.158   8.1195   25.072   14.501  213.238   25.375  160.616   51.822 52.62198 57.70133 
1 1 1   14   34   27 o  247.003   19.694   48.614   7.3839   46.874   8.6038   53.477   14.385  240.427   23.687  245.528   39.626 -5.100800 46.16647 
1 1 1   14   34   28 o  130.845   33.984   15.070   6.8671   14.288   8.0663   17.129   13.090  126.298   38.353  136.163   49.096 -9.865105 62.30097 
1 1 1   14   34   29 o  235.490   17.709   44.014   6.3365   43.265   8.9795   44.758   8.9429  228.805   26.107  233.161   25.473 -4.355804 36.47553 
1 1 1   14   34   30 o  105.095   32.989   9.5676   5.9092   11.311   8.2580   7.7380   8.4594  113.625   39.161  101.463   38.893 12.16266 55.19266 
1 1 1   14   34   31 o   64.228   28.743  -1.4258   5.8090   2.0980   8.4293  -4.6129   8.0165   85.005   36.383   69.001   31.965 16.00421 48.42986 
1 1 1   14   34   32 o  118.975   34.798   12.764   6.7386   8.0234   10.541   16.039   8.7630  105.658   42.511  130.764   40.030 -25.10580 58.39221 
1 1 1   14   34   33 f  112.975   39.593   11.512   8.4584   0.0000   0.0000   11.512   8.4584  ?   ?   112.975   39.593 0.000000 39.59312 
1 1 1   14   34   34 o  153.143   27.419   20.198   6.1912   26.383   9.4756   15.591   8.1782  167.745   37.810  128.005   38.562 39.73962 54.00549 
1 1 1   14   34   35 o  227.957   19.058   42.137   6.5886   40.637   9.9224   43.321   8.8115  214.337   31.157  225.937   25.951 -11.59958 40.54878 
1 1 1   14   34   36 f  141.602   30.100   18.004   6.3230   16.848   9.4669   18.934   8.4957  128.763   41.899  138.914   38.581 -10.15077 56.95620 
1 1 1   14   34   37 o  137.893   29.275   17.092   5.9879   21.125   9.1535   14.075   7.9169  144.655   40.000  119.360   38.267 25.29444 55.35669 
1 1 1   14   34   38 f  149.886   38.946   22.593   9.0164   22.593   9.0164   0.0000   0.0000  149.886   38.946  ?   ?  0.000000 38.94645 
1 1 1   14   35    0 o  260.416   23.436   53.938   9.1675   53.938   9.1675   53.938   9.1675  260.416   23.436  260.416   23.436 0.000000 0.000000 
1 1 1   14   35    1 o  139.599   28.303   16.097   5.8407   12.179   8.0466   20.461   8.4914  121.065   38.555  154.914   36.424 -33.84827 53.03953 
1 1 1   14   35    2 o  103.083   31.821   8.6690   5.5243   11.642   7.9546   5.8992   7.6778  118.816   38.386   96.840   37.069 21.97543 53.36320 
1 1 1   14   35    3 o  266.726   16.122   55.455   6.5509   52.084   9.2414   58.860   9.2876  255.694   23.890  272.541   22.464 -16.84743 32.79255 
1 1 1   14   35    4 o  343.020   13.777   91.041   7.2334   88.045   10.283   93.975   10.177  334.692   20.166  346.199   19.282 -11.50784 27.90134 
1 1 1   14   35    5 o  139.720   23.969   15.831   4.9415   17.967   6.3101   12.442   7.9462  147.383   29.004  121.961   38.250 25.42302 48.00315 
1 1 1   14   35    6 o  485.168   10.247  181.259   7.6099  188.059   9.6035  169.785   12.475  493.366   12.717  466.841   17.459 26.52576 21.59947 
1 1 1   14   35    7 o  158.858   21.418   20.164   5.0752   18.730   6.4604   22.475   8.2022  150.463   29.104  163.289   33.926 -12.82564 44.69894 
1 1 1   14   35    8 o  218.170   16.217   37.196   5.3768   34.596   6.6853   41.957   9.0480  208.830   21.209  228.097   26.404 -19.26697 33.86737 
1 1 1   14   35    9 o  211.726   16.758   35.097   5.3865   34.702   6.7465   35.792   8.9461  209.064   21.384  209.469   28.654 -0.4057770 35.75335 
1 1 1   14   35   10 o  106.738   32.366   9.4148   5.7476   11.990   7.9771   6.6342   8.2885  119.912   38.409  100.892   38.540 19.02003 54.41143 
1 1 1   14   35   11 o  326.269   21.853   84.234   10.850   0.0000   0.0000   84.234   10.850  ?   ?   326.269   21.853 0.000000 21.85282 
1 1 1   14   35   12 o  367.059   21.119  106.351   11.815   0.0000   0.0000  106.351   11.815  ?   ?   367.059   21.119 0.000000 21.11922 
1 1 1   14   35   13 o  196.488   25.758   31.262   7.5600   24.028   11.338   37.053   10.144  164.126   44.163  211.031   32.444 -46.90460 54.79956 
1 1 1   14   35   14 o  530.384   11.015  217.009   8.9424  197.923   10.658  262.395   16.435  505.393   13.778  579.019   18.545 -73.62589 23.10259 
1 1 1   14   35   15 o  144.030   44.118   18.353   10.642   0.0000   0.0000   18.353   10.642  ?   ?   144.030   44.118 0.000000 44.11829 
1 1 1   14   35   16 o  201.527   19.644   32.179   5.9825   34.664   7.1700   26.484   10.853  208.003   22.900  173.068   41.506 34.93491 47.40451 
1 1 1   14   35   17 o  189.763   20.994   28.719   5.9957   22.697   7.0582   44.329   11.363  165.421   28.930  230.139   33.219 -64.71864 44.05061 
1 1 1   14   35   18 o  315.001   14.245   77.044   6.8680   75.979   8.0710   79.839   13.076  311.440   16.995  313.578   27.521 -2.137268 32.34554 
1 1 1   14   35   19 o  252.136   17.296   49.938   6.6347   50.656   7.9157   48.244   12.165  252.585   20.655  239.241   34.192 13.34325 39.94641 
1 1 1   14   35   20 o  251.577   17.340   49.754   6.6365   51.834   7.8078   44.338   12.597  255.656   20.115  226.816   37.602 28.83978 42.64430 
1 1 1   14   35   21 o   79.191   31.865   2.9967   5.9231  -0.0993   6.8890   11.774   11.599   74.468   32.386  122.101   45.831 -47.63376 56.11876 
1 1 1   14   35   22 o  148.258   32.513   18.848   7.1749   18.848   7.1749   0.0000   0.0000  148.258   32.513  ?   ?  0.000000 32.51286 
1 1 1   14   35   23 o  261.975   17.544   54.105   6.9943   53.176   8.1144   56.790   13.796  258.242   20.703  257.047   36.057 1.195251 41.57759 
1 1 1   14   35   24 o  121.413   47.801   11.125   13.046   0.0000   0.0000   11.125   13.046  ?   ?   121.413   47.801 0.000000 47.80085 
1 1 1   14   35   25 o  178.928   26.229   26.486   6.9702   27.615   8.0100   22.964   14.146  180.790   29.997  153.553   51.277 27.23784 59.40701 
1 1 1   14   35   26 o  312.556   16.520   76.931   7.8752   84.509   9.2718   57.307   14.921  326.389   18.636  253.251   39.806 73.13815 43.95221 
1 1 1   14   35   27 o  238.511   19.951   45.580   7.2168   48.251   8.4700   38.503   13.786  243.703   22.978  200.997   45.827 42.70596 51.26540 
1 1 1   14   35   28 o   84.926   33.994   4.1571   6.7025   7.0517   7.7821  -4.1590   13.191   97.756   37.344   90.264   41.524 7.491631 55.84578 
1 1 1   14   35   29 o   62.705   29.162  -4.5910   6.7721  -0.0698   7.8763 -17.4114   13.263   77.644   34.176   74.650   36.326 2.994019 49.87498 
1 1 1   14   35   30 o   71.605   31.368  -0.0279   6.5667   1.4249   10.345  -1.0083   8.4983   89.829   39.362   77.974   34.840 11.85551 52.56574 
1 1 1   14   35   31 o  153.585   36.995   21.773   8.5935   0.0000   0.0000   21.773   8.5935  ?   ?   153.585   36.995 0.000000 36.99483 
1 1 1   14   35   32 o  117.947   35.994   12.860   7.0917   12.197   14.205   13.080   8.1846  118.942   48.793  118.142   38.983 0.7993317 62.45356 
1 1 1   14   35   33 f  134.577   30.606   16.210   6.1620   32.300   9.1923   3.0794   8.3040  189.612   32.864   85.201   36.280 104.4109 48.95157 
1 1 1   14   35   34 o   74.183   31.097   2.3445   5.9451   3.0827   8.9251   1.7556   7.9710   86.504   37.240   80.247   34.868 6.256996 51.01580 
1 1 1   14   35   35 o  175.561   22.935   25.940   6.0157   32.556   9.1262   20.856   7.9997  188.797   32.770  147.874   35.740 40.92328 48.48922 
1 1 1   14   35   36 o   67.346   29.386   0.6045   5.7126   4.1419   8.5797  -2.2128   7.6567   86.934   36.944   69.534   31.857 17.40005 48.78272 
1 1 1   14   36    0 o  396.615   18.539  122.445   11.198  122.445   11.198  122.445   11.198  396.615   18.539  396.615   18.539 0.000000 0.000000 
1 1 1   14   36    1 o  343.828   13.976   91.571   7.3550   94.492   10.522   88.780   10.285  346.607   19.918  335.851   20.099 10.75620 28.29618 
1 1 1   14   36    2 o  393.202   13.092  119.586   7.8796  128.374   11.393  111.527   10.910  405.330   18.363  377.579   18.877 27.75116 26.33562 
1 1 1   14   36    3 o  182.224   21.063   26.431   5.7666   22.701   7.8817   30.729   8.4592  164.478   32.460  193.343   29.521 -28.86536 43.87589 
1 1 1   14   36    4 o  246.896   14.412   47.414   5.4226   47.743   6.8046   46.841   8.9761  246.602   18.155  241.744   24.601 4.857819 30.57492 
1 1 1   14   36    5 o  277.846   14.061   59.966   5.9602   57.368   7.4083   64.733   10.036  270.474   17.997  285.181   23.192 -14.70679 29.35568 
1 1 1   14   36    6 o  274.612   13.989   58.579   5.8603   58.740   7.1857   58.258   10.127  273.956   17.224  269.660   24.814 4.295715 30.20587 
1 1 1   14   36    7 f   93.914   30.091   7.0737   4.8959   8.3013   6.0649   4.7773   8.2949  101.743   33.557   94.870   37.872 6.872887 50.60014 
1 1 1   14   36    8 o  382.627   11.633  113.029   6.8132  118.956   8.5731  102.869   11.225  391.659   14.301  361.254   20.384 30.40524 24.89996 
1 1 1   14   36    9 o   90.920   30.744   6.4085   5.0857  -0.8753   6.3113   19.896   8.5883   69.876   30.678  151.687   37.260 -81.81165 48.26429 
1 1 1   14   36   10 o  417.250   11.438  134.398   7.3046  129.753   8.9419  143.715   12.665  408.992   14.284  428.060   19.329 -19.06824 24.03438 
1 1 1   14   36   11 f  280.714   19.465   62.116   8.3120   66.851   12.533   58.399   11.106  286.347   28.994  268.347   27.425 18.00076 39.90947 
1 1 1   14   36   12 o  368.514   22.959  108.045   12.886   0.0000   0.0000  108.045   12.886  ?   ?   368.514   22.959 0.000000 22.95919 
1 1 1   14   36   13 o  400.120   21.704  126.868   13.242   0.0000   0.0000  126.868   13.242  ?   ?   400.120   21.704 0.000000 21.70381 
1 1 1   14   36   14 o  234.045   17.016   42.991   6.0539   39.073   7.1149   53.270   11.523  221.524   21.244  254.320   30.192 -32.79564 36.91732 
1 1 1   14   36   15 o  245.917   16.814   47.431   6.2911   51.211   7.5138   38.569   11.505  254.557   19.431  212.184   36.757 42.37363 41.57712 
1 1 1   14   36   16 o  276.633   15.530   59.784   6.5492   52.193   7.7132   79.396   12.398  256.779   19.777  313.413   26.082 -56.63373 32.73208 
1 1 1   14   36   17 o  236.195   18.296   44.019   6.5629   43.545   7.7319   45.242   12.413  233.415   21.898  229.820   36.509 3.594757 42.57226 
1 1 1   14   36   18 o  119.206   31.702   12.142   5.8846   13.406   6.9573   8.9636   11.031  124.466   35.036  113.214   44.136 11.25294 56.35132 
1 1 1   14   36   19 o  331.520   16.995   86.278   8.5947   86.278   8.5947   0.0000   0.0000  331.520   16.995  ?   ?  0.000000 16.99475 
1 1 1   14   36   20 o   79.700   33.617   1.6800   7.0178   1.6800   7.0178   0.0000   0.0000   79.700   33.617  ?   ?  0.000000 33.61665 
1 1 1   14   36   21 o  538.233   11.824  224.391   9.7408  215.030   11.396  249.783   18.769  525.520   14.167  559.789   21.905 -34.26819 26.08732 
1 1 1   14   36   22 o  166.976   27.127   23.210   6.6950   31.101   7.8544   2.2409   12.803  193.710   27.244  101.231   44.088 92.47929 51.82608 
1 1 1   14   36   23 o  278.793   17.088   61.326   7.2568   58.238   8.4058   70.361   14.379  269.889   20.501  287.275   33.321 -17.38577 39.12249 
1 1 1   14   36   24 o  274.940   17.975   59.925   7.5228   57.158   8.8712   67.011   14.194  266.240   21.965  279.127   33.920 -12.88718 40.41101 
1 1 1   14   36   25 o  154.572   30.354   20.546   6.9253   26.148   8.0650   4.8169   13.513  174.239   31.395  106.593   45.856 67.64607 55.57370 
1 1 1   14   36   26 o  172.219   33.399   26.007   8.4864   25.778   10.825   26.371   13.671  165.163   42.555  161.471   50.093 3.692398 65.72834 
1 1 1   14   36   27 o  117.430   39.401   12.402   8.3528   20.800   10.521  -1.9134   13.737  147.069   43.611   94.850   43.155 52.21857 61.35342 
1 1 1   14   36   28 f  138.007   37.748   17.611   8.2039   12.734   10.384   25.712   13.383  119.028   43.603  158.062   49.650 -39.03458 66.07855 
1 1 1   14   36   29 o   79.421   33.516   2.2950   6.9815   6.3107   8.2625  -7.7288   13.054   95.346   37.881   83.681   39.419 11.66458 54.66972 
1 1 1   14   36   30 o   71.166   33.211  -5.2190   8.9047 -23.4349   12.663   12.602   12.525   66.342   32.899  118.333   46.757 -51.99138 57.17157 
1 1 1   14   36   31 o   79.790   32.138   3.8098   6.0318   5.6609   8.6790   2.0804   8.3889   93.172   38.171   83.075   35.933 10.09660 52.42300 
1 1 1   14   36   32 o  159.063   35.028   23.566   8.2975   0.0000   0.0000   23.566   8.2975  ?   ?   159.063   35.028 0.000000 35.02782 
1 1 1   14   36   33 o  102.318   32.973   9.5929   5.8720  -0.4668   8.8543   17.491   7.8455   78.181   35.197  134.332   36.985 -56.15128 51.05624 
1 1 1   14   36   34 o  236.627   26.523   48.361   9.4410   48.361   9.4410   0.0000   0.0000  236.627   26.523  ?   ?  0.000000 26.52305 
1 1 1   14   37    0 o  192.374   34.374   31.811   9.1592   31.811   9.1592   31.811   9.1592  192.374   34.374  192.374   34.374 0.000000 0.000000 
1 1 1   14   37    1 o  188.176   22.736   28.397   6.4157   32.235   9.0432   24.508   9.1036  197.062   31.006  168.965   36.284 28.09708 47.72672 
1 1 1   14   37    2 o  245.259   18.326   47.316   6.8300   43.058   9.3250   52.244   10.032  230.310   26.963  254.355   26.139 -24.04480 37.55352 
1 1 1   14   37    3 o  197.193   21.560   31.017   6.4014   37.816   9.1531   24.508   8.9561  214.917   28.529  169.195   35.705 45.72226 45.70317 
1 1 1   14   37    4 o   61.201   27.285  -1.5821   5.1813   0.2765   6.3540  -5.2705   8.9511   73.150   31.456   74.196   34.159 -1.045952 46.43639 
1 1 1   14   37    5 o  126.091   28.175   13.277   5.3008   16.233   6.5231   7.5302   9.0955  138.574   31.472  105.444   40.350 33.12977 51.17240 
1 1 1   14   37    6 o   79.056   30.370   3.7325   5.1651   1.1218   6.4980   8.2126   8.5123   76.277   32.270  106.174   39.377 -29.89729 50.91064 
1 1 1   14   37    7 o  351.814   12.485   95.747   6.7232   96.279   8.3626   94.775   11.305  351.764   15.532  345.834   21.463 5.929169 26.49347 
1 1 1   14   37    8 o  167.760   21.338   22.541   5.3552   20.835   6.4713   26.249   9.5387  158.875   27.614  174.427   36.881 -15.55202 46.07253 
1 1 1   14   37    9 o   88.599   30.942   5.9220   5.1638   4.5053   6.3797   8.6135   8.7933   86.752   33.636  107.995   40.028 -21.24258 52.28375 
1 1 1   14   37   10 o  256.647   15.226   51.414   5.9543   55.565   7.3873   43.717   10.060  265.717   18.274  230.623   29.150 35.09364 34.40435 
1 1 1   14   37   11 o  120.904   36.066   12.527   7.1799   8.7660   10.640   15.670   9.7286  112.392   43.477  133.715   42.373 -21.32310 60.71059 
1 1 1   14   37   12 o  229.203   22.664   42.091   7.8470   47.886   11.412   36.893   10.808  239.645   31.903  208.103   35.184 31.54256 47.49469 
1 1 1   14   37   13 o  251.812   29.208   52.206   11.049   0.0000   0.0000   52.206   11.049  ?   ?   251.812   29.208 0.000000 29.20787 
1 1 1   14   37   14 o  236.304   31.032   46.512   10.953   0.0000   0.0000   46.512   10.953  ?   ?   236.304   31.032 0.000000 31.03245 
1 1 1   14   37   15 o  407.936   14.941  129.616   9.3291  125.927   12.265  134.680   14.371  398.793   20.158  410.426   22.968 -11.63364 30.55955 
1 1 1   14   37   16 o  218.604   19.359   37.955   6.4104   30.452   7.4992   58.314   12.353  192.750   26.089  264.419   31.118 -71.66907 40.60730 
1 1 1   14   37   17 o   98.752   35.309   7.5534   6.7564   7.5534   6.7564   0.0000   0.0000   98.752   35.309  ?   ?  0.000000 35.30914 
1 1 1   14   37   18 o  269.110   19.634   57.555   8.0316   57.555   8.0316   0.0000   0.0000  269.110   19.634  ?   ?  0.000000 19.63417 
1 1 1   14   37   19 o  217.092   20.126   37.665   6.6116   34.943   7.7046   45.270   12.878  206.781   24.840  226.576   38.511 -19.79477 45.82717 
1 1 1   14   37   20 o  166.702   27.348   23.214   6.7360   25.288   7.9449   17.910   12.703  172.029   31.327  138.735   48.527 33.29419 57.76013 
1 1 1   14   37   21 o  174.458   26.174   25.275   6.7735   26.631   7.9088   21.543   13.121  176.933   30.293  148.921   49.370 28.01117 57.92259 
1 1 1   14   37   22 o  378.148   27.947  118.586   16.061   0.0000   0.0000  118.586   16.061  ?   ?   378.148   27.947 0.000000 27.94711 
1 1 1   14   37   23 o   84.002   35.895   1.8968   8.1809   5.0408   10.778  -2.3774   12.566   99.997   41.891   91.128   41.389 8.868622 58.88892 
1 1 1   14   37   24 o  144.387   37.084   18.972   8.2387   4.5251   10.372   43.670   13.561   97.363   40.957  216.544   42.433 -119.1804 58.97482 
1 1 1   14   37   25 o  141.345   33.190   17.749   7.0581   19.699   8.2985   12.649   13.420  146.871   36.947  122.126   48.354 24.74496 60.85394 
1 1 1   14   37   26 o  121.144   34.687   13.261   6.7596   16.768   7.8992   3.6696   13.064  134.856   37.104  101.668   44.399 33.18782 57.86160 
1 1 1   14   37   27 f  139.549   31.713   17.318   6.6200   18.049   7.8874   15.576   12.177  139.639   36.496  127.008   47.098 12.63081 59.58360 
1 1 1   14   37   28 o  129.349   39.735   16.072   8.6254   18.786   12.281   13.430   12.117  135.090   47.679  119.970   46.399 15.12018 66.52934 
1 1 1   14   37   29 o  106.968   39.616   10.213   8.6097   18.258   13.005   3.9359   11.487  131.842   48.717   95.967   41.778 35.87507 64.17757 
1 1 1   14   37   30 o  222.207   21.242   40.671   7.1367   49.525   9.1078   26.588   11.487  242.262   24.917  159.665   45.045 82.59738 51.47766 
1 1 1   14   37   31 o   75.434   32.042   2.1716   6.4486   8.6354   8.3123  -7.5989   10.220  100.163   38.516   71.830   34.143 28.33252 51.47063 
1 1 1   14   37   32 o  362.764   19.205  107.212   10.626  107.212   10.626   0.0000   0.0000  362.764   19.205  ?   ?  0.000000 19.20477 
1 1 1   14   38    0 o   69.815   42.555   4.0865   8.5695   4.0865   8.5695   4.0865   8.5695   69.815   42.555   69.815   42.555 0.000000 0.000000 
1 1 1   14   38    1 o  101.963   33.366   8.4744   6.0004   8.6775   8.6379   8.2850   8.3416  107.670   39.719  105.685   39.023 1.984680 55.68133 
1 1 1   14   38    2 o  171.121   25.188   23.871   6.4000   30.588   8.7595   16.179   9.3738  191.401   30.956  135.570   41.384 55.83083 51.68122 
1 1 1   14   38    3 o  216.197   21.577   37.319   7.0450   46.305   9.8137   27.764   10.120  238.187   27.418  178.441   38.203 59.74622 47.02400 
1 1 1   14   38    4 o  310.863   13.520   74.956   6.4331   74.234   7.9196   76.356   11.030  307.790   16.875  308.836   23.509 -1.046143 28.93878 
1 1 1   14   38    5 o   88.259   31.239   5.8167   5.2758   5.1160   6.5412   7.1208   8.9244   89.357   34.213  103.198   39.846 -13.84085 52.51897 
1 1 1   14   38    6 o  130.774   28.065   14.323   5.4496   10.835   6.5269   22.353   9.9024  113.057   34.537  158.442   40.636 -45.38454 53.33030 
1 1 1   14   38    7 o  207.582   18.503   34.080   5.8173   32.734   6.9590   37.204   10.600  201.675   22.953  209.333   34.268 -7.657745 41.24458 
1 1 1   14   38    8 o  218.154   17.346   37.482   5.7443   43.191   7.0547   26.249   9.8954  233.244   19.953  172.915   38.389 60.32860 43.26428 
1 1 1   14   38    9 o  259.705   14.991   52.687   5.9338   57.458   7.2265   42.813   10.396  270.241   17.566  226.714   30.753 43.52664 35.41618 
1 1 1   14   38   10 o  242.887   16.415   46.307   6.0667   48.355   7.3418   41.900   10.772  246.936   19.585  223.112   32.497 23.82407 37.94284 
1 1 1   14   38   11 o  118.553   30.581   11.986   5.5857   10.765   6.6940   14.786   10.136  112.456   35.080  129.753   43.404 -17.29639 55.80801 
1 1 1   14   38   12 o  124.278   35.890   13.463   7.2090   15.501   10.554   11.680   9.8704  132.151   44.290  118.862   42.658 13.28880 61.49242 
1 1 1   14   38   13 o  238.726   22.697   45.867   8.1936   47.971   11.463   43.670   11.716  238.528   32.223  225.588   35.069 12.93988 47.62506 
1 1 1   14   38   14 o  351.092   25.408  100.045   13.562  100.045   13.562   0.0000   0.0000  351.092   25.408  ?   ?  0.000000 25.40779 
1 1 1   14   38   16 o  456.679   15.509  163.142   10.841  169.314   14.083  154.162   16.985  462.007   19.914  435.262   25.608 26.74475 32.43991 
1 1 1   14   38   17 o   71.660   30.937   0.3891   6.1948  -6.0863   7.1418   20.066   12.449   62.489   29.348  145.111   48.088 -82.62248 56.33636 
1 1 1   14   38   18 f  406.700   16.221  129.867   10.098  114.915   13.071  151.997   15.902  377.431   22.732  432.890   24.096 -55.45880 33.12580 
1 1 1   14   38   19 o  181.147   31.311   28.149   8.3675   36.479   10.898   16.188   13.060  203.171   36.381  132.723   48.858 70.44734 60.91541 
1 1 1   14   38   20 o  246.041   24.253   49.546   9.0148   65.279   12.190   30.559   13.392  279.008   28.967  176.034   48.261 102.9741 56.28729 
1 1 1   14   38   21 o  104.862   38.690   8.8978   8.1968   8.7725   10.667   9.0784   12.808  108.922   43.116  113.606   46.436 -4.684517 63.36587 
1 1 1   14   38   22 o   72.764   31.620   0.3591   6.5565  -3.0870   7.7305   9.1914   12.376   70.535   32.201  112.614   45.794 -42.07838 55.98182 
1 1 1   14   38   23 o  126.052   33.129   14.197   6.4756   16.466   7.6824   8.6285   12.036  134.152   36.460  110.106   45.011 24.04652 57.92474 
1 1 1   14   38   24 o  349.839   14.809   96.201   7.9296   93.911   9.5543  101.269   14.215  342.876   18.271  347.777   26.914 -4.900696 32.52956 
1 1 1   14   38   25 o   54.981   26.352  -7.4538   6.3607 -14.7916   7.6535   8.9325   11.437   52.697   26.031  108.246   44.021 -55.54880 51.14171 
1 1 1   14   38   26 o  286.809   22.064   67.516   9.6118   61.326   14.091   72.902   13.145  258.916   36.574  290.030   30.046 -31.11371 47.33305 
1 1 1   14   38   27 o  179.958   32.277   29.044   8.5641   44.187   13.272   18.240   11.210  212.474   42.297  132.835   45.635 79.63916 62.22219 
1 1 1   14   38   28 o   94.756   34.477   7.6630   6.4759   2.7251   7.9735   17.233   11.100   82.733   35.397  128.761   45.341 -46.02792 57.52177 
1 1 1   14   38   29 o  120.168   34.082   13.586   6.5580   10.246   8.1530   19.708   11.038  105.449   38.636  135.919   45.292 -30.46976 59.53199 
1 1 1   14   38   30 o  110.843   34.358   11.604   6.4327   12.925   8.1697   9.4492   10.435  114.742   38.965  104.566   42.218 10.17587 57.45056 
1 1 1   14   39    0 o  220.440   31.504   40.733   10.001   40.733   10.001   40.733   10.001  220.440   31.504  220.440   31.504 0.000000 0.000000 
1 1 1   14   39    1 o  327.560   15.693   83.762   7.8678   95.622   11.337   72.742   10.928  346.427   21.486  300.532   23.956 45.89499 32.17935 
1 1 1   14   39    2 f  284.264   18.036   63.719   7.8067   70.248   11.103   57.335   10.978  294.737   24.844  264.487   27.521 30.24942 37.07613 
1 1 1   14   39    3 o   99.929   34.784   7.9299   6.5230   8.2154   8.8389   7.5886   9.6662  105.822   39.947  105.833   41.299 -0.1145172E-01 57.45819 
1 1 1   14   39    4 o  288.265   14.412   64.688   6.3589   59.237   7.7558   75.867   11.107  273.735   18.621  306.931   23.829 -33.19592 30.24218 
1 1 1   14   39    5 o  116.811   30.105   11.637   5.4165   9.9124   6.7215   14.833   9.1477  108.555   35.304  129.403   41.098 -20.84812 54.17909 
1 1 1   14   39    6 o  329.834   13.312   84.502   6.7208   85.449   8.2927   82.690   11.473  330.422   16.397  320.560   23.547 9.861938 28.69355 
1 1 1   14   39    7 o   56.013   26.094  -4.3567   5.4590  -5.9035   6.4574  -0.4821   10.220   59.183   27.831   87.722   38.755 -28.53943 47.71279 
1 1 1   14   39    8 o   71.366   29.726   1.5539   5.3828  -3.4782   6.4174   13.496   9.8862   63.679   29.172  124.539   42.852 -60.85971 51.83869 
1 1 1   14   39    9 o  122.049   36.246   13.049   7.2637   9.9292   10.479   15.934   10.078  113.836   43.370  132.943   43.228 -19.10761 61.23422 
1 1 1   14   39   10 o  298.936   19.189   70.904   8.7337   58.512   12.706   82.003   12.025  263.141   32.220  317.804   24.919 -54.66364 40.73196 
1 1 1   14   39   11 o  126.563   35.981   14.152   7.3002   14.152   7.3002   0.0000   0.0000  126.563   35.981  ?   ?  0.000000 35.98140 
1 1 1   14   39   14 f  271.783   31.678   62.653   12.931   0.0000   0.0000   62.653   12.931  ?   ?   271.783   31.678 0.000000 31.67775 
1 1 1   14   39   15 o   98.151   42.287   3.0484   11.526   0.0000   0.0000   3.0484   11.526  ?   ?    98.151   42.287 0.000000 42.28723 
1 1 1   14   39   16 o  202.008   43.962   38.296   13.207   0.0000   0.0000   38.296   13.207  ?   ?   202.008   43.962 0.000000 43.96191 
1 1 1   14   39   17 o   92.102   36.813   5.2090   7.8475   16.226   10.365  -9.5904   12.013  131.874   43.886   78.920   37.368 52.95426 57.64013 
1 1 1   14   39   18 o   79.700   33.137   2.5649   6.6720  -7.8974   7.7917   31.322   12.918   62.619   29.779  178.997   46.669 -116.3785 55.36006 
1 1 1   14   39   19 o  197.261   22.894   31.868   6.7838   41.760   8.0287   7.1801   12.683  225.662   23.593  108.563   45.459 117.0987 51.21694 
1 1 1   14   39   20 o  174.835   26.283   25.696   6.8159   31.045   8.1374   13.120   12.477  190.880   28.743  121.796   47.090 69.08378 55.16890 
1 1 1   14   39   21 o   94.484   34.089   7.2568   6.3116   10.547   7.5739  -0.2212   11.418  109.049   37.508   89.628   40.191 19.42056 54.97433 
1 1 1   14   39   22 o  121.132   32.862   13.251   6.2477   8.9714   7.4538   23.360   11.456  102.465   37.033  151.907   45.613 -49.44152 58.75321 
1 1 1   14   39   23 f   63.054   28.834  -2.6351   6.2319  -0.6915   7.5299  -6.8610   11.103   73.653   32.860   77.322   36.402 -3.668907 49.03953 
1 1 1   14   39   24 o  147.865   36.954   20.637   8.3403   4.1420   12.246   34.908   11.390   98.288   42.953  190.576   40.307 -92.28796 58.90332 
1 1 1   14   39   25 o   52.571   25.995 -14.7809   7.6988 -13.9762   11.741 -15.3879   10.197   70.643   34.330   63.258   31.010 7.385281 46.26155 
1 1 1   14   39   26 o   80.440   32.889   3.7587   6.4274   3.8545   7.9809   3.5821   10.842   85.593   35.962   92.735   40.474 -7.141884 54.14272 
1 1 1   14   39   27 o   85.778   33.528   5.4495   6.3788   6.2964   7.8440   3.7957   10.961   91.928   36.783   92.987   40.636 -1.058647 54.81136 
1 1 1   14   40    0 o  277.318   26.287   62.239   10.928   62.239   10.928   62.239   10.928  277.318   26.287  277.318   26.287 0.000000 0.000000 
1 1 1   14   40    1 o  344.682   15.759   93.022   8.3141   91.556   11.749   94.492   11.767  337.091   22.907  342.735   22.556 -5.643494 32.14825 
1 1 1   14   40    2 o  359.440   15.085  100.974   8.2992  109.269   11.817   92.902   11.658  369.836   20.962  339.814   22.541 30.02249 30.78194 
1 1 1   14   40    3 o  342.710   15.729   91.969   8.2508   91.085   11.790   92.817   11.550  336.046   23.062  339.775   22.334 -3.729004 32.10338 
1 1 1   14   40    4 o  101.566   34.976   8.4651   6.5869   6.2568   9.7424   10.325   8.9399  101.243   40.822  111.983   40.544 -10.73969 57.53462 
1 1 1   14   40    5 o  176.273   27.667   25.969   7.2190   32.799   9.9277   18.306   10.516  194.241   34.663  140.348   44.001 53.89258 56.01424 
1 1 1   14   40    6 o  316.621   16.920   79.024   8.1703   86.427   11.677   71.923   11.436  326.829   23.499  296.645   25.433 30.18460 34.62653 
1 1 1   14   40    8 o  145.544   47.018   20.226   11.935   20.226   11.935   0.0000   0.0000  145.544   47.018  ?   ?  0.000000 47.01849 
1 1 1   14   40    9 o  159.653   30.575   21.838   7.1994   21.838   7.1994   0.0000   0.0000  159.653   30.575  ?   ?  0.000000 30.57463 
1 1 1   14   40   10 o  133.773   29.383   15.356   5.8519   11.872   6.8029   25.270   11.475  116.110   35.213  162.965   44.673 -46.85425 56.88257 
1 1 1   14   40   11 o  299.930   14.980   70.419   6.8769   68.009   8.1668   76.290   12.749  292.626   18.326  303.065   27.794 -10.43890 33.29169 
1 1 1   14   40   12 o  222.557   24.680   40.683   8.2658   23.698   11.135   61.533   12.337  157.578   44.312  269.733   30.412 -112.1548 53.74409 
1 1 1   14   40   13 o  116.409   38.396   12.035   7.9402   15.049   10.820   8.5184   11.688  127.870   44.783  110.377   44.639 17.49318 63.23120 
1 1 1   14   40   14 f   65.635   30.822  -6.2425   7.8735  -9.4963   10.412  -1.8974   12.032   72.484   34.457   89.861   40.689 -17.37605 53.31858 
1 1 1   14   40   15 o  189.443   29.777   30.682   8.3494   32.075   11.000   28.790   12.824  186.537   39.744  170.142   47.452 16.39496 61.89756 
1 1 1   14   40   16 o  192.132   29.961   31.689   8.5237   25.402   11.458   39.482   12.755  161.031   44.833  204.835   42.090 -43.80412 61.49446 
1 1 1   14   40   17 o  185.210   23.431   28.342   6.4938   31.457   7.6428   20.254   12.315  193.338   26.525  141.710   47.840 51.62782 54.70194 
1 1 1   14   40   18 o  104.370   38.133   9.2642   7.9344   19.538   11.117  -1.4023   11.327  139.885   45.399   87.069   39.447 52.81610 60.14283 
1 1 1   14   40   19 o  104.043   38.046   9.2948   7.9002   17.402   10.925   0.4100   11.437  132.244   45.059   90.184   40.348 42.06068 60.48335 
1 1 1   14   40   20 o  119.968   34.057   13.202   6.5452   9.4749   7.9813   20.856   11.438  104.388   38.230  142.383   46.033 -37.99445 59.83737 
1 1 1   14   40   21 o  107.237   34.539   10.465   6.4439   13.097   7.9256   5.3307   11.068  117.648   38.339   98.087   41.829 19.56131 56.74125 
1 1 1   14   40   22 o   86.851   36.112   4.2106   7.9244   0.8114   11.642   7.1453   10.817   90.224   40.512  101.200   42.145 -10.97599 58.45839 
1 1 1   14   40   23 o  154.829   36.178   22.639   8.4192   43.067   12.537   5.8578   11.363  210.924   40.301   98.875   42.279 112.0490 58.40966 
1 1 1   14   40   24 o  213.106   21.308   37.537   6.8572   35.922   8.5016   40.545   11.600  203.133   28.095  206.188   38.162 -3.054520 47.38884 
1 1 1   14   41    0 o   86.676   47.093   9.3730   8.8059   9.3730   8.8059   9.3730   8.8059   86.676   47.093   86.676   47.093 0.000000 0.000000 
1 1 1   14   41    1 o   73.853   31.417   1.2102   6.2160   0.5913   8.8505   1.8127   8.7322   83.621   36.530   86.009   36.927 -2.387390 51.94323 
1 1 1   14   41    2 o  324.990   23.023   85.589   11.378   85.589   11.378   0.0000   0.0000  324.990   23.023  ?   ?  0.000000 23.02301 
1 1 1   14   41    3 o  289.775   18.919   66.889   8.3452   66.889   8.3452   0.0000   0.0000  289.775   18.919  ?   ?  0.000000 18.91900 
1 1 1   14   41    4 o  228.711   24.010   42.805   8.2798   42.805   8.2798   0.0000   0.0000  228.711   24.010  ?   ?  0.000000 24.01012 
1 1 1   14   41    5 o  136.354   46.831   17.684   11.805   17.684   11.805   0.0000   0.0000  136.354   46.831  ?   ?  0.000000 46.83088 
1 1 1   14   41    6 o   49.090   24.479 -17.6794   7.4145 -20.1973   10.476 -15.1527   10.495   61.363   30.339   66.285   32.268 -4.922039 44.29090 
1 1 1   14   41    7 o   68.217   29.608   0.1591   5.7344  -0.5747   7.0327   1.6150   9.9058   72.821   32.161   89.413   38.860 -16.59285 50.44272 
1 1 1   14   41    8 o  225.367   18.711   40.598   6.3962   39.650   7.5868   42.926   11.893  220.466   22.813  219.521   36.691 0.9447937 43.20459 
1 1 1   14   41    9 o  198.404   21.694   32.017   6.4808   32.606   7.7165   30.606   11.940  197.701   26.141  178.687   43.957 19.01466 51.14254 
1 1 1   14   41   10 o  203.502   20.279   33.459   6.2324   29.635   7.3265   43.472   11.855  188.210   26.138  220.584   36.380 -32.37430 44.79655 
1 1 1   14   41   11 o  247.016   17.834   48.659   6.6974   48.374   7.8931   49.392   12.656  244.199   21.331  234.979   36.364 9.220215 42.15859 
1 1 1   14   41   12 o  141.490   29.496   17.401   6.1808   20.558   7.3079   9.4681   11.585  152.401   32.330  110.937   44.590 41.46400 55.07734 
1 1 1   14   41   13 o  194.105   30.227   32.583   8.6882   22.324   12.105   43.482   12.477  148.127   47.301  217.084   38.983 -68.95712 61.29527 
1 1 1   14   41   14 o   74.247   33.640  -2.0396   8.2395   0.5286   11.290  -4.9665   12.052   90.239   40.250   83.813   38.953 6.425247 56.01257 
1 1 1   14   41   15 o  126.776   37.740   15.102   7.8678   25.355   11.064   4.6117   11.191  159.568   43.915   97.730   41.878 61.83715 60.68187 
1 1 1   14   41   16 f   75.208   33.253  -0.0380   7.5388  -0.3069   10.410   0.2585   10.933   85.344   38.315   88.064   39.420 -2.720085 54.97247 
1 1 1   14   41   17 o  160.033   33.198   23.162   7.8654   23.698   11.029   22.607   11.220  152.590   44.487  148.307   45.277 4.282761 63.47537 
1 1 1   14   41   18 o  236.723   19.240   45.425   6.9110   52.057   8.4913   32.414   11.894  251.143   22.322  179.793   43.658 71.35060 49.03382 
1 1 1   14   41   19 o  136.968   37.335   17.962   8.0417   4.9100   11.305   31.331   11.442   97.138   41.865  177.074   42.709 -79.93570 59.80576 
1 1 1   14   41   20 o  119.212   46.115   14.004   11.971   0.0000   0.0000   14.004   11.971  ?   ?   119.212   46.115 0.000000 46.11533 
1 1 1   14   41   21 o  254.302   19.451   52.680   7.5136   49.942   9.3275   57.740   12.680  242.425   25.521  252.052   33.711 -9.626801 42.28162 
1 1 1   14   42    0 f  332.863   22.248   88.403   11.219   88.403   11.219   88.403   11.219  332.863   22.248  332.863   22.248 0.000000 0.000000 
1 1 1   14   42    1 o  170.846   37.965   26.908   9.6703   0.0000   0.0000   26.908   9.6703  ?   ?   170.846   37.965 0.000000 37.96517 
1 1 1   14   42    2 o  108.529   36.781   10.413   7.2795  -3.2818   11.169   20.527   9.5983   83.793   38.422  146.563   41.116 -62.77011 56.27359 
1 1 1   14   42    3 o  101.593   37.376   8.5140   7.6413   10.372   11.973   7.2375   9.9253  113.640   45.454  101.977   41.173 11.66294 61.32915 
1 1 1   14   42    4 o   88.162   35.771   4.5769   7.5315   15.510   11.735  -3.0804   9.8209  127.317   46.397   79.045   36.165 48.27185 58.82734 
1 1 1   14   42    5 o  300.635   18.963   72.495   8.6814   59.632   13.358   81.900   11.422  259.409   34.499  315.512   23.828 -56.10254 41.92783 
1 1 1   14   42    6 o  112.256   37.646   11.394   7.6253   17.346   11.749   7.0625   10.023  132.444   46.646  101.385   41.218 31.05811 62.24757 
1 1 1   14   42    7 f  115.800   37.977   12.315   7.7718   13.280   11.799   11.576   10.329  120.405   45.985  114.371   43.182 6.034378 63.08165 
1 1 1   14   42    8 o  133.785   37.927   16.822   8.1229   5.9820   11.965   26.089   11.063  102.684   43.633  162.597   43.569 -59.91341 61.66108 
1 1 1   14   42    9 o  254.623   22.637   53.279   8.7305   55.161   13.052   51.754   11.745  247.549   35.460  242.584   32.444 4.965500 48.06232 
1 1 1   14   42   10 o   67.862   31.337  -3.7637   7.6144 -11.7362   11.373   2.7134   10.251   72.410   34.844   91.008   39.543 -18.59846 52.70413 
1 1 1   14   42   11 f   67.026   31.147  -4.3973   7.7015 -11.3315   11.158   1.9115   10.643   71.931   34.588   90.312   39.740 -18.38169 52.68410 
1 1 1   14   42   12 f   98.252   37.726   7.7377   7.9677   10.202   11.384   5.3712   11.155  110.487   44.276   98.655   42.030 11.83189 61.04800 
1 1 1   14   42   13 o  241.576   24.772   48.917   9.0302   64.168   13.118   35.181   12.449  268.985   32.523  187.478   44.119 81.50703 54.81040 
1 1 1   14   42   14 f  126.827   37.975   15.416   7.9491   8.5702   10.974   22.974   11.530  105.180   42.986  148.141   46.012 -42.96061 62.96787 
1 1 1   14   42   15 o  292.640   20.319   69.822   9.0451   69.326   13.008   70.286   12.586  280.932   30.753  284.510   29.321 -3.578064 42.49118 
1 1 1   14   42   16 o  156.353   34.105   22.555   7.9321   27.454   11.544   18.174   10.917  162.669   44.896  132.259   45.042 30.41006 63.59615 
1 1 1   14   42   17 o  181.814   30.674   29.415   8.2324   28.734   12.092   30.004   11.239  164.805   46.119  172.345   42.801 -7.540100 62.91946 
1 1 1   14   43    1 o   94.157   39.602   4.9251   9.6948   0.0000   0.0000   4.9251   9.6948  ?   ?    94.157   39.602 0.000000 39.60199 
1 1 1   14   43    2 o   96.677   32.540   8.1283   5.6973   6.2266   7.1070   11.548   9.5303   91.429   35.486  112.501   41.677 -21.07234 54.73807 
1 1 1   14   43    3 o  149.576   28.083   19.434   6.1935   17.795   7.6343   22.588   10.593  138.089   35.816  149.743   43.582 -11.65405 56.41066 
1 1 1   14   43    4 o   47.393   23.218  -9.8282   5.6901  -8.7211   7.3109 -11.5292   9.0621   58.060   27.938   62.860   30.457 -4.800869 41.33017 
1 1 1   14   43    5 o   65.795   29.438  -1.0690   6.0894   6.5290   7.6011 -14.6821   10.174   93.405   36.575   64.147   31.346 29.25819 48.16914 
1 1 1   14   43    6 o   81.734   31.875   4.5862   5.7551   9.3337   7.1862  -3.9049   9.6104  102.730   36.448   75.809   35.076 26.92048 50.58485 
1 1 1   14   43    7 o   84.998   32.638   5.3041   5.9636   10.609   7.2040  -6.2484   10.631  107.713   36.589   76.036   35.741 31.67678 51.14865 
1 1 1   14   43    8 o  199.197   21.539   32.708   6.4626   27.013   7.7800   45.383   11.607  175.114   30.112  222.973   35.176 -47.85910 46.30386 
1 1 1   14   43    9 o  198.841   22.200   32.756   6.6414   34.514   8.2700   29.562   11.145  200.091   27.750  172.185   42.538 27.90576 50.78912 
1 1 1   14   43   10 f  110.811   33.209   11.272   6.0769   9.7612   7.3690   14.484   10.744  104.090   36.911  120.973   44.347 -16.88314 57.69834 
1 1 1   14   43   11 o  193.996   21.744   31.145   6.3456   28.753   7.7455   36.028   11.066  181.368   28.869  194.592   38.516 -13.22374 48.13423 
1 1 1   15    0    2 o  231.004   10.021   41.082   3.5280   41.082   3.5280   41.082   3.5280  231.004   10.021  231.004   10.021 0.000000 0.000000 
1 1 1   15    0    3 o  602.020   10.799  277.736   9.9433  277.736   9.9433  277.736   9.9433  602.020   10.799  602.020   10.799 0.000000 0.000000 
1 1 1   15    0    4 o  919.469   13.665  647.800   19.222  647.800   19.222  647.800   19.222  919.469   13.665  919.469   13.665 0.000000 0.000000 
1 1 1   15    0    5 o   82.078   14.169   5.5971   1.6209   5.5971   1.6209   5.5971   1.6209   82.078   14.169   82.078   14.169 0.000000 0.000000 
1 1 1   15    0    7 o  643.996   7.8728  317.598   7.7577  317.598   7.7577  317.598   7.7577  643.996   7.8728  643.996   7.8728 0.000000 0.000000 
1 1 1   15    0    8 o  286.341   7.1296   62.874   3.1204   62.874   3.1204   62.874   3.1204  286.341   7.1296  286.341   7.1296 0.000000 0.000000 
1 1 1   15    0    9 o  2016.53   18.100  3115.61   55.856  3115.61   55.856  3115.61   55.856  2016.53   18.100  2016.53   18.100 0.000000 0.000000 
1 1 1   15    0   10 o  483.899   7.8475  179.376   5.8090  179.376   5.8090  179.376   5.8090  483.899   7.8475  483.899   7.8475 0.000000 0.000000 
1 1 1   15    0   11 o  475.603   5.2402  173.189   3.8137  173.189   3.8137  173.189   3.8137  475.603   5.2402  475.603   5.2402 0.000000 0.000000 
1 1 1   15    0   12 o  243.053   7.2198   45.337   2.6806   45.337   2.6806   45.337   2.6806  243.053   7.2198  243.053   7.2198 0.000000 0.000000 
1 1 1   15    0   13 o  523.029   5.5364  209.447   4.4311  209.447   4.4311  209.447   4.4311  523.029   5.5364  523.029   5.5364 0.000000 0.000000 
1 1 1   15    0   14 o  614.344   5.8239  288.949   5.4753  288.949   5.4753  288.949   5.4753  614.344   5.8239  614.344   5.8239 0.000000 0.000000 
1 1 1   15    0   15 o  342.057   7.7434   89.697   4.0495   89.697   4.0495   89.697   4.0495  342.057   7.7434  342.057   7.7434 0.000000 0.000000 
1 1 1   15    0   16 o  1136.22   8.1081  988.364   14.099  988.364   14.099  988.364   14.099  1136.22   8.1081  1136.22   8.1081 0.000000 0.000000 
1 1 1   15    0   17 o  542.121   5.9679  225.029   4.9507  225.029   4.9507  225.029   4.9507  542.121   5.9679  542.121   5.9679 0.000000 0.000000 
1 1 1   15    0   18 o  868.869   7.0021  577.965   9.3108  577.965   9.3108  577.965   9.3108  868.869   7.0021  868.869   7.0021 0.000000 0.000000 
1 1 1   15    0   19 o  381.127   6.4477  111.279   3.7589  111.279   3.7589  111.279   3.7589  381.127   6.4477  381.127   6.4477 0.000000 0.000000 
1 1 1   15    0   20 o  637.308   7.3673  311.025   7.1845  311.025   7.1845  311.025   7.1845  637.308   7.3673  637.308   7.3673 0.000000 0.000000 
1 1 1   15    0   21 o  720.456   7.7667  397.468   8.5625  397.468   8.5625  397.468   8.5625  720.456   7.7667  720.456   7.7667 0.000000 0.000000 
1 1 1   15    0   22 o   65.516   27.950   4.6774   2.8552   4.6774   2.8552   4.6774   2.8552   65.516   27.950   65.516   27.950 0.000000 0.000000 
1 1 1   15    0   23 o  853.023   7.3229  557.125   9.5597  557.125   9.5597  557.125   9.5597  853.023   7.3229  853.023   7.3229 0.000000 0.000000 
1 1 1   15    0   24 o  385.211   7.6458  113.726   4.5041  113.726   4.5041  113.726   4.5041  385.211   7.6458  385.211   7.6458 0.000000 0.000000 
1 1 1   15    0   25 o   69.764   30.247   5.3407   3.3356   5.3407   3.3356   5.3407   3.3356   69.764   30.247   69.764   30.247 0.000000 0.000000 
1 1 1   15    0   26 o  428.624   7.7293  140.781   5.0672  140.781   5.0672  140.781   5.0672  428.624   7.7293  428.624   7.7293 0.000000 0.000000 
1 1 1   15    0   27 o  1413.16   11.526  1529.73   24.928  1529.73   24.928  1529.73   24.928  1413.16   11.526  1413.16   11.526 0.000000 0.000000 
1 1 1   15    0   28 o  929.849   9.2013  662.221   13.093  662.221   13.093  662.221   13.093  929.849   9.2013  929.849   9.2013 0.000000 0.000000 
1 1 1   15    0   29 o  172.745   15.960   23.452   4.1372   23.452   4.1372   23.452   4.1372  172.745   15.960  172.745   15.960 0.000000 0.000000 
1 1 1   15    0   30 o  821.859   7.8201  517.296   9.8354  517.296   9.8354  517.296   9.8354  821.859   7.8201  821.859   7.8201 0.000000 0.000000 
1 1 1   15    0   31 o   93.599   30.509   8.5758   3.8696   8.5758   3.8696   8.5758   3.8696   93.599   30.509   93.599   30.509 0.000000 0.000000 
1 1 1   15    0   32 o  305.674   10.393   71.825   4.8498   71.825   4.8498   71.825   4.8498  305.674   10.393  305.674   10.393 0.000000 0.000000 
1 1 1   15    0   33 o  237.202   17.816   43.919   6.3846   43.919   6.3846   43.919   6.3846  237.202   17.816  237.202   17.816 0.000000 0.000000 
1 1 1   15    0   34 o  757.478   7.8680  439.566   9.1201  439.566   9.1201  439.566   9.1201  757.478   7.8680  757.478   7.8680 0.000000 0.000000 
1 1 1   15    0   35 o  237.418   12.323   43.568   4.4507   43.568   4.4507   43.568   4.4507  237.418   12.323  237.418   12.323 0.000000 0.000000 
1 1 1   15    0   36 o   37.149   24.945  -1.5797   4.0059  -1.5797   4.0059  -1.5797   4.0059   37.149   24.945   37.149   24.945 0.000000 0.000000 
1 1 1   15    0   37 o  394.619   9.0516  119.517   5.4608  119.517   5.4608  119.517   5.4608  394.619   9.0516  394.619   9.0516 0.000000 0.000000 
1 1 1   15    0   38 o  227.804   12.984   40.214   4.4936   40.214   4.4936   40.214   4.4936  227.804   12.984  227.804   12.984 0.000000 0.000000 
1 1 1   15    0   39 o  389.705   10.484  116.720   6.2431  116.720   6.2431  116.720   6.2431  389.705   10.484  389.705   10.484 0.000000 0.000000 
1 1 1   15    0   40 o  571.680   11.070  251.033   9.6785  251.033   9.6785  251.033   9.6785  571.680   11.070  571.680   11.070 0.000000 0.000000 
1 1 1   15    0   41 o  422.165   9.0442  136.838   5.8381  136.838   5.8381  136.838   5.8381  422.165   9.0442  422.165   9.0442 0.000000 0.000000 
1 1 1   15    0   42 o  171.976   16.876   23.437   4.3441   23.437   4.3441   23.437   4.3441  171.976   16.876  171.976   16.876 0.000000 0.000000 
1 1 1   15    0   43 o  117.385   26.914   12.226   4.2115   12.226   4.2115   12.226   4.2115  117.385   26.914  117.385   26.914 0.000000 0.000000 
1 1 1   15    0   44 o  395.038   9.5641  119.974   5.7753  119.974   5.7753  119.974   5.7753  395.038   9.5641  395.038   9.5641 0.000000 0.000000 
1 1 1   15    0   45 o  184.693   28.263   28.476   7.4340   28.476   7.4340   28.476   7.4340  184.693   28.263  184.693   28.263 0.000000 0.000000 
1 1 1   15    0   46 o  370.654   10.260  105.773   5.8109  105.773   5.8109  105.773   5.8109  370.654   10.260  370.654   10.260 0.000000 0.000000 
1 1 1   15    0   47 o   84.249   40.156   8.4041   5.9232   8.4041   5.9232   8.4041   5.9232   84.249   40.156   84.249   40.156 0.000000 0.000000 
1 1 1   15    0   48 f   71.838   39.840   5.9316   6.4445   5.9316   6.4445   5.9316   6.4445   71.838   39.840   71.838   39.840 0.000000 0.000000 
1 1 1   15    0   49 o   73.532   40.312   6.3455   6.5122   6.3455   6.5122   6.3455   6.5122   73.532   40.312   73.532   40.312 0.000000 0.000000 
1 1 1   15    0   50 o   40.041   27.050  -1.9943   4.8461  -1.9943   4.8461  -1.9943   4.8461   40.041   27.050   40.041   27.050 0.000000 0.000000 
1 1 1   15    0   51 o   55.508   34.720   1.8819   6.0670   1.8819   6.0670   1.8819   6.0670   55.508   34.720   55.508   34.720 0.000000 0.000000 
1 1 1   15    0   52 o   83.440   38.387   8.2635   5.3774   8.2635   5.3774   8.2635   5.3774   83.440   38.387   83.440   38.387 0.000000 0.000000 
1 1 1   15    0   53 o  167.606   21.980   23.130   5.3701   23.130   5.3701   23.130   5.3701  167.606   21.980  167.606   21.980 0.000000 0.000000 
1 1 1   15    0   54 o  113.752   34.927   12.926   5.3173   12.926   5.3173   12.926   5.3173  113.752   34.927  113.752   34.927 0.000000 0.000000 
1 1 1   15    0   55 o   80.385   37.647   7.8555   5.1828   7.8555   5.1828   7.8555   5.1828   80.385   37.647   80.385   37.647 0.000000 0.000000 
1 1 1   15    0   56 o  130.443   43.031   18.147   7.6314   18.147   7.6314   18.147   7.6314  130.443   43.031  130.443   43.031 0.000000 0.000000 
1 1 1   15    0   57 o   39.763   27.039  -2.1546   5.0052  -2.1546   5.0052  -2.1546   5.0052   39.763   27.039   39.763   27.039 0.000000 0.000000 
1 1 1   15    0   58 o   70.958   38.281   6.5156   5.7804   6.5156   5.7804   6.5156   5.7804   70.958   38.281   70.958   38.281 0.000000 0.000000 
1 1 1   15    0   59 o   52.487   33.054   2.0509   5.6021   2.0509   5.6021   2.0509   5.6021   52.487   33.054   52.487   33.054 0.000000 0.000000 
1 1 1   15    0   60 o  104.622   33.949   11.577   4.8080   11.577   4.8080   11.577   4.8080  104.622   33.949  104.622   33.949 0.000000 0.000000 
1 1 1   15    1    0 o  748.993   11.719  429.827   13.427  429.827   13.427  429.827   13.427  748.993   11.719  748.993   11.719 0.000000 0.000000 
1 1 1   15    1    1 f  1023.92   10.163  802.869   15.927  809.773   22.823  796.315   22.237  1027.98   14.505  1019.43   14.251 8.555969 20.33468 
1 1 1   15    1    3 o  622.893   7.7723  297.046   7.4102  305.406   10.624  289.124   10.341  631.484   10.991  614.421   10.996 17.06384 15.54738 
1 1 1   15    1    4 o  308.920   7.1441   73.057   3.3780   71.697   4.7212   74.483   4.8353  305.986   10.080  311.873   10.129 -5.887024 14.29042 
1 1 1   15    1    5 o  1357.92   10.458  1412.10   21.737  1405.15   37.616  1415.58   26.635  1353.71   18.154  1359.38   12.801 -5.671753 22.21341 
1 1 1   15    1    6 o  872.298   6.5379  582.473   8.7292  593.747   12.626  572.149   12.082  880.585   9.3673  864.432   9.1315 16.15302 13.08170 
1 1 1   15    1    7 o  319.554   4.8577   78.160   2.3760   79.759   3.4725   76.753   3.2580  322.783   7.0285  316.644   6.7222 6.138885 9.725689 
1 1 1   15    1    8 o  1040.69   7.3948  829.121   11.779  831.399   16.754  826.894   16.564  1041.96   10.505  1039.14   10.414 2.821289 14.79232 
1 1 1   15    1    9 o  216.731   5.1011   35.954   1.6922   36.159   2.6618   35.814   2.1922  217.326   8.0019  216.300   6.6215 1.026489 10.38633 
1 1 1   15    1   10 o  561.602   4.8872  241.409   4.2011  249.132   6.7667  236.565   5.3589  570.458   7.7497  555.916   6.2980 14.54279 9.986087 
1 1 1   15    1   11 o  147.452   5.4426   16.642   1.2284   17.056   1.7994   16.281   1.6810  149.050   7.9156  145.635   7.5670 3.415237 10.95068 
1 1 1   15    1   12 o  1336.57   6.3829  1367.47   13.058  1362.75   18.409  1372.26   18.526  1334.11   9.0149  1338.76   9.0409 -4.647827 12.76736 
1 1 1   15    1   13 o  1228.38   6.4322  1155.06   12.094  1156.12   18.556  1154.29   15.946  1228.76   9.8662  1227.86   8.4845 0.8901367 13.01266 
1 1 1   15    1   14 o  960.855   5.4581  706.689   8.0272  703.603   12.285  708.988   10.604  958.647   8.3725  962.358   7.1987 -3.710938 11.04179 
1 1 1   15    1   15 o  933.318   5.7361  666.778   8.1944  667.828   11.590  665.727   11.588  933.966   8.1072  932.494   8.1185 1.471191 11.47328 
1 1 1   15    1   16 o  531.466   4.8135  216.197   3.9157  204.058   6.6467  222.649   4.8458  516.257   8.4114  539.320   5.8702 -23.06238 10.25724 
1 1 1   15    1   17 o  1230.33   6.1011  1158.73   11.489  1146.98   16.073  1171.00   16.430  1223.94   8.5795  1236.68   8.6798 -12.74011 12.20438 
1 1 1   15    1   18 o  613.474   4.7777  288.069   4.4863  289.655   7.1076  287.018   5.7841  615.094   7.5494  612.325   6.1714 2.768677 9.750871 
1 1 1   15    1   19 o  344.322   4.9569   90.749   2.6124   95.896   4.0315   87.023   3.4300  353.915   7.4421  337.158   6.6464 16.75723 9.978010 
1 1 1   15    1   20 o  1038.75   5.9312  825.979   9.4302  814.356   12.312  842.475   14.668  1031.32   7.7994  1048.89   9.1362 -17.57007 12.01256 
1 1 1   15    1   21 o  345.824   6.4744   91.555   3.4271   92.937   4.6335   89.887   5.0922  348.379   8.6893  342.592   9.7109 5.786865 13.03093 
1 1 1   15    1   22 o  613.307   4.6867  287.919   4.3996  300.842   6.4222  276.491   6.0393  626.864   6.6933  600.963   6.5656 25.90100 9.375848 
1 1 1   15    1   23 o  723.098   4.9031  400.239   5.4268  396.896   7.6762  403.580   7.6730  719.999   6.9654  726.039   6.9046 -6.039368 9.807635 
1 1 1   15    1   24 o   60.951   20.409   2.6756   2.2409   0.1636   3.2291   5.0095   3.1124   53.967   22.785   80.152   23.709 -26.18489 32.88240 
1 1 1   15    1   25 o  683.044   5.0498  357.140   5.2795  352.906   7.4991  361.301   7.4339  678.900   7.2166  686.933   7.0703 -8.033325 10.10289 
1 1 1   15    1   26 o  685.763   5.5102  360.012   5.7838  358.914   7.6949  361.439   8.7688  684.636   7.3430  686.988   8.3391 -2.351868 11.11130 
1 1 1   15    1   27 o  1308.10   7.1464  1310.26   14.309  1308.45   21.925  1311.61   18.885  1306.72   10.962  1308.51   9.4291 -1.792725 14.45913 
1 1 1   15    1   28 o  661.193   6.5835  334.743   6.6628  337.714   10.716  332.871   8.5069  663.862   10.546  659.237   8.4307 4.625671 13.50184 
1 1 1   15    1   29 o  385.564   6.1895  113.826   3.6528  114.442   5.2241  113.237   5.1095  386.509   8.8304  384.474   8.6824 2.034119 12.38387 
1 1 1   15    1   30 o   49.697   20.854   0.2637   2.6781   5.5072   3.8359  -4.7227   3.7407   84.823   26.571   43.463   20.658 41.36045 33.65727 
1 1 1   15    1   31 o  133.255   14.455   13.794   2.9009   13.658   4.1644   13.922   4.0434  131.447   21.437  132.904   20.539 -1.457047 29.68814 
1 1 1   15    1   32 o  417.483   6.3288  133.484   4.0442  143.849   6.2705  126.103   5.2919  433.195   9.4569  405.656   8.5228 27.53894 12.73074 
1 1 1   15    1   33 o  504.717   6.7095  195.133   5.1833  200.008   7.7753  191.233   6.9538  510.705   9.9467  499.458   9.0961 11.24731 13.47871 
1 1 1   15    1   34 o  404.233   6.7018  125.183   4.1466  128.679   5.5379  120.723   6.2558  409.685   8.8314  396.692   10.303 12.99347 13.56990 
1 1 1   15    1   35 o  316.572   6.9618   76.792   3.3734   75.604   4.8242   77.929   4.7189  313.907   10.040  318.725   9.6729 -4.817993 13.94189 
1 1 1   15    1   36 o  428.258   6.0146  140.506   3.9426  142.577   5.6959  138.600   5.4627  431.172   8.6307  425.139   8.3948 6.032104 12.03998 
1 1 1   15    1   37 o  119.566   15.697   11.210   2.8034   11.326   4.1775   11.114   3.7813  118.575   23.843  117.845   21.765 0.7300873 32.28343 
1 1 1   15    1   38 o  515.291   5.8220  203.445   4.5919  207.380   6.5789  199.707   6.4122  519.945   8.2666  510.243   8.2103 9.702484 11.65103 
1 1 1   15    1   39 o  269.789   8.3727   55.851   3.4575   56.680   4.7180   54.890   5.0814  271.483   11.354  267.034   12.432 4.449677 16.83669 
1 1 1   15    1   40 o   95.501   24.273   7.4211   3.5557   8.3785   5.3643   6.6709   4.7489  102.213   31.325   92.453   29.638 9.760475 43.12338 
1 1 1   15    1   41 o  199.615   10.202   30.718   3.1068   31.795   4.4238   29.670   4.3642  202.381   14.374  195.400   14.699 6.980255 20.55960 
1 1 1   15    1   42 o   35.068   16.997  -4.6622   2.8278  -5.2478   3.9454  -4.0436   4.0551   43.687   20.890   47.185   22.146 -3.497944 30.44383 
1 1 1   15    1   43 o   85.904   22.391   6.0164   2.9742   5.3940   4.1613   6.6665   4.2526   83.811   27.804   91.043   27.889 -7.232430 39.38039 
1 1 1   15    1   44 o  162.166   12.891   20.455   3.1734   21.107   4.5574   19.841   4.4215  163.378   18.554  158.330   18.599 5.047379 26.27090 
1 1 1   15    1   45 o   50.260   23.842  -5.6089   4.9343 -10.0197   7.0716  -1.4238   6.8883   56.673   27.323   71.610   31.718 -14.93685 41.86349 
1 1 1   15    1   46 o  211.501   12.008   34.691   3.8712   38.693   6.4391   32.426   4.8444  221.217   19.207  203.508   15.673 17.70938 24.79033 
1 1 1   15    1   47 o  298.668   9.6166   68.747   4.3963   57.272   7.1186   75.823   5.5895  269.985   17.317  313.147   11.662 -43.16238 20.87786 
1 1 1   15    1   48 o  130.326   18.004   13.569   3.4956   14.103   4.9727   13.047   4.9149  130.277   25.850  124.966   26.516 5.310814 37.03156 
1 1 1   15    1   49 o  161.577   16.764   20.669   4.0857   25.228   5.2946   13.958   6.4238  177.576   19.818  126.903   32.825 50.67306 38.34301 
1 1 1   15    1   50 o  132.124   20.319   14.154   3.9775   13.969   5.1251   14.435   6.3073  128.775   26.870  128.921   32.089 -0.1455994 41.85383 
1 1 1   15    1   51 o   45.840   22.200  -7.2936   4.7994  -9.1136   5.6321  -2.4677   9.1711   48.610   23.658   78.760   35.606 -30.14996 42.74896 
1 1 1   15    1   52 o  218.767   12.842   37.392   4.2814   36.123   6.1503   38.585   5.9637  212.397   19.123  220.181   17.849 -7.783295 26.15889 
1 1 1   15    1   53 o   89.946   25.428   6.8573   3.6565   8.6509   5.3135   5.2438   5.0396  100.053   31.262   83.379   30.402 16.67413 43.60717 
1 1 1   15    1   54 f  276.653   9.8807   59.305   4.1840   63.990   6.0162   54.918   5.8227  285.724   13.757  264.008   14.464 21.71585 19.96130 
1 1 1   15    1   55 o  147.687   16.690   17.543   3.7066   14.191   5.3071   20.736   5.1791  127.272   28.003  158.072   22.002 -30.80083 35.61287 
1 1 1   15    1   56 o   76.012   29.166   4.0760   4.7603   4.6280   7.5196   3.7068   6.1494   86.396   35.478   79.293   32.266 7.102295 47.95599 
1 1 1   15    1   57 o  198.714   13.593   31.306   4.1095   28.673   5.3217   35.195   6.4680  187.194   18.829  206.152   20.782 -18.95750 28.04275 
1 1 1   15    1   58 o   54.697   23.624   0.3512   3.6155  -1.5876   4.9824   2.5076   5.2545   57.178   26.005   70.610   29.387 -13.43245 39.24075 
1 1 1   15    1   59 o   62.184   25.939   1.7431   4.1073   3.1613   5.6044   0.0976   6.0368   73.218   30.400   66.040   29.446 7.177330 42.32328 
1 1 1   15    1   60 o  157.627   17.431   20.623   4.1351   14.280   5.6885   27.731   6.0214  121.187   30.647  178.656   22.520 -57.46925 38.03167 
1 1 1   15    2    0 o   82.797   18.748   5.9895   2.0720   5.9895   2.0720   5.9895   2.0720   82.797   18.748   82.797   18.748 0.000000 0.000000 
1 1 1   15    2    1 o  1274.65   12.047  1244.50   23.503  1232.92   32.988  1256.45   33.496  1268.16   16.995  1280.19   17.094 -12.03076 24.10453 
1 1 1   15    2    2 o  641.526   7.5961  315.078   7.4589  301.453   10.402  329.500   10.702  627.391   10.832  655.935   10.659 -28.54388 15.19669 
1 1 1   15    2    3 o  164.685   8.9860   20.828   2.2565   0.0000   0.0000   20.828   2.2565  ?   ?   164.685   8.9860 0.000000 8.985951 
1 1 1   15    2    4 o  731.084   8.1431  409.207   9.1123  410.157   13.311  408.369   12.501  731.773   11.884  730.210   11.185 1.562561 16.31931 
1 1 1   15    2    5 o  740.244   6.8307  419.475   7.7394  416.933   13.633  420.683   9.4010  737.787   12.073  741.262   8.2857 -3.475159 14.64258 
1 1 1   15    2    6 o  1012.11   6.4738  784.147   10.029  790.658   16.068  779.992   12.836  1016.11   10.331  1009.35   8.3088 6.768494 13.25763 
1 1 1   15    2    7 o  218.490   5.9364   36.542   1.9853   0.0000   0.0000   36.542   1.9853  ?   ?   218.490   5.9364 0.000000 5.936381 
1 1 1   15    2    8 o  1202.73   7.3789  1107.41   13.584  1139.72   22.200  1088.07   17.175  1219.86   11.890  1192.07   9.4128 27.79114 15.16463 
1 1 1   15    2    9 o  1255.96   8.5444  1207.71   16.426  1230.54   23.796  1186.94   22.701  1267.50   12.266  1244.88   11.914 22.62878 17.09945 
1 1 1   15    2   10 o  849.180   5.8746  551.977   7.6357  557.871   12.240  548.221   9.7701  853.578   9.3681  846.235   7.5429 7.343384 12.02736 
1 1 1   15    2   11 o  770.820   5.0643  454.785   5.9751  455.594   8.3903  453.953   8.5110  771.453   7.1056  770.059   7.2208 1.394043 10.13060 
1 1 1   15    2   12 o  885.004   5.5204  599.518   7.4779  612.110   10.699  587.493   10.456  894.176   7.8174  876.011   7.7978 18.16437 11.04166 
1 1 1   15    2   13 o  131.306   6.4592   13.198   1.2982   12.732   1.9159   13.594   1.7651  128.572   9.8096  132.962   8.7214 -4.390747 13.12598 
1 1 1   15    2   14 o  1011.36   6.0158  782.955   9.3125  774.899   13.042  791.335   13.302  1006.04   8.4695  1016.65   8.5480 -10.60992 12.03334 
1 1 1   15    2   15 o  652.291   4.9687  325.674   4.9608  349.026   9.2909  316.362   5.8671  675.162   8.9904  642.877   5.9625 32.28448 10.78789 
1 1 1   15    2   16 o  356.719   4.3786   97.396   2.3907   96.340   3.6228   98.211   3.1819  354.753   6.6719  358.193   5.8036 -3.439301 8.842917 
1 1 1   15    2   17 o  998.124   5.6701  762.597   8.6626  757.060   13.144  766.848   11.518  994.363   8.6359  1000.83   7.5188 -6.463257 11.45036 
1 1 1   15    2   18 o  355.839   5.0753   96.922   2.7643  100.817   4.8634   95.062   3.3598  362.860   8.7565  352.395   6.2289 10.46512 10.74592 
1 1 1   15    2   19 o  1047.32   5.5285  839.626   8.8625  820.485   12.289  860.372   12.793  1035.21   7.7555  1060.06   7.8847 -24.85706 11.05966 
1 1 1   15    2   20 o  966.408   5.6707  714.924   8.3881  718.430   12.968  712.401   10.999  968.622   8.7465  964.621   7.4496 4.001343 11.48903 
1 1 1   15    2   21 o  707.282   6.1228  382.954   6.6284  398.787   8.7565  361.706   10.144  721.688   7.9270  687.238   9.6433 34.44928 12.48320 
1 1 1   15    2   22 o  239.210   6.8636   43.808   2.5130   41.529   3.4561   46.366   3.6607  232.862   9.6965  246.046   9.7202 -13.18483 13.72971 
1 1 1   15    2   23 o  710.115   4.9046  385.996   5.3309  390.338   7.7288  382.056   7.3625  714.021   7.0718  706.416   6.8092 7.605469 9.817156 
1 1 1   15    2   24 o  1098.63   6.3313  924.049   10.647  928.601   14.188  918.183   16.106  1101.19   8.4179  1094.89   9.6108 6.297363 12.77610 
1 1 1   15    2   25 o  813.838   5.6270  507.041   7.0095  502.883   9.2850  512.550   10.688  810.403   7.4853  818.091   8.5357 -7.687805 11.35288 
1 1 1   15    2   26 o  427.935   5.9289  140.200   3.8835  138.682   5.2351  142.057   5.7910  425.551   8.0372  430.671   8.7850 -5.119385 11.90680 
1 1 1   15    2   27 o  486.397   5.7664  181.124   4.2931  179.101   5.8407  183.501   6.3317  483.599   7.8906  489.479   8.4511 -5.880524 11.56211 
1 1 1   15    2   28 o  162.773   13.369   20.455   3.3015   19.635   5.1917   21.012   4.2779  158.238   22.033  164.522   17.244 -6.283508 27.97905 
1 1 1   15    2   29 o  336.629   6.4788   86.771   3.3382   84.310   4.9599   88.810   4.5136  331.706   9.7690  340.489   8.6606 -8.782501 13.05525 
1 1 1   15    2   30 o  258.359   7.7790   51.128   3.0762   56.598   4.5379   46.478   4.1844  271.714   10.911  246.218   11.103 25.49562 15.56704 
1 1 1   15    2   31 o  606.445   5.6561  281.608   5.2503  288.046   8.1413  277.025   6.8696  613.123   8.6751  601.375   7.4631 11.74835 11.44356 
1 1 1   15    2   32 o  769.691   5.7709  453.665   6.7988  456.239   10.521  451.820   8.9088  771.548   8.9089  767.956   7.5790 3.592285 11.69657 
1 1 1   15    2   33 o  376.054   7.0469  108.338   4.0562  103.655   6.6920  111.057   5.0997  367.492   11.897  380.639   8.7531 -13.14706 14.77009 
1 1 1   15    2   34 o  386.600   7.4652  114.530   4.4174  110.285   5.4304  122.832   7.5951  379.232   9.3553  399.919   12.408 -20.68698 15.53945 
1 1 1   15    2   35 o  426.706   6.0392  139.477   3.9444  138.834   5.7092  140.063   5.4558  425.504   8.7660  427.422   8.3393 -1.918030 12.09905 
1 1 1   15    2   36 o  453.041   5.9857  157.238   4.1507  156.524   6.0641  157.867   5.6933  451.749   8.7700  453.745   8.1976 -1.996399 12.00472 
1 1 1   15    2   37 o  341.541   6.9325   89.409   3.6241   89.612   5.3663   89.238   4.9141  341.623   10.263  340.998   9.4150 0.6249084 13.92699 
1 1 1   15    2   38 o  222.824   9.7108   38.122   3.3120   40.197   4.7302   36.126   4.6389  228.055   13.613  216.075   14.103 11.97969 19.60154 
1 1 1   15    2   39 o  204.204   10.481   32.129   3.2650   32.346   4.5882   31.906   4.6472  204.221   14.778  202.764   15.082 1.456955 21.11506 
1 1 1   15    2   40 o  396.595   7.9473  120.692   4.8244  118.394   7.5739  122.261   6.2582  392.018   12.623  398.817   10.252 -6.799347 16.26126 
1 1 1   15    2   41 o   73.465   23.034   4.2024   2.8818   5.3348   4.1566   3.1542   3.9990   83.769   27.788   71.891   26.925 11.87804 38.69240 
1 1 1   15    2   42 o  286.486   7.8887   63.010   3.4592   58.449   4.9732   67.286   4.8148  275.386   11.798  295.666   10.639 -20.27994 15.88696 
1 1 1   15    2   43 o  239.125   10.335   44.021   3.7827   45.661   6.5320   43.194   4.6399  241.521   17.795  236.140   12.886 5.380737 21.97037 
1 1 1   15    2   44 o  128.549   22.767   13.400   4.3158   0.0000   0.0000   13.400   4.3158  ?   ?   128.549   22.767 0.000000 22.76749 
1 1 1   15    2   45 f  189.538   14.709   28.051   4.2340   23.962   6.5626   30.966   5.5415  171.538   25.793  198.101   18.489 -26.56284 31.73531 
1 1 1   15    2   46 o  110.435   20.469   9.8913   3.3326   8.7122   4.3718   11.527   5.1492  102.214   27.389  117.103   28.903 -14.88823 39.81911 
1 1 1   15    2   47 o  322.527   8.2129   80.020   4.0544   80.437   5.8770   79.642   5.6007  322.458   11.907  321.004   11.399 1.454102 16.48380 
1 1 1   15    2   48 o  176.190   13.230   24.225   3.5418   26.544   5.1541   22.150   4.8752  182.793   18.684  166.546   19.493 16.24680 27.00133 
1 1 1   15    2   49 o  231.238   10.664   41.327   3.7744   43.228   5.3453   39.437   5.3304  234.944   14.942  224.120   15.636 10.82494 21.62760 
1 1 1   15    2   50 o  226.382   11.122   39.675   3.8537   34.405   5.3927   45.175   5.5091  208.576   17.041  239.977   15.075 -31.40063 22.75149 
1 1 1   15    2   51 o  156.278   19.997   19.711   4.6736   21.948   5.2779   11.586   10.058  164.402   21.488  116.973   42.905 47.42994 47.98513 
1 1 1   15    2   52 o  102.634   27.019   8.9990   4.3026   3.9957   5.7079   15.583   6.5479   80.783   31.677  133.025   32.448 -52.24125 45.34679 
1 1 1   15    2   53 o  143.177   19.877   16.675   4.2385   24.505   5.5504   5.7220   6.5647  173.286   21.379   89.475   34.270 83.81047 40.39241 
1 1 1   15    2   54 o  187.859   13.591   27.782   3.8817   34.580   5.6127   21.550   5.3742  207.699   17.828  161.486   22.341 46.21298 28.58250 
1 1 1   15    2   55 o  112.295   22.051   10.611   3.6550   14.988   5.2911   6.6165   5.0548  131.283   27.224   88.752   30.635 42.53035 40.98383 
1 1 1   15    2   56 o   70.537   29.688   1.8773   5.4547  -0.6707   7.4519   4.8185   8.0062   72.518   32.497   88.235   36.461 -15.71719 48.84092 
1 1 1   15    2   57 f   96.683   26.743   8.3073   4.0909   7.7987   5.0102   9.3249   7.0863   93.309   30.487  100.725   36.145 -7.415146 47.28549 
1 1 1   15    2   58 o  172.118   14.947   23.819   3.8986   24.505   5.2004   22.939   5.8909  171.296   20.224  162.704   24.408 8.591751 31.69783 
1 1 1   15    2   59 o   71.387   26.134   4.1143   3.7293   6.1486   4.8918   1.2915   5.7625   83.301   30.017   68.023   29.602 15.27760 42.15766 
1 1 1   15    2   60 o   58.984   24.296   1.7593   3.5401  -1.6758   5.2149   4.6952   4.8211   57.173   26.230   75.930   29.295 -18.75680 39.32208 
1 1 1   15    3    0 o  723.898   11.410  401.498   12.635  401.498   12.635  401.498   12.635  723.898   11.410  723.898   11.410 0.000000 0.000000 
1 1 1   15    3    1 o  199.617   7.0345   30.504   2.1493   32.084   3.2594   29.289   2.8590  204.418   10.452  195.576   9.5504 8.841980 14.15838 
1 1 1   15    3    2 o  487.003   6.7983  181.560   5.0676  187.573   7.6012  176.750   6.7991  494.923   10.034  480.453   9.2456 14.46979 13.64410 
1 1 1   15    3    3 o  1142.65   11.048  999.938   19.323   0.0000   0.0000  999.938   19.323  ?   ?   1142.65   11.048 0.000000 11.04825 
1 1 1   15    3    4 o  383.306   5.3301  112.461   3.1272  102.586   5.7189  116.673   3.7350  366.011   10.208  390.405   6.2504 -24.39395 11.96979 
1 1 1   15    3    5 o  759.511   8.6225  441.664   10.024  437.357   14.140  446.015   14.212  755.638   12.226  763.084   12.168 -7.446350 17.24888 
1 1 1   15    3    6 o  789.591   6.3111  477.245   7.6274  473.911   10.658  480.745   10.921  786.743   8.8505  792.390   9.0040 -5.646240 12.62552 
1 1 1   15    3    7 o  913.970   6.8711  639.465   9.6123  649.008   13.759  630.367   13.434  920.643   9.7642  907.329   9.6734 13.31348 13.74459 
1 1 1   15    3    8 o  760.835   6.2480  443.112   7.2762  471.040   10.769  419.652   9.8699  784.356   8.9699  740.346   8.7098 44.01007 12.50279 
1 1 1   15    3    9 o  889.992   7.8655  606.398   10.715  615.583   13.242  588.977   18.236  896.630   9.6484  876.822   13.588 19.80853 16.66477 
1 1 1   15    3   10 o  1568.25   8.3986  1882.93   20.160  1994.59   30.418  1795.46   26.922  1613.72   12.315  1531.13   11.488 82.58850 16.84115 
1 1 1   15    3   11 o  535.436   4.3647  219.432   3.5771  222.120   5.0614  216.750   5.0562  538.679   6.1386  532.126   6.2078 6.552795 8.730355 
1 1 1   15    3   12 o  698.365   4.8746  373.302   5.2107  385.127   7.4911  362.218   7.2527  709.293   6.9000  687.874   6.8885 21.41919 9.749910 
1 1 1   15    3   13 o  1168.04   6.6372  1044.39   11.866  1046.14   16.822  1042.66   16.741  1168.88   9.4026  1166.93   9.3727 1.944824 13.27614 
1 1 1   15    3   14 o  922.183   5.6784  650.958   8.0152  651.894   11.386  650.038   11.285  922.760   8.0614  921.449   8.0013 1.311829 11.35816 
1 1 1   15    3   15 o  1545.76   9.1873  1829.53   21.737  1850.32   49.732  1824.62   24.168  1552.93   20.922  1543.60   10.229 9.328857 23.28909 
1 1 1   15    3   16 o  323.714   5.9434   80.215   2.9449   0.0000   0.0000   80.215   2.9449  ?   ?   323.714   5.9434 0.000000 5.943433 
1 1 1   15    3   17 o  433.203   4.9095  143.644   3.2554  129.587   4.4564  159.727   4.7668  411.427   7.0766  456.779   6.8179 -45.35129 9.826581 
1 1 1   15    3   18 o  412.827   4.3605  130.446   2.7553  128.325   3.9782  132.401   3.8198  409.429   6.3481  415.886   6.0007 -6.456970 8.735323 
1 1 1   15    3   19 o  357.848   4.6157   98.016   2.5282   98.855   3.7163   97.294   3.4494  359.345   6.7565  356.503   6.3214 2.841888 9.252613 
1 1 1   15    3   20 o  623.809   4.8425  297.863   4.6237  291.986   7.1811  302.025   6.0429  617.548   7.5972  628.116   6.2855 -10.56775 9.860229 
1 1 1   15    3   21 o  311.078   5.2068   74.074   2.4792   71.688   3.6785   76.060   3.3560  305.987   7.8541  315.196   6.9561 -9.208435 10.49161 
1 1 1   15    3   22 o  1212.33   7.1520  1125.27   13.271  1120.58   16.252  1134.64   22.993  1209.68   8.7775  1216.88   12.345 -7.203979 15.14702 
1 1 1   15    3   23 o  266.336   6.2925   54.306   2.5652   49.758   3.8541   57.923   3.4371  254.879   9.8792  275.032   8.1647 -20.15324 12.81643 
1 1 1   15    3   24 o  900.258   5.7687  620.443   7.9490  612.006   10.480  631.873   12.198  894.016   7.6584  908.338   8.7735 -14.32123 11.64582 
1 1 1   15    3   25 o  354.096   6.3232   95.994   3.4271   95.830   4.6277   96.194   5.0999  353.738   8.5470  354.384   9.4019 -0.6459656 12.70620 
1 1 1   15    3   26 o  651.664   5.1478  325.090   5.1348  323.468   7.3926  326.602   7.1374  649.943   7.4310  653.098   7.1399 -3.154785 10.30528 
1 1 1   15    3   27 o  891.674   5.8763  608.714   8.0201  608.226   10.766  609.322   12.021  891.183   7.8928  891.912   8.8056 -0.7295532 11.82518 
1 1 1   15    3   28 o  605.206   5.9476  280.431   5.5095  276.260   9.8716  282.319   6.6399  600.406   10.742  607.183   7.1445 -6.777161 12.90069 
1 1 1   15    3   29 o  350.436   6.4177   94.035   3.4424   96.449   5.2170   92.174   4.5813  354.787   9.6069  346.876   8.6286 7.910553 12.91300 
1 1 1   15    3   30 o  989.752   5.8396  750.082   8.8467  750.635   12.699  749.560   12.331  989.857   8.3817  989.176   8.1444 0.6806641 11.68697 
1 1 1   15    3   31 o  487.901   5.9492  182.287   4.4428  178.270   6.9176  185.107   5.7963  482.289   9.3709  491.564   7.7038 -9.275970 12.13098 
1 1 1   15    3   32 o  502.288   5.6606  193.198   4.3520  194.189   6.4073  192.349   5.9296  503.402   8.3156  501.055   7.7317 2.347504 11.35463 
1 1 1   15    3   33 o  447.426   6.4677  153.341   4.4293  144.639   7.3770  158.247   5.5389  434.179   11.100  454.426   7.9632 -20.24762 13.66137 
1 1 1   15    3   34 o  221.864   10.279   37.764   3.4905   37.515   4.4129   38.179   5.7049  220.576   13.130  221.987   16.917 -1.410858 21.41468 
1 1 1   15    3   35 o   97.193   19.363   7.5522   2.7795   7.7475   4.3175   7.4140   3.6322   98.270   27.579   95.876   24.623 2.393867 36.97088 
1 1 1   15    3   36 o  394.214   6.3473  119.071   3.8299  123.777   5.7555  115.331   5.1308  401.655   9.3618  387.782   8.6443 13.87329 12.74234 
1 1 1   15    3   37 o  277.161   7.6584   58.899   3.2489   64.375   5.0225   54.959   4.2604  289.438   11.337  267.521   10.404 21.91711 15.38764 
1 1 1   15    3   38 o  273.281   8.2919   57.292   3.4684   65.539   4.9276   49.194   4.8829  292.020   11.024  252.837   12.617 39.18396 16.75515 
1 1 1   15    3   39 o   52.627   22.043   0.4081   2.9833   0.4423   4.1073   0.3700   4.3402   61.091   25.740   62.402   26.385 -1.310806 36.86077 
1 1 1   15    3   40 o  210.935   10.739   34.305   3.4559   38.647   6.0142   32.164   4.2226  222.553   17.804  203.765   13.617 18.78770 22.41475 
1 1 1   15    3   41 o  205.164   11.920   32.533   3.7272   37.540   7.7455   31.024   4.2518  217.497   23.647  199.963   13.980 17.53452 27.47040 
1 1 1   15    3   42 o  106.870   21.347   9.2431   3.3696   16.220   5.8574   5.7918   4.1196  140.477   28.221   86.032   27.607 54.44462 39.47856 
1 1 1   15    3   43 o  341.827   8.1236   89.756   4.2504   93.457   7.2362   87.806   5.2518  347.649   13.599  337.742   10.159 9.906830 16.97448 
1 1 1   15    3   44 o  216.991   10.446   36.279   3.4695   37.760   5.3494   35.203   4.5582  219.829   16.008  212.719   14.079 7.109238 21.31879 
1 1 1   15    3   45 o  356.880   9.0384   98.007   4.9373   99.237   7.4480   97.044   6.5943  357.881   13.597  354.340   12.158 3.541107 18.24002 
1 1 1   15    3   46 o  117.300   19.873   11.099   3.4407   7.9419   4.6074   15.079   5.1735   97.920   28.812  135.168   25.949 -37.24815 38.77542 
1 1 1   15    3   47 o  227.060   10.350   39.781   3.5972   39.058   5.2272   40.431   4.9580  223.391   15.381  227.640   14.302 -4.248611 21.00298 
1 1 1   15    3   48 o  356.241   7.8383   97.611   4.2740   98.419   6.1568   96.860   5.9379  356.760   11.275  354.024   10.958 2.736633 15.72255 
1 1 1   15    3   49 o  251.184   9.9334   48.703   3.8191   39.768   5.3219   58.190   5.4837  225.086   15.542  273.699   13.090 -48.61235 20.32017 
1 1 1   15    3   50 o  232.363   11.298   41.817   4.0181   40.097   5.5242   43.750   5.8552  225.629   16.101  235.634   16.335 -10.00548 22.93681 
1 1 1   15    3   51 o  150.003   17.108   17.933   3.8577   19.790   5.3680   15.950   5.5477  155.191   23.319  137.293   27.360 17.89854 35.94952 
1 1 1   15    3   52 o  192.452   14.433   29.130   4.2207   32.760   6.9575   27.017   5.3092  200.123   23.140  183.415   19.196 16.70869 30.06575 
1 1 1   15    3   53 o   52.330   23.509  -1.3630   3.9254   1.2328   5.0607  -5.2840   6.2196   67.693   28.549   58.150   27.335 9.542599 39.52550 
1 1 1   15    3   54 o  228.900   12.334   41.000   4.3056   47.397   5.6224   31.929   6.6951  244.859   15.075  196.799   22.639 48.06010 27.19846 
1 1 1   15    3   55 o  120.200   27.647   12.670   4.9805   11.458   5.4865   18.343   11.874  112.795   30.877  132.842   46.881 -20.04630 56.13570 
1 1 1   15    3   56 o   74.924   28.860   3.9011   4.6727   10.899   6.3794  -4.1988   6.8636  108.258   34.314   62.600   29.195 45.65741 45.05283 
1 1 1   15    3   57 o   51.124   23.295  -1.7316   4.0219  -4.4001   4.7800   4.7373   7.4423   49.963   23.632   85.600   35.240 -35.63674 42.43004 
1 1 1   15    3   58 o  230.073   11.992   41.769   4.2086   35.173   6.6439   46.190   5.4390  204.338   21.568  240.057   14.876 -35.71944 26.20090 
1 1 1   15    3   59 f   94.458   23.984   7.9783   3.4739   9.6455   4.9598   6.3727   4.8673  100.663   29.964   84.269   29.986 16.39380 42.39118 
1 1 1   15    3   60 o   57.894   23.632   1.7778   3.3118  -5.2852   4.6559   9.0112   4.7117   46.454   22.339   96.825   29.292 -50.37036 36.83852 
1 1 1   15    4    0 o  978.394   13.852  733.445   20.734  733.445   20.734  733.445   20.734  978.394   13.852  978.394   13.852 0.000000 0.000000 
1 1 1   15    4    1 o  676.969   6.3670  350.816   6.5974  379.664   12.313  339.200   7.8135  704.071   11.426  665.633   7.6690 38.43817 13.76108 
1 1 1   15    4    2 o  827.373   7.1543  524.046   9.0602  558.107   16.897  510.301   10.734  853.554   12.933  816.397   8.5897 37.15668 15.52569 
1 1 1   15    4    3 o  974.560   9.9025  727.276   14.771  704.740   20.317  752.551   21.515  959.087   13.840  991.059   14.183 -31.97217 19.81654 
1 1 1   15    4    4 o  1125.79   15.550  971.276   26.795   0.0000   0.0000  971.276   26.795  ?   ?   1125.79   15.550 0.000000 15.54994 
1 1 1   15    4    5 o  939.047   9.7912  675.221   14.073  662.764   19.607  688.458   20.211  930.101   13.773  947.947   13.930 -17.84583 19.58887 
1 1 1   15    4    6 o  1641.61   12.333  2064.16   30.989  2090.03   38.549  2016.90   52.104  1651.50   15.250  1621.42   20.994 30.07813 25.94840 
1 1 1   15    4    7 f  345.866   6.2939   91.569   3.3319   91.925   4.1316   90.907   5.6349  346.518   7.7898  344.542   10.685 1.976044 13.22311 
1 1 1   15    4    8 o  1242.79   8.5815  1182.52   16.324  1224.98   23.932  1145.58   22.324  1264.63   12.363  1222.99   11.925 41.63928 17.17752 
1 1 1   15    4    9 o  566.642   6.5552  245.786   5.6855  271.737   7.3617  207.431   8.9499  595.769   8.0730  520.438   11.235 75.33142 13.83475 
1 1 1   15    4   10 f  965.147   7.2284  713.097   10.678  719.896   15.167  706.415   15.037  969.600   10.220  960.478   10.228 9.122009 14.45894 
1 1 1   15    4   11 o  574.858   4.4512  252.934   3.9166  243.352   5.3745  263.785   5.7192  563.835   6.2276  587.026   6.3652 -23.19141 8.904943 
1 1 1   15    4   12 o  919.427   5.2329  647.052   7.3642  659.131   11.391  638.378   9.6527  927.875   8.0206  913.192   6.9058 14.68286 10.58395 
1 1 1   15    4   13 o  570.497   4.9104  249.118   4.2878  246.022   6.7975  251.163   5.5259  566.882   7.8341  572.809   6.3027 -5.927124 10.05466 
1 1 1   15    4   14 o  818.138   5.3294  512.346   6.6739  511.169   11.528  512.940   8.1849  817.066   9.2179  818.578   6.5326 -1.512268 11.29795 
1 1 1   15    4   15 o  611.366   4.4544  286.084   4.1683  276.018   6.2752  294.032   5.5762  600.467   6.8276  619.774   5.8781 -19.30688 9.009323 
1 1 1   15    4   16 o  728.784   5.6465  406.557   6.2987  394.063   13.879  409.798   7.0685  717.219   12.643  731.665   6.3117 -14.44659 14.13051 
1 1 1   15    4   17 o  239.948   5.7971   44.072   2.1291   42.503   3.3077   45.182   2.7821  235.600   9.1724  242.934   7.4820 -7.333054 11.83693 
1 1 1   15    4   18 o  252.655   5.5572   48.864   2.1491   38.757   3.4839   55.072   2.7305  224.960   10.118  268.214   6.6511 -43.25404 12.10827 
1 1 1   15    4   19 o  1339.31   7.0030  1373.24   14.356  1385.55   22.217  1364.42   18.810  1344.98   10.792  1334.83   9.2067 10.14575 14.18544 
1 1 1   15    4   20 o  496.788   4.4943  188.906   3.4174  185.541   4.9807  191.899   4.6977  492.302   6.6098  500.676   6.1300 -8.374390 9.014750 
1 1 1   15    4   21 o  412.694   4.7713  130.368   3.0139  128.320   4.5156  132.013   4.0474  409.395   7.2062  415.262   6.3678 -5.867126 9.616527 
1 1 1   15    4   22 o  703.527   5.6383  378.889   6.0715  377.762   7.5412  380.966   10.237  702.431   7.0140  705.288   9.4824 -2.857300 11.79460 
1 1 1   15    4   23 o  286.710   6.4700   62.933   2.8393   60.941   4.0259   64.905   4.0050  282.082   9.3244  291.118   8.9881 -9.036011 12.95106 
1 1 1   15    4   24 o  982.430   5.9650  738.893   8.9698  748.308   12.102  727.417   13.361  988.544   7.9985  974.576   8.9569 13.96735 12.00845 
1 1 1   15    4   25 o  555.649   5.0472  236.345   4.2926  231.080   6.2230  241.124   5.9290  549.349   7.4009  561.180   6.9025 -11.83124 10.12019 
1 1 1   15    4   26 o  802.092   5.6140  492.523   6.8923  485.532   9.2149  501.401   10.384  796.275   7.5606  809.129   8.3843 -12.85394 11.28981 
1 1 1   15    4   27 o  237.697   8.5558   43.275   3.1128   45.440   4.3784   41.062   4.4263  243.485   11.748  231.092   12.561 12.39294 17.19892 
1 1 1   15    4   28 o  750.585   6.0586  431.351   6.9606  442.943   12.736  426.414   8.3117  760.224   10.945  746.204   7.2772 14.01984 13.14357 
1 1 1   15    4   29 o  382.696   6.6955  112.152   3.9220  119.542   7.3286  109.186   4.6428  394.835   12.127  377.552   8.0340 17.28375 14.54645 
1 1 1   15    4   30 o  151.923   12.580   17.826   2.8991   14.901   4.6137   19.735   3.7267  137.222   22.764  159.560   15.453 -22.33728 27.51333 
1 1 1   15    4   31 o  346.128   6.5435   91.754   3.4667   92.996   5.3565   90.859   4.5476  348.293   10.048  344.343   8.6281 3.949524 13.24397 
1 1 1   15    4   32 o  417.835   6.5384  133.721   4.1817  126.983   7.1804  137.180   5.1440  406.825   11.531  423.123   7.9426 -16.29767 14.00189 
1 1 1   15    4   33 o  489.041   5.6666  183.158   4.2417  181.516   6.3060  184.515   5.7323  486.640   8.4659  490.714   7.6318 -4.074554 11.39808 
1 1 1   15    4   34 o  394.974   7.4369  119.548   4.4960  123.791   5.7041  112.588   7.3059  401.776   9.2754  382.852   12.467 18.92416 15.53920 
1 1 1   15    4   35 o  280.112   7.4992   60.137   3.2152   56.627   4.8215   62.948   4.3147  271.535   11.601  286.430   9.8414 -14.89490 15.21295 
1 1 1   15    4   36 f  264.169   7.7339   53.501   3.1272   54.079   4.6767   53.034   4.2057  265.310   11.516  262.823   10.455 2.486847 15.55391 
1 1 1   15    4   37 o  151.262   12.965   17.732   2.9728   18.108   4.2876   17.384   4.1254  151.833   18.855  148.791   18.514 3.041718 26.42535 
1 1 1   15    4   38 o  192.888   9.9681   28.650   2.9329   36.120   4.5739   23.433   3.8222  216.073   13.903  173.745   14.505 42.32790 20.09232 
1 1 1   15    4   39 o  509.790   6.9183  199.264   5.3984  210.465   8.5955  191.969   6.9372  523.238   10.732  500.038   9.0638 23.20065 14.04776 
1 1 1   15    4   40 o  221.268   10.650   37.651   3.6068   33.888   7.9703   38.620   4.0446  206.039   25.841  223.660   11.857 -17.62090 28.43166 
1 1 1   15    4   41 o  284.395   9.7538   62.176   4.2459   54.638   8.3656   64.792   4.9277  263.727   20.895  290.125   11.097 -26.39856 23.65868 
1 1 1   15    4   42 o  362.643   6.8538  100.892   3.8044   95.829   5.5473  105.388   5.2274  352.892   10.270  370.269   9.2235 -17.37747 13.80378 
1 1 1   15    4   43 o  243.223   9.2954   45.497   3.4605   43.801   5.1996   46.846   4.6365  237.418   14.376  246.350   12.296 -8.931763 18.91739 
1 1 1   15    4   44 o  100.639   22.878   8.3058   3.4444   15.760   6.7747   5.7073   3.9999  136.426   32.839   84.950   27.197 51.47638 42.63844 
1 1 1   15    4   45 o  118.227   19.301   11.227   3.3722   16.610   4.6016   4.9827   4.9562  143.636   21.599   83.737   30.208 59.89843 37.13538 
1 1 1   15    4   46 o  177.825   13.553   24.656   3.6612   22.878   4.8912   26.921   5.5214  169.684   19.168  183.968   19.927 -14.28340 27.64955 
1 1 1   15    4   47 o  287.424   8.7524   63.599   3.8505   58.850   5.6239   67.789   5.2831  275.416   13.341  296.069   11.658 -20.65283 17.71665 
1 1 1   15    4   48 o   89.875   23.274   6.6938   3.2271   6.8001   4.7433   6.6022   4.4033   91.546   29.649   89.990   28.506 1.556808 41.12983 
1 1 1   15    4   49 o  252.711   9.9602   49.302   3.8527   48.786   5.5728   49.775   5.3322  249.729   14.643  252.542   13.847 -2.813004 20.15371 
1 1 1   15    4   50 o  170.554   14.557   22.863   3.7637   16.825   5.1731   29.653   5.4860  142.549   24.598  192.806   18.830 -50.25668 30.97760 
1 1 1   15    4   51 f  271.327   10.405   56.959   4.3213   62.349   5.8663   50.563   6.3898  282.810   13.552  253.041   16.590 29.76917 21.42120 
1 1 1   15    4   52 o  167.316   15.612   22.165   3.9519   25.496   6.0416   19.674   5.2246  176.350   22.925  154.690   22.745 21.65973 32.29361 
1 1 1   15    4   53 o  212.213   14.260   35.443   4.6050   34.446   5.6435   37.430   7.9663  207.542   17.942  212.298   24.994 -4.756149 30.76717 
1 1 1   15    4   54 o  181.370   16.362   26.244   4.4933   26.753   5.4715   25.191   7.8744  181.329   20.049  168.864   31.628 12.46472 37.44715 
1 1 1   15    4   55 o   71.502   27.827   3.2760   4.3791  -6.7003   7.3974   8.6582   5.4334   61.375   29.137   98.746   31.707 -37.37019 43.06134 
1 1 1   15    4   56 o   88.761   26.501   6.8719   3.8752   6.9973   5.0733   6.6962   6.0044   89.919   30.705   89.854   33.121 0.6545258E-01 45.16364 
1 1 1   15    4   57 o   58.146   25.101   0.4263   4.0777   4.7693   4.7326 -12.0888   8.0339   78.366   29.302   56.520   27.668 21.84587 40.30081 
1 1 1   15    4   58 o   94.670   24.140   7.9323   3.5088   1.2860   4.9018   14.916   5.0248   64.843   27.749  129.270   26.291 -64.42667 38.22553 
1 1 1   15    4   59 o   80.033   25.008   5.7058   3.4001   8.1318   4.8033   3.2692   4.8137   92.896   29.810   70.789   28.641 22.10633 41.33920 
1 1 1   15    4   60 o   58.112   23.738   1.7967   3.3442   6.5689   4.7186  -3.0199   4.7404   84.192   29.568   51.413   24.071 32.77895 38.12714 
1 1 1   15    5    0 o  801.370   8.5319  491.748   10.463  491.748   10.463  491.748   10.463  801.370   8.5319  801.370   8.5319 0.000000 0.000000 
1 1 1   15    5    1 o  407.062   5.3557  126.832   3.3369  130.445   6.1853  125.350   3.9631  412.740   9.7907  404.661   6.3985 8.078644 11.69608 
1 1 1   15    5    2 o  431.655   10.137  142.680   6.6972  142.680   6.6972   0.0000   0.0000  431.655   10.137  ?   ?  0.000000 10.13650 
1 1 1   15    5    3 o  372.347   6.9981  106.134   3.9884  122.821   6.2826   94.869   5.1619  400.489   10.249  351.991   9.5810 48.49799 14.02986 
1 1 1   15    5    4 o  571.120   10.620  249.783   9.2835   0.0000   0.0000  249.783   9.2835  ?   ?   571.120   10.620 0.000000 10.61981 
1 1 1   15    5    5 f  1569.58   14.500  1887.58   34.835  1870.08   48.749  1905.85   49.797  1561.41   20.397  1576.23   20.640 -14.81689 29.01862 
1 1 1   15    5    6 o  634.904   6.6898  308.576   6.5012  314.568   8.1329  297.971   10.820  640.997   8.2893  623.757   11.333 17.24054 14.04094 
1 1 1   15    5    7 o  1544.84   11.759  1827.82   27.805  1834.16   34.212  1815.49   47.721  1547.22   14.446  1538.49   20.265 8.733032 24.88698 
1 1 1   15    5    8 o  564.615   6.5992  244.032   5.7032  247.377   7.0392  237.643   9.7298  568.438   8.0904  557.044   11.412 11.39343 13.98855 
1 1 1   15    5    9 o  1368.18   18.608  1435.27   38.967  1435.27   38.967   0.0000   0.0000  1368.18   18.608  ?   ?  0.000000 18.60758 
1 1 1   15    5   10 o  584.362   12.189  261.548   10.902  261.548   10.902   0.0000   0.0000  584.362   12.189  ?   ?  0.000000 12.18876 
1 1 1   15    5   11 o  562.237   8.4587  242.018   7.2794  261.642   11.019  226.819   9.6968  584.459   12.317  544.201   11.641 40.25793 16.94771 
1 1 1   15    5   12 o  574.254   5.4302  252.417   4.7730  253.487   6.8874  251.428   6.6206  575.419   7.8199  573.084   7.5477 2.334900 10.86818 
1 1 1   15    5   13 o  1140.83   6.0667  996.261   10.594  988.452   16.022  1002.33   14.121  1136.20   9.2126  1144.21   8.0629 -8.010986 12.24267 
1 1 1   15    5   14 o  1002.79   5.5796  769.736   8.5642  781.130   13.282  761.627   11.204  1010.06   8.5910  997.432   7.3390 12.63153 11.29896 
1 1 1   15    5   15 o  352.339   4.3280   95.019   2.3341   91.076   3.6470   97.755   3.0377  344.921   6.9079  357.362   5.5535 -12.44147 8.863398 
1 1 1   15    5   16 o  512.653   5.1425  201.167   4.0353  194.161   9.1476  202.860   4.4964  503.467   11.870  514.795   5.7063 -11.32819 13.17081 
1 1 1   15    5   17 o  904.624   5.8383  626.429   8.0839  608.690   13.973  635.354   9.9111  891.520   10.239  910.997   7.1078 -19.47736 12.46467 
1 1 1   15    5   18 o  885.936   5.3530  600.799   7.2588  604.457   11.276  598.210   9.4856  888.509   8.2914  883.964   7.0107 4.545044 10.85803 
1 1 1   15    5   19 o  409.544   5.1585  128.387   3.2337  120.989   6.0080  131.405   3.8368  397.469   9.8755  414.314   6.0503 -16.84451 11.58150 
1 1 1   15    5   20 o  548.161   4.8143  230.001   4.0394  226.371   6.4387  232.357   5.1871  543.744   7.7364  550.931   6.1512 -7.187195 9.883732 
1 1 1   15    5   21 o  337.684   5.5553   87.290   2.8714   82.749   4.9189   89.637   3.5364  328.701   9.7768  342.174   6.7523 -13.47348 11.88189 
1 1 1   15    5   22 o  969.546   7.8067  719.768   11.585  712.585   13.246  743.139   23.894  964.619   8.9717  984.394   15.858 -19.77533 18.21986 
1 1 1   15    5   23 o  1022.61   5.6527  800.531   8.8478  812.946   12.782  789.108   12.260  1030.36   8.1045  1015.15   7.8903 15.20447 11.31102 
1 1 1   15    5   24 o  871.447   5.2884  581.343   7.0540  583.069   10.207  579.766   9.7598  872.618   7.6419  870.161   7.3278 2.456970 10.58747 
1 1 1   15    5   25 o  853.228   5.3067  557.300   6.9305  563.811   10.080  551.463   9.5443  858.070   7.6748  848.642   7.3477 9.428223 10.62501 
1 1 1   15    5   26 o  870.253   5.7816  579.804   7.7012  575.375   10.373  585.245   11.496  866.797   7.8182  874.143   8.5921 -7.345764 11.61667 
1 1 1   15    5   27 o  399.976   5.7165  122.480   3.4998  122.410   5.3604  122.533   4.6204  399.762   8.7604  400.006   7.5465 -0.2440186 11.56265 
1 1 1   15    5   28 o  654.146   5.5253  327.607   5.5322  327.275   8.7598  327.827   7.1352  653.628   8.7557  654.284   7.1247 -0.6558838 11.28825 
1 1 1   15    5   29 o  309.386   7.4766   73.312   3.5406   79.793   6.6751   70.775   4.1765  322.490   13.523  303.933   8.9777 18.55673 16.23166 
1 1 1   15    5   30 o  401.854   6.2126  123.662   3.8213  119.659   6.1440  126.187   4.8801  395.101   10.160  405.864   7.8555 -10.76361 12.84233 
1 1 1   15    5   31 o  240.004   8.1644   44.135   2.9992   50.576   4.7595   39.892   3.8627  256.742   12.112  228.068   11.065 28.67482 16.40500 
1 1 1   15    5   32 o  562.923   5.8629  242.677   5.0517  239.006   8.5409  244.652   6.2650  558.293   9.9947  565.109   7.2430 -6.816101 12.34326 
1 1 1   15    5   33 o  102.209   17.851   8.2809   2.6911   7.0803   4.2645   9.0754   3.4690   94.534   27.692  106.417   22.023 -11.88260 35.38177 
1 1 1   15    5   34 o  432.920   6.9563  143.603   4.6095  141.322   5.8516  147.333   7.4827  429.307   8.9051  438.102   11.159 -8.794769 14.27643 
1 1 1   15    5   35 o  373.620   6.9004  106.969   3.9462  111.025   5.5152  102.714   5.6486  380.422   9.4717  365.847   10.087 14.57507 13.83715 
1 1 1   15    5   36 o  628.338   5.5800  302.434   5.3665  316.451   8.0878  291.407   7.1731  642.384   8.2256  616.532   7.6012 25.85217 11.19995 
1 1 1   15    5   37 o  432.784   7.1601  143.586   4.7431  152.063   7.7899  138.592   5.9791  444.797   11.442  424.960   9.1922 19.83743 14.67704 
1 1 1   15    5   38 o  304.413   7.9069   71.079   3.6842   76.857   6.7644   68.642   4.3929  315.789   13.995  298.990   9.5989 16.79892 16.97033 
1 1 1   15    5   39 o  198.217   12.503   30.373   3.7741   33.901   6.3774   28.472   4.6819  207.833   20.307  191.236   16.146 16.59793 25.94354 
1 1 1   15    5   40 o  333.323   7.1113   85.217   3.6281   83.037   5.8675   86.566   4.6165  328.422   11.672  335.731   8.9836 -7.308777 14.72900 
1 1 1   15    5   41 f  234.109   9.2577   42.117   3.3173   44.423   5.2650   40.599   4.2720  239.311   14.441  229.184   12.222 10.12662 18.91904 
1 1 1   15    5   42 o  121.541   16.012   11.647   2.9063   10.586   4.2848   12.552   3.9552  113.604   25.292  124.918   21.459 -11.31363 33.16858 
1 1 1   15    5   43 o  107.303   19.729   9.2768   3.1209   6.3174   4.8177   11.417   4.0968   90.152   29.917  118.349   23.445 -28.19672 38.00863 
1 1 1   15    5   44 o  431.874   7.2768  143.224   4.8102  139.381   8.5575  144.999   5.8161  424.419   13.173  434.217   8.7509 -9.797852 15.81467 
1 1 1   15    5   45 o  226.461   10.540   39.547   3.6533   35.236   5.1425   43.939   5.1911  212.169   15.952  237.531   14.345 -25.36189 21.45336 
1 1 1   15    5   46 o  334.796   8.5959   86.243   4.4050   85.014   5.9773   87.704   6.5167  331.627   11.776  336.576   12.650 -4.949402 17.28226 
1 1 1   15    5   47 o  200.361   11.631   31.148   3.5518   35.636   5.1982   27.217   4.8643  213.092   16.055  185.679   17.315 27.41287 23.61328 
1 1 1   15    5   48 o  180.695   12.862   25.455   3.5342   25.660   5.1448   25.271   4.8632  179.513   19.014  178.475   18.050 1.038391 26.21705 
1 1 1   15    5   49 o   70.244   25.015   3.5485   3.3879   1.6734   4.6295   5.7106   4.9713   67.727   27.827   86.373   30.349 -18.64552 41.17537 
1 1 1   15    5   50 o  346.697   8.7757   92.667   4.6569   98.113   6.4122   86.589   6.7745  355.698   11.778  333.569   13.269 22.12900 17.74171 
1 1 1   15    5   51 o  108.034   23.766   9.7722   3.8232   10.019   5.2873   9.5020   5.5347  107.666   30.626  104.999   31.744 2.667885 44.10912 
1 1 1   15    5   52 o   58.650   25.499  -0.1481   4.2681  -1.4730   5.1640   2.7083   7.5824   60.398   27.060   83.599   35.085 -23.20144 44.30785 
1 1 1   15    5   53 f   49.843   22.676  -1.8626   3.7919  -3.2020   4.8937   0.1500   5.9987   54.182   25.056   69.161   30.147 -14.97837 39.20024 
1 1 1   15    5   54 o   98.093   24.435   8.2348   3.6552   3.0382   5.2072   13.283   5.1321   74.309   29.886  123.504   27.817 -49.19550 40.82792 
1 1 1   15    5   55 o  131.635   21.709   14.475   4.2216   8.7731   7.4385   17.184   5.1273  100.489   36.891  142.186   24.440 -41.69680 44.25254 
1 1 1   15    5   56 o   65.481   25.558   2.6643   3.7024   3.1526   4.7178   1.8814   5.9738   71.890   28.605   72.644   30.848 -0.7537918 42.06938 
1 1 1   15    5   57 o   75.403   26.512   4.6383   3.7941   3.6106   4.7337   6.4846   6.3448   73.306   28.815   88.714   33.760 -15.40801 44.38507 
1 1 1   15    5   58 o  191.178   13.601   29.159   3.9539   24.985   5.0754   35.603   6.3062  173.247   19.477  206.484   20.212 -33.23625 28.06950 
1 1 1   15    5   59 o  149.235   16.064   18.222   3.6115   20.725   4.6442   14.394   5.7443  156.750   19.798  122.392   30.713 34.35825 36.54094 
1 1 1   15    5   60 o   52.531   23.008   0.1363   3.5313   1.1257   5.1121  -0.7667   4.8838   63.970   27.859   57.568   26.008 6.402458 38.11221 
1 1 1   15    6    0 o  964.802   9.6739  712.784   14.283  712.784   14.283  712.784   14.283  964.802   9.6739  964.802   9.6739 0.000000 0.000000 
1 1 1   15    6    1 o  591.641   5.1137  267.928   4.6309  269.154   6.5920  266.733   6.5069  592.950   7.2632  590.279   7.2019 2.670776 10.22849 
1 1 1   15    6    2 o  985.753   9.8358  744.055   14.841  744.055   14.841   0.0000   0.0000  985.753   9.8358  ?   ?  0.000000 9.835842 
1 1 1   15    6    3 o  1365.46   12.836  1428.19   26.828  1430.56   38.113  1425.86   37.772  1365.97   18.229  1363.74   18.095 2.230591 25.68517 
1 1 1   15    6    4 f  856.018   12.955  561.307   16.975   0.0000   0.0000  561.307   16.975  ?   ?   856.018   12.955 0.000000 12.95522 
1 1 1   15    6    5 o  685.216   8.3116  359.465   8.7173  360.087   12.439  358.864   12.220  685.677   11.852  684.519   11.663 1.157715 16.62840 
1 1 1   15    6    6 o  1432.87   13.508  1572.83   29.626  1557.62   41.481  1588.68   42.327  1425.24   19.015  1439.35   19.213 -14.10974 27.03123 
1 1 1   15    6    7 f  1036.24   8.7430  822.132   13.867  836.258   17.340  797.067   23.098  1044.99   10.841  1019.93   14.795 25.05847 18.34209 
1 1 1   15    6    8 o  1001.06   8.5387  767.238   13.083  771.313   16.105  759.327   22.438  1003.62   10.484  995.502   14.725 8.113953 18.07605 
1 1 1   15    6   10 o  292.174   7.2979   65.351   3.2637   66.254   3.9651   63.453   5.7471  294.168   8.8063  287.809   13.046 6.358429 15.73991 
1 1 1   15    6   11 o  1419.40   11.067  1542.91   24.044  1551.95   29.672  1525.62   41.030  1423.30   13.620  1410.49   19.005 12.81116 23.38122 
1 1 1   15    6   12 o  1205.26   7.5361  1112.09   13.903  1110.64   17.794  1114.38   22.274  1204.35   9.6530  1206.20   12.064 -1.852905 15.45083 
1 1 1   15    6   13 f  1675.86   8.9552  2150.39   22.971  2189.35   33.067  2114.04   31.935  1690.57   12.779  1661.27   12.559 29.30591 17.91731 
1 1 1   15    6   14 o  696.145   5.6153  370.954   5.9834  380.459   7.7549  356.973   9.4055  704.964   7.1869  682.800   8.9995 22.16425 11.51701 
1 1 1   15    6   15 o  1041.32   5.7709  830.032   9.1980  841.433   14.299  821.984   12.013  1048.30   8.9114  1036.18   7.5747 12.11597 11.69569 
1 1 1   15    6   16 o  544.466   4.7130  226.904   3.9277  218.487   6.6412  231.432   4.8709  534.198   8.1222  549.851   5.7875 -15.65338 9.973228 
1 1 1   15    6   17 o  470.414   4.9347  169.383   3.5531  168.727   6.7944  169.630   4.1685  469.400   9.4566  470.743   5.7854 -1.342896 11.08596 
1 1 1   15    6   18 o  395.958   4.7857  120.007   2.9004  119.100   4.8047  120.528   3.6381  394.404   7.9589  396.798   5.9901 -2.394379 9.961219 
1 1 1   15    6   19 o  1369.58   7.1322  1436.07   14.951  1451.29   23.252  1425.35   19.523  1376.47   11.036  1364.28   9.3490 12.19092 14.46377 
1 1 1   15    6   20 o  492.627   5.2882  185.767   3.9874  188.031   6.0269  184.004   5.3176  495.554   7.9457  490.243   7.0866 5.311005 10.64678 
1 1 1   15    6   21 o  549.644   5.3948  231.261   4.5386  218.793   6.5842  242.550   6.2649  534.546   8.0472  562.846   7.2720 -28.29932 10.84620 
1 1 1   15    6   22 o  282.682   7.8623   61.187   3.4019   61.978   4.8868   60.444   4.7385  284.426   11.225  280.889   11.021 3.536743 15.73125 
1 1 1   15    6   23 o  476.024   5.3284  173.463   3.8824  165.488   6.4180  178.065   4.8756  464.843   9.0203  482.265   6.6050 -17.42184 11.17998 
1 1 1   15    6   24 o  154.698   10.751   18.423   2.5298   13.506   4.8828   20.228   2.9577  130.243   25.406  162.021   12.012 -31.77791 28.10222 
1 1 1   15    6   25 o  273.309   8.0579   57.204   3.3709   55.066   5.5639   58.445   4.2370  267.645   13.627  276.208   10.022 -8.562622 16.91521 
1 1 1   15    6   26 o  376.946   6.1583  108.786   3.5531  111.855   5.0525  105.784   4.9976  382.151   8.6378  371.630   8.7859 10.52078 12.32084 
1 1 1   15    6   27 o  109.616   15.270   9.3973   2.4924   9.8658   4.0151   9.1037   3.1791  111.026   24.301  107.086   20.134 3.940086 31.55856 
1 1 1   15    6   28 o  530.253   7.0388  215.319   5.7128   0.0000   0.0000  215.319   5.7128  ?   ?   530.253   7.0388 0.000000 7.038771 
1 1 1   15    6   29 o  396.037   6.4621  120.107   3.9172  120.984   7.3279  119.757   4.6350  397.185   12.054  395.411   7.6583 1.774414 14.28069 
1 1 1   15    6   30 f  315.292   6.6940   76.134   3.2305   82.602   5.1480   71.932   4.1491  328.254   10.246  306.386   8.8475 21.86743 13.53739 
1 1 1   15    6   31 f  463.970   6.1957  164.862   4.4000  171.370   7.7515  161.768   5.3444  472.714   10.713  459.516   7.5985 13.19839 13.13431 
1 1 1   15    6   32 o  439.846   5.8442  148.163   3.9346  146.668   5.9685  149.312   5.2325  437.422   8.9144  441.433   7.7441 -4.010803 11.80841 
1 1 1   15    6   33 o  335.661   6.6059   86.311   3.3939   85.405   5.1799   86.993   4.4926  333.672   10.142  336.861   8.7133 -3.189178 13.37110 
1 1 1   15    6   34 o  455.727   6.1064  159.094   4.2595  163.878   5.9781  154.161   6.0707  462.331   8.4478  448.377   8.8456 13.95462 12.23152 
1 1 1   15    6   35 o  580.433   6.5681  258.146   5.8353  254.868   8.7932  260.725   7.8003  576.287   9.9687  583.057   8.7404 -6.769470 13.25786 
1 1 1   15    6   36 o  354.443   7.6152   96.318   4.1314   92.517   6.8554   98.485   5.1771  346.802   12.915  358.238   9.4416 -11.43576 15.99790 
1 1 1   15    6   37 o  455.617   6.4214  159.089   4.4782  159.651   8.0195  158.835   5.3982  455.727   11.497  455.109   7.7493 0.6182556 13.86455 
1 1 1   15    6   38 o  335.561   7.2926   86.344   3.7456   89.927   5.2676   82.680   5.3271  342.150   10.058  328.004   10.611 14.14621 14.62031 
1 1 1   15    6   39 o  130.840   13.759   13.344   2.7142   15.775   4.1569   11.537   3.5836  141.150   19.784  120.237   20.188 20.91284 28.26547 
1 1 1   15    6   40 o  166.716   11.537   21.498   2.9259   20.632   4.7053   22.043   3.7361  161.749   19.392  168.292   14.650 -6.543030 24.30373 
1 1 1   15    6   41 o  350.901   7.0845   94.466   3.8051   96.923   6.2332   93.007   4.8041  354.728   11.480  347.915   9.0213 6.812317 14.60053 
1 1 1   15    6   42 o  221.643   9.4717   37.778   3.2133   42.463   5.0397   34.569   4.1711  233.879   14.145  211.190   12.966 22.68861 19.18848 
1 1 1   15    6   43 o  358.463   6.9731   98.623   3.8260   98.366   5.7079   98.834   5.1556  357.357   10.435  358.424   9.3975 -1.066589 14.04307 
1 1 1   15    6   44 o  254.179   9.8669   49.757   3.8387   46.244   7.3987   51.051   4.4904  241.873   20.169  257.191   11.407 -15.31842 23.17091 
1 1 1   15    6   45 o  265.841   9.0551   54.392   3.6846   52.311   5.1172   56.632   5.3096  259.963   12.860  270.496   12.824 -10.53290 18.16179 
1 1 1   15    6   46 o  247.383   10.375   47.207   3.9286   51.446   5.3741   42.343   5.7574  257.148   13.703  232.421   16.287 24.72708 21.28458 
1 1 1   15    6   47 o  254.915   9.3586   50.074   3.6515   54.785   5.4014   46.109   4.9555  265.717   13.281  243.403   13.352 22.31445 18.83224 
1 1 1   15    6   48 o   99.423   22.452   8.1745   3.3360   4.8771   4.6314   11.730   4.8091   81.606   29.228  118.037   27.180 -36.43036 39.91270 
1 1 1   15    6   49 o  336.973   9.2634   87.575   4.7779   85.948   6.2278   89.903   7.4490  332.882   12.223  339.608   14.330 -6.726593 18.83479 
1 1 1   15    6   50 o  129.270   19.514   13.519   3.7408   14.243   5.0023   12.600   5.6347  130.278   25.997  120.771   30.480 9.506470 40.06075 
1 1 1   15    6   51 o  186.296   14.831   27.323   4.1940   27.815   5.5617   26.675   6.3855  185.975   19.845  180.262   23.719 5.713287 30.92587 
1 1 1   15    6   52 o  145.682   17.519   17.012   3.8282   10.240   5.5697   23.075   5.2704  108.190   31.635  168.497   20.883 -60.30746 37.90575 
1 1 1   15    6   53 o  117.397   20.731   11.376   3.5890   11.247   5.2877   11.486   4.8871  113.087   30.040  115.032   28.017 -1.945137 41.07681 
1 1 1   15    6   54 o  272.795   11.251   57.926   4.6980   49.472   8.4637   61.690   5.6479  244.934   22.839  280.659   13.147 -35.72516 26.35292 
1 1 1   15    6   55 o  172.754   15.679   23.855   4.1008   24.386   6.5208   23.507   5.2742  168.708   26.094  168.806   20.856 -0.9782410E-01 33.40521 
1 1 1   15    6   56 o   48.518   22.217  -1.9315   3.7169  -4.7616   4.7011   2.7875   6.0705   48.874   23.210   75.765   31.564 -26.89090 39.17865 
1 1 1   15    6   57 f   93.994   23.925   7.7324   3.4509   7.7404   4.7733   7.7236   4.9950   92.607   29.716   92.509   30.451 0.9742737E-01 42.54776 
1 1 1   15    6   58 o  141.873   18.058   16.658   3.8325   13.190   4.8762   22.262   6.1988  120.544   27.088  158.022   26.571 -37.47871 37.94460 
1 1 1   15    6   59 f  167.729   15.019   22.815   3.8149   24.700   5.5651   21.144   5.2399  169.411   21.979  156.139   22.581 13.27135 31.51172 
1 1 1   15    6   60 o  194.449   17.692   31.439   5.2081   31.914   7.5661   31.012   7.1799  186.330   27.342  184.999   26.080 1.331619 37.78545 
1 1 1   15    7    0 o  102.513   10.361   8.2886   1.5876   8.2886   1.5876   8.2886   1.5876  102.513   10.361  102.513   10.361 0.000000 0.000000 
1 1 1   15    7    1 o  508.667   6.8770  198.069   5.3543  198.069   5.3543   0.0000   0.0000  508.667   6.8770  ?   ?  0.000000 6.877023 
1 1 1   15    7    2 o  431.556   4.6430  142.549   3.0669  138.807   4.2991  146.427   4.3765  425.828   6.5960  437.362   6.5375 -11.53357 9.286874 
1 1 1   15    7    3 o  750.306   8.5716  431.010   9.8440  402.628   13.165  467.003   14.825  725.050   11.863  780.837   12.404 -55.78735 17.16369 
1 1 1   15    7    4 o  630.859   7.5508  304.676   7.2911  300.324   9.7465  310.206   10.987  626.260   10.168  636.440   11.279 -10.17957 15.18508 
1 1 1   15    7    5 f  197.675   9.7683   29.920   2.9556   28.517   4.1740   31.331   4.1856  192.400   14.275  201.774   13.633 -9.373413 19.73909 
1 1 1   15    7    6 o  279.855   8.7100   59.963   3.7310   57.928   5.2724   62.004   5.2805  275.007   12.525  284.523   12.125 -9.516388 17.43283 
1 1 1   15    7    7 o  889.119   7.9518  605.211   10.822  618.589   13.519  581.354   18.054  898.813   9.8270  871.140   13.540 27.67279 16.73018 
1 1 1   15    7    8 o  719.382   7.2204  396.170   7.9505  406.508   9.9191  377.593   13.296  728.656   8.8937  702.122   12.372 26.53308 15.23698 
1 1 1   15    7    9 o  913.099   9.9593  638.425   13.919  638.425   13.919   0.0000   0.0000  913.099   9.9593  ?   ?  0.000000 9.959265 
1 1 1   15    7   10 o  883.795   8.0454  597.996   10.883  608.199   13.505  579.095   18.382  891.221   9.9002  869.414   13.813 21.80725 16.99445 
1 1 1   15    7   11 o  654.826   7.1456  328.259   7.1620  328.486   8.7745  327.806   12.397  655.006   8.7520  654.187   12.380 0.8187866 15.16151 
1 1 1   15    7   12 o  1116.47   7.9883  954.314   13.651  960.068   15.792  937.300   27.154  1119.76   9.2139  1105.86   16.042 13.90442 18.49983 
1 1 1   15    7   13 o  1327.54   7.4431  1349.20   15.124  1372.94   21.680  1326.68   21.109  1338.94   10.578  1316.20   10.478 22.74182 14.88926 
1 1 1   15    7   14 o  513.683   4.8269  201.973   3.7952  199.954   5.2739  204.140   5.4656  511.076   6.7418  516.394   6.9149 -5.317505 9.657489 
1 1 1   15    7   15 o  956.992   6.0113  701.060   8.8053  705.443   12.448  696.671   12.457  959.871   8.4727  953.881   8.5320 5.989807 12.02420 
1 1 1   15    7   16 o  514.321   5.3802  202.484   4.2355  195.895   6.4395  207.508   5.6230  505.818   8.3175  520.627   7.0562 -14.80960 10.90732 
1 1 1   15    7   17 o  1528.83   8.3747  1789.65   19.597  1814.09   34.781  1778.28   23.722  1538.46   14.770  1523.80   10.171 14.66711 17.93321 
1 1 1   15    7   18 o  540.113   4.6662  223.294   3.8576  231.187   6.2701  218.487   4.8932  549.511   7.4547  534.241   5.9840 15.26984 9.559314 
1 1 1   15    7   19 o  729.877   5.4464  407.788   6.0845  411.000   8.8182  404.869   8.4062  732.658   7.8634  727.186   7.5524 5.472351 10.90281 
1 1 1   15    7   20 o  1020.69   6.3868  797.563   9.9780  810.461   14.466  785.856   13.781  1028.74   9.1868  1013.02   8.8880 15.71448 12.78256 
1 1 1   15    7   21 o  177.515   8.5973   24.131   2.3360   26.839   4.2222   22.936   2.8042  186.505   14.915  172.709   10.660 13.79607 18.33307 
1 1 1   15    7   22 o  234.237   8.9991   42.020   3.2264   43.055   4.6296   41.042   4.4990  236.673   12.828  231.064   12.770 5.608521 18.10056 
1 1 1   15    7   23 o  863.800   5.6043  571.203   7.4097  576.444   11.681  567.674   9.5851  867.573   8.7961  861.044   7.2728 6.529358 11.41342 
1 1 1   15    7   24 o  459.570   5.4114  161.684   3.8065  165.523   6.5542  159.730   4.6760  464.871   9.2112  456.751   6.6884 8.119751 11.38342 
1 1 1   15    7   25 o  902.035   6.2619  622.962   8.6457  620.084   12.565  625.550   11.915  899.746   9.1236  903.745   8.6134 -3.998657 12.54713 
1 1 1   15    7   26 f  111.170   15.698   9.6705   2.5968   13.968   5.1926   8.2375   2.9987  132.261   26.572  101.779   19.962 30.48180 33.23486 
1 1 1   15    7   27 o  577.908   5.8486  255.704   5.1735  265.884   9.9993  251.983   6.0455  588.984   11.092  573.642   6.8853 15.34186 13.05497 
1 1 1   15    7   28 o  596.189   5.9061  272.152   5.3896  273.088   10.326  271.801   6.3185  596.843   11.303  595.753   6.9291 1.090088 13.25809 
1 1 1   15    7   29 o  287.286   7.9733   63.224   3.5061   71.044   8.5296   61.634   3.8460  303.354   18.458  283.619   8.8594 19.73547 20.47376 
1 1 1   15    7   30 o  286.781   6.9554   62.993   3.0531   62.778   4.8212   63.137   3.9449  286.115   11.009  287.031   8.9792 -0.9164429 14.20647 
1 1 1   15    7   31 o   97.561   20.203   7.6083   2.9176   14.428   6.0184   5.5134   3.3358  133.592   30.149   83.660   24.488 49.93247 38.84045 
1 1 1   15    7   32 o  259.320   7.7013   51.529   3.0568   54.499   4.8421   49.561   3.9415  266.461   11.872  254.203   10.130 12.25801 15.60669 
1 1 1   15    7   33 o  278.133   7.2688   59.276   3.0945   63.975   4.9132   56.187   3.9839  288.709   11.118  270.663   9.6164 18.04669 14.70005 
1 1 1   15    7   34 o  145.596   14.862   16.483   3.2656   21.396   5.7525   14.147   3.9668  164.439   23.526  133.846   19.974 30.59351 30.86115 
1 1 1   15    7   35 o  139.682   17.838   15.306   3.7268   14.541   5.6206   15.906   4.9785  133.897   28.310  141.161   23.894 -7.264313 37.04596 
1 1 1   15    7   36 o  112.689   15.512   9.9718   2.6047   12.208   4.0409   8.3819   3.4069  123.550   22.183  101.913   22.447 21.63728 31.55906 
1 1 1   15    7   37 o  274.577   7.3243   57.806   3.0782   57.804   4.6822   57.808   4.0852  274.237   11.155  274.388   9.7270 -0.1506042 14.80001 
1 1 1   15    7   38 o  197.318   10.226   29.994   3.0778   34.732   4.2849   24.944   4.4238  211.918   13.277  178.912   16.334 33.00560 21.04975 
1 1 1   15    7   39 o  281.094   7.2645   60.603   3.1256   62.812   4.8005   58.978   4.1180  285.768   10.975  277.060   9.7106 8.708496 14.65413 
1 1 1   15    7   40 o  289.078   7.5172   64.119   3.3261   68.740   5.3891   61.276   4.2274  298.753   11.785  282.344   9.7819 16.40900 15.31582 
1 1 1   15    7   41 o  133.556   14.639   13.958   2.9435   14.618   4.7720   13.552   3.7396  134.387   24.084  130.527   19.300 3.859940 30.86315 
1 1 1   15    7   42 o  305.585   7.4021   71.683   3.4622   75.258   5.2199   68.875   4.6263  312.560   10.911  299.152   10.104 13.40811 14.87045 
1 1 1   15    7   43 o  193.311   11.855   28.949   3.4909   32.021   6.7372   27.822   4.0816  200.403   22.344  188.993   14.214 11.40939 26.48190 
1 1 1   15    7   44 o   99.746   19.623   8.0610   2.8892   5.8733   4.3928   9.7287   3.8355   86.614   28.559  108.789   23.704 -22.17496 37.11421 
1 1 1   15    7   45 o  201.080   11.334   31.318   3.4741   36.333   4.9186   26.326   4.9077  215.702   14.991  182.657   17.779 33.04518 23.25561 
1 1 1   15    7   46 o  223.923   11.282   38.836   3.8545   39.944   5.2441   37.534   5.6845  226.007   15.249  218.437   17.140 7.570648 22.94084 
1 1 1   15    7   47 o  146.761   16.302   17.026   3.6002   23.546   4.9241   9.5371   5.2770  171.982   19.024  106.239   30.714 65.74356 36.12895 
1 1 1   15    7   48 o  183.226   14.269   26.289   3.9703   23.742   5.1694   29.952   6.1996  172.185   19.986  193.077   21.334 -20.89256 29.23343 
1 1 1   15    7   49 o  205.873   11.656   32.941   3.6579   34.073   5.3255   31.931   5.0329  207.668   16.901  201.145   16.492 6.522171 23.61405 
1 1 1   15    7   50 o   77.913   27.208   4.6141   3.9925   7.3345   4.6837  -2.6170   7.6361   93.688   29.363   71.558   32.407 22.12971 43.73111 
1 1 1   15    7   51 o  118.087   20.512   11.418   3.5730   19.538   5.4224   5.1861   4.7502  153.814   23.800   82.738   29.604 71.07610 37.98473 
1 1 1   15    7   52 o  191.282   13.465   28.711   3.9171   29.700   6.1191   28.024   5.0988  191.146   21.276  187.164   18.021 3.981979 27.88211 
1 1 1   15    7   53 o  141.787   18.623   16.283   3.9438   12.901   6.1999   18.582   5.1113  119.854   32.828  149.556   23.070 -29.70221 40.12410 
1 1 1   15    7   54 o   61.524   24.541   1.9587   3.4807   1.3040   4.9474   2.6004   4.8977   66.789   28.201   71.179   28.858 -4.390495 40.34961 
1 1 1   15    7   55 o  122.740   22.695   12.740   4.1066   15.359   6.5241   11.022   5.2850  129.053   32.922  110.472   30.331 18.58093 44.76422 
1 1 1   15    7   56 o  119.430   21.233   12.003   3.7392   14.893   4.9132   8.0237   5.7643  130.997   25.421   94.937   32.718 36.06001 41.43279 
1 1 1   15    7   57 o   84.547   24.863   6.2756   3.4318   3.6829   4.6462   9.3882   5.0908   73.022   28.595  100.697   30.444 -27.67499 41.76728 
1 1 1   15    7   58 o  145.875   19.314   17.809   4.2064   11.746   5.6405   25.405   6.3138  110.346   31.712  170.091   24.997 -59.74494 40.37933 
1 1 1   15    7   59 o  159.959   16.145   20.964   3.8989   13.353   5.6905   27.699   5.3528  116.967   31.207  181.372   19.593 -64.40448 36.84755 
1 1 1   15    8    0 o  617.626   7.4930  292.110   7.0812  292.110   7.0812  292.110   7.0812  617.626   7.4930  617.626   7.4930 0.000000 0.000000 
1 1 1   15    8    1 o  1110.35   7.6304  943.834   12.968  949.628   18.464  938.194   18.218  1113.58   10.833  1106.86   10.753 6.719360 15.26352 
1 1 1   15    8    2 o  1307.86   8.7086  1309.60   17.433  1289.69   24.200  1331.08   25.135  1297.63   12.184  1318.26   12.457 -20.63281 17.42490 
1 1 1   15    8    3 f  540.439   7.2897  223.592   6.0301  224.184   8.1287  222.866   8.9922  541.092   9.8148  539.468   10.890 1.624329 14.66031 
1 1 1   15    8    4 o  719.338   8.4487  396.160   9.3023  386.440   12.746  407.239   13.608  710.334   11.723  729.178   12.192 -18.84424 16.91359 
1 1 1   15    8    5 o  1326.11   12.666  1347.01   25.710  1360.92   36.713  1333.62   36.015  1332.36   18.002  1318.95   17.839 13.40735 25.34433 
1 1 1   15    8    6 f  338.162   5.8472   87.533   3.0265   84.693   3.4416   97.222   6.3570  332.621   6.7599  356.290   11.657 -23.66879 13.47500 
1 1 1   15    8    7 o  826.179   6.5144  522.502   8.2380  520.263   9.4062  529.872   17.067  824.378   7.4545  831.676   13.407 -7.298523 15.34018 
1 1 1   15    8    8 o  1207.44   8.4046  1116.19   15.533  1135.07   18.192  1065.39   29.838  1217.53   9.7620  1178.99   16.535 38.53735 19.20139 
1 1 1   15    8    9 o  1118.99   11.330  958.958   19.405  958.958   19.405   0.0000   0.0000  1118.99   11.330  ?   ?  0.000000 11.32959 
1 1 1   15    8   10 o  546.313   6.9089  228.476   5.7773  224.001   6.9295  238.678   10.463  540.903   8.3698  558.217   12.245 -17.31445 14.83233 
1 1 1   15    8   11 o  1030.94   7.5396  813.674   11.897  818.051   13.714  800.362   23.919  1033.66   8.6681  1021.95   15.291 11.70361 17.57724 
1 1 1   15    8   12 o  808.580   6.6017  500.493   8.1705  505.188   9.3949  485.920   16.552  812.332   7.5560  796.391   13.579 15.94080 15.53930 
1 1 1   15    8   13 o  1089.86   7.9179  909.379   13.208  915.971   15.268  889.771   26.331  1093.73   9.1203  1077.42   15.967 16.31702 18.38810 
1 1 1   15    8   14 o  578.283   6.8960  256.006   6.1039  256.006   6.1039   0.0000   0.0000  578.283   6.8960  ?   ?  0.000000 6.896001 
1 1 1   15    8   15 o  708.013   5.2728  383.708   5.7141  380.467   7.9286  387.211   8.2426  704.956   7.3479  711.169   7.5722 -6.212891 10.55130 
1 1 1   15    8   16 o  273.184   7.4164   57.136   3.1011   57.975   5.9714   56.827   3.6289  274.677   14.252  272.424   8.7027 2.253632 16.69909 
1 1 1   15    8   17 f  955.838   6.7069  699.433   9.8125  709.417   12.694  684.608   15.468  962.537   8.6160  945.424   10.689 17.11285 13.72891 
1 1 1   15    8   18 o  522.394   5.8012  208.903   4.6386  206.510   5.8866  212.822   7.5339  519.354   7.4052  527.169   9.3369 -7.814880 11.91697 
1 1 1   15    8   19 o  970.013   6.2578  720.319   9.2911  736.826   13.326  704.703   12.961  980.916   8.8753  959.299   8.8272 21.61725 12.51760 
1 1 1   15    8   20 o  422.350   4.9519  136.543   3.2012  132.702   5.2304  138.844   4.0480  416.296   8.2084  425.869   6.2100 -9.573761 10.29285 
1 1 1   15    8   21 o  651.646   5.3935  325.065   5.3797  325.899   8.0019  324.377   7.2671  652.385   8.0135  650.890   7.2943 1.495544 10.83616 
1 1 1   15    8   22 o  1011.45   6.5228  783.232   10.098  806.652   14.705  762.332   13.892  1026.25   9.3616  997.684   9.0968 28.56921 13.05335 
1 1 1   15    8   23 o  249.869   6.8827   47.803   2.6323   55.871   4.9476   44.618   3.1089  270.010   11.971  241.374   8.4148 28.63644 14.63289 
1 1 1   15    8   24 o  788.437   5.9250  475.910   7.1503  483.133   10.565  469.806   9.7128  794.237   8.6907  783.245   8.1017 10.99261 11.88134 
1 1 1   15    8   25 o  884.566   5.7605  599.038   7.7994  604.543   12.430  595.463   10.017  888.382   9.1411  881.819   7.4212 6.562988 11.77431 
1 1 1   15    8   26 f  983.846   6.5122  741.152   9.8068  757.928   17.742  733.771   11.768  994.380   11.657  978.825   7.8546 15.55463 14.05601 
1 1 1   15    8   27 o  180.296   10.125   24.989   2.7830   24.224   5.4757   25.255   3.2314  176.241   20.692  181.124   11.719 -4.883026 23.78017 
1 1 1   15    8   28 o  284.562   7.7100   62.024   3.3582   62.154   7.2089   61.988   3.7951  283.940   16.660  284.447   8.7167 -0.5069580 18.80277 
1 1 1   15    8   29 o  148.158   13.430   16.984   3.0124   10.640   7.9455   18.049   3.2554  118.233   38.381  152.689   14.088 -34.45650 40.88474 
1 1 1   15    8   30 o  297.359   7.4399   67.737   3.3862   64.462   6.3480   69.040   4.0034  289.699   14.316  300.150   8.7140 -10.45108 16.75950 
1 1 1   15    8   31 o  213.873   9.2918   35.066   3.0417   45.237   5.8660   31.326   3.5574  242.003   15.925  201.721   11.570 40.28232 19.68430 
1 1 1   15    8   32 o  139.793   13.446   15.152   2.8417   14.404   5.6137   15.410   3.2950  133.577   28.334  140.681   15.563 -7.103745 32.32708 
1 1 1   15    8   33 o  534.657   6.2735  218.981   5.1340  228.776   8.3533  213.035   6.5084  546.081   9.9939  527.183   8.0657 18.89850 12.84260 
1 1 1   15    8   34 o  285.416   7.5936   62.441   3.3174   63.077   4.6557   61.786   4.7280  286.652   10.611  283.681   10.889 2.970886 15.20405 
1 1 1   15    8   35 o  439.111   6.3677  147.745   4.2798  144.845   5.8228  151.153   6.3119  434.547   8.7544  443.844   9.2910 -9.296844 12.76569 
1 1 1   15    8   36 o  496.636   5.5739  188.954   4.2371  192.910   6.3643  185.804   5.6784  501.501   8.2911  492.274   7.5361 9.227509 11.20423 
1 1 1   15    8   37 o  108.234   17.415   9.2834   2.7873   11.134   3.9962   7.5306   3.8896  117.567   23.031   96.391   25.837 21.17573 34.61177 
1 1 1   15    8   38 o  336.792   7.1337   86.982   3.6775   87.573   5.0953   86.340   5.3130  337.628   9.8596  335.177   10.356 2.450867 14.29897 
1 1 1   15    8   39 o  387.395   6.1564  115.041   3.6505  122.398   5.6025  109.614   4.8123  399.194   9.1691  377.892   8.3198 21.30124 12.38107 
1 1 1   15    8   40 o  303.650   7.4059   70.747   3.4421   73.249   5.8667   69.434   4.2505  308.251   12.434  300.603   9.2381 7.647705 15.49040 
1 1 1   15    8   41 o  402.442   6.8304  124.250   4.2074  143.894   7.7780  116.124   5.0026  432.065   11.761  388.818   8.4057 43.24661 14.45618 
1 1 1   15    8   42 o  153.974   11.961   18.399   2.7967   15.401   4.2331   20.722   3.7257  138.814   20.543  162.818   15.123 -24.00423 25.50931 
1 1 1   15    8   43 o  329.776   8.0768   83.568   4.0769   91.914   7.7057   80.324   4.8044  344.266   14.623  323.019   9.7172 21.24741 17.55758 
1 1 1   15    8   44 o   75.405   22.646   4.5593   2.8236   4.0896   4.2016   4.9462   3.8131   76.801   27.797   80.071   26.617 -3.269585 38.48557 
1 1 1   15    8   45 o  124.201   18.791   12.351   3.4606   16.222   4.3866   5.9694   5.6315  142.076   20.786   90.086   32.233 51.99023 38.35432 
1 1 1   15    8   46 o  264.181   10.926   53.899   4.4180   51.646   5.3175   58.920   7.9387  257.642   13.532  273.075   19.114 -15.43271 23.41867 
1 1 1   15    8   47 o  107.156   20.431   9.3594   3.2287   11.225   4.6325   7.5972   4.5024  115.686   26.703   95.589   28.571 20.09718 39.10702 
1 1 1   15    8   48 o  101.684   22.987   8.5759   3.4936   14.215   4.5727   0.6695   5.4146  131.416   23.600   68.656   29.267 62.76033 37.59678 
1 1 1   15    8   49 o  196.918   14.555   30.416   4.3558   30.803   5.1598   29.456   8.1258  197.212   17.267  187.124   29.335 10.08730 34.03952 
1 1 1   15    8   50 o  133.489   16.775   14.218   3.3518   10.693   4.7716   17.651   4.7093  111.858   27.949  147.182   21.542 -35.32339 35.28708 
1 1 1   15    8   51 o   79.504   24.905   5.1724   3.3698   5.0733   5.0738   5.2507   4.5076   83.088   30.473   82.342   28.901 0.7461166 41.99854 
1 1 1   15    8   52 o  198.709   12.923   30.926   3.9093   27.341   6.2349   33.248   5.0182  182.424   22.829  204.783   16.141 -22.35944 27.95878 
1 1 1   15    8   53 o  300.739   9.1572   69.959   4.2153   63.017   6.4098   75.249   5.5954  282.632   14.869  310.835   11.761 -28.20322 18.95793 
1 1 1   15    8   54 o  162.503   16.607   21.189   4.0725   20.654   6.9751   21.465   5.0164  152.304   30.975  161.538   20.769 -9.233902 37.29389 
1 1 1   15    8   55 o  190.234   12.877   28.528   3.7274   29.306   5.2408   27.732   5.3026  190.101   18.235  184.410   19.061 5.690399 26.37864 
1 1 1   15    8   56 o  138.845   18.221   15.801   3.7789   14.558   4.9553   17.529   5.8417  128.987   25.997  140.423   28.159 -11.43579 38.32446 
1 1 1   15    8   57 o  149.445   16.794   18.211   3.7751   8.7104   5.6428   25.908   5.0791   96.683   32.385  177.074   19.039 -80.39011 37.56685 
1 1 1   15    8   58 o   61.938   24.834   2.2674   3.5835   6.1849   4.5792  -3.9222   5.7559   83.313   29.136   55.878   26.276 27.43512 39.23445 
1 1 1   15    8   59 o  174.643   13.812   24.552   3.6621   16.847   4.7358   36.012   5.7757  138.447   23.166  207.996   18.329 -69.54831 29.54051 
1 1 1   15    9    0 o  406.627   6.8511  126.665   4.2614  126.665   4.2614  126.665   4.2614  406.627   6.8511  406.627   6.8511 0.000000 0.000000 
1 1 1   15    9    1 o  689.890   7.9960  364.374   8.4434  364.374   8.4434   0.0000   0.0000  689.890   7.9960  ?   ?  0.000000 7.995950 
1 1 1   15    9    2 o  843.150   7.3176  544.219   9.4437  537.308   16.079  547.860   11.668  837.546   12.542  845.903   9.0119 -8.356445 15.44427 
1 1 1   15    9    3 o  1371.52   12.894  1440.88   27.069  1422.09   37.373  1461.62   39.260  1361.98   17.927  1380.69   18.577 -18.71130 25.81674 
1 1 1   15    9    4 o  707.405   6.7662  383.074   7.3263  383.793   8.7997  381.452   13.226  708.029   8.1199  705.707   12.244 2.322327 14.69183 
1 1 1   15    9    5 o  922.161   7.8917  651.028   11.139  651.084   13.439  650.905   19.911  922.129   9.5213  921.731   14.113 0.3978271 17.02468 
1 1 1   15    9    6 o  277.704   6.2766   59.033   2.6679   58.831   2.9872   59.829   5.9312  277.221   7.0399  279.454   13.866 -2.232819 15.55102 
1 1 1   15    9    7 o  564.188   6.8152  243.668   5.8854  252.437   7.2434  226.631   10.096  574.216   8.2413  543.956   12.126 30.25995 14.66151 
1 1 1   15    9    8 o  567.642   7.4782  246.675   6.4974  246.675   6.4974   0.0000   0.0000  567.642   7.4782  ?   ?  0.000000 7.478204 
1 1 1   15    9    9 o  484.169   5.4711  179.435   4.0545  179.980   4.5077  177.126   9.2789  484.894   6.0734  480.867   12.607 4.026581 13.99341 
1 1 1   15    9   10 o  1344.29   9.1259  1383.68   18.777  1378.20   21.483  1401.39   38.650  1341.53   10.462  1351.82   18.679 -10.29529 21.40978 
1 1 1   15    9   11 o  813.411   6.6009  506.492   8.2183  508.780   9.3898  499.002   16.990  815.214   7.5251  807.026   13.755 8.188721 15.67853 
1 1 1   15    9   12 o  1031.08   7.6161  813.909   12.020  814.618   13.780  811.655   24.579  1031.47   8.7281  1029.07   15.604 2.402710 17.87956 
1 1 1   15    9   13 f  907.464   7.0731  630.427   9.8245  624.614   11.110  651.282   21.043  903.229   8.0359  921.851   14.913 -18.62195 16.94042 
1 1 1   15    9   14 o  186.170   8.3278   26.537   2.3731   26.846   2.5489   24.527   6.5019  187.245   8.8935  176.983   24.673 10.26163 26.22668 
1 1 1   15    9   15 o  1195.53   9.7298  1094.55   17.805  1084.77   21.311  1117.16   32.400  1190.00   11.700  1206.94   17.538 -16.94202 21.08260 
1 1 1   15    9   16 f  620.765   9.6527  295.106   9.1716  295.106   9.1716   0.0000   0.0000  620.765   9.6527  ?   ?  0.000000 9.652659 
1 1 1   15    9   17 o  678.368   5.3669  352.259   5.5726  354.535   7.8433  349.938   7.9191  680.488   7.5302  676.057   7.6528 4.431091 10.73640 
1 1 1   15    9   18 o  790.524   5.7006  478.384   6.8977  481.120   9.7320  475.621   9.7777  792.686   8.0211  788.138   8.1052 4.547302 11.40317 
1 1 1   15    9   19 o  789.206   5.7374  476.797   6.9307  489.126   9.9153  465.019   9.6914  799.240   8.1051  779.295   8.1248 19.94550 11.47632 
1 1 1   15    9   20 o  336.949   6.1496   86.917   3.1716   82.941   4.4780   90.919   4.4926  329.096   8.8899  344.568   8.5184 -15.47202 12.31228 
1 1 1   15    9   21 o  717.947   6.2125  394.613   6.8270  392.513   8.8803  397.647   10.675  715.950   8.1036  720.529   9.6796 -4.578857 12.62392 
1 1 1   15    9   22 o  276.836   7.3512   58.681   3.1150   60.900   4.5492   56.723   4.2741  281.946   10.541  272.114   10.262 9.832428 14.71143 
1 1 1   15    9   23 o  600.556   5.5805  276.107   5.1297  278.554   7.5935  274.054   6.9573  603.103   8.2258  598.241   7.5979 4.862366 11.19785 
1 1 1   15    9   24 o  404.194   5.8949  125.077   3.6470  136.812   7.0683  120.819   4.2575  422.544   10.929  397.226   7.0024 25.31866 12.97969 
1 1 1   15    9   25 o  625.448   6.4730  299.520   6.1968  296.104   9.8929  301.727   7.9496  621.640   10.397  627.654   8.2748 -6.013916 13.28808 
1 1 1   15    9   26 o  179.433   9.8463   24.744   2.6939   16.021   4.9863   28.339   3.2013  142.325   23.724  191.979   10.940 -49.65318 26.12516 
1 1 1   15    9   27 o  920.575   5.9578  648.883   8.3949  654.257   13.347  645.366   10.798  924.045   9.4369  917.931   7.6855 6.114502 12.17048 
1 1 1   15    9   28 o  357.670   6.5383   97.968   3.5795   97.356   6.9557   98.188   4.1746  356.232   12.757  358.031   7.6178 -1.799286 14.85819 
1 1 1   15    9   29 o  606.775   6.1179  281.948   5.6820  283.203   11.839  281.572   6.4767  607.487   12.732  606.313   6.9789 1.174072 14.51914 
1 1 1   15    9   30 o  579.262   5.6657  256.951   5.0234  258.611   8.4723  256.051   6.2383  580.811   9.5301  578.152   7.0494 2.659546 11.85400 
1 1 1   15    9   31 o  263.381   7.8841   53.158   3.1784   45.974   5.7761   56.278   3.8065  243.995   15.547  270.939   9.1788 -26.94411 18.05444 
1 1 1   15    9   32 o  552.143   5.7275  233.492   4.8405  249.088   8.3995  225.736   5.9229  569.892   9.6292  542.783   7.1291 27.10919 11.98108 
1 1 1   15    9   33 o   43.060   19.831  -2.3112   3.0198  -6.5008   5.2730  -0.2665   3.6838   51.631   24.537   55.614   23.934 -3.983322 34.27661 
1 1 1   15    9   34 o  233.736   10.345   41.938   3.7012   37.514   5.7438   45.079   4.8401  219.825   17.208  241.759   13.129 -21.93384 21.64477 
1 1 1   15    9   35 o  377.504   6.5768  109.210   3.8002  116.113   6.8837  106.184   4.5577  388.707   11.570  372.117   8.0019 16.58994 14.06747 
1 1 1   15    9   36 o  227.857   8.8756   39.840   3.0955   33.777   5.9662   42.073   3.6210  207.994   18.948  234.064   10.107 -26.07021 21.47516 
1 1 1   15    9   37 o  483.903   6.1681  179.460   4.5685  183.577   6.4350  175.277   6.4871  489.097   8.5958  477.870   8.8689 11.22711 12.35088 
1 1 1   15    9   38 o  292.949   7.1551   65.815   3.2083   63.858   4.9105   67.273   4.2380  288.135   11.134  295.959   9.3554 -7.823120 14.54277 
1 1 1   15    9   39 o  296.540   7.2907   67.458   3.3092   80.782   5.4895   59.851   4.1476  324.010   11.069  279.067   9.7099 44.94278 14.72414 
1 1 1   15    9   40 o  358.066   6.9256   98.352   3.7957  103.392   6.5252   95.774   4.6665  366.347   11.637  353.114   8.6338 13.23291 14.48983 
1 1 1   15    9   41 o  242.539   8.7351   45.204   3.2428   49.721   5.4759   42.764   4.0243  253.141   14.190  235.600   11.160 17.54095 18.05243 
1 1 1   15    9   42 o  161.205   13.026   20.214   3.1866   25.268   6.4363   18.573   3.6676  177.152   24.383  153.884   15.795 23.26805 29.05176 
1 1 1   15    9   43 o  285.076   8.4513   62.480   3.6877   62.425   4.9813   62.548   5.4855  284.408   11.443  284.438   12.600 -0.2990723E-01 17.02014 
1 1 1   15    9   44 o  224.888   10.232   38.981   3.5221   33.937   4.7656   45.054   5.2286  208.463   15.036  240.565   14.263 -32.10197 20.72533 
1 1 1   15    9   45 o   80.926   23.166   5.3415   3.0154   10.776   4.1868  -0.5152   4.3464  114.150   24.681   58.713   25.626 55.43661 35.57876 
1 1 1   15    9   46 o   55.067   23.419   0.2618   3.4525  -2.2021   4.1488   5.8105   6.2260   52.182   23.732   90.846   33.680 -38.66389 41.20076 
1 1 1   15    9   47 o  255.240   10.896   50.349   4.2568   50.913   5.3479   49.374   7.0323  255.587   13.720  249.842   18.521 5.745316 23.04953 
1 1 1   15    9   48 o  294.050   9.4535   66.697   4.2548   63.046   5.4902   72.186   6.7327  285.027   12.584  304.318   14.454 -19.29083 19.16466 
1 1 1   15    9   49 f  170.499   14.147   22.816   3.6587   24.843   4.9280   20.325   5.4613  176.453   18.522  157.509   23.361 18.94366 29.81283 
1 1 1   15    9   50 o   56.124   22.857   1.1885   3.0890  -0.5645   4.4937   2.7588   4.2531   58.962   25.886   69.872   27.359 -10.91000 37.66470 
1 1 1   15    9   51 o   91.636   23.301   7.0564   3.2756   2.5570   4.7950   10.993   4.4854   71.403   28.692  113.616   26.310 -42.21366 38.92884 
1 1 1   15    9   52 o   57.060   23.934   0.7953   3.5253   3.6104   5.5622  -1.0948   4.5576   78.347   31.095   57.439   25.600 20.90787 40.27765 
1 1 1   15    9   53 o   72.341   24.907   4.0963   3.3401   4.1182   4.8136   4.0760   4.6384   77.204   29.399   76.412   28.916 0.7912903 41.23640 
1 1 1   15    9   54 o  198.286   13.208   30.981   3.9856   29.168   6.6880   31.980   4.9632  186.413   23.997  199.962   16.359 -13.54897 29.04283 
1 1 1   15    9   55 o  112.156   21.670   10.622   3.5854   9.3163   5.3593   11.681   4.8239  101.402   31.349  114.704   27.773 -13.30151 41.88181 
1 1 1   15    9   56 o  117.951   20.424   11.677   3.5537   8.5279   5.2837   14.278   4.8023   96.778   31.287  127.878   25.430 -31.10033 40.31808 
1 1 1   15    9   57 o  101.890   22.260   9.0028   3.3744   6.8084   4.5394   11.713   5.0449   87.097   29.046  112.478   29.087 -25.38101 41.10627 
1 1 1   15    9   58 o   72.304   25.697   4.3594   3.5733   7.1134   4.2335  -2.4623   6.6631   87.959   27.961   63.048   29.184 24.91081 40.41676 
1 1 1   15    9   59 o   62.828   24.227   2.8145   3.2958   0.0332   4.5428   5.9052   4.7889   58.108   25.747   81.214   29.633 -23.10543 39.25543 
1 1 1   15   10    1 o  607.263   5.4575  282.270   5.0727  268.649   6.9308  297.984   7.4446  592.385   7.6438  623.886   7.7959 -31.50073 10.91807 
1 1 1   15   10    2 o  909.280   9.5493  633.069   13.290  608.365   17.802  664.176   19.976  891.170   13.051  931.085   14.017 -39.91431 19.15204 
1 1 1   15   10    3 o  705.688   6.7801  381.219   7.3235  372.605   8.6302  403.381   13.843  697.633   8.0821  725.693   12.462 -28.06073 14.85344 
1 1 1   15   10    4 o  432.026   5.9862  142.871   3.9585  137.687   4.5453  159.150   8.0543  424.100   7.0021  455.853   11.543 -31.75278 13.50110 
1 1 1   15   10    5 o  506.308   6.1548  196.227   4.7698  189.557   5.4814  217.031   9.6802  497.608   7.1967  532.318   11.881 -34.70990 13.89050 
1 1 1   15   10    6 o  678.990   6.7984  352.922   7.0654  347.167   8.2776  368.370   13.561  673.397   8.0309  693.463   12.776 -20.06604 15.09082 
1 1 1   15   10    7 o  1053.34   7.6168  849.411   12.280  865.583   14.334  804.785   23.811  1063.26   8.8075  1024.79   15.180 38.46655 17.54995 
1 1 1   15   10    8 o  531.700   6.2567  216.407   5.0919  216.407   5.0919   0.0000   0.0000  531.700   6.2567  ?   ?  0.000000 6.256732 
1 1 1   15   10    9 o  207.827   9.3774   33.072   2.9830   31.767   3.3964   37.477   6.2388  203.370   10.951  220.277   18.680 -16.90753 21.65329 
1 1 1   15   10   10 o  1106.16   7.9321  936.778   13.430  941.673   15.478  921.865   27.017  1108.97   9.1183  1096.67   16.095 12.30652 18.49842 
1 1 1   15   10   11 o  941.520   7.1825  678.637   10.351  681.873   11.877  668.411   21.110  943.716   8.2220  933.919   14.768 9.796570 16.90228 
1 1 1   15   10   12 o  417.055   7.4292  133.162   4.7425  129.004   5.6063  143.621   8.8924  410.461   8.9235  432.952   13.419 -22.49106 16.11488 
1 1 1   15   10   13 o  496.204   5.9391  188.478   4.5108  189.356   5.0391  184.938   10.119  497.344   6.6195  491.286   13.457 6.057678 14.99691 
1 1 1   15   10   14 o  1223.99   7.7410  1147.02   14.503  1167.24   18.914  1118.17   22.592  1234.56   10.009  1208.13   12.217 26.43201 15.79396 
1 1 1   15   10   15 o  566.408   7.4235  245.622   6.4359  239.995   10.737  248.777   8.0406  559.683   12.533  569.975   9.2165 -10.29187 15.55693 
1 1 1   15   10   16 o  533.318   6.6836  217.748   5.4559  214.226   7.6855  221.327   7.7466  528.900   9.4935  537.597   9.4142 -8.697144 13.36990 
1 1 1   15   10   17 o  1175.81   7.6304  1058.54   13.733  1056.65   17.564  1061.51   22.026  1174.60   9.7695  1177.06   12.226 -2.460205 15.64954 
1 1 1   15   10   18 o  854.456   5.8948  558.905   7.7096  560.190   10.787  557.563   11.022  855.326   8.2397  853.307   8.4392 2.018738 11.79465 
1 1 1   15   10   19 f  325.691   6.9099   81.212   3.4447   86.712   4.3935   72.438   5.5495  336.503   8.5301  307.478   11.792 29.02567 14.55352 
1 1 1   15   10   20 o  628.213   5.5672  302.114   5.3532  306.040   7.5316  298.105   7.6101  632.201   7.7833  623.944   7.9684 8.256714 11.13892 
1 1 1   15   10   21 o  453.012   6.1660  157.112   4.2755  160.410   5.6715  152.770   6.5072  457.684   8.0958  446.602   9.5193 11.08258 12.49634 
1 1 1   15   10   22 o  383.314   7.6346  112.510   4.4793  107.779   6.1089  118.012   6.5876  375.069   10.641  392.457   10.966 -17.38821 15.28043 
1 1 1   15   10   23 o  536.762   6.3860  220.589   5.2466  237.839   8.4964  209.957   6.6703  557.188   9.9624  523.591   8.3230 33.59784 12.98160 
1 1 1   15   10   24 o  124.433   15.276   12.057   2.8483   13.282   4.2698   11.076   3.8234  129.571   22.336  118.122   21.955 11.44914 31.31949 
1 1 1   15   10   25 o  310.643   7.4680   73.901   3.5509   77.339   5.4123   71.303   4.7050  317.658   11.131  305.051   10.077 12.60730 15.01503 
1 1 1   15   10   26 o  372.322   5.9282  106.139   3.3784  104.933   5.7073  106.789   4.1917  370.040   10.077  373.415   7.3338 -3.375092 12.46281 
1 1 1   15   10   27 o  279.109   7.3141   59.666   3.1247   51.152   5.9771   62.867   3.6654  257.653   15.224  286.466   8.3595 -28.81317 17.36776 
1 1 1   15   10   28 o  398.937   6.8243  121.892   4.1671  111.998   12.264  123.183   4.4307  380.607   21.134  401.027   7.2182 -20.42014 22.33292 
1 1 1   15   10   29 o  234.904   8.0575   42.279   2.8971   44.620   5.4660   41.365   3.4164  240.523   14.921  232.293   9.6087 8.229935 17.74699 
1 1 1   15   10   30 o  378.882   6.1552  109.945   3.5696  116.364   6.3941  107.039   4.3025  389.487   10.726  373.772   7.5204 15.71570 13.09934 
1 1 1   15   10   31 o  407.439   6.1056  127.151   3.8077  130.929   6.7387  125.380   4.6151  413.099   10.657  404.509   7.4539 8.590698 13.00537 
1 1 1   15   10   32 o  126.184   15.014   12.423   2.8429   12.976   5.0207   12.162   3.4491  126.814   26.709  124.181   18.728 2.633011 32.62103 
1 1 1   15   10   33 o   99.640   18.383   7.9051   2.7003   12.746   4.8767   5.7648   3.2428  125.646   26.206   84.977   23.919 40.66912 35.48071 
1 1 1   15   10   34 o  257.102   9.1800   50.715   3.6126   45.840   5.5108   54.388   4.7839  243.499   14.857  266.039   11.748 -22.54005 18.94061 
1 1 1   15   10   35 o  324.927   7.7551   80.957   3.8569   93.079   6.3939   74.023   4.8358  347.935   12.006  310.484   10.176 37.45065 15.73809 
1 1 1   15   10   36 o  289.469   8.4065   64.287   3.7247   73.226   6.3927   59.693   4.5829  308.327   13.546  278.716   10.743 29.61166 17.28851 
1 1 1   15   10   37 o  128.397   14.268   12.869   2.7567   15.332   5.5491   12.062   3.1763  137.313   27.363  123.683   17.248 13.63005 32.34523 
1 1 1   15   10   38 o  262.282   8.4437   52.806   3.3898   53.325   6.9328   52.643   3.8860  261.739   17.404  261.750   9.6993 -0.1132202E-01 19.92445 
1 1 1   15   10   39 o  216.926   10.288   36.189   3.4159   29.806   8.9160   37.287   3.6981  190.796   31.639  220.118   10.976 -29.32161 33.48845 
1 1 1   15   10   40 o  175.906   11.528   23.941   3.0868   24.801   6.2433   23.663   3.5513  176.058   23.776  174.545   13.395 1.513214 27.28963 
1 1 1   15   10   41 o  210.449   10.473   34.101   3.3734   32.945   5.1765   34.955   4.4476  205.270   16.618  212.168   13.770 -6.897690 21.58176 
1 1 1   15   10   42 o  164.865   14.655   21.233   3.6595   26.768   6.6242   18.801   4.3903  182.330   24.344  153.960   19.036 28.36945 30.90267 
1 1 1   15   10   43 o   56.780   22.240   1.5931   2.8111   5.4741   3.9190  -2.5202   4.0345   83.368   26.944   50.622   23.168 32.74619 35.53530 
1 1 1   15   10   44 o  301.759   8.0151   69.999   3.7020   70.743   5.3029   69.292   5.1705  302.660   11.447  299.581   11.276 3.078888 16.06785 
1 1 1   15   10   45 o  186.898   11.005   27.065   3.1343   28.823   4.6655   25.620   4.2314  191.600   16.057  180.741   15.443 10.85887 22.27825 
1 1 1   15   10   46 o  252.680   10.548   49.293   4.0797   46.462   5.2012   53.821   6.5770  244.132   13.977  261.903   16.491 -17.77147 21.61736 
1 1 1   15   10   47 o  192.981   11.102   28.891   3.2656   34.659   4.9019   24.287   4.3789  210.201   15.342  175.415   16.503 34.78609 22.53239 
1 1 1   15   10   48 o  106.404   19.609   9.2211   3.0760   7.5534   4.4757   10.714   4.2345   94.993   28.507  113.134   25.109 -18.14097 37.98822 
1 1 1   15   10   49 o   57.000   23.511   1.0202   3.3209   1.7354   4.2911  -0.0477   5.2438   65.921   26.904   65.223   28.310 0.6972275 39.05491 
1 1 1   15   10   50 o  152.409   14.167   18.290   3.2671   19.168   4.7832   17.522   4.4732  153.637   20.881  146.966   20.438 6.671234 29.21879 
1 1 1   15   10   51 o   80.971   24.533   5.4373   3.3033   7.7057   5.0548   3.7466   4.3640   95.365   30.578   74.490   28.081 20.87436 41.51605 
1 1 1   15   10   52 o  123.624   20.345   12.557   3.7158   17.328   6.3675   10.093   4.5758  140.557   30.475  107.932   27.592 32.62515 41.11016 
1 1 1   15   10   53 o   70.691   24.766   3.8436   3.3093   0.5376   4.8991   6.6180   4.4879   64.087   27.590   88.355   28.853 -24.26842 39.92154 
1 1 1   15   10   54 o   50.450   23.045  -1.9587   3.9667   4.2131   8.8721  -3.5006   4.4346   89.456   37.768   49.913   23.341 39.54254 44.39837 
1 1 1   15   10   55 o  164.061   15.819   21.605   3.9231   19.076   5.8235   23.707   5.3084  147.997   26.690  169.082   20.961 -21.08458 33.93661 
1 1 1   15   10   56 o   98.899   22.128   8.4187   3.2659   6.8135   4.6025   10.047   4.6350   87.793   29.246  105.246   28.202 -17.45291 40.62824 
1 1 1   15   10   57 o   71.628   24.579   4.2839   3.2515  -0.9421   4.4492   10.274   4.7634   55.513   24.975  105.173   28.762 -49.66022 38.09202 
1 1 1   15   10   58 o   83.587   24.831   6.2889   3.4087   7.3215   4.4967   4.8942   5.2264   88.708   28.877   78.143   30.403 10.56480 41.93122 
1 1 1   15   10   59 o  126.748   18.321   13.530   3.4513   19.875   4.4609   4.0696   5.4472  153.141   19.471   74.843   30.402 78.29769 36.10276 
1 1 1   15   11    0 o  1509.96   19.838  1747.73   45.831  1747.73   45.831  1747.73   45.831  1509.96   19.838  1509.96   19.838 0.000000 0.000000 
1 1 1   15   11    1 o  677.873   6.6577  351.759   6.9078  339.382   11.655  358.461   8.5765  665.679   11.439  684.257   8.1888 -18.57782 14.06792 
1 1 1   15   11    2 o  550.645   6.2472  232.102   5.2654  230.068   6.2672  236.984   9.7084  548.201   7.4690  556.263   11.402 -8.062195 13.63088 
1 1 1   15   11    3 o  259.794   6.7043   51.666   2.6659   50.482   3.0440   55.566   5.5234  256.788   7.7445  269.317   13.399 -12.52875 15.47621 
1 1 1   15   11    4 o  1333.37   10.350  1361.47   21.123  1362.19   25.727  1359.97   36.999  1333.53   12.604  1331.80   18.150 1.731445 22.09768 
1 1 1   15   11    5 o  829.916   7.4840  527.288   9.5068  527.353   11.430  527.143   17.125  829.907   8.9980  829.500   13.488 0.4067383 16.21354 
1 1 1   15   11    6 o  578.995   6.4930  256.624   5.7543  252.283   6.6956  268.889   11.255  574.050   7.6203  592.477   12.411 -18.42651 14.56339 
1 1 1   15   11    7 o  921.283   8.0354  649.818   11.331  649.818   11.331   0.0000   0.0000  921.283   8.0354  ?   ?  0.000000 8.035363 
1 1 1   15   11    8 o  560.379   5.7695  240.376   4.9487  236.383   5.4926  257.595   11.406  555.691   6.4576  579.873   12.851 -24.18207 14.38209 
1 1 1   15   11    9 o  871.704   8.1358  581.774   10.855  574.239   13.031  598.859   19.622  865.959   9.8312  884.019   14.501 -18.05969 17.51982 
1 1 1   15   11   10 o  440.239   7.3353  148.376   4.9428  147.317   5.8388  151.056   9.2855  438.634   8.6966  444.011   13.663 -5.376526 16.19587 
1 1 1   15   11   11 o  1026.20   8.9758  806.370   14.099  794.473   16.920  833.396   25.501  1018.48   10.853  1042.67   15.979 -24.18677 19.31636 
1 1 1   15   11   12 o  386.492   5.9950  114.347   3.5465  112.415   3.8632  124.703   8.9439  383.203   6.5864  403.382   14.486 -20.17865 15.91285 
1 1 1   15   11   13 o  261.653   6.9945   52.413   2.8013   52.000   3.0030   55.180   7.7740  260.613   7.5282  267.504   19.112 -6.891235 20.54148 
1 1 1   15   11   14 o  607.159   9.4503  282.305   8.7825  275.007   11.666  291.853   13.343  599.105   12.722  617.100   14.126 -17.99536 19.01034 
1 1 1   15   11   15 o  437.953   6.1760  146.830   4.1401  144.133   5.2683  151.185   6.6945  433.872   7.9330  444.305   9.8440 -10.43195 12.64262 
1 1 1   15   11   16 o  1222.10   7.8224  1143.56   14.632  1151.79   18.833  1131.02   23.242  1226.31   10.034  1214.95   12.498 11.36670 16.02724 
1 1 1   15   11   17 o  455.978   5.8138  159.164   4.0576  154.346   4.9615  168.893   7.0510  448.992   7.2195  469.593   9.8098 -20.60080 12.18002 
1 1 1   15   11   18 o  558.067   5.9204  238.418   5.0572  244.123   6.4443  229.273   8.1591  564.657   7.4563  547.125   9.7429 17.53204 12.26866 
1 1 1   15   11   19 o  319.162   6.9131   77.990   3.3772   78.555   4.1692   76.912   5.7592  320.282   8.5046  316.822   11.876 3.460785 14.60729 
1 1 1   15   11   20 o  930.699   7.5194  663.254   10.712  666.673   15.132  659.820   15.166  932.859   10.598  928.045   10.677 4.813660 15.04314 
1 1 1   15   11   21 o  332.868   8.0165   84.849   4.0844  104.829   5.6549   63.059   5.9057  369.925   9.9872  286.801   13.453 83.12451 16.75489 
1 1 1   15   11   22 o  627.567   6.3579  301.534   6.1072  294.186   7.6611  314.344   10.115  619.796   8.0755  640.545   10.317 -20.74902 13.10196 
1 1 1   15   11   23 o  290.761   7.3330   64.739   3.2635   65.206   4.7173   64.309   4.5197  291.718   10.565  289.717   10.192 2.000885 14.67964 
1 1 1   15   11   24 o  349.533   6.9080   93.553   3.6958   96.742   5.3074   90.551   5.1495  355.342   9.7581  343.784   9.7862 11.55765 13.81989 
1 1 1   15   11   25 o  983.303   6.6293  740.385   9.9776  737.860   14.092  742.923   14.129  981.351   9.3816  984.712   9.3743 -3.361816 13.26237 
1 1 1   15   11   26 f  743.032   6.1132  422.749   6.9525  425.125   10.015  420.540   9.6590  744.909   8.7841  740.905   8.5172 4.004333 12.23534 
1 1 1   15   11   27 o  366.773   7.2294  103.036   4.0585  105.937   6.4439  101.128   5.2251  371.682   11.327  363.260   9.3975 8.422211 14.71763 
1 1 1   15   11   28 o  355.255   8.2203   96.700   4.4699   97.071   8.5777   96.562   5.2372  355.379   15.769  354.923   9.6404 0.4556580 18.48251 
1 1 1   15   11   29 o  466.334   6.4573  166.564   4.6091  175.460   6.9125  159.443   6.1845  478.408   9.4399  456.096   8.8590 22.31207 12.94574 
1 1 1   15   11   30 o   98.070   18.300   7.6486   2.6459   9.7971   4.7318   6.6713   3.1914  110.136   28.006   91.102   22.910 19.03350 36.18261 
1 1 1   15   11   31 o  167.330   10.977   21.580   2.7958   28.221   4.8919   18.359   3.4071  190.653   16.940  153.812   14.649 36.84114 22.39538 
1 1 1   15   11   32 o  135.106   12.965   14.158   2.6482   7.2052   4.7406   17.311   3.1928   95.853   29.459  149.357   14.134 -53.50421 32.67453 
1 1 1   15   11   33 o  611.659   6.0544  286.622   5.6682  291.618   8.8871  283.196   7.3594  616.511   9.4178  607.769   7.9111 8.742554 12.29961 
1 1 1   15   11   34 o  135.699   15.394   14.374   3.1409   18.629   5.3052   12.078   3.8973  153.065   23.386  123.035   21.477 30.02996 31.75162 
1 1 1   15   11   35 o  199.571   9.2188   30.569   2.8161   37.559   5.5297   28.121   3.2721  219.914   16.549  190.953   11.245 28.96082 20.00814 
1 1 1   15   11   36 o  417.927   6.9208  133.909   4.4272  144.367   7.2500  127.690   5.5906  433.370   10.930  407.865   8.9551 25.50516 14.12987 
1 1 1   15   11   37 f   54.200   21.543   1.2318   2.6733   0.6179   6.0553   1.3804   2.9793   73.545   31.135   57.196   22.740 16.34946 38.55456 
1 1 1   15   11   38 o  242.793   8.8023   45.268   3.2711   45.204   6.9069   45.286   3.7141  240.439   18.921  242.722   9.9971 -2.283844 21.39931 
1 1 1   15   11   39 o  261.007   9.7420   52.376   3.8920   55.087   7.4417   51.355   4.5662  265.515   18.425  258.211   11.554 7.304138 21.74770 
1 1 1   15   11   40 o   63.898   24.964   2.0525   3.5350   12.980   9.2321   0.1751   3.8267  125.704   41.399   57.851   24.631 67.85291 48.17238 
1 1 1   15   11   41 f  383.179   8.7079  112.862   5.1072  128.451   11.221  108.789   5.7357  405.865   18.063  375.947   9.9676 29.91812 20.63095 
1 1 1   15   11   42 o   46.063   20.408  -0.8576   2.8540   3.8558   6.0282  -2.2193   3.2401   83.349   32.590   44.976   20.649 38.37354 38.58081 
1 1 1   15   11   43 o  130.206   16.104   13.389   3.1411   5.0994   6.4638   15.952   3.5940   89.416   34.063  142.091   16.854 -52.67459 38.00463 
1 1 1   15   11   44 o  391.665   9.4134  118.141   5.6433  122.269   8.1821  114.395   7.7937  397.150   13.460  384.225   13.252 12.92474 18.88878 
1 1 1   15   11   45 o  140.893   21.573   16.048   4.5042   22.028   7.2853   12.348   5.7308  161.844   30.529  120.483   30.921 41.36079 43.45198 
1 1 1   15   11   46 o  147.899   15.258   17.226   3.4044   19.757   4.5627   14.049   5.1133  157.223   19.369  129.728   26.643 27.49496 32.93956 
1 1 1   15   11   47 o  216.456   10.173   36.178   3.3705   44.793   5.2313   30.064   4.4072  239.402   14.342  195.824   14.813 43.57790 20.61884 
1 1 1   15   11   48 o   75.204   24.847   4.4411   3.3247   3.6552   4.5190   5.3685   4.9088   75.262   28.527   84.468   30.108 -9.206429 41.47585 
1 1 1   15   11   49 o  238.738   9.7645   44.030   3.5681   46.808   5.5056   42.018   4.6853  244.268   14.795  231.954   13.252 12.31451 19.86212 
1 1 1   15   11   50 o  124.827   17.542   12.526   3.2592   10.270   4.9592   14.242   4.3241  109.082   29.147  131.471   22.284 -22.38879 36.68928 
1 1 1   15   11   51 o   46.582   21.098  -1.5097   3.2376  -0.8136   5.1681  -1.9593   4.1536   62.096   27.490   52.304   23.771 9.792858 36.34243 
1 1 1   15   11   52 o  142.639   16.464   16.294   3.5286   14.505   5.7491   17.375   4.4694  128.454   29.815  145.603   20.632 -17.14867 36.25738 
1 1 1   15   11   53 o  133.844   20.147   14.750   3.9994   4.3322   9.1303   17.223   4.4490   91.088   38.378  144.547   20.700 -53.45924 43.60420 
1 1 1   15   11   54 o  151.659   14.990   18.365   3.4341   18.945   5.0089   17.851   4.7174  150.380   22.449  146.290   21.728 4.089890 31.24173 
1 1 1   15   11   55 o   68.939   24.870   3.6268   3.3595   2.7955   4.5798   4.5951   4.9430   69.727   28.033   78.438   29.810 -8.710602 40.92033 
1 1 1   15   11   56 o   45.738   20.779  -1.3502   3.1702  -1.4850   4.4816  -1.2152   4.4852   54.533   24.749   55.290   24.956 -0.7574501 35.14707 
1 1 1   15   11   57 o   69.139   25.675   3.7033   3.6212   1.1022   4.3930   9.2183   6.3966   61.412   26.275   97.631   34.415 -36.21968 43.29796 
1 1 1   15   11   58 o   63.087   23.497   3.0081   3.0375   4.8478   4.2164   1.0232   4.3795   75.705   27.777   60.586   26.084 15.11885 38.10480 
1 1 1   15   12    0 o  281.703   7.7561   60.881   3.3386   60.881   3.3386   60.881   3.3386  281.703   7.7561  281.703   7.7561 0.000000 0.000000 
1 1 1   15   12    1 o  433.291   6.1908  143.713   4.1058  143.094   4.8772  145.221   7.6067  432.336   7.3702  435.440   11.413 -3.104889 13.58589 
1 1 1   15   12    2 o  854.450   7.5843  558.934   9.9191  556.491   11.992  564.225   17.649  852.514   9.1903  858.175   13.436 -5.661011 16.27873 
1 1 1   15   12    3 o  1491.00   11.365  1702.65   25.936  1673.38   30.979  1771.26   47.425  1477.87   13.695  1519.45   20.391 -41.58350 24.56345 
1 1 1   15   12    4 o  890.455   7.8102  607.047   10.645  600.882   12.734  621.353   19.398  885.850   9.3911  900.518   14.073 -14.66803 16.91909 
1 1 1   15   12    5 o  445.930   6.3241  152.222   4.3166  152.402   5.0259  151.715   8.4273  446.175   7.3594  445.034   12.372 1.140320 14.39503 
1 1 1   15   12    6 o  297.459   7.6473   67.740   3.4818   67.740   3.4818   0.0000   0.0000  297.459   7.6473  ?   ?  0.000000 7.647321 
1 1 1   15   12    7 o  364.129   5.8568  101.495   3.2643   99.835   3.5711  109.927   8.0494  361.131   6.4605  378.768   13.884 -17.63629 15.31371 
1 1 1   15   12    8 o  250.123   6.5994   47.893   2.5265   49.329   2.7278   39.218   6.7025  253.843   7.0206  225.247   19.637 28.59561 20.85405 
1 1 1   15   12    9 o  371.740   7.6640  105.799   4.3608  109.229   5.1677   97.316   8.1273  377.692   8.9390  356.336   14.901 21.35580 17.37655 
1 1 1   15   12   10 o  696.355   7.5941  371.250   8.0942  372.492   9.7314  368.464   14.581  697.460   9.1156  693.436   13.737 4.023499 16.48670 
1 1 1   15   12   11 o  685.216   7.6768  359.475   8.0515  358.849   9.6242  360.934   14.697  684.560   9.1851  686.286   13.991 -1.726685 16.73671 
1 1 1   15   12   12 o  524.894   7.5772  210.939   6.0876  211.733   7.2443  209.031   11.230  525.838   9.0007  522.260   14.049 3.577881 16.68462 
1 1 1   15   12   13 o  843.571   8.3338  544.880   10.761  534.127   12.792  570.907   19.901  835.114   10.007  862.995   15.066 -27.88080 18.08678 
1 1 1   15   12   14 o   68.775   19.709   3.7126   2.1815   3.2195   2.2670   9.8822   8.0187   65.152   20.430  116.090   38.600 -50.93788 43.67290 
1 1 1   15   12   15 o  1342.38   8.3554  1379.82   17.168  1381.35   21.974  1377.42   27.504  1342.89   10.691  1340.65   13.403 2.248657 17.14452 
1 1 1   15   12   16 o  447.471   5.8603  153.281   4.0138  159.260   4.9802  142.198   6.7803  456.085   7.1340  430.868   10.281 25.21640 12.51371 
1 1 1   15   12   17 o  218.400   7.9595   36.524   2.6608   36.218   3.1535   37.278   4.9572  217.462   9.4743  220.007   14.807 -2.545670 17.57867 
1 1 1   15   12   18 o  443.358   6.8275  150.495   4.6333  143.473   5.8884  161.911   7.5076  432.830   8.8881  459.732   10.669 -26.90167 13.88627 
1 1 1   15   12   19 o  566.839   6.8230  246.004   5.9197  251.084   8.0150  239.907   8.7808  572.566   9.1456  559.622   10.251 12.94318 13.73776 
1 1 1   15   12   20 o  549.833   6.6156  231.463   5.5676  230.321   6.4016  235.007   11.281  548.437   7.6259  553.675   13.311 -5.237915 15.34058 
1 1 1   15   12   21 o  187.112   9.4142   26.886   2.6876   28.249   3.6874   25.341   3.9255  191.555   12.648  181.221   14.267 10.33394 19.06604 
1 1 1   15   12   22 o  278.918   7.1684   59.571   3.0603   63.789   4.2850   55.178   4.3723  288.559   9.7016  268.349   10.645 20.21075 14.40261 
1 1 1   15   12   23 o  617.315   5.8373  291.759   5.5155  296.411   7.8503  287.225   7.7508  622.095   8.2445  612.378   8.2691 9.716736 11.67685 
1 1 1   15   12   24 o  774.545   6.0931  459.341   7.2237  468.994   10.350  450.173   10.087  782.456   8.6419  766.599   8.5964 15.85663 12.18931 
1 1 1   15   12   25 o  402.630   6.4418  124.137   3.9699  127.368   5.6567  121.001   5.5729  407.722   9.0641  397.395   9.1619 10.32724 12.88796 
1 1 1   15   12   26 o  263.909   8.1415   53.356   3.2887   52.562   4.7141   54.109   4.5903  261.793   11.765  265.641   11.289 -3.847839 16.30508 
1 1 1   15   12   27 o  270.237   8.5627   55.958   3.5418   58.705   5.5173   54.033   4.6192  276.564   13.033  265.421   11.370 11.14310 17.29590 
1 1 1   15   12   28 o  436.305   7.4364  145.837   4.9662  157.168   9.1866  141.159   5.9031  452.429   13.266  429.148   8.9868 23.28107 16.02333 
1 1 1   15   12   29 f  238.331   9.8857   43.559   3.6063   40.692   4.8345   47.155   5.4148  229.726   13.813  247.286   14.368 -17.55978 19.93085 
1 1 1   15   12   30 o  221.526   9.5786   37.635   3.2479   38.806   4.9711   36.763   4.2901  224.174   14.566  218.383   12.892 5.791092 19.45196 
1 1 1   15   12   31 o  326.367   7.7100   81.639   3.8515   80.275   5.7544   82.745   5.1839  323.325   11.628  328.379   10.314 -5.054108 15.54257 
1 1 1   15   12   32 o  252.679   9.4008   48.981   3.6358   50.468   5.2173   47.577   5.0696  255.825   13.370  248.367   13.385 7.458237 18.91886 
1 1 1   15   12   33 f  161.746   10.600   20.175   2.6098   20.831   4.9050   19.916   3.0824  162.809   20.110  160.439   12.654 2.370361 23.76058 
1 1 1   15   12   34 o  332.984   7.6996   85.021   3.9243   77.306   5.8009   91.531   5.3287  317.087   11.952  345.260   10.083 -28.17310 15.63737 
1 1 1   15   12   35 o  208.851   9.7480   33.495   3.1162   37.318   5.2799   31.451   3.8602  219.290   15.837  201.772   12.561 17.51820 20.21374 
1 1 1   15   12   36 o  261.432   7.8092   52.430   3.1249   45.993   6.0451   54.778   3.6505  243.360   16.323  267.124   8.9283 -23.76402 18.60538 
1 1 1   15   12   37 o  287.495   8.5450   63.451   3.7602   69.760   6.7728   60.640   4.5210  300.540   14.723  280.832   10.518 19.70828 18.09376 
1 1 1   15   12   38 o   38.513   18.210  -3.2376   2.8334 -10.2076   4.9922   0.0746   3.4414   43.479   21.390   54.728   23.331 -11.24903 31.65244 
1 1 1   15   12   39 o  181.147   12.499   25.429   3.4444   31.998   6.7651   23.130   4.0020  200.800   22.392  172.167   15.347 28.63301 27.14707 
1 1 1   15   12   40 o   98.895   19.977   7.9104   2.9199  -1.9340   9.2264   9.0061   3.0781   82.497   36.616  105.736   19.745 -23.23901 41.60026 
1 1 1   15   12   41 o  436.303   6.6481  146.074   4.4397  141.929   7.8875  147.996   5.3714  428.776   12.018  438.904   7.9956 -10.12744 14.43487 
1 1 1   15   12   42 o  224.839   9.5206   38.916   3.2765   42.440   6.3507   37.637   3.8248  232.411   17.993  220.556   11.368 11.85510 21.28330 
1 1 1   15   12   43 o  141.529   17.861   15.894   3.7831   15.353   5.9772   16.255   4.8863  135.265   29.684  141.451   23.386 -6.185303 37.78974 
1 1 1   15   12   44 o  259.648   12.623   52.199   5.0165   56.178   6.7481   47.284   7.5002  267.774   16.545  244.148   20.253 23.62558 26.15213 
1 1 1   15   12   45 o  182.443   12.649   25.910   3.5103   21.813   6.7915   27.403   4.1006  161.845   28.454  187.188   14.423 -25.34247 31.90071 
1 1 1   15   12   46 o  229.661   12.809   41.038   4.4847   43.671   7.5813   39.621   5.5622  233.587   21.444  224.514   16.297 9.072754 26.93368 
1 1 1   15   12   47 o   89.319   24.766   6.6409   3.5040   15.344   7.2776   4.0144   3.9978  132.058   35.318   75.050   27.122 57.00817 44.53023 
1 1 1   15   12   48 o  225.261   12.914   39.570   4.4339   31.417   7.7577   43.525   5.4035  194.698   26.737  235.512   15.069 -40.81383 30.69132 
1 1 1   15   12   49 f  225.712   11.787   39.640   4.0580   35.743   7.9556   41.010   4.7179  208.144   25.505  229.005   13.520 -20.86057 28.86653 
1 1 1   15   12   50 o  292.002   10.415   66.027   4.6550   70.625   11.559   65.137   5.0857  292.194   26.122  289.668   11.470 2.526276 28.52903 
1 1 1   15   12   51 o  292.485   9.9439   66.240   4.4518   60.625   9.0601   68.028   5.1113  273.078   21.859  295.910   11.285 -22.83179 24.60029 
1 1 1   15   12   52 o  133.401   17.393   14.365   3.4670   11.130   5.4428   16.574   4.4974  111.834   30.812  141.674   21.407 -29.84055 37.51834 
1 1 1   15   12   53 o   51.960   23.033  -0.6958   3.6398  -1.8166   6.7902  -0.2439   4.3115   67.425   30.545   57.927   25.396 9.497448 39.72366 
1 1 1   15   12   54 o  118.997   18.841   11.671   3.3175   11.554   4.8818   11.771   4.5221  113.921   28.158  116.050   26.092 -2.128883 38.38817 
1 1 1   15   12   55 o  183.395   12.770   26.589   3.5623   26.369   4.9029   26.835   5.1846  179.828   18.056  180.829   19.017 -1.000748 26.22327 
1 1 1   15   12   56 o   89.182   23.691   7.0060   3.2887   6.5124   4.4599   7.5942   4.8687   85.571   28.790   91.186   30.066 -5.614975 41.62749 
1 1 1   15   12   57 o  110.764   22.177   10.685   3.6288   11.668   4.5020   8.8621   6.1309  113.135   26.469   95.784   33.700 17.35094 42.85180 
1 1 1   15   12   58 o   97.826   24.012   8.6325   3.5689  -7.7291   5.6139   19.730   4.6234   48.349   23.551  152.118   20.368 -103.7694 31.13669 
1 1 1   15   13    0 o  539.746   7.7330  223.134   6.3856  223.134   6.3856  223.134   6.3856  539.746   7.7330  539.746   7.7330 0.000000 0.000000 
1 1 1   15   13    1 o  964.490   8.2162  712.224   12.129  706.225   14.658  725.257   21.604  960.325   9.9718  972.845   14.508 -12.52026 17.60472 
1 1 1   15   13    2 o  776.588   7.2743  461.704   8.6467  449.715   10.250  491.285   16.101  766.383   8.7382  800.782   13.136 -34.39929 15.77687 
1 1 1   15   13    3 f  442.967   6.3833  150.208   4.3280  149.828   5.0605  151.244   8.3520  442.385   7.4734  444.340   12.280 -1.954590 14.37554 
1 1 1   15   13    4 o  527.513   6.4193  213.020   5.1831  207.914   6.0501  227.102   10.048  521.127   7.5849  544.492   12.057 -23.36481 14.24423 
1 1 1   15   13    5 f  591.208   7.8975  267.604   7.1466  267.604   7.1466   0.0000   0.0000  591.208   7.8975  ?   ?  0.000000 7.897497 
1 1 1   15   13    6 o  894.245   7.9833  612.254   10.927  633.104   13.560  573.636   18.454  909.252   9.7432  865.219   13.935 44.03284 17.00318 
1 1 1   15   13    7 o  1030.19   7.6153  812.529   12.008  828.167   14.042  769.962   23.167  1039.99   8.8211  1002.28   15.101 37.70508 17.48867 
1 1 1   15   13    8 o  292.537   6.4458   65.512   2.8862   66.926   3.1507   58.135   7.1962  295.671   6.9619  274.807   17.195 20.86429 18.55072 
1 1 1   15   13    9 o  160.283   12.901   19.811   3.1382   20.083   3.6182   18.983   6.3051  161.194   14.831  154.798   27.624 6.396286 31.35376 
1 1 1   15   13   10 o  319.901   8.3772   78.358   4.1019   78.804   4.7187   76.977   8.2982  320.785   9.6103  316.356   17.202 4.429749 19.70424 
1 1 1   15   13   11 o  270.735   9.4862   56.132   3.9310   57.525   4.5576   52.084   7.7684  274.048   10.865  259.775   19.683 14.27246 22.48324 
1 1 1   15   13   12 o  866.933   8.4146  575.489   11.166  572.877   13.424  581.354   20.116  864.862   10.140  870.838   15.092 -5.975464 18.18188 
1 1 1   15   13   13 o  911.555   10.713  636.476   14.947  617.682   20.150  659.470   22.288  897.656   14.665  927.413   15.701 -29.75708 21.48499 
1 1 1   15   13   14 o  314.324   10.066   75.673   4.8429   75.062   5.5887   77.514   9.7035  313.011   11.665  317.120   20.095 -4.109344 23.23527 
1 1 1   15   13   15 o  917.973   8.5431  645.292   12.004  642.205   14.140  653.258   22.713  915.668   10.089  922.929   16.078 -7.260864 18.98140 
1 1 1   15   13   16 o  744.735   10.368  424.849   11.818   0.0000   0.0000  424.849   11.818  ?   ?   744.735   10.368 0.000000 10.36781 
1 1 1   15   13   17 o  317.337   6.6940   77.100   3.2514   72.834   3.8452   87.801   6.0905  308.406   8.1457  338.506   11.755 -30.10034 14.30145 
1 1 1   15   13   18 o  531.496   6.0654  216.265   4.9344  215.184   6.0578  218.395   8.5061  530.120   7.4657  533.933   10.408 -3.812866 12.80885 
1 1 1   15   13   19 o  308.849   7.4591   73.040   3.5262   74.011   4.0218   69.815   7.3320  310.870   8.4523  301.247   15.958 9.623383 18.05825 
1 1 1   15   13   20 o  198.876   9.2825   30.296   2.8256   30.841   3.3597   28.978   5.2232  200.320   10.999  193.463   17.840 6.857361 20.95827 
1 1 1   15   13   21 o  918.281   6.9175  645.675   9.7229  641.248   12.270  653.144   15.939  914.985   8.7614  923.183   11.280 -8.198120 14.28266 
1 1 1   15   13   22 o  932.071   6.4068  665.187   9.1404  662.940   12.721  667.586   13.142  930.287   8.9335  933.515   9.1978 -3.228333 12.82219 
1 1 1   15   13   23 o   94.809   18.172   7.1382   2.5411   4.6975   3.4393   10.072   3.7708   78.918   25.214  112.367   22.706 -33.44859 33.93067 
1 1 1   15   13   24 o  693.216   5.9406  367.948   6.3033  372.504   8.9201  363.404   8.9084  697.329   8.3573  688.752   8.4502 8.577332 11.88483 
1 1 1   15   13   25 o  632.054   5.9605  305.901   5.7664  311.662   8.2405  300.373   8.0720  637.807   8.4410  626.151   8.4224 11.65607 11.92421 
1 1 1   15   13   26 o  107.961   17.446   9.1906   2.7846   10.708   4.1804   7.9804   3.7335  115.579   24.397   99.663   24.619 15.91636 34.65937 
1 1 1   15   13   27 o  486.013   8.1508  180.994   6.0634  201.035   9.6026  167.706   7.8195  511.821   12.257  467.605   10.925 44.21597 16.41967 
1 1 1   15   13   28 o  293.371   8.5503   65.965   3.8394   66.379   4.9625   65.348   6.0601  294.147   11.022  291.668   13.574 2.478668 17.48578 
1 1 1   15   13   29 o  374.655   6.8665  107.537   3.9376  108.801   5.7258  106.403   5.4238  376.635   9.9322  372.496   9.5129 4.139038 13.75292 
1 1 1   15   13   30 o  283.464   7.9152   61.588   3.4342   66.641   5.1561   57.559   4.6041  294.619   11.434  273.842   10.984 20.77768 15.85530 
1 1 1   15   13   31 o  193.160   10.794   28.732   3.1787   30.687   4.7830   27.186   4.2540  198.959   15.837  187.327   14.961 11.63214 21.78663 
1 1 1   15   13   32 o  128.809   15.976   12.984   3.0821   14.478   4.5783   11.745   4.1680  134.701   23.033  120.954   23.359 13.74683 32.80525 
1 1 1   15   13   33 o  157.354   12.917   19.175   3.0837   17.207   4.7994   20.559   4.0242  147.289   21.960  162.405   16.414 -15.11636 27.41637 
1 1 1   15   13   34 o   69.187   25.181   3.0953   3.4551   3.1689   4.3890   2.9752   5.6026   74.182   28.115   79.352   31.298 -5.170105 42.07164 
1 1 1   15   13   35 o  241.035   11.662   44.690   4.3026   47.573   5.9286   41.481   6.2541  247.691   15.719  230.774   17.844 16.91695 23.78036 
1 1 1   15   13   36 o  174.296   14.719   23.618   3.8901   27.941   5.1343   17.790   5.9607  189.014   17.963  148.075   27.305 40.93857 32.68393 
1 1 1   15   13   37 o  103.409   23.985   8.7157   3.7227   5.4095   4.8032   13.689   5.8913   86.121   29.855  128.679   30.395 -42.55810 42.60542 
1 1 1   15   13   38 f  221.637   9.0514   37.744   3.0706   32.195   6.1518   39.586   3.5437  202.175   20.148  226.857   10.205 -24.68207 22.58508 
1 1 1   15   13   39 o  242.345   8.3075   45.112   3.0816   46.025   5.8622   44.764   3.6225  243.127   15.839  241.234   9.8107 1.892609 18.63158 
1 1 1   15   13   40 o  206.546   10.488   32.941   3.3047   36.967   9.4095   32.374   3.5296  212.672   29.718  204.609   11.314 8.063187 31.79841 
1 1 1   15   13   41 o  115.706   16.677   10.627   2.8683   2.4160   5.6484   13.479   3.3295   76.470   30.995  130.476   17.082 -54.00612 35.39052 
1 1 1   15   13   42 o  229.282   11.235   40.570   3.9429   35.126   6.1277   44.418   5.1509  210.864   19.196  238.925   14.148 -28.06142 23.84622 
1 1 1   15   13   43 o  131.917   17.246   13.812   3.3989   18.097   5.9557   11.743   4.1391  147.907   27.313  119.699   23.430 28.20781 35.98583 
1 1 1   15   13   44 o   97.260   22.329   7.7915   3.2538   14.946   6.4456   5.3447   3.7693  132.255   32.153   82.034   26.416 50.22072 41.61259 
1 1 1   15   13   45 o  278.267   9.0314   59.648   3.8467   77.145   7.5609   53.537   4.4681  314.396   15.712  263.194   11.091 51.20233 19.23222 
1 1 1   15   13   46 o  249.590   12.310   48.292   4.7028   60.679   7.7234   40.993   5.9285  277.088   18.314  228.014   17.112 49.07367 25.06400 
1 1 1   15   13   47 o  154.982   16.798   19.057   3.9210   19.522   7.0982   18.853   4.7038  150.605   31.791  152.797   20.641 -2.191986 37.90350 
1 1 1   15   13   48 o  270.560   9.8357   56.549   4.0732   50.831   7.7646   58.721   4.7844  252.007   20.302  275.279   11.355 -23.27196 23.26157 
1 1 1   15   13   49 o  151.225   15.952   18.145   3.6367   30.159   7.8265   14.837   4.1069  189.547   27.803  134.993   20.523 54.55409 34.55671 
1 1 1   15   13   50 o  344.841   9.8122   91.996   5.1791  101.457   21.580   91.418   5.3351  328.957   43.958  343.629   10.143 -14.67194 45.11327 
1 1 1   15   13   51 o   79.763   26.173   5.2004   3.6912  -8.7644   10.733   7.0735   3.9310   74.033   35.132   91.008   26.567 -16.97501 44.04589 
1 1 1   15   13   52 o  294.287   10.657   67.310   4.8005   42.557   9.3596   76.145   5.5920  222.949   28.048  312.521   11.690 -89.57269 30.38662 
1 1 1   15   13   53 o   84.184   25.296   6.0713   3.5226   4.1262   6.3197   6.9481   4.2428   81.565   32.881   89.495   27.931 -7.930595 43.14281 
1 1 1   15   13   54 o  246.484   11.473   47.493   4.3284   36.095   7.0635   54.347   5.4773  207.806   22.570  262.180   13.696 -54.37354 26.40072 
1 1 1   15   13   55 o   71.716   25.754   4.0709   3.5982   14.912   6.0503  -1.8614   4.4757  126.375   31.414   53.613   24.485 72.76152 39.82947 
1 1 1   15   13   56 o   90.040   25.715   7.2920   3.7198   11.378   5.8098   4.4532   4.8426  108.429   32.465   76.194   29.371 32.23519 43.77949 
1 1 1   15   13   57 o  176.805   15.555   25.419   4.1668   21.816   5.6359   29.763   6.1882  157.473   24.153  186.074   22.163 -28.60005 32.78109 
1 1 1   15   14    0 o  236.169   9.3771   42.900   3.3776   42.900   3.3776   42.900   3.3776  236.169   9.3771  236.169   9.3771 0.000000 0.000000 
1 1 1   15   14    1 o  806.519   7.4625  497.998   9.2124  492.732   11.117  509.543   16.459  802.174   9.0540  815.499   13.186 -13.32458 15.99527 
1 1 1   15   14    2 o  943.124   8.1784  681.034   11.806  666.805   14.058  715.093   21.749  933.128   9.8425  965.945   14.710 -32.81696 17.69901 
1 1 1   15   14    3 o  1134.79   11.268  986.367   19.572  986.367   19.572   0.0000   0.0000  1134.79   11.268  ?   ?  0.000000 11.26828 
1 1 1   15   14    4 o  1117.27   11.153  956.134   19.072  956.134   19.072   0.0000   0.0000  1117.27   11.153  ?   ?  0.000000 11.15266 
1 1 1   15   14    5 o  618.927   6.8582  293.262   6.4971  300.437   7.8562  277.736   11.557  626.410   8.1937  602.096   12.540 24.31360 14.97954 
1 1 1   15   14    6 o  916.302   8.1204  642.854   11.389  643.003   13.749  642.529   20.330  916.313   9.8029  915.618   14.506 0.6952515 17.50805 
1 1 1   15   14    7 o  200.080   8.1214   30.651   2.4872   31.559   2.6969   25.487   6.4334  203.014   8.6789  180.583   23.860 22.43112 25.38913 
1 1 1   15   14    8 o  824.229   6.8561  520.092   8.6496  528.196   10.014  496.273   17.167  830.582   7.8765  804.716   13.937 25.86646 16.00896 
1 1 1   15   14    9 o  627.827   9.1343  301.843   8.7778  306.441   12.107  296.747   12.745  632.425   12.507  622.291   13.381 10.13403 18.31577 
1 1 1   15   14   10 o  1091.39   11.480  912.471   19.178  913.300   26.837  911.606   27.416  1091.38   16.065  1090.32   16.428 1.059937 22.97762 
1 1 1   15   14   11 o  336.912   11.080   86.951   5.7136   85.937   7.4066   88.441   8.9790  334.833   14.452  339.116   17.357 -4.282471 22.58573 
1 1 1   15   14   12 o  384.374   16.716  113.315   9.8345   0.0000   0.0000  113.315   9.8345  ?   ?   384.374   16.716 0.000000 16.71591 
1 1 1   15   14   13 o  586.969   10.199  263.896   9.1633  265.313   12.427  262.207   13.566  588.340   13.799  584.794   15.156 3.545593 20.49686 
1 1 1   15   14   14 f  365.507   9.1536  102.313   5.1210  101.154   5.8254  106.257   10.743  363.391   10.473  371.582   18.952 -8.191162 21.65369 
1 1 1   15   14   15 o  1175.68   10.142  1058.76   18.250  1038.37   21.658  1108.69   33.892  1164.08   12.155  1201.86   18.424 -37.78223 22.07235 
1 1 1   15   14   16 o  207.466   11.524   33.081   3.6451   30.062   5.0378   36.398   5.2805  197.231   16.849  217.251   15.992 -20.01982 23.23053 
1 1 1   15   14   17 f  786.479   7.4619  473.629   8.9826  468.382   12.493  479.244   12.924  781.918   10.439  790.914   10.676 -8.995911 14.93133 
1 1 1   15   14   18 o  682.643   6.7617  356.796   7.0651  354.802   8.0639  363.381   14.656  680.686   7.7397  688.421   13.909 -7.735046 15.91767 
1 1 1   15   14   19 o  170.243   11.516   22.312   2.9832   21.859   3.3948   23.849   6.2505  168.330   13.284  174.399   24.056 -6.069107 27.47970 
1 1 1   15   14   20 o  585.035   6.2361  262.052   5.5842  258.243   6.8172  269.820   9.7354  580.705   7.6698  593.398   10.719 -12.69348 13.18001 
1 1 1   15   14   21 o  613.189   6.3241  287.893   5.9356  282.835   7.3025  297.741   10.189  607.701   7.8508  623.319   10.680 -15.61755 13.25498 
1 1 1   15   14   22 o  431.801   6.7529  142.776   4.4631  146.793   5.5338  135.302   7.5492  437.769   8.2587  420.102   11.740 17.66730 14.35405 
1 1 1   15   14   23 o  608.215   6.5028  283.274   6.0538  284.491   7.5637  281.105   10.098  609.421   8.1086  605.563   10.895 3.858093 13.58112 
1 1 1   15   14   24 o  197.193   9.3808   29.799   2.8314   30.353   3.8935   29.177   4.1249  198.486   12.885  194.473   13.950 4.012634 18.99053 
1 1 1   15   14   25 o  330.810   6.9856   83.821   3.5371   83.485   4.8654   84.196   5.1514  330.028   9.6316  331.401   10.155 -1.373352 13.99649 
1 1 1   15   14   26 o  218.737   13.600   36.881   4.5307   35.868   9.1326   37.212   5.2181  213.057   28.738  219.469   15.636 -6.412231 32.71601 
1 1 1   15   14   27 o  542.998   6.1092  225.819   5.0775  228.128   7.2747  223.626   7.0902  545.557   8.7118  540.160   8.5756 5.397217 12.22442 
1 1 1   15   14   28 o  272.064   7.8310   56.724   3.2611   58.890   4.7135   54.735   4.5165  277.021   11.116  267.075   11.048 9.946289 15.67287 
1 1 1   15   14   29 o  406.825   6.9274  126.810   4.3137  128.559   5.8734  124.762   6.3560  409.425   9.3724  403.247   10.298 6.178467 13.92428 
1 1 1   15   14   30 f  170.644   11.158   22.453   2.8984   24.124   4.2827   21.041   3.9370  176.233   16.053  164.527   15.829 11.70572 22.54423 
1 1 1   15   14   31 o  209.245   10.039   33.605   3.2153   35.641   4.5628   31.596   4.5316  214.759   13.956  202.030   14.756 12.72884 20.31074 
1 1 1   15   14   32 o  316.104   7.6607   76.610   3.7065   79.173   5.5174   74.503   5.0038  321.013   11.229  311.478   10.496 9.534698 15.37037 
1 1 1   15   14   33 o  430.776   7.8699  142.313   5.1891  148.088   6.6999  133.656   8.2032  439.155   9.9674  416.747   12.860 22.40790 16.27042 
1 1 1   15   14   34 o  503.833   8.1049  194.739   6.2503  197.328   8.5213  191.724   9.1957  506.664   10.988  499.199   12.035 7.465027 16.29645 
1 1 1   15   14   35 o  219.626   11.905   37.230   3.9872   36.382   5.1376   38.515   6.3224  216.442   15.613  222.027   18.780 -5.584763 24.42230 
1 1 1   15   14   36 o  304.634   8.3764   71.237   3.9058   72.493   5.8849   70.249   5.2216  306.734   12.535  302.141   11.291 4.593079 16.86991 
1 1 1   15   14   37 o  180.107   11.811   25.093   3.2379   22.917   5.0597   26.603   4.2137  170.409   19.765  184.872   15.021 -14.46361 24.82519 
1 1 1   15   14   38 o  235.257   10.697   42.605   3.8518   48.576   6.6969   39.654   4.7085  249.355   17.661  226.146   13.667 23.20929 22.33123 
1 1 1   15   14   39 o  159.879   14.405   19.944   3.4873   11.381   5.5261   25.610   4.4954  116.798   30.559  180.863   16.418 -64.06535 34.68996 
1 1 1   15   14   40 o  133.501   19.503   14.226   3.8676   21.435   9.3211   12.726   4.2508  157.380   38.914  125.145   23.041 32.23560 45.22329 
1 1 1   15   14   41 o  226.355   10.856   39.511   3.7611   39.981   5.7653   39.163   4.9625  225.924   16.792  224.233   14.537 1.691406 22.21037 
1 1 1   15   14   42 o  329.201   8.0303   83.305   4.0463   90.544   6.9599   79.608   4.9732  341.904   13.299  321.402   10.109 20.50143 16.70529 
1 1 1   15   14   43 o  103.366   20.689   8.7084   3.1591   13.161   6.0351   7.0280   3.7077  124.351   31.633   92.187   25.443 32.16428 40.59565 
1 1 1   15   14   44 o  215.721   10.291   35.906   3.3981   35.239   6.4637   36.161   3.9946  210.358   20.328  215.811   12.142 -5.453293 23.67849 
1 1 1   15   14   45 o  370.602   8.9778  105.812   5.0927  110.885   8.0854  102.475   6.5568  377.607   13.989  363.849   11.773 13.75888 18.28417 
1 1 1   15   14   46 o   58.839   24.373   0.9956   3.5903  -2.3559   6.3813   2.5479   4.3429   65.910   29.757   69.744   27.541 -3.833847 40.54630 
1 1 1   15   14   47 o  186.560   12.594   27.149   3.5753   31.595   7.0184   25.592   4.1548  196.844   23.776  180.326   15.195 16.51865 28.21645 
1 1 1   15   14   48 o  113.343   20.695   10.531   3.4580   13.978   7.2430   9.5135   3.9355  125.227   35.920  106.368   24.654 18.85960 43.56662 
1 1 1   15   14   49 o  239.089   12.233   44.564   4.4618   30.512   19.817   45.314   4.5793  165.009   60.269  241.017   12.456 -76.00787 61.54266 
1 1 1   15   14   50 o  155.069   15.077   19.056   3.5334   15.437   7.1414   20.229   4.0659  130.526   35.019  159.111   16.956 -28.58466 38.90775 
1 1 1   15   14   51 o  129.152   18.473   13.556   3.5477   5.4322   6.5815   16.884   4.2121   87.853   34.135  143.871   19.640 -56.01821 39.38214 
1 1 1   15   14   52 o  101.598   23.988   8.8492   3.6706   1.0000   9.1986   10.336   4.0031   83.429   36.817  109.764   24.453 -26.33488 44.19827 
1 1 1   15   14   53 o   75.723   25.488   4.7000   3.4955   8.4604   6.5612   3.2098   4.1304   97.994   34.821   69.977   27.083 28.01733 44.11355 
1 1 1   15   14   54 o   42.219   20.144  -4.1745   3.6275  -3.9212   6.5517  -4.2865   4.3562   61.194   28.534   47.377   22.453 13.81738 36.30854 
1 1 1   15   14   55 o  102.885   24.464   9.3455   3.7962   9.9056   6.1843   9.0068   4.8088  101.823   33.900   98.769   29.528 3.054482 44.95711 
1 1 1   15   14   56 o  149.991   15.617   18.292   3.5329   17.326   5.6138   18.925   4.5459  137.955   27.550  149.648   20.376 -11.69270 34.26651 
1 1 1   15   14   57 o   79.526   27.337   5.6443   4.0229   2.1072   5.6049   9.4026   5.7775   69.324   29.670   97.601   32.769 -28.27622 44.20500 
1 1 1   15   15    0 o  393.009   11.831  118.586   7.1026  118.586   7.1026  118.586   7.1026  393.009   11.831  393.009   11.831 0.000000 0.000000 
1 1 1   15   15    1 o  216.116   9.0055   35.765   2.9790   34.532   3.4133   39.707   6.1027  212.336   10.502  226.846   17.717 -14.51012 20.59546 
1 1 1   15   15    2 o  969.695   10.212  720.156   15.158  720.156   15.158   0.0000   0.0000  969.695   10.212  ?   ?  0.000000 10.21228 
1 1 1   15   15    3 o  458.754   6.6944  161.115   4.7007  162.568   5.5983  157.644   8.6550  460.788   7.9376  453.609   12.466 7.178802 14.77825 
1 1 1   15   15    4 f  438.979   6.6708  147.525   4.4822  144.809   5.2694  154.632   8.5247  434.892   7.9161  449.256   12.397 -14.36462 14.70881 
1 1 1   15   15    5 f  1423.95   11.063  1553.14   24.113  1578.83   29.953  1505.85   40.646  1435.35   13.634  1400.92   18.955 34.43188 23.34934 
1 1 1   15   15    6 o  481.648   6.8407  177.601   5.0431  176.981   5.8963  179.291   9.7335  480.776   8.0124  483.712   13.147 -2.936432 15.39584 
1 1 1   15   15    7 o  859.410   7.0077  565.454   9.2182  569.184   10.631  554.154   18.504  862.190   8.0559  850.301   14.218 11.88831 16.34132 
1 1 1   15   15    8 o  459.081   6.1699  161.340   4.3355  160.500   4.8210  164.891   9.9132  457.869   6.8790  463.833   13.963 -5.964020 15.56569 
1 1 1   15   15    9 o  1335.97   10.803  1367.17   22.092  1368.41   27.034  1364.68   38.327  1336.28   13.217  1333.55   18.777 2.726074 22.96232 
1 1 1   15   15   10 o  712.828   7.8866  389.064   8.6048  390.987   10.418  384.934   15.265  714.508   9.5257  708.658   14.073 5.849609 16.99371 
1 1 1   15   15   11 o  400.231   10.518  122.701   6.4433  135.150   8.8429  108.610   9.4077  419.913   13.758  376.313   16.333 43.59921 21.35557 
1 1 1   15   15   12 o  383.059   10.969  112.409   6.4314  110.680   8.4268  114.821   9.9532  379.961   14.490  386.888   16.808 -6.927216 22.19107 
1 1 1   15   15   13 o  653.536   8.1100  327.055   8.1126  326.463   9.5781  328.559   15.261  652.871   9.5848  654.574   15.231 -1.702332 17.99627 
1 1 1   15   15   14 o  361.413   9.4299  100.043   5.2165   96.305   5.9010  113.410   11.159  354.552   10.874  384.343   18.968 -29.79135 21.86405 
1 1 1   15   15   15 o  476.975   8.7995  174.236   6.4243  173.464   7.4140  176.561   12.870  475.861   10.179  479.646   17.530 -3.784424 20.27081 
1 1 1   15   15   16 o  638.972   8.5035  312.681   8.3167  311.376   9.7990  316.041   15.726  637.551   10.041  641.837   16.008 -4.285645 18.89673 
1 1 1   15   15   17 o  619.308   7.3347  293.688   6.9528  304.082   9.6772  282.597   9.9960  630.026   10.035  607.316   10.753 22.71039 14.70836 
1 1 1   15   15   18 o  707.854   6.8504  383.655   7.4222  382.362   8.4666  387.946   15.426  706.607   7.8281  711.229   14.171 -4.621216 16.18901 
1 1 1   15   15   19 o  654.718   6.2841  328.200   6.2975  329.321   7.7540  326.028   10.794  655.761   7.7252  652.267   10.811 3.494202 13.28784 
1 1 1   15   15   20 o   85.856   19.678   5.8935   2.5306   7.2647   2.9132   1.6771   5.1083   95.375   20.561   72.655   29.467 22.71938 35.93104 
1 1 1   15   15   21 o  727.759   8.0932  405.678   9.0153  405.678   9.0153   0.0000   0.0000  727.759   8.0932  ?   ?  0.000000 8.093218 
1 1 1   15   15   22 o  174.210   10.839   23.354   2.8759   25.372   3.3868   18.138   5.4451  181.476   12.265  151.474   24.308 30.00208 27.22650 
1 1 1   15   15   23 o  612.718   7.2687  287.548   6.8169  287.429   7.5315  288.089   16.034  612.536   8.0331  612.172   17.112 0.3641968 18.90359 
1 1 1   15   15   24 o  519.677   7.4270  206.874   5.9077  207.996   6.4764  201.314   14.417  521.037   8.1207  511.432   18.417 9.604950 20.12793 
1 1 1   15   15   25 o  260.964   10.007   52.215   3.9973   48.272   9.2994   53.108   4.4272  248.566   24.772  263.138   10.992 -14.57141 27.10162 
1 1 1   15   15   26 o  663.870   6.9026  337.613   7.0140  355.248   12.053  328.583   8.6247  680.403   11.573  654.760   8.6058 25.64319 14.42233 
1 1 1   15   15   27 o  603.943   6.0554  279.370   5.5977  300.084   8.1215  260.625   7.7259  625.693   8.4802  583.087   8.6566 42.60577 12.11821 
1 1 1   15   15   28 o  486.637   6.1834  181.403   4.6058  183.245   6.5036  179.550   6.5235  488.884   8.6912  483.920   8.8072 4.964722 12.37347 
1 1 1   15   15   29 o  623.250   6.1191  297.568   5.8374  312.022   8.5133  284.742   8.0194  637.888   8.7193  609.383   8.5977 28.50574 12.24532 
1 1 1   15   15   30 o   91.135   19.349   6.6627   2.6156   8.0826   3.8964   5.4980   3.5288   99.960   25.411   83.695   25.357 16.26527 35.89825 
1 1 1   15   15   31 o  600.395   6.6664  276.250   6.1263  289.428   8.4536  261.673   8.8907  614.209   8.9920  583.856   9.9486 30.35272 13.41011 
1 1 1   15   15   32 o  412.110   8.3094  130.273   5.2414  130.393   6.9472  130.113   7.9859  411.946   11.018  411.237   12.687 0.7085266 16.80347 
1 1 1   15   15   33 o  588.446   7.7157  265.568   6.9495  273.898   9.5038  255.995   10.188  597.086   10.399  576.987   11.536 20.09943 15.53118 
1 1 1   15   15   34 f  243.323   8.8920   45.450   3.3117   47.724   5.0172   43.695   4.4085  248.527   13.237  237.958   12.144 10.56889 17.96382 
1 1 1   15   15   35 o  411.015   7.0041  129.554   4.4064  134.983   6.4958  124.927   5.9971  419.068   10.127  403.224   9.7169 15.84399 14.03474 
1 1 1   15   15   36 o  210.006   10.328   33.917   3.3198   36.026   5.1060   32.373   4.3694  215.221   15.606  204.277   14.060 10.94406 21.00536 
1 1 1   15   15   37 o  173.041   13.081   23.239   3.4392   29.346   5.8820   20.067   4.2393  192.874   20.225  159.772   17.629 33.10164 26.82970 
1 1 1   15   15   38 o  206.076   11.200   32.816   3.5195   40.558   5.8354   28.390   4.4124  227.864   16.851  190.821   15.234 37.04318 22.71588 
1 1 1   15   15   39 o   76.646   25.736   4.4394   3.5636   13.617   8.9148   2.6940   3.8877  127.191   40.590   68.797   26.368 58.39412 48.40228 
1 1 1   15   15   40 o  313.332   8.8049   75.504   4.2228   75.045   6.5452   75.831   5.5269  311.294   13.737  313.466   11.519 -2.172333 17.92736 
1 1 1   15   15   41 o  194.182   13.716   29.358   4.0503   28.084   5.6052   30.751   5.8593  188.185   19.754  197.020   19.693 -8.835785 27.89387 
1 1 1   15   15   42 o  159.469   14.852   19.929   3.5836   32.682   5.8285   12.178   4.5440  203.261   18.953  121.380   25.279 81.88125 31.59485 
1 1 1   15   15   43 o  116.614   21.855   11.095   3.7576   16.006   5.7786   7.4969   4.9462  138.349   28.244   95.715   30.201 42.63348 41.34989 
1 1 1   15   15   44 o  262.570   10.608   53.238   4.2632   56.239   6.8764   51.365   5.4336  267.550   16.878  256.737   13.878 10.81287 21.85116 
1 1 1   15   15   45 o   65.480   25.968   2.1161   3.8763  -5.0495   6.1332   6.8821   5.0019   58.839   27.493   92.276   30.477 -33.43692 41.04505 
1 1 1   15   15   46 o  153.618   21.574   19.138   4.9329   20.866   6.4912   16.775   7.5891  157.753   27.904  137.750   35.701 20.00278 45.31191 
1 1 1   15   15   47 o  136.980   17.422   14.994   3.5701   17.938   15.265   14.824   3.6719  139.108   52.501  135.966   18.093 3.141983 55.53107 
1 1 1   15   15   48 o  114.284   21.390   10.761   3.6042   1.4907   12.093   11.665   3.7758   96.477   42.408  119.055   21.512 -22.57799 47.55242 
1 1 1   15   15   49 o  130.949   18.290   13.844   3.5659   5.1448   8.2932   15.818   3.9497   92.776   37.573  139.870   18.935 -47.09426 42.07515 
1 1 1   15   15   50 o  117.511   19.769   11.331   3.4295   3.6772   6.7476   13.997   3.9823   82.763   33.753  130.531   20.616 -47.76787 39.55085 
1 1 1   15   15   51 o  142.128   17.506   16.310   3.7278   33.920   9.1038   12.762   4.0860  196.360   31.344  123.419   22.457 72.94113 38.55871 
1 1 1   15   15   52 o   78.161   25.632   5.0730   3.5405   6.0852   6.6275   4.6687   4.1882   89.333   34.381   77.323   27.784 12.00994 44.20411 
1 1 1   15   15   53 o  127.719   18.732   13.414   3.5531   14.540   6.5656   12.948   4.2253  124.586   33.641  123.245   23.251 1.340530 40.89445 
1 1 1   15   15   54 o   77.103   26.741   4.9464   3.8537   5.2731   6.3175   4.7528   4.8634   84.072   33.212   78.416   29.625 5.655716 44.50420 
1 1 1   15   15   55 o   61.828   24.402   2.3618   3.4076  -3.4433   5.6544   5.6723   4.2701   56.566   26.420   80.884   28.144 -24.31770 38.60145 
1 1 1   15   15   56 o  148.543   15.770   18.001   3.5308   12.620   5.7142   21.324   4.4906  113.824   31.651  159.880   18.703 -46.05595 36.76412 
1 1 1   15   16    1 o  387.643   8.5303  115.064   5.0614  114.445   6.9496  115.762   7.3860  386.506   11.747  388.702   12.414 -2.195374 17.09128 
1 1 1   15   16    2 f  651.259   7.0624  324.719   7.0400  322.902   8.5125  328.653   12.523  649.377   8.5643  654.933   12.492 -5.555786 15.14620 
1 1 1   15   16    3 o  406.171   6.9085  126.303   4.2950  126.745   5.1314  125.268   7.8489  406.851   8.2401  404.333   12.682 2.518005 15.12425 
1 1 1   15   16    4 o  1345.90   10.617  1387.51   21.871  1406.91   27.132  1351.50   36.958  1354.98   13.082  1327.23   18.193 27.74915 22.40780 
1 1 1   15   16    5 o  263.109   8.2903   53.008   3.3387   56.917   3.8723   41.684   6.5905  272.621   9.2799  232.326   18.691 40.29553 20.86826 
1 1 1   15   16    6 o  1492.67   11.552  1706.92   26.394  1727.67   32.643  1667.73   44.858  1501.32   14.205  1473.94   19.883 27.37402 24.43631 
1 1 1   15   16    7 o  320.288   6.9274   78.539   3.3961   77.920   3.7675   81.222   7.8437  319.008   7.7159  325.457   15.745 -6.449280 17.53438 
1 1 1   15   16    8 o  601.047   6.3687  276.565   5.8590  273.005   6.5863  290.065   12.827  597.139   7.2060  615.185   13.622 -18.04584 15.41067 
1 1 1   15   16    9 o  413.712   8.0817  131.059   5.1177  137.458   6.1351  116.421   9.2793  423.649   9.4612  389.644   15.559 34.00516 18.20963 
1 1 1   15   16   10 o  535.485   9.9034  219.629   8.1171  223.337   11.394  215.808   11.567  539.779   13.790  530.574   14.243 9.204712 19.82517 
1 1 1   15   16   11 o  381.954   8.7465  111.724   5.1135  107.703   5.9177  123.574   10.159  374.971   10.311  401.362   16.537 -26.39081 19.48822 
1 1 1   15   16   12 o  577.389   8.0859  255.286   7.1461  253.826   8.4634  258.913   13.337  575.667   9.6052  581.068   14.996 -5.400391 17.80819 
1 1 1   15   16   13 o  368.603   9.4177  104.066   5.3134  114.339   6.2498   77.279   10.092  386.328   10.569  316.450   20.954 69.87842 23.46853 
1 1 1   15   16   14 o  174.621   16.037   23.589   4.2385   23.562   4.7262   23.698   9.5803  174.282   17.975  171.583   37.523 2.699280 41.60656 
1 1 1   15   16   15 o  242.383   12.474   45.150   4.6121   44.429   5.1638   47.990   10.255  240.297   14.101  248.009   27.476 -7.711563 30.88321 
1 1 1   15   16   16 o  272.280   12.046   56.822   5.0203   59.015   5.7345   49.627   10.388  277.431   13.504  252.236   27.343 25.19482 30.49617 
1 1 1   15   16   17 o  637.568   8.2596  311.324   8.0604  318.978   10.047  297.500   13.502  645.235   10.173  622.806   14.164 22.42896 17.43876 
1 1 1   15   16   18 o  532.087   7.6072  216.818   6.1955  217.093   8.5104  216.507   9.0369  532.268   10.446  531.505   11.108 0.7631836 15.24827 
1 1 1   15   16   19 o  367.215   7.5498  103.272   4.2435  113.314   5.3514   86.261   6.9650  384.593   9.0906  335.349   13.569 49.24414 16.33290 
1 1 1   15   16   20 o  790.594   6.5818  478.626   7.9647  476.428   9.8953  482.670   13.422  788.652   8.1974  793.511   11.050 -4.859863 13.75902 
1 1 1   15   16   21 f  198.413   10.751   30.267   3.2528   29.609   3.3866   38.098   11.687  196.189   11.326  218.323   36.245 -22.13333 37.97361 
1 1 1   15   16   22 o  419.654   7.4808  134.897   4.8051  134.947   5.1735  134.586   12.967  419.702   8.0533  418.012   20.266 1.690155 21.80739 
1 1 1   15   16   23 o  362.223   7.1025  100.500   3.9378  101.041   4.7129   99.247   7.1669  363.132   8.4793  359.595   13.021 3.536652 15.53861 
1 1 1   15   16   24 o  246.850   13.320   46.923   5.0143   37.232   8.9209   51.398   6.0626  217.415   27.417  258.129   15.415 -40.71393 31.45310 
1 1 1   15   16   25 o  740.609   8.0597  420.325   9.1365  435.432   13.416  407.259   12.477  753.268   11.636  728.566   11.188 24.70197 16.14245 
1 1 1   15   16   26 o  302.686   6.9908   70.192   3.2388   70.287   4.4546   70.086   4.7175  302.748   9.6130  302.275   10.196 0.4730225 14.01328 
1 1 1   15   16   27 o  502.142   6.0574  193.140   4.6557  196.914   6.5308  189.241   6.6386  506.818   8.4187  496.815   8.7300 10.00351 12.12801 
1 1 1   15   16   28 o  296.657   7.2751   67.444   3.3034   71.188   4.6484   63.624   4.6955  304.597   9.9702  287.907   10.655 16.69022 14.59232 
1 1 1   15   16   29 o  198.539   9.4468   30.243   2.8708   29.864   4.1304   30.596   3.9929  196.537   13.818  199.032   13.181 -2.495132 19.09691 
1 1 1   15   16   30 f  258.964   9.9930   51.478   3.9610   51.138   4.6668   52.357   7.4907  257.950   11.820  259.474   18.993 -1.524475 22.37030 
1 1 1   15   16   31 o  105.232   21.691   8.9106   3.3777   7.5745   4.2007   11.354   5.6812   96.942   27.202  117.845   31.058 -20.90308 41.28625 
1 1 1   15   16   32 o  570.312   6.8619  249.336   5.9900  276.426   8.3454  220.551   8.6027  600.120   9.0854  535.789   10.490 64.33093 13.87737 
1 1 1   15   16   33 o  154.262   12.016   18.422   2.8148   18.854   4.0255   18.008   3.9374  155.156   17.242  151.586   17.279 3.569580 24.40985 
1 1 1   15   16   34 o  174.711   11.331   23.581   3.0137   22.072   4.3113   25.023   4.2145  167.997   17.000  179.284   15.511 -11.28616 23.01289 
1 1 1   15   16   35 o  209.388   9.7920   33.698   3.1383   36.365   4.6743   31.510   4.2346  216.556   14.180  201.588   13.807 14.96779 19.79180 
1 1 1   15   16   36 o  289.034   8.3389   64.152   3.6892   64.633   5.4202   63.736   5.0356  289.553   12.230  287.668   11.436 1.884552 16.74380 
1 1 1   15   16   37 o  233.710   9.7249   42.011   3.4788   47.451   5.7488   38.868   4.3697  247.026   15.279  224.035   12.796 22.99097 19.92964 
1 1 1   15   16   38 o  323.402   8.2416   80.356   4.0796   79.556   6.2161   80.962   5.4071  320.940   12.654  324.147   10.898 -3.207581 16.70004 
1 1 1   15   16   39 o  252.881   13.109   49.589   5.0565   27.367   9.3835   58.682   6.0025  179.732   35.369  274.811   14.320 -95.07916 38.15753 
1 1 1   15   16   40 o  150.299   16.086   17.769   3.6431   16.085   5.0996   19.524   5.2064  140.400   24.628  155.737   22.493 -15.33702 33.35379 
1 1 1   15   16   41 o  187.508   12.408   27.309   3.5411   31.074   5.4146   24.496   4.6809  198.527   18.015  176.214   17.590 22.31290 25.17828 
1 1 1   15   16   42 o  324.766   9.3261   81.235   4.6359   86.272   6.8167   76.900   6.3235  333.576   13.351  315.007   13.115 18.56821 18.71489 
1 1 1   15   16   43 o  159.740   14.824   20.024   3.5832   17.419   5.7248   21.701   4.5944  144.900   26.799  165.262   18.479 -20.36241 32.55269 
1 1 1   15   16   44 o  153.252   16.454   18.572   3.7993   18.167   6.0242   18.839   4.8957  147.449   27.710  152.669   21.550 -5.219910 35.10323 
1 1 1   15   16   45 o  229.076   14.309   41.036   4.9919   44.840   6.5812   35.882   7.6602  237.962   18.207  209.961   24.284 28.00139 30.35142 
1 1 1   15   16   46 o  178.507   18.451   25.403   4.9685   15.162   14.708   26.722   5.2788  132.481   51.153  182.855   19.145 -50.37413 54.61840 
1 1 1   15   16   47 o  178.294   18.433   25.388   4.9578   9.0734   11.949   28.780   5.4489  112.958   45.328  189.692   19.023 -76.73405 49.15775 
1 1 1   15   16   48 o  191.683   15.013   28.965   4.3696   39.230   7.1744   22.912   5.5093  220.051   21.578  167.498   22.023 52.55389 30.83228 
1 1 1   15   16   49 o  121.626   23.973   12.429   4.3042   4.1236   7.5616   16.410   5.2350   87.200   35.665  139.490   25.457 -52.29062 43.81868 
1 1 1   15   16   50 o   48.230   22.343  -2.7619   3.9165  -5.0375   5.9046  -0.9743   5.2335   56.506   26.585   61.693   27.469 -5.186714 38.22717 
1 1 1   15   16   51 o  128.151   25.516   14.099   4.8292   0.8580   8.9488   19.539   5.7361   82.319   36.321  151.310   25.686 -68.99108 44.48604 
1 1 1   15   16   52 o   58.076   25.436  -0.1559   4.3152  -3.9346   6.4224   2.9539   5.8263   60.947   28.362   75.742   31.180 -14.79548 42.15015 
1 1 1   15   16   53 o  109.613   23.040   10.323   3.7428   20.228   6.5973   5.6210   4.5451  149.908   29.802   82.139   29.004 67.76812 41.58549 
1 1 1   15   16   54 o   41.352   19.585  -3.3264   3.3044  -9.4870   5.6419  -0.1098   4.0768   46.821   22.975   56.020   24.624 -9.199463 33.67785 
1 1 1   15   16   55 o  130.492   18.057   14.147   3.5099   8.8138   5.5542   17.692   4.5288   96.182   32.130  144.186   21.149 -48.00394 38.46622 
1 1 1   15   16   56 o   48.648   22.467  -2.0669   3.9163  -8.3846   5.5009   4.4267   5.5769   46.910   22.949   77.055   30.950 -30.14494 38.52990 
1 1 1   15   17    0 o  155.757   22.496   19.727   5.0379   19.727   5.0379   19.727   5.0379  155.757   22.496  155.757   22.496 0.000000 0.000000 
1 1 1   15   17    1 o  176.109   13.648   23.913   3.6502   22.400   4.9712   25.684   5.3769  169.719   19.490  181.868   19.626 -12.14932 27.65979 
1 1 1   15   17    2 o  882.919   8.0844  596.909   10.925  599.937   13.383  590.859   18.916  885.042   9.8795  877.969   14.076 7.073181 17.19719 
1 1 1   15   17    3 o  772.782   9.4558  457.368   11.185  464.274   15.858  450.533   15.777  778.321   13.312  766.706   13.444 11.61523 18.91925 
1 1 1   15   17    4 o  678.578   9.1996  352.644   9.5551  365.264   13.517  340.041   13.509  690.393   12.792  666.097   13.250 24.29572 18.41679 
1 1 1   15   17    5 o  530.204   8.9606  215.283   7.2719  209.596   9.9405  221.831   10.666  522.995   12.418  538.014   12.952 -15.01849 17.94301 
1 1 1   15   17    6 o  659.729   9.2474  333.333   9.3380  337.217   13.093  329.311   13.322  663.340   12.895  655.491   13.278 7.848999 18.50932 
1 1 1   15   17    7 o  959.913   8.8453  705.650   12.996  711.053   16.041  695.328   22.172  963.418   10.878  952.253   15.212 11.16467 18.70073 
1 1 1   15   17    8 o  900.400   8.5964  620.848   11.847  625.884   14.612  611.188   20.240  903.898   10.562  892.811   14.811 11.08661 18.19082 
1 1 1   15   17    9 o  417.977   10.512  133.834   6.7254  130.350   9.1743  137.880   9.8881  412.320   14.537  424.023   15.235 -11.70245 21.05790 
1 1 1   15   17   10 o  781.357   8.2649  467.525   9.8846  456.889   11.776  492.885   18.185  772.312   9.9619  801.725   14.819 -29.41394 17.85593 
1 1 1   15   17   11 o  751.720   8.2830  432.739   9.5305  438.359   11.556  420.792   16.851  756.477   9.9807  740.751   14.862 15.72583 17.90219 
1 1 1   15   17   12 o  719.802   8.2844  396.779   9.1273  397.781   10.908  394.440   16.669  720.610   9.8892  717.126   15.186 3.484375 18.12245 
1 1 1   15   17   13 o  663.108   8.2984  336.747   8.4226  331.236   9.9041  351.146   16.009  657.569   9.8402  676.571   15.459 -19.00140 18.32523 
1 1 1   15   17   14 o  902.786   8.9578  624.263   12.378  610.432   14.688  658.152   22.993  892.568   10.751  926.100   16.220 -33.53192 19.46002 
1 1 1   15   17   15 o  420.697   9.3293  135.577   6.0074  141.362   7.0069  119.527   11.671  429.518   10.658  394.405   19.333 35.11273 22.07593 
1 1 1   15   17   16 o  534.673   10.200  219.042   8.3475  219.042   8.3475   0.0000   0.0000  534.673   10.200  ?   ?  0.000000 10.20001 
1 1 1   15   17   17 o   66.763   27.005   1.4575   4.2784   0.8419   4.7027   4.4150   10.308   67.112   27.855  105.370   42.164 -38.25761 50.53392 
1 1 1   15   17   18 o  460.795   9.2125  162.678   6.4976  159.234   7.4799  173.267   13.116  455.803   10.721  474.820   18.047 -19.01727 20.99147 
1 1 1   15   17   19 o  535.018   9.1619  219.321   7.5028  223.549   8.8025  208.090   14.347  540.040   10.649  520.274   18.016 19.76563 20.92771 
1 1 1   15   17   20 o  510.723   9.3028  199.881   7.2722  199.244   8.5176  201.596   13.969  509.784   10.916  512.028   17.823 -2.243622 20.90041 
1 1 1   15   17   21 o  666.574   6.4508  340.274   6.5816  335.187   8.0611  350.446   11.399  661.456   7.9620  676.028   11.016 -14.57239 13.59196 
1 1 1   15   17   22 o  310.004   7.4809   73.621   3.5497   75.465   4.2098   69.084   6.6027  313.806   8.7647  299.906   14.383 13.89944 16.84351 
1 1 1   15   17   23 o  409.291   8.8164  128.393   5.5232  122.797   7.7652  134.123   7.8577  399.957   12.684  418.036   12.280 -18.07843 17.65499 
1 1 1   15   17   24 o  292.868   12.155   65.841   5.4488   64.658   9.3881   66.442   6.6911  288.539   21.410  293.601   14.938 -5.062347 26.10625 
1 1 1   15   17   25 o   48.464   20.366   0.2409   2.5602   2.8649   2.9226  -8.4149   5.3083   65.423   23.241   48.646   23.507 16.77671 33.05627 
1 1 1   15   17   26 o  295.446   8.0239   66.906   3.6286   67.865   4.3227   64.620   6.6765  297.463   9.4940  289.395   15.125 8.068787 17.85799 
1 1 1   15   17   27 o  211.969   10.078   34.477   3.2697   39.225   3.9339   23.867   5.8804  225.724   11.423  174.045   22.608 51.67886 25.32993 
1 1 1   15   17   28 f  160.870   12.587   20.014   3.0747   22.960   3.6642   13.004   5.6526  172.169   14.026  126.339   29.727 45.82986 32.86996 
1 1 1   15   17   29 o  422.722   8.4929  137.054   5.4951  140.149   6.6147  130.162   9.8717  427.273   10.114  410.880   15.697 16.39291 18.67308 
1 1 1   15   17   30 o  140.586   15.041   15.407   3.1864   13.492   3.8428   19.621   5.7005  130.515   19.863  156.822   24.554 -26.30693 31.58228 
1 1 1   15   17   31 o  170.774   10.692   22.496   2.7808   22.496   4.0212   22.496   3.8498  170.022   15.627  170.145   14.933 -0.1233826 21.61482 
1 1 1   15   17   32 o  234.001   8.6100   42.024   3.0838   39.968   4.3917   44.023   4.3313  227.491   12.663  239.205   11.830 -11.71425 17.32881 
1 1 1   15   17   33 o   60.635   21.642   2.4699   2.5372   5.3762   3.6826  -0.1564   3.5006   82.952   26.043   54.371   23.364 28.58057 34.98694 
1 1 1   15   17   34 o  156.314   12.106   18.931   2.8739   19.454   4.2820   18.503   3.8769  157.306   18.115  153.662   16.755 3.643875 24.67524 
1 1 1   15   17   35 o  187.714   10.661   27.200   3.0506   30.691   4.5977   24.455   4.0774  198.586   15.242  177.151   15.184 21.43469 21.51458 
1 1 1   15   17   36 f  112.413   17.992   10.066   2.9913   10.732   4.6570   9.5982   3.9029  114.085   27.075  108.341   24.152 5.744240 36.28205 
1 1 1   15   17   37 o  324.109   7.9831   80.683   3.9604   82.396   6.0280   79.382   5.2532  326.784   12.052  321.029   10.691 5.754608 16.11005 
1 1 1   15   17   38 o   60.316   25.189   0.7607   3.8792   12.586   8.7861  -2.1029   4.3235  123.023   40.381   54.022   24.432 69.00109 47.19685 
1 1 1   15   17   39 o  254.399   9.4444   49.813   3.6776   55.297   5.5214   45.440   4.9304  266.904   13.560  241.932   13.366 24.97185 19.03995 
1 1 1   15   17   40 o  166.697   13.646   21.672   3.4513   27.584   5.4160   17.629   4.4784  186.618   19.236  148.486   20.231 38.13298 27.91666 
1 1 1   15   17   41 o  231.672   10.610   41.408   3.7625   40.204   5.6723   42.354   5.0277  226.437   16.479  233.167   14.155 -6.729233 21.72348 
1 1 1   15   17   42 o  220.698   11.761   37.772   3.9587   37.879   5.7525   37.676   5.4561  219.365   17.272  219.075   16.390 0.2894135 23.81099 
1 1 1   15   17   43 o  267.826   10.106   55.349   4.1430   62.633   6.5487   50.488   5.3497  283.076   15.169  254.548   13.782 28.52832 20.49500 
1 1 1   15   17   44 o   64.639   27.046   1.0424   4.4849   1.2830   5.6113   0.6168   7.4627   71.665   30.135   78.702   33.967 -7.036873 45.40725 
1 1 1   15   17   45 f   93.542   28.074   7.3108   4.3406  -5.5971   13.167   8.8846   4.5976   89.412   41.260  102.362   28.365 -12.95016 50.06936 
1 1 1   15   17   46 o  198.221   13.521   30.737   4.0777   34.719   6.7089   28.404   5.1351  207.469   21.436  188.943   17.972 18.52580 27.97315 
1 1 1   15   17   47 o  358.938   9.9976   99.627   5.4927   94.424   8.0576  104.144   7.5073  347.117   15.166  365.476   13.420 -18.35898 20.25073 
1 1 1   15   17   48 o  115.567   24.821   11.285   4.2595   11.961   7.8204   11.000   5.0791  115.525   38.105  112.515   29.229 3.010826 48.02425 
1 1 1   15   17   49 o   99.560   26.909   8.5503   4.1983   4.8406   6.2209   11.653   5.6892   84.924   33.134  114.514   31.481 -29.58937 45.70496 
1 1 1   15   17   50 o  160.856   20.570   21.220   4.9487   3.3086   9.5129   27.865   5.7944   89.949   38.579  184.428   20.895 -94.47856 43.87427 
1 1 1   15   17   51 o   94.988   29.942   7.9391   4.8627  -4.1248   9.2238   12.583   5.7226   73.663   34.182  117.820   31.229 -44.15652 46.29941 
1 1 1   15   17   52 o  123.332   29.355   13.685   5.4616   4.3163   9.0443   19.062   6.8520   89.388   37.958  144.393   31.857 -55.00510 49.55469 
1 1 1   15   17   53 o   81.816   28.975   5.6411   4.5393   0.2298   6.0616   12.550   6.8493   67.685   29.877  113.516   35.497 -45.83084 46.39749 
1 1 1   15   17   54 o  149.807   18.766   18.631   4.2087   12.762   5.9148   24.649   5.9898  115.129   32.268  168.830   23.842 -53.70131 40.12119 
1 1 1   15   17   55 o   65.668   26.166   2.7788   3.9528   8.1708   5.4781  -3.0779   5.7093   92.763   31.899   57.174   26.651 35.58936 41.56775 
1 1 1   15   18    0 o  900.942   14.201  622.200   19.572  622.200   19.572  622.200   19.572  900.942   14.201  900.942   14.201 0.000000 0.000000 
1 1 1   15   18    1 o  484.826   8.6305  180.007   6.4046  180.326   8.9233  179.667   9.1978  485.111   12.017  484.204   12.410 0.9067993 17.27539 
1 1 1   15   18    2 o  917.414   8.3268  644.508   11.693  651.035   14.403  631.894   20.024  921.909   10.207  907.853   14.410 14.05634 17.65871 
1 1 1   15   18    3 o  569.609   7.1517  248.419   6.2353  243.064   7.4220  261.266   11.495  563.380   8.6070  583.863   12.863 -20.48358 15.47677 
1 1 1   15   18    4 o  1187.35   9.7836  1079.85   17.781  1091.30   21.928  1057.86   30.384  1193.38   12.004  1174.23   16.905 19.14807 20.73362 
1 1 1   15   18    5 o  1099.28   9.3081  925.521   15.662  939.879   19.349  898.242   26.670  1107.56   11.414  1082.13   16.102 25.42505 19.73697 
1 1 1   15   18    6 o  488.439   7.2592  182.669   5.4271  185.794   6.4574  175.150   10.015  492.554   8.5651  477.993   13.689 14.56168 16.14770 
1 1 1   15   18    7 o  1137.98   9.6737  991.924   16.850  989.595   20.560  996.687   29.405  1136.41   11.820  1139.72   16.856 -3.318115 20.58731 
1 1 1   15   18    8 o  730.841   7.8727  409.011   8.8068  405.327   10.564  417.404   15.945  727.448   9.4880  737.832   14.118 -10.38489 17.01037 
1 1 1   15   18    9 o  248.605   10.800   47.352   4.1095   44.405   4.8059   55.368   7.9257  240.324   13.115  267.793   19.469 -27.46851 23.47438 
1 1 1   15   18   10 o  271.984   10.490   56.675   4.3669   58.175   5.0925   52.507   8.4884  275.512   12.076  260.472   21.483 15.03946 24.64398 
1 1 1   15   18   11 o  493.993   8.2930  186.888   6.2705  184.761   7.3362  192.655   12.080  491.109   9.7595  501.105   15.750 -9.996582 18.52850 
1 1 1   15   18   12 o  214.378   12.883   35.360   4.2077   32.191   4.7651   46.578   8.9653  204.266   15.353  244.773   24.248 -40.50711 28.70030 
1 1 1   15   18   13 o  406.360   8.9557  126.485   5.5703  125.633   6.4986  128.845   10.815  404.924   10.485  409.649   17.248 -4.724823 20.18528 
1 1 1   15   18   14 o  278.103   11.390   59.278   4.8485   59.251   5.4731   59.378   10.451  277.982   12.863  276.457   24.968 1.524994 28.08675 
1 1 1   15   18   15 f  459.339   10.295  161.682   7.2383  161.682   7.2383   0.0000   0.0000  459.339   10.295  ?   ?  0.000000 10.29520 
1 1 1   15   18   16 o  526.146   8.8311  212.073   7.1120  202.284   8.1454  243.478   14.590  513.764   10.358  563.009   16.930 -49.24524 19.84726 
1 1 1   15   18   17 o  289.865   11.647   64.422   5.1673   65.279   5.8548   61.401   10.990  291.716   13.113  280.815   25.859 10.90094 28.99382 
1 1 1   15   18   18 f  593.098   10.602  269.653   9.6248  269.653   9.6248   0.0000   0.0000  593.098   10.602  ?   ?  0.000000 10.60221 
1 1 1   15   18   19 o  534.295   7.7856  218.683   6.3671  224.630   8.8764  212.381   9.1382  541.281   10.714  526.258   11.345 15.02277 15.60414 
1 1 1   15   18   20 o  273.475   10.511   57.343   4.3999   53.115   6.1287   61.840   6.3204  262.483   15.321  283.376   14.622 -20.89319 21.17851 
1 1 1   15   18   21 o  696.358   7.7626  371.517   8.2739  375.365   11.634  367.579   11.769  699.589   10.865  692.261   11.107 7.327209 15.53755 
1 1 1   15   18   22 o  388.384   8.8662  115.619   5.2707  116.987   7.3908  114.203   7.5186  390.393   12.369  385.684   12.736 4.708984 17.75354 
1 1 1   15   18   23 o  371.072   7.5189  105.505   4.2706   99.738   5.2699  116.537   7.2887  360.657   9.5463  389.610   12.222 -28.95306 15.50855 
1 1 1   15   18   24 o  187.491   9.9734   27.040   2.8519   26.657   3.3314   28.088   5.5173  185.973   11.764  189.829   19.255 -3.855438 22.56439 
1 1 1   15   18   25 o   62.343   21.808   2.6732   2.5656   2.0046   2.9196   4.9397   5.3756   60.350   22.916   86.743   31.434 -26.39299 38.90079 
1 1 1   15   18   26 o  195.601   9.8971   29.431   2.9535   27.608   3.4381   34.566   5.7694  189.204   11.933  210.865   18.049 -21.66103 21.63749 
1 1 1   15   18   27 o  313.960   8.4847   75.592   4.0774   78.920   5.0879   69.617   6.8165  320.638   10.367  300.671   14.812 19.96667 18.07929 
1 1 1   15   18   28 o  351.326   8.3748   94.663   4.5036   97.764   5.7695   89.828   7.2051  356.809   10.564  341.618   13.779 15.19095 17.36292 
1 1 1   15   18   29 o  497.377   7.4955  189.673   5.7063  192.935   6.6543  180.608   11.093  501.481   8.6692  484.027   14.972 17.45380 17.30118 
1 1 1   15   18   30 o  334.850   6.9641   85.956   3.5693   88.778   5.0545   83.150   5.0412  340.029   9.7115  329.041   10.010 10.98788 13.94652 
1 1 1   15   18   31 o  556.843   6.2284  237.651   5.3086  247.288   7.6208  228.567   7.3989  567.613   8.7716  545.689   8.8584 21.92407 12.46646 
1 1 1   15   18   32 o   77.495   19.983   4.8452   2.3856   6.5725   3.3517   3.0716   3.3963   90.041   23.915   68.639   24.969 21.40260 34.57423 
1 1 1   15   18   33 o  272.317   7.8711   56.907   3.2808   60.277   4.6957   53.693   4.5857  279.908   10.960  264.130   11.343 15.77795 15.77296 
1 1 1   15   18   34 o  134.639   13.539   14.131   2.7523   13.150   3.8601   15.146   3.9253  128.348   20.326  138.264   19.054 -9.915848 27.86049 
1 1 1   15   18   35 o  248.586   8.7344   47.477   3.3234   47.387   4.7616   47.563   4.6406  247.515   12.610  248.349   12.208 -0.8341217 17.55144 
1 1 1   15   18   36 o  141.648   13.769   15.659   2.9475   14.251   4.5342   16.689   3.8789  132.729   23.161  145.368   17.805 -12.63913 29.21385 
1 1 1   15   18   37 o  166.287   16.722   21.720   4.1984   24.595   8.7572   20.862   4.7840  170.631   34.712  162.136   19.680 8.495026 39.90282 
1 1 1   15   18   38 o  144.492   13.986   16.320   3.0544   17.654   4.7417   15.374   3.9932  148.332   21.513  138.882   19.307 9.450134 28.90580 
1 1 1   15   18   39 o   91.521   21.892   6.8677   3.0256   5.0838   4.4242   8.4350   4.1469   82.581   28.652  100.831   26.516 -18.24935 39.03883 
1 1 1   15   18   40 o  162.415   13.609   20.589   3.3521   22.172   4.8053   19.089   4.6783  167.060   19.137  154.505   20.271 12.55484 27.87780 
1 1 1   15   18   41 o   50.665   22.137  -0.4948   3.2514   4.1424   4.6632  -4.8821   4.5359   78.603   29.146   48.716   23.036 29.88698 37.15030 
1 1 1   15   18   42 o  156.758   14.926   19.300   3.5381   22.143   5.4643   17.249   4.6427  165.641   22.104  146.139   21.389 19.50258 30.75835 
1 1 1   15   18   43 o  131.259   31.562   14.795   6.2632   11.402   11.179   16.348   7.5616  119.679   44.978  136.488   35.764 -16.80890 57.46397 
1 1 1   15   18   44 o  143.837   21.695   16.813   4.6278  -2.2287   13.864   19.201   4.9094   96.902   43.795  153.997   21.407 -57.09454 48.74717 
1 1 1   15   18   45 o  243.297   11.052   45.825   4.1156   43.522   6.4121   47.438   5.3671  234.273   18.020  246.205   14.304 -11.93201 23.00666 
1 1 1   15   18   46 o   46.944   21.656  -2.5114   3.6229   1.6840   6.0358  -4.8742   4.5296   74.491   31.285   48.322   22.899 26.16909 38.77010 
1 1 1   15   18   47 o   55.360   23.998  -0.1107   3.7580  -6.6809   6.1522   3.7999   4.7464   55.467   26.401   76.286   29.159 -20.81950 39.33532 
1 1 1   15   18   48 o   74.152   27.517   3.8815   4.1581  -0.5539   6.8975   6.4137   5.2117   71.773   31.767   88.997   31.085 -17.22425 44.44556 
1 1 1   15   18   49 o  100.795   26.032   8.7696   4.0443   8.7884   6.1063   8.7549   5.3981  100.337   33.688   99.888   31.554 0.4490585 46.15815 
1 1 1   15   18   50 o  105.303   29.074   9.8351   4.8402  -0.6219   9.3703   13.641   5.6528   80.744   36.293  123.538   30.158 -42.79449 47.18773 
1 1 1   15   18   51 o   98.297   28.452   8.5747   4.5259   12.394   6.3677   4.6756   6.4340  115.369   33.851   83.557   33.355 31.81203 47.52311 
1 1 1   15   18   52 o   75.256   28.287   4.2554   4.4217   4.5324   5.7956   3.8696   6.8399   80.415   31.796   81.317   33.659 -0.9021606 46.30270 
1 1 1   15   18   53 o   78.760   27.557   5.2528   4.0966   3.5193   5.7345   7.0596   5.8544   75.780   31.034   89.448   32.745 -13.66830 45.11448 
1 1 1   15   18   54 o   56.296   24.767  -0.0025   4.1320  -1.6080   5.8966   1.5465   5.7919   61.494   28.092   69.093   29.871 -7.598656 41.00587 
1 1 1   15   18   55 o   96.799   29.039   8.8782   4.6448   9.9703   5.6258   6.5397   8.2325  100.676   32.256   88.899   36.873 11.77701 48.99056 
1 1 1   15   19    0 o  700.035   12.880  375.711   13.790  375.711   13.790  375.711   13.790  700.035   12.880  700.035   12.880 0.000000 0.000000 
1 1 1   15   19    1 o  382.614   9.2792  112.127   5.4343  110.021   7.5069  114.445   7.8768  378.862   12.945  386.385   13.319 -7.523499 18.57327 
1 1 1   15   19    2 o  312.631   9.8855   74.869   4.7304   74.568   6.4150   75.227   7.0032  311.882   13.438  313.209   14.608 -1.326843 19.84891 
1 1 1   15   19    3 o  992.395   8.7590  754.263   13.305  747.392   16.123  768.927   23.555  987.693   10.665  1001.24   15.370 -13.55225 18.70747 
1 1 1   15   19    4 o  984.366   8.7215  742.108   13.141  735.940   15.887  755.468   23.382  980.099   10.590  992.430   15.392 -12.33093 18.68365 
1 1 1   15   19    5 o  987.076   10.695  746.481   16.159  746.527   22.527  746.433   23.192  986.593   14.918  986.467   15.360 0.1257324 21.41156 
1 1 1   15   19    6 f  356.023   9.8064   97.097   5.3439   90.756   6.8057  107.292   8.6299  344.083   12.922  374.008   15.075 -29.92563 19.85535 
1 1 1   15   19    7 o  426.739   6.7717  139.432   4.4231  138.279   5.0073  143.527   9.4363  424.943   7.6984  432.620   14.250 -7.677368 16.19687 
1 1 1   15   19    8 o  795.578   7.0738  484.649   8.6140  488.062   9.9053  474.062   17.448  798.310   8.1064  786.198   14.499 12.11255 16.61115 
1 1 1   15   19    9 o  263.446   10.744   53.180   4.3323   48.475   5.0241   66.822   8.5551  251.106   13.117  294.314   19.094 -43.20706 23.16549 
1 1 1   15   19   10 o  737.183   8.2699  416.210   9.3313  408.872   11.212  432.745   16.831  730.528   10.027  751.090   14.640 -20.56128 17.74508 
1 1 1   15   19   11 o  851.217   8.6625  554.992   11.286  548.881   13.608  568.460   20.201  846.349   10.505  860.708   15.334 -14.35864 18.58714 
1 1 1   15   19   12 o  917.526   9.0031  644.896   12.644  644.507   15.321  645.729   22.388  917.044   10.915  917.186   15.947 -0.1423950 19.32515 
1 1 1   15   19   13 f  498.039   10.128  190.070   7.7206  190.070   7.7206   0.0000   0.0000  498.039   10.128  ?   ?  0.000000 10.12782 
1 1 1   15   19   14 o  788.020   10.417  475.910   12.565  475.910   12.565   0.0000   0.0000  788.020   10.417  ?   ?  0.000000 10.41711 
1 1 1   15   19   15 o  682.139   8.6711  356.479   9.0535  355.130   10.733  359.805   16.855  680.703   10.302  684.453   16.089 -3.749695 19.10410 
1 1 1   15   19   16 o  395.183   9.5776  119.679   5.7933  119.442   6.7083  120.374   11.490  394.701   11.104  395.557   18.978 -0.8566284 21.98766 
1 1 1   15   19   17 o  155.645   20.116   18.961   4.6802   15.492   5.2751   31.792   10.145  139.421   25.665  199.275   34.511 -59.85339 43.00771 
1 1 1   15   19   18 o  132.668   23.263   13.980   4.5517   12.664   5.1917   18.353   9.4635  125.435   27.774  150.255   40.312 -24.82072 48.95356 
1 1 1   15   19   19 o  373.660   8.8105  107.002   5.0391  107.503   6.9669  106.453   7.2971  374.301   12.160  372.416   12.801 1.884399 17.65646 
1 1 1   15   19   20 o  331.777   9.2530   84.379   4.6989   90.998   6.8437   78.476   6.4633  344.272   12.987  319.692   13.208 24.58002 18.52376 
1 1 1   15   19   21 o  471.506   8.0378  170.366   5.8009  176.070   8.1834  164.605   8.2241  479.043   11.161  463.136   11.601 15.90659 16.09820 
1 1 1   15   19   22 o  261.589   12.756   52.555   5.1074   49.938   8.6121   53.975   6.3433  253.094   22.464  264.393   15.746 -11.29938 27.43332 
1 1 1   15   19   23 o   59.066   21.466   2.2148   2.5094   2.0675   2.8118   2.7914   5.5621   60.036   22.559   78.885   31.163 -18.84882 38.47101 
1 1 1   15   19   24 o  215.902   9.3537   35.752   3.0911   34.819   3.6065   38.338   6.0001  212.680   11.117  222.241   17.788 -9.561279 20.97617 
1 1 1   15   19   25 o  212.005   10.057   34.491   3.2636   33.773   3.8480   36.331   6.1603  209.319   12.062  216.059   18.816 -6.740540 22.34958 
1 1 1   15   19   26 o  455.217   7.5379  158.849   5.2521  160.005   6.7148  157.027   8.4296  456.639   9.6071  452.005   12.184 4.633759 15.51602 
1 1 1   15   19   27 o  262.427   8.6700   52.827   3.4826   57.791   4.1733   41.443   6.3201  274.381   9.9370  230.876   18.027 43.50568 20.58480 
1 1 1   15   19   28 o  381.358   7.7525  111.523   4.5253  110.086   5.1246  116.610   9.6427  378.781   8.8390  388.668   16.209 -9.886780 18.46218 
1 1 1   15   19   29 o  135.191   13.813   14.225   2.8181   13.119   3.2044   18.001   5.9198  129.275   16.576  149.354   26.884 -20.07825 31.58360 
1 1 1   15   19   30 o  213.350   8.7622   34.937   2.8614   33.637   3.9799   36.328   4.1168  208.660   12.519  216.884   12.453 -8.223984 17.65836 
1 1 1   15   19   31 o  329.833   7.0075   83.425   3.5378   83.278   4.8915   83.585   5.1228  329.241   9.7064  329.790   10.148 -0.5485840 14.04300 
1 1 1   15   19   32 o  137.938   12.115   14.766   2.5319   15.793   3.5313   13.679   3.6321  141.872   16.574  131.467   18.566 10.40468 24.88790 
1 1 1   15   19   33 o  314.152   7.4444   75.728   3.5796   77.116   5.1036   74.384   5.0222  316.602   10.532  310.942   10.552 5.660278 14.90847 
1 1 1   15   19   34 o  185.869   10.372   26.666   2.9389   26.906   4.2992   26.455   4.0266  185.800   15.252  184.413   14.379 1.386459 20.96114 
1 1 1   15   19   35 o  154.439   14.001   18.597   3.2737   14.899   4.7410   21.968   4.5258  135.643   23.698  167.025   17.987 -31.38156 29.75051 
1 1 1   15   19   36 o  176.834   15.476   24.447   4.1467   24.107   8.0459   24.570   4.8389  170.024   32.093  176.589   18.161 -6.564819 36.87562 
1 1 1   15   19   37 o  342.207   9.3374   90.109   4.8909   95.349   9.9709   88.449   5.6124  348.703   18.750  338.725   10.825 9.978333 21.65069 
1 1 1   15   19   38 o  226.558   9.8322   39.531   3.4096   37.241   4.9581   41.585   4.6963  218.525   14.912  231.395   13.316 -12.87006 19.99220 
1 1 1   15   19   39 f  248.443   9.3242   47.524   3.5457   41.019   5.0849   53.680   4.9468  229.384   14.558  263.467   12.267 -34.08340 19.03715 
1 1 1   15   19   40 o  201.317   11.653   31.427   3.5753   26.861   5.0195   36.129   5.0939  184.349   18.019  214.832   15.598 -30.48357 23.83231 
1 1 1   15   19   41 o  320.811   8.9308   79.254   4.3854   68.608   6.3828   88.773   6.0355  297.146   14.034  338.803   11.638 -41.65735 18.23179 
1 1 1   15   19   42 o  200.624   22.555   32.442   6.8060   31.397   14.012   32.764   7.7862  181.727   49.178  200.000   26.053 -18.27238 55.65289 
1 1 1   15   19   43 o  196.959   16.075   30.546   4.8038   35.117   6.1298   23.271   7.7337  210.024   19.283  165.066   31.763 44.95746 37.15798 
1 1 1   15   19   44 o  122.117   19.585   12.079   3.5370   7.3131   5.4932   15.454   4.6227   94.854   31.952  137.268   22.802 -42.41433 39.25361 
1 1 1   15   19   45 o   97.512   24.633   7.9957   3.6777   4.6066   6.1601   9.8727   4.5844   85.034   33.029  107.600   27.678 -22.56594 43.09227 
1 1 1   15   19   46 o   53.415   23.294  -0.3206   3.5845  -2.4129   5.8656   0.9265   4.5285   62.326   28.296   64.003   27.000 -1.677029 39.11126 
1 1 1   15   19   47 o   58.523   24.640   0.7656   3.7592   6.8191   6.1733  -2.8021   4.7392   92.841   33.679   54.178   24.911 38.66315 41.89093 
1 1 1   15   19   48 o   99.731   25.778   8.5481   3.9637   5.2825   5.9523   11.150   5.3131   85.664   32.675  112.331   30.234 -26.66780 44.51682 
1 1 1   15   19   49 o   90.391   27.410   7.0465   4.1221   9.1184   6.2863   5.4835   5.4598  101.487   34.181   84.645   31.508 16.84192 46.48732 
1 1 1   15   19   50 o  180.073   20.749   26.683   5.6144   20.430   9.6707   29.862   6.8954  142.770   41.667  188.120   24.531 -45.35020 48.35186 
1 1 1   15   19   51 f   68.471   26.950   2.9155   4.1460   7.3107   5.9706  -1.1776   5.7617   92.077   33.164   63.160   28.418 28.91706 43.67371 
1 1 1   15   19   52 o   74.585   28.392   4.1516   4.4885  -3.9409   5.7764   16.484   7.1309   56.645   26.536  130.067   35.034 -73.42274 43.94942 
1 1 1   15   19   53 o  165.923   17.534   22.607   4.3855   27.491   6.1873   17.677   6.2168  178.884   23.140  137.589   30.336 41.29495 38.15398 
1 1 1   15   19   54 o   91.388   26.913   7.6788   4.0184   9.3516   5.5420   5.8244   5.8351   98.215   32.063   83.142   32.187 15.07335 45.43143 
1 1 1   15   20    0 o  388.225   13.290  115.857   7.8761  115.857   7.8761  115.857   7.8761  388.225   13.290  388.225   13.290 0.000000 0.000000 
1 1 1   15   20    1 o  813.453   9.7444  506.909   12.133  507.096   17.117  506.720   17.200  813.208   13.752  812.898   13.823 0.3101196 19.49867 
1 1 1   15   20    2 o  638.683   9.0635  312.451   8.8604  316.041   12.474  308.794   12.588  642.080   12.692  634.653   12.958 7.426697 18.13865 
1 1 1   15   20    3 f  1335.67   13.108  1367.79   26.797  1407.03   38.995  1332.68   36.887  1353.40   18.824  1317.30   18.294 36.10876 26.24941 
1 1 1   15   20    4 o  355.876   9.9357   97.027   5.4121   96.563   7.2864   97.598   8.0833  354.872   13.414  356.695   14.806 -1.823212 19.97873 
1 1 1   15   20    5 f  770.211   7.8973  454.309   9.3101  445.953   11.171  473.309   16.845  762.975   9.5659  785.586   14.009 -22.61090 16.96372 
1 1 1   15   20    6 o  986.558   8.8384  745.516   13.347  739.856   16.107  757.915   23.840  982.609   10.710  993.816   15.672 -11.20697 18.98198 
1 1 1   15   20    7 o  409.541   6.9733  128.431   4.3712  126.611   4.9136  135.339   9.5712  406.596   7.8952  420.001   14.888 -13.40482 16.85221 
1 1 1   15   20    8 o  361.186   7.3271   99.901   4.0507   99.015   4.5431  103.339   8.9464  359.549   8.2551  366.925   15.929 -7.375336 17.94141 
1 1 1   15   20    9 o  471.413   8.3149  170.216   5.9997  170.113   7.2281  170.444   10.758  471.183   10.022  471.298   14.913 -0.1155396 17.96822 
1 1 1   15   20   10 o  792.484   8.5416  481.075   10.361  474.689   12.493  495.144   18.542  787.039   10.371  803.222   15.082 -16.18359 18.30357 
1 1 1   15   20   11 o  570.529   8.2931  249.333   7.2421  252.378   8.7332  242.631   12.959  573.890   9.9420  562.237   15.058 11.65356 18.04434 
1 1 1   15   20   12 o  804.817   10.505  496.454   12.940  496.454   12.940   0.0000   0.0000  804.817   10.505  ?   ?  0.000000 10.50466 
1 1 1   15   20   13 o  624.752   8.6505  299.030   8.2722  301.504   9.8195  292.983   15.352  627.200   10.229  617.580   16.241 9.619629 19.19340 
1 1 1   15   20   14 o  486.550   8.9290  181.389   6.6497  178.930   7.7252  188.420   13.065  483.136   10.447  495.089   17.240 -11.95291 20.15835 
1 1 1   15   20   15 o  317.768   10.891   77.424   5.2974   73.839   6.0045   90.012   11.252  310.224   12.645  341.016   21.669 -30.79251 25.08928 
1 1 1   15   20   16 o  230.483   13.764   40.928   4.8337   39.838   5.4978   44.639   10.146  227.126   15.915  238.305   28.372 -11.17926 32.53106 
1 1 1   15   20   17 o  289.320   11.907   64.222   5.2727   63.829   5.9910   65.571   11.105  288.326   13.575  290.012   25.270 -1.685730 28.68584 
1 1 1   15   20   18 o  507.883   9.2082  197.723   7.1583  199.936   8.3911  191.808   13.719  510.571   10.737  499.117   17.958 11.45401 20.92282 
1 1 1   15   20   19 o  383.073   8.5196  112.469   4.9954  118.487   7.0677  106.461   7.0615  392.932   11.751  372.401   12.388 20.53125 17.07543 
1 1 1   15   20   20 o  423.377   8.3374  137.384   5.4029  143.295   7.5934  131.322   7.6893  432.103   11.481  413.589   12.146 18.51495 16.71372 
1 1 1   15   20   21 o  251.424   13.182   48.701   5.0553   39.416   8.4821   53.817   6.2956  223.988   25.177  263.989   15.650 -40.00110 29.64458 
1 1 1   15   20   22 o  509.902   9.2918  199.398   7.2519  220.043   12.656  189.305   8.8488  534.660   15.465  496.534   11.643 38.12659 19.35748 
1 1 1   15   20   23 o  264.727   12.794   53.861   5.1840   50.352   8.5708   55.885   6.5097  253.938   22.276  268.889   15.887 -14.95094 27.36089 
1 1 1   15   20   24 o  141.361   12.314   15.472   2.6378   15.597   2.9891   15.034   5.6082  141.701   13.963  136.348   27.815 5.353165 31.12269 
1 1 1   15   20   25 o  256.785   8.5185   50.571   3.3481   54.482   3.9293   40.203   6.3973  266.451   9.6344  227.321   18.548 39.12917 20.90057 
1 1 1   15   20   26 o  312.622   7.6986   74.934   3.6838   75.601   4.3196   73.156   7.0544  313.904   8.9903  308.101   14.959 5.802795 17.45247 
1 1 1   15   20   27 o  465.366   7.3990  166.044   5.2703  168.082   5.9809  158.962   11.148  468.097   8.3476  453.800   16.050 14.29657 18.09088 
1 1 1   15   20   28 o  129.338   14.708   13.064   2.8600   16.710   3.3159   2.4735   5.6516  146.426   15.007   77.697   31.175 68.72909 34.59874 
1 1 1   15   20   29 f  237.145   9.2226   43.180   3.3476   42.573   3.8485   45.067   6.7861  235.342   10.684  240.391   18.588 -5.048584 21.43918 
1 1 1   15   20   30 o  262.053   8.8845   52.725   3.5636   54.964   4.1594   46.547   6.9101  267.425   10.162  244.207   18.627 23.21771 21.21854 
1 1 1   15   20   31 o  252.225   8.0385   48.826   3.1034   43.664   4.2245   54.877   4.5740  238.155   11.589  267.043   11.190 -28.88794 16.10992 
1 1 1   15   20   32 o  273.021   7.8254   57.212   3.2702   59.815   4.6026   54.559   4.6472  278.799   10.785  266.181   11.406 12.61804 15.69803 
1 1 1   15   20   33 o  337.005   7.7284   87.183   3.9865   82.531   5.1072   94.439   6.3777  327.523   10.188  350.020   11.904 -22.49646 15.66846 
1 1 1   15   20   34 f  178.005   11.713   24.536   3.1734   26.385   4.4963   22.700   4.4794  183.683   16.157  169.955   17.468 13.72803 23.79450 
1 1 1   15   20   35 o   80.283   21.182   5.2436   2.6406   0.2628   3.6835   10.509   3.7875   57.050   24.225  113.643   22.570 -56.59333 33.10923 
1 1 1   15   20   36 o   43.203   20.010  -2.5236   3.1388  -1.5118   7.9531  -2.7103   3.4162   77.053   34.107   45.119   20.889 31.93425 39.99565 
1 1 1   15   20   37 o   47.308   20.514  -0.2978   2.7481   3.0240   3.8303  -3.8217   3.9451   69.968   26.322   46.649   21.878 23.31843 34.22710 
1 1 1   15   20   38 o  457.207   7.1314  160.540   4.9906  169.473   7.3561  152.921   6.7932  468.886   10.250  445.488   9.9625 23.39758 14.29355 
1 1 1   15   20   39 o  203.042   10.992   31.917   3.4033   35.679   4.9358   28.508   4.6989  213.628   15.194  190.530   16.268 23.09784 22.26007 
1 1 1   15   20   40 f  115.493   25.969   11.118   4.4794   0.0000   0.0000   11.118   4.4794  ?   ?   115.493   25.969 0.000000 25.96949 
1 1 1   15   20   41 o  230.908   19.658   42.357   6.8817   55.707   13.249   37.424   8.0534  255.940   34.715  214.542   24.993 41.39819 42.77567 
1 1 1   15   20   42 o  302.027   11.094   70.551   5.1289   71.228   6.1844   69.062   9.1789  302.763   13.345  294.492   20.491 8.271118 24.45351 
1 1 1   15   20   43 o  171.495   13.719   23.031   3.5709   25.187   5.5020   21.462   4.6939  176.940   20.707  163.781   19.082 13.15909 28.15822 
1 1 1   15   20   44 o  112.156   21.055   10.324   3.4818   12.108   5.3886   9.0461   4.5619  118.635   29.734  103.085   28.129 15.55019 40.93079 
1 1 1   15   20   45 o  127.459   20.021   13.220   3.7772   13.092   5.7921   13.315   4.9823  122.595   30.882  125.268   26.796 -2.672630 40.88656 
1 1 1   15   20   46 o   88.710   26.584   6.6312   3.8942   4.2790   6.5371   7.9250   4.8484   84.502   33.656   96.339   29.823 -11.83674 44.96822 
1 1 1   15   20   47 o   91.278   25.372   7.1016   3.6727   4.0391   5.7350   9.2308   4.7819   80.412   31.682  102.912   29.074 -22.49988 43.00078 
1 1 1   15   20   48 o  213.299   13.101   35.750   4.2567   37.602   6.3109   34.205   5.7657  215.548   19.334  205.996   18.483 9.552780 26.74722 
1 1 1   15   20   49 o  103.731   30.839   9.6402   5.2561   0.6178   9.8469   13.235   6.2157   84.665   37.690  120.177   32.851 -35.51181 49.99691 
1 1 1   15   20   50 o  172.855   16.090   23.983   4.2081   25.633   6.0618   22.448   5.8464  174.537   23.270  162.587   24.233 11.95061 33.59688 
1 1 1   15   20   51 o  168.038   18.456   23.147   4.6687   13.023   6.0936   37.539   7.2649  117.399   32.699  210.920   22.870 -93.52106 39.90268 
1 1 1   15   20   52 o  181.467   16.991   26.843   4.6644   18.785   5.9657   39.518   7.4816  144.193   28.040  215.244   23.068 -71.05072 36.30935 
1 1 1   15   20   53 o   55.977   24.651  -0.0317   4.1027  -0.7738   5.7590   0.7330   5.8461   62.711   28.295   66.956   29.458 -4.244862 40.84574 
1 1 1   15   21    0 o  124.512   33.663   14.240   5.5449   14.240   5.5449   14.240   5.5449  124.512   33.663  124.512   33.663 0.000000 0.000000 
1 1 1   15   21    1 o  369.453   9.5336  104.574   5.3912   93.391   7.4069  117.174   7.8621  348.932   13.868  390.889   13.141 -41.95773 19.10511 
1 1 1   15   21    2 o  635.846   9.1600  309.725   8.9149  313.500   12.625  305.971   12.590  639.396   12.900  631.660   13.022 7.736633 18.32987 
1 1 1   15   21    3 o  324.206   10.153   80.541   5.0385   87.622   6.9819   72.846   7.2785  337.997   13.496  307.688   15.505 30.30844 20.55532 
1 1 1   15   21    4 o  448.757   7.7098  154.233   5.2957  154.991   6.3852  152.562   9.4786  449.786   9.2747  445.959   13.886 3.827667 16.69859 
1 1 1   15   21    5 o  395.423   7.8680  119.756   4.7621  121.355   5.6963  116.045   8.6782  397.991   9.3508  388.886   14.579 9.104980 17.32037 
1 1 1   15   21    6 o  458.942   7.7015  161.317   5.4100  160.760   6.3908  162.726   10.163  458.079   9.1148  460.510   14.418 -2.430878 17.05743 
1 1 1   15   21    7 o  473.010   6.8575  171.335   4.9648  167.796   5.6251  183.808   10.561  468.056   7.8518  489.445   14.098 -21.38916 16.13673 
1 1 1   15   21    8 o  456.499   6.9590  159.588   4.8624  156.903   5.4549  169.973   10.728  452.601   7.8741  470.575   14.895 -17.97360 16.84788 
1 1 1   15   21    9 o  368.453   9.0706  104.015   5.1155  104.897   6.1907  102.116   9.0830  369.917   10.934  364.615   16.275 5.301910 19.60669 
1 1 1   15   21   10 o  395.998   10.813  120.214   6.5541  120.214   6.5541   0.0000   0.0000  395.998   10.813  ?   ?  0.000000 10.81315 
1 1 1   15   21   11 o  315.569   12.081   76.379   5.8355   76.379   5.8355   0.0000   0.0000  315.569   12.081  ?   ?  0.000000 12.08121 
1 1 1   15   21   12 o  618.821   8.5396  293.402   8.0886  291.327   9.6379  298.347   14.875  616.478   10.214  623.189   15.595 -6.710876 18.64194 
1 1 1   15   21   13 o  309.115   10.599   73.261   5.0147   67.742   5.7359   91.161   10.330  297.130   12.612  343.486   19.730 -46.35577 23.41679 
1 1 1   15   21   14 o  281.306   11.698   60.704   5.0371   58.389   5.8062   67.745   10.127  275.768   13.756  295.396   22.569 -19.62714 26.43081 
1 1 1   15   21   15 o  172.817   16.671   23.181   4.3551   19.902   4.9393   34.635   9.2320  159.338   20.744  209.104   29.677 -49.76570 36.20871 
1 1 1   15   21   16 o  270.287   12.250   56.069   5.0678   50.998   5.7616   73.401   10.652  257.200   14.696  307.358   22.804 -50.15833 27.12945 
1 1 1   15   21   17 o  517.661   9.0532  205.421   7.1733  211.086   8.6001  192.467   13.004  524.579   10.711  500.038   16.990 24.54037 20.08477 
1 1 1   15   21   18 o  699.198   16.018  376.181   17.143   0.0000   0.0000  376.181   17.143  ?   ?   699.198   16.018 0.000000 16.01840 
1 1 1   15   21   19 o  333.933   13.582   85.695   6.9424   82.013   8.9422   91.283   11.015  325.683   18.008  343.024   21.080 -17.34091 27.72504 
1 1 1   15   21   20 o  600.467   11.250  276.775   10.340   0.0000   0.0000  276.775   10.340  ?   ?   600.467   11.250 0.000000 11.24973 
1 1 1   15   21   21 o  423.335   8.4820  137.404   5.4961  144.969   7.7991  129.941   7.7464  434.472   11.728  411.264   12.306 23.20825 16.99917 
1 1 1   15   21   22 o   69.700   26.095   2.8674   3.7557  -0.5578   5.3429   6.2129   5.2803   66.204   28.656   92.120   31.325 -25.91574 42.45532 
1 1 1   15   21   23 o   99.414   26.213   7.9879   4.0457   10.729   5.7006   5.2057   5.7427  114.940   31.477   89.103   32.459 25.83720 45.21527 
1 1 1   15   21   24 o  289.320   10.659   64.281   4.7201   64.683   6.6515   63.873   6.6993  289.345   15.071  287.486   15.279 1.859161 21.46140 
1 1 1   15   21   25 o  279.273   11.042   59.923   4.7202   61.106   6.6611   58.730   6.6898  281.059   15.544  275.449   15.935 5.609802 22.26107 
1 1 1   15   21   26 o  174.514   11.169   23.502   2.9677   22.778   3.2600   27.002   7.1700  171.614   12.497  183.980   26.201 -12.36577 29.02896 
1 1 1   15   21   27 o  419.518   7.0303  134.935   4.5143  133.437   5.3745  138.523   8.3191  417.020   8.4199  424.175   12.813 -7.154816 15.33225 
1 1 1   15   21   28 o  412.237   7.2499  130.323   4.5745  128.567   5.4258  134.641   8.5071  409.272   8.6612  418.005   13.296 -8.732910 15.86850 
1 1 1   15   21   29 o  140.775   13.570   15.421   2.8877   14.119   3.2506   20.294   6.2899  134.166   16.153  158.474   26.892 -24.30788 31.37047 
1 1 1   15   21   30 o  243.829   9.4490   45.682   3.5265   49.328   4.1207   35.702   6.8171  253.240   10.631  212.869   21.205 40.37160 23.72037 
1 1 1   15   21   31 o  238.337   9.9179   43.678   3.6181   45.038   4.1975   39.744   7.1369  241.846   11.339  224.612   21.003 17.23450 23.86834 
1 1 1   15   21   32 o  189.637   10.128   27.745   2.9291   28.120   3.8520   27.230   4.5101  190.370   13.303  186.762   15.929 3.607697 20.75386 
1 1 1   15   21   33 o  288.323   7.8288   63.836   3.4550   67.711   4.9669   60.202   4.8090  296.471   10.945  279.498   11.241 16.97226 15.68962 
1 1 1   15   21   34 o  349.508   7.6917   93.811   4.1148   89.232   6.0551   97.740   5.6089  340.117   11.631  356.267   10.286 -16.15063 15.52668 
1 1 1   15   21   35 o  304.158   9.4724   71.190   4.4099   59.863   8.6313   75.192   5.1300  275.396   20.626  312.347   10.730 -36.95117 23.25022 
1 1 1   15   21   36 o  105.531   17.197   8.8962   2.6821   6.8531   3.8820   10.762   3.7100   91.443   26.317  115.071   21.863 -23.62795 34.21344 
1 1 1   15   21   37 o  190.812   10.474   28.156   3.0474   32.172   4.4405   24.580   4.1896  203.117   14.376  177.094   15.616 26.02313 21.22573 
1 1 1   15   21   38 o  121.080   20.970   11.873   3.7455   8.6588   8.9547   12.554   4.1235  108.404   40.351  124.104   22.538 -15.70027 46.21873 
1 1 1   15   21   39 o  180.060   15.814   25.465   4.3142   26.210   9.7872   25.286   4.8063  173.112   37.981  178.814   17.797 -5.702301 41.94358 
1 1 1   15   21   40 o  191.861   14.881   28.834   4.3360   29.951   5.2118   26.324   7.8146  194.659   17.685  177.313   29.854 17.34624 34.69937 
1 1 1   15   21   41 o   43.649   20.690  -4.1754   3.7026  -4.3562   4.2694  -3.6269   7.4369   47.707   22.494   68.981   31.527 -21.27357 38.72886 
1 1 1   15   21   42 o   58.953   23.450   1.6297   3.1698   7.5689   4.8570  -2.7766   4.1835   95.403   29.902   50.730   23.355 44.67268 37.94142 
1 1 1   15   21   43 o  241.805   10.758   45.238   3.9817   47.260   5.9327   43.581   5.3709  245.107   15.899  235.701   14.965 9.406036 21.83442 
1 1 1   15   21   44 o   71.590   24.811   3.8749   3.3170   1.1038   4.8652   6.2817   4.5341   66.628   28.041   87.801   29.017 -21.17284 40.35190 
1 1 1   15   21   45 o  150.934   16.909   18.184   3.8393   16.884   6.1697   19.006   4.9047  139.720   29.761  152.438   21.627 -12.71779 36.78912 
1 1 1   15   21   46 o   61.809   25.268   1.5449   3.7934  -2.7341   6.1751   4.1384   4.8074   62.981   28.763   77.627   29.423 -14.64645 41.14611 
1 1 1   15   21   47 o  193.886   13.816   29.632   4.0735   32.124   5.8925   27.350   5.6375  199.080   19.591  183.100   20.465 15.97974 28.33104 
1 1 1   15   21   48 o   69.824   28.807   2.1560   4.9868  -7.9366   9.6530   5.8300   5.8241   69.955   33.232   86.811   32.497 -16.85626 46.47995 
1 1 1   15   21   49 o  245.404   13.289   47.470   4.9730   32.745   6.6970   65.569   7.4249  198.321   22.458  285.936   17.042 -87.61470 28.19213 
1 1 1   15   21   50 o  104.705   25.862   9.6848   4.1204   6.3380   5.9943   12.683   5.6731   87.764   32.946  117.094   31.120 -29.32925 45.32018 
1 1 1   15   21   51 o  101.137   27.199   9.2618   4.3021   10.243   5.4352   7.6150   7.0398  104.303   31.440   93.055   35.525 11.24796 47.43937 
1 1 1   15   21   52 o   84.780   26.600   6.4519   3.8424   5.9748   5.3815   6.9482   5.4880   83.589   31.248   87.877   31.774 -4.287689 44.56490 
1 1 1   15   21   53 f  108.349   27.939   10.945   4.6633   12.280   5.6021   7.9315   8.4150  112.402   31.369   93.422   37.844 18.98023 49.15434 
1 1 1   15   22    0 o   80.504   39.041   7.3636   5.6247   7.3636   5.6247   7.3636   5.6247   80.504   39.041   80.504   39.041 0.000000 0.000000 
1 1 1   15   22    1 o  310.645   10.560   73.966   5.0211   76.780   7.1551   71.236   7.0480  316.266   14.781  304.614   15.116 11.65186 21.14172 
1 1 1   15   22    2 o  924.176   10.514  654.654   14.872  668.787   21.378  641.400   20.704  933.368   14.964  914.088   14.797 19.27979 21.04491 
1 1 1   15   22    3 o  371.425   9.8160  105.723   5.5805  103.433   7.5865  108.422   8.2378  367.162   13.499  375.852   14.319 -8.689331 19.67943 
1 1 1   15   22    4 o  775.395   8.0342  460.556   9.5353  458.564   11.584  464.744   16.793  773.545   9.7835  778.173   14.099 -4.627808 17.16097 
1 1 1   15   22    5 o  348.700   8.3871   93.150   4.4764   96.339   5.3713   85.900   8.0995  354.547   9.8978  334.420   15.823 20.12704 18.66397 
1 1 1   15   22    6 o  397.715   8.0295  121.170   4.8880  118.655   5.7397  127.809   9.3254  393.489   9.5298  407.989   14.933 -14.50012 17.71474 
1 1 1   15   22    7 o  556.590   6.8609  237.258   5.8451  232.249   6.6323  254.678   12.369  550.622   7.8694  576.010   14.029 -25.38776 16.08558 
1 1 1   15   22    8 o  227.215   11.021   39.585   3.8330   39.585   3.8330   0.0000   0.0000  227.215   11.021  ?   ?  0.000000 11.02122 
1 1 1   15   22    9 o  193.880   16.830   29.113   4.9449   29.113   4.9449   0.0000   0.0000  193.880   16.830  ?   ?  0.000000 16.83007 
1 1 1   15   22   10 o   68.960   26.322   2.5461   3.8643   1.1964   4.5223   6.1985   7.4392   67.168   27.540   99.764   36.849 -32.59569 46.00291 
1 1 1   15   22   11 o  726.674   8.5363  404.635   9.4947  412.094   11.631  389.734   16.439  733.124   10.365  712.223   15.080 20.90070 18.29818 
1 1 1   15   22   12 o  432.527   9.1314  143.389   6.0453  140.507   7.0792  151.150   11.618  428.031   10.805  443.248   17.125 -15.21658 20.24857 
1 1 1   15   22   13 o  196.856   14.663   29.940   4.3865   29.310   5.0616   31.839   8.7912  194.416   17.186  200.296   29.564 -5.880356 34.19633 
1 1 1   15   22   14 o  450.436   11.213  155.658   7.7306  149.268   9.9951  165.173   12.196  440.690   14.818  463.230   17.201 -22.54105 22.70333 
1 1 1   15   22   15 o  248.936   16.179   47.878   6.1310   52.987   7.9097   40.187   9.7041  261.325   19.925  225.522   28.768 35.80328 34.99384 
1 1 1   15   22   16 o  807.481   11.035  500.311   13.639  504.367   18.619  495.614   20.037  809.845   15.020  802.440   16.314 7.405762 22.17522 
1 1 1   15   22   17 o  344.895   13.136   91.392   6.9346   86.135   9.0380   98.916   10.813  333.830   17.752  357.384   19.845 -23.55353 26.62588 
1 1 1   15   22   18 o  427.157   12.477  140.161   8.1575  149.927   11.523  130.350   11.550  441.076   17.069  411.050   18.357 30.02530 25.06629 
1 1 1   15   22   19 f  229.748   18.773   41.019   6.5439   35.190   8.6240   48.931   10.047  210.789   27.376  249.264   26.752 -38.47589 38.27655 
1 1 1   15   22   20 o  332.505   11.262   84.899   5.7319   84.228   6.6133   86.925   11.492  330.997   13.053  334.017   22.610 -3.020477 26.10786 
1 1 1   15   22   21 o  138.518   18.979   15.100   3.9181   15.661   5.4096   14.480   5.6825  139.536   26.293  133.589   28.650 5.947021 38.88629 
1 1 1   15   22   22 o  707.858   8.0226  384.199   8.6923  387.954   12.070  380.154   12.528  710.694   11.095  703.385   11.637 7.308716 16.07874 
1 1 1   15   22   23 o  290.817   10.605   64.953   4.7205   71.640   6.6507   58.165   6.7010  304.990   14.247  274.126   16.040 30.86325 21.45379 
1 1 1   15   22   24 o  390.874   9.0942  117.247   5.4409  126.227   7.7108  108.342   7.6785  405.085   12.436  375.143   13.373 29.94180 18.26146 
1 1 1   15   22   25 o  153.526   19.074   18.538   4.3856   18.305   5.6603   18.889   6.9371  151.032   25.386  152.034   30.865 -1.002304 39.96325 
1 1 1   15   22   26 o   87.143   27.087   5.9600   3.9951   12.491   5.7211  -0.2557   5.5812  123.265   30.492   68.276   29.421 54.98850 42.37120 
1 1 1   15   22   27 o  145.806   12.446   16.487   2.7510   14.003   3.0489   27.366   6.3801  133.824   15.152  185.855   22.913 -52.03127 27.46942 
1 1 1   15   22   28 o  428.511   7.1738  140.836   4.7052  138.485   5.5749  146.657   8.7729  424.721   8.5756  436.157   13.141 -11.43600 15.69162 
1 1 1   15   22   29 o  115.515   16.190   10.527   2.7839   12.750   3.1203   1.8543   6.1631  127.289   16.397   77.788   32.051 49.50072 36.00179 
1 1 1   15   22   30 o  296.122   9.6533   67.412   4.3754   69.792   4.6326   47.745   13.316  301.248   10.047  239.436   37.570 61.81244 38.89017 
1 1 1   15   22   31 o  483.846   7.4090  179.677   5.4870  182.394   6.6720  173.999   9.6449  487.173   8.9475  474.647   13.276 12.52557 16.00940 
1 1 1   15   22   32 o  234.892   10.092   42.464   3.6283   47.445   4.2775   29.688   6.8508  248.115   11.263  192.656   23.734 55.45897 26.27106 
1 1 1   15   22   33 o   64.678   24.594   2.4263   3.3655   9.0812   11.074   1.7491   3.5326  115.798   44.473   62.338   24.769 53.46005 50.90488 
1 1 1   15   22   34 o  290.073   9.8138   64.775   4.3573   69.277   8.7302   63.281   5.0283  296.910   19.315  286.402   11.470 10.50797 22.46433 
1 1 1   15   22   35 o  206.354   9.6019   32.782   3.0328   35.873   4.2686   29.632   4.3096  214.948   13.036  194.925   14.549 20.02299 19.53512 
1 1 1   15   22   36 o   64.345   21.705   3.0829   2.5348   3.9382   3.6055   2.2471   3.5643   73.721   25.849   64.711   25.127 9.009514 36.04903 
1 1 1   15   22   37 o  201.582   13.205   31.615   4.0519   20.412   9.0217   34.446   4.5350  152.596   38.599  210.193   14.179 -57.59752 41.12033 
1 1 1   15   22   38 o  107.211   23.946   9.5074   3.8303   5.4070   11.566   10.012   4.0594  105.853   43.789  109.867   24.735 -4.013817 50.29204 
1 1 1   15   22   39 o  259.404   11.074   52.001   4.3968   50.399   5.2130   55.950   8.1839  254.460   13.432  265.366   20.303 -10.90593 24.34364 
1 1 1   15   22   40 o   51.636   23.011  -1.1573   3.6809  -0.9547   4.2104  -1.8142   7.5821   56.168   24.842   73.573   32.888 -17.40440 41.21584 
1 1 1   15   22   41 o  117.388   18.368   11.095   3.1921   7.8850   4.5909   14.100   4.4414   96.944   28.822  131.037   22.982 -34.09263 36.86278 
1 1 1   15   22   42 o   70.914   24.348   3.8027   3.1908   3.1888   4.6729   4.3390   4.3675   73.863   28.745   77.853   28.315 -3.989792 40.34892 
1 1 1   15   22   43 o  177.286   13.643   24.640   3.6738   18.469   5.4246   29.869   4.9932  149.260   24.601  194.084   16.979 -44.82423 29.89174 
1 1 1   15   22   44 o  113.975   20.677   10.679   3.4744   14.147   5.3251   8.1085   4.5847  128.564   27.865   97.419   28.763 31.14513 40.04695 
1 1 1   15   22   45 o  107.456   23.302   9.7156   3.7223   9.8202   5.9894   9.6498   4.7512  105.732   33.216  105.420   28.682 0.3116837 43.88545 
1 1 1   15   22   46 o   54.057   23.522  -0.1497   3.6382  -2.6237   5.1271   2.3596   5.1635   56.856   26.056   71.746   29.423 -14.88960 39.30195 
1 1 1   15   22   47 f   54.938   24.099  -0.3487   3.8869  -2.2918   5.5076   1.5791   5.4861   59.725   27.232   70.293   29.690 -10.56776 40.28722 
1 1 1   15   22   48 o  220.197   15.275   38.572   5.1166   33.893   10.296   40.106   5.8962  190.395   36.661  223.320   17.386 -32.92525 40.57462 
1 1 1   15   22   49 o  177.595   15.473   25.274   4.1641   23.426   5.8652   27.152   5.9130  166.071   23.750  180.250   21.880 -14.17937 32.29290 
1 1 1   15   22   50 o  319.798   11.593   80.247   5.6746   75.195   7.6937   86.275   8.4033  305.335   16.524  326.770   16.858 -21.43533 23.60602 
1 1 1   15   22   51 o  192.861   14.185   29.787   4.1581   27.947   5.7134   31.858   6.0631  182.222   20.860  194.835   20.646 -12.61314 29.34948 
1 1 1   15   22   52 f  176.974   34.309   30.632   8.9582   30.632   8.9582   0.0000   0.0000  176.974   34.309  ?   ?  0.000000 34.30914 
1 1 1   15   23    0 o  357.530   14.175   98.445   7.7297   98.445   7.7297   98.445   7.7297  357.530   14.175  357.530   14.175 0.000000 0.000000 
1 1 1   15   23    1 o   66.238   26.174   1.8778   3.9250   2.4320   5.5426   1.3204   5.5591   77.713   30.978   73.859   30.437 3.854195 43.42897 
1 1 1   15   23    2 o  678.175   9.4483  352.492   9.8077  351.429   13.748  353.593   13.996  676.677   13.273  678.729   13.472 -2.051758 18.91242 
1 1 1   15   23    3 o  740.119   9.6873  419.862   10.974  423.522   15.400  416.086   15.643  742.796   13.545  736.192   13.882 6.604309 19.39537 
1 1 1   15   23    4 o  432.752   9.6483  143.544   6.3909  149.268   8.8531  137.315   9.2351  441.009   13.115  422.874   14.268 18.13528 19.38002 
1 1 1   15   23    5 o  685.682   7.8466  360.191   8.2352  357.855   9.9824  365.170   14.571  683.285   9.5447  689.658   13.804 -6.373291 16.78218 
1 1 1   15   23    6 o  363.755   9.9625  101.437   5.5469  101.437   5.5469   0.0000   0.0000  363.755   9.9625  ?   ?  0.000000 9.962487 
1 1 1   15   23    7 o  622.019   9.4010  296.564   8.9505  296.564   8.9505   0.0000   0.0000  622.019   9.4010  ?   ?  0.000000 9.400968 
1 1 1   15   23    8 o  234.792   10.877   42.279   3.9090   41.364   4.5462   44.874   7.6557  231.785   12.865  240.299   21.026 -8.513702 24.64948 
1 1 1   15   23    9 o  390.441   10.713  116.915   6.4022  117.080   8.5460  116.704   9.6650  390.394   14.302  389.557   16.209 0.8367615 21.61667 
1 1 1   15   23   10 o  483.883   10.313  179.557   7.6381  178.538   10.310  180.797   11.372  482.101   13.971  484.958   15.321 -2.857819 20.73439 
1 1 1   15   23   11 o  634.940   10.184  309.167   9.8970  292.889   13.214  329.970   14.937  617.439   13.982  655.191   14.895 -37.75146 20.42899 
1 1 1   15   23   12 o  252.580   14.829   49.211   5.7079   56.281   7.5636   39.858   8.6994  269.629   18.438  225.296   25.686 44.33273 31.61858 
1 1 1   15   23   13 o  475.193   9.0281  173.114   6.5666  173.675   7.8962  171.856   11.824  475.780   10.843  472.530   16.348 3.250153 19.61692 
1 1 1   15   23   14 o  642.266   8.6942  316.227   8.5470  310.098   10.185  330.817   15.715  635.772   10.466  655.683   15.659 -19.91156 18.83441 
1 1 1   15   23   15 o  109.694   25.192   9.7099   4.1406   8.1875   4.7643   14.409   8.3706  101.270   29.157  133.398   38.717 -32.12749 48.46820 
1 1 1   15   23   16 o  422.388   9.6359  136.850   6.2298  133.183   7.4097  145.691   11.507  416.479   11.624  434.734   17.293 -18.25507 20.83610 
1 1 1   15   23   17 f  331.467   14.423   84.531   7.3177   76.686   9.5960   95.434   11.312  314.321   20.050  350.509   21.185 -36.18805 29.16848 
1 1 1   15   23   18 o  306.244   11.833   72.044   5.5466   63.841   6.3609   98.069   11.330  287.657   14.493  355.301   20.927 -67.64349 25.45550 
1 1 1   15   23   19 o  283.881   12.244   61.934   5.3201   58.398   6.0771   73.533   11.007  275.054   14.486  306.720   23.627 -31.66559 27.71385 
1 1 1   15   23   20 o  685.227   9.2385  360.243   9.6896  356.070   11.472  370.628   18.100  680.891   11.008  692.951   17.065 -12.05975 20.30681 
1 1 1   15   23   21 o  359.798   9.3776   99.342   5.1644   94.807   7.0165  104.704   7.6290  351.042   13.059  368.843   13.513 -17.80136 18.79174 
1 1 1   15   23   22 o  414.031   8.9168  131.531   5.6508  138.192   7.8164  124.239   8.1788  423.933   12.046  401.754   13.300 22.17868 17.94436 
1 1 1   15   23   23 o  485.588   8.4660  180.904   6.2924  179.484   8.6009  182.540   9.2298  483.150   11.630  487.095   12.380 -3.945465 16.98595 
1 1 1   15   23   24 o  314.850   11.231   76.215   5.4123   77.157   6.7010   74.446   9.1793  316.417   13.836  309.167   19.497 7.249847 23.90785 
1 1 1   15   23   25 o  726.852   8.2095  405.377   9.1334  410.953   12.761  399.521   13.078  730.952   11.406  720.568   11.858 10.38354 16.45287 
1 1 1   15   23   26 o  484.536   8.7188  180.237   6.4662  186.504   9.0433  173.681   9.2494  492.204   12.004  474.809   12.727 17.39459 17.49468 
1 1 1   15   23   27 o  123.172   28.794   12.486   5.3313   10.620   6.0081   19.397   11.562  113.710   32.744  150.986   45.933 -37.27517 56.40902 
1 1 1   15   23   28 o  329.576   8.8591   83.432   4.4690   79.383   4.7007  121.504   14.414  321.384   9.5558  392.507   24.109 -71.12244 25.93363 
1 1 1   15   23   29 f  238.793   9.2794   43.826   3.3917   44.506   3.9095   41.756   6.8194  240.481   10.621  230.641   19.500 9.839493 22.20459 
1 1 1   15   23   30 o  248.619   9.2742   47.520   3.5292   49.941   4.1156   40.796   6.8603  254.700   10.557  227.699   19.883 27.00134 22.51213 
1 1 1   15   23   31 o  416.064   7.4878  132.901   4.7686  129.263   5.6557  141.846   8.8685  410.042   9.0114  428.318   13.527 -18.27655 16.25408 
1 1 1   15   23   32 o   63.666   28.264  -1.4988   5.5002   1.5633   10.539  -2.6449   6.4479   95.217   40.716   66.534   29.987 28.68337 50.56732 
1 1 1   15   23   33 o   54.619   25.062  -3.0916   4.7636   1.6904   7.3526  -6.5509   6.2536   82.276   34.540   57.358   27.099 24.91802 43.90232 
1 1 1   15   23   34 o  314.739   8.9537   76.205   4.3134   75.980   5.0676   76.795   8.2176  313.961   10.545  313.346   17.200 0.6149902 20.17494 
1 1 1   15   23   35 o  340.607   9.4687   89.326   4.9364   73.232   9.5133   95.256   5.7747  304.382   20.540  351.428   10.736 -47.04626 23.17599 
1 1 1   15   23   36 o   92.792   24.812   7.1177   3.5923   15.181   11.527   6.2504   3.7805  133.123   46.246   87.531   26.184 45.59212 53.14393 
1 1 1   15   23   37 o  276.968   9.0419   59.068   3.8332   57.332   5.4326   60.789   5.4093  271.971   13.050  280.168   12.614 -8.196716 18.14987 
1 1 1   15   23   38 o  139.489   17.911   15.498   3.7358   18.739   4.2327   4.0743   7.9463  153.431   18.390   90.586   36.747 62.84515 41.09156 
1 1 1   15   23   39 o   89.726   21.295   6.6370   2.8807   8.2335   4.1538   5.1577   3.9985   99.082   26.760   81.270   27.261 17.81113 38.20042 
1 1 1   15   23   40 o  144.086   14.326   16.325   3.1177   17.263   4.5567   15.499   4.2749  146.080   20.982  138.338   20.835 7.741882 29.56923 
1 1 1   15   23   41 o   75.390   23.833   4.5605   3.0790   9.3867   4.4983   0.3061   4.2234  105.173   27.597   60.254   25.770 44.91972 37.75848 
1 1 1   15   23   42 o  243.220   10.686   45.788   3.9781   37.364   5.6721   53.943   5.5807  217.155   17.206  262.613   13.933 -45.45808 22.14004 
1 1 1   15   23   43 f   46.317   21.109  -1.8010   3.3044   1.6074   4.9764  -4.4890   4.4193   68.831   28.618   48.238   22.788 20.59283 36.58265 
1 1 1   15   23   44 o  100.547   23.972   8.5533   3.6373   9.3651   5.8087   8.0296   4.6652  103.643   32.731   96.692   29.124 6.951218 43.81258 
1 1 1   15   23   45 o  264.097   15.530   55.190   6.2503   55.190   6.2503   0.0000   0.0000  264.097   15.530  ?   ?  0.000000 15.53048 
1 1 1   15   23   46 o  112.037   21.772   10.517   3.5991   6.2284   5.2230   14.394   4.9664   87.460   31.069  129.481   25.963 -42.02158 40.48876 
1 1 1   15   23   47 o  143.106   22.179   17.109   4.7009   11.739   10.803   18.363   5.2212  113.103   43.792  147.363   23.972 -34.26064 49.92385 
1 1 1   15   23   48 o  133.188   23.439   15.116   4.6037   20.130   5.5900   4.5461   8.1163  153.352   24.650   87.365   36.455 65.98756 44.00682 
1 1 1   15   23   49 o  102.754   26.519   9.4436   4.1990   9.8913   5.5494   8.8441   6.4225  102.877   31.916   97.838   34.485 5.039009 46.98749 
1 1 1   15   23   50 o  343.012   15.510   94.411   8.1433   94.411   8.1433   0.0000   0.0000  343.012   15.510  ?   ?  0.000000 15.51031 
1 1 1   15   23   51 o   72.052   30.569   2.4809   5.8576 -10.8424   9.1527   11.724   7.6233   61.617   30.026  106.701   37.574 -45.08458 48.09763 
1 1 1   15   24    0 o  471.531   13.045  170.820   9.3990  170.820   9.3990  170.820   9.3990  471.531   13.045  471.531   13.045 0.000000 0.000000 
1 1 1   15   24    1 o  180.169   15.645   25.142   4.2717   25.345   5.9279   24.922   6.1610  179.872   21.989  178.121   23.145 1.750687 31.92495 
1 1 1   15   24    2 o  458.174   9.3940  160.923   6.5879  161.503   9.0824  160.279   9.5703  458.659   12.937  456.834   13.687 1.825806 18.83333 
1 1 1   15   24    3 o  290.842   14.862   65.175   6.5942   65.175   6.5942   0.0000   0.0000  290.842   14.862  ?   ?  0.000000 14.86233 
1 1 1   15   24    4 o  674.043   13.322  348.888   13.744  348.888   13.744   0.0000   0.0000  674.043   13.322  ?   ?  0.000000 13.32156 
1 1 1   15   24    5 o  428.690   9.6623  140.901   6.3400  140.901   6.3400   0.0000   0.0000  428.690   9.6623  ?   ?  0.000000 9.662252 
1 1 1   15   24    6 o  344.256   8.5806   90.831   4.5213   89.680   5.3465   93.721   8.4716  341.964   10.214  349.079   15.855 -7.114899 18.86066 
1 1 1   15   24    7 o  191.967   11.194   28.370   3.2747   29.361   3.6690   24.489   7.2614  195.181   12.345  175.431   27.983 19.75008 30.58462 
1 1 1   15   24    8 o  506.940   7.0387  196.878   5.4616  190.658   6.1460  220.231   11.909  498.789   8.0502  535.273   14.536 -36.48361 16.61605 
1 1 1   15   24    9 o  253.154   11.454   49.183   4.4381   47.252   5.3345   53.524   7.9989  247.558   14.137  262.593   20.053 -15.03558 24.53482 
1 1 1   15   24   10 o  394.848   9.2679  119.540   5.6012  129.159   6.9714  102.022   9.4082  410.260   11.102  363.981   16.887 46.27859 20.20946 
1 1 1   15   24   11 o  546.406   8.6257  228.875   7.2141  221.630   8.6553  245.360   13.056  537.469   10.521  564.767   15.104 -27.29736 18.40685 
1 1 1   15   24   12 o  257.031   11.705   50.722   4.6049   50.999   5.5222   50.088   8.3435  257.170   14.082  253.539   21.709 3.630615 25.87652 
1 1 1   15   24   13 o  767.691   8.9316  451.909   10.495  456.631   12.914  442.721   18.013  771.320   10.938  758.374   15.518 12.94617 18.98519 
1 1 1   15   24   14 o  595.480   8.8787  271.915   8.0926  278.278   9.8192  258.442   14.289  602.144   10.654  579.227   16.117 22.91748 19.31970 
1 1 1   15   24   15 f  109.200   32.441   9.5225   5.8179   27.717   7.7415 -14.0892   8.8189  186.472   27.987   62.170   30.104 124.3021 41.10400 
1 1 1   15   24   16 o  237.523   17.478   43.764   6.3096   45.872   8.5781   41.279   9.3135  241.939   23.459  228.458   27.167 13.48181 35.89369 
1 1 1   15   24   17 o  455.878   9.5292  159.460   6.6493  156.844   7.8178  166.303   12.643  451.888   11.303  464.079   17.799 -12.19165 21.08455 
1 1 1   15   24   18 o  379.083   10.449  110.334   6.0629  104.797   7.0465  126.115   11.897  369.198   12.469  403.737   19.252 -34.53900 22.93726 
1 1 1   15   24   19 o  621.840   9.1617  296.705   8.7202  284.224   10.137  332.229   17.102  608.295   10.887  655.925   17.034 -47.62988 20.21634 
1 1 1   15   24   20 o  306.202   11.817   72.081   5.5382   69.602   6.3297   80.177   11.438  300.649   13.755  319.992   23.518 -19.34320 27.24509 
1 1 1   15   24   21 o  139.518   22.701   15.528   4.6811   13.138   5.2516   24.771   10.328  127.006   27.787  172.085   39.973 -45.07835 48.68219 
1 1 1   15   24   22 o   97.605   25.712   7.7320   3.8948   4.0605   5.3904   11.742   5.6337   82.589   31.192  119.619   30.635 -37.03032 43.71984 
1 1 1   15   24   23 o  403.489   9.9741  125.066   6.1599  137.496   7.8702  105.410   9.8968  422.679   12.165  368.983   17.523 53.69586 21.33193 
1 1 1   15   24   24 o  382.177   9.6401  112.198   5.6392  114.877   7.7381  109.164   8.2351  386.108   13.094  376.137   14.304 9.971008 19.39182 
1 1 1   15   24   25 o  136.544   25.207   15.083   5.0741   14.266   5.7164   18.117   11.018  131.761   29.119  146.566   44.889 -14.80457 53.50682 
1 1 1   15   24   26 o  325.520   12.951   81.709   6.4530   86.607   7.4608   67.161   12.857  334.806   14.559  289.322   29.443 45.48383 32.84569 
1 1 1   15   24   27 o  193.230   16.100   29.121   4.7185   31.588   6.5861   26.520   6.7633  199.774   21.898  181.930   24.944 17.84410 33.19217 
1 1 1   15   24   28 o  271.003   12.377   56.645   5.1341   59.483   7.2788   53.835   7.2426  276.173   17.306  262.439   18.141 13.73450 25.07242 
1 1 1   15   24   29 o  292.508   8.5456   65.739   3.8261   65.711   4.4459   65.820   7.5121  292.243   9.9391  290.541   16.966 1.702271 19.66285 
1 1 1   15   24   30 o  277.538   8.9522   59.218   3.8030   60.380   4.4011   55.794   7.5554  280.047   10.267  266.785   18.619 13.26230 21.26245 
1 1 1   15   24   31 o  202.559   19.784   32.409   6.0555   32.216   11.343   32.486   7.1614  193.573   39.618  201.480   23.673 -7.906479 46.15199 
1 1 1   15   24   32 o  113.483   17.155   10.247   2.8868   9.3232   3.2142   14.100   6.5652  107.365   20.302  129.047   33.083 -21.68205 38.81556 
1 1 1   15   24   33 o  140.210   15.153   15.439   3.2003   13.837   3.5618   22.152   7.2900  131.910   18.120  163.121   30.314 -31.21100 35.31630 
1 1 1   15   24   34 o  232.826   18.267   42.666   6.4576   47.547   11.639   40.496   7.7618  239.035   32.667  225.045   22.850 13.99028 39.86560 
1 1 1   15   24   35 o  192.360   12.915   28.780   3.7807   26.246   4.3788   36.203   7.4937  182.919   15.795  212.225   23.461 -29.30650 28.28258 
1 1 1   15   24   36 o  252.996   8.9520   49.279   3.4666   51.449   4.8079   46.931   5.0029  257.849   12.182  245.648   13.356 12.20120 18.07722 
1 1 1   15   24   37 f   54.227   23.145   0.1637   3.3941   0.8176   3.7069  -3.2272   8.4418   59.043   24.637   75.004   34.011 -15.96085 41.99657 
1 1 1   15   24   38 o  380.612   7.6455  111.406   4.4541  120.968   6.4342  102.608   6.1721  395.720   10.623  364.310   11.069 31.40961 15.34128 
1 1 1   15   24   39 o  314.275   10.369   76.301   4.9880   76.998   5.8291   74.394   9.6395  315.183   12.083  305.455   20.741 9.727386 24.00344 
1 1 1   15   24   40 o  410.871   8.0501  129.971   5.0626  130.885   6.9446  128.934   7.3960  411.240   11.033  407.814   11.849 3.425995 16.18981 
1 1 1   15   24   41 o   57.937   23.048   1.5923   3.0623   0.5993   4.4961   2.4516   4.1823   62.831   26.723   68.249   27.003 -5.417942 37.99071 
1 1 1   15   24   42 o  119.193   19.464   11.565   3.4284   15.205   5.0180   8.3793   4.6951  134.636   25.278   98.972   29.075 35.66418 38.52731 
1 1 1   15   24   43 o  129.283   18.346   13.517   3.5285   12.145   5.1498   14.731   4.8443  118.317   28.725  132.352   24.825 -14.03499 37.96577 
1 1 1   15   24   44 o  112.789   23.453   10.734   3.9170   6.0121   5.6065   15.236   5.4747   87.754   32.056  132.762   27.831 -45.00869 42.45170 
1 1 1   15   24   45 o   81.203   25.578   5.5253   3.5491   9.6310   5.3141   2.2197   4.7684  104.114   31.022   69.237   28.321 34.87682 42.00470 
1 1 1   15   24   46 o   71.358   27.863   3.2208   4.4016  -0.6120   10.337   4.0697   4.8647   83.934   37.886   76.693   29.471 7.241020 47.99880 
1 1 1   15   24   47 f  169.758   18.069   23.433   4.6227   29.806   5.6772   10.893   7.9633  190.612   19.745  107.654   38.350 82.95793 43.13471 
1 1 1   15   24   48 o  285.749   14.049   64.716   6.1447   35.701   9.7989   83.519   7.8883  195.294   34.017  323.012   15.955 -127.7182 37.57291 
1 1 1   15   24   49 f  134.961   20.016   15.283   4.0095   12.239   5.0901   20.258   6.5084  115.254   28.905  148.684   29.639 -33.42973 41.39970 
1 1 1   15   24   50 o  173.046   18.957   24.896   4.9391   24.074   6.3976   26.109   7.7707  164.445   26.304  166.369   31.672 -1.924332 41.17057 
1 1 1   15   25    2 o  464.243   13.079  165.550   9.2936  165.550   9.2936   0.0000   0.0000  464.243   13.079  ?   ?  0.000000 13.07876 
1 1 1   15   25    3 o   98.038   26.066   7.7264   3.9789   6.1740   5.4119   9.5528   5.8701   92.556   31.712  109.651   32.588 -17.09453 45.47162 
1 1 1   15   25    4 o  285.808   11.594   62.700   5.0722   61.975   6.8087   63.604   7.6031  283.367   15.760  286.816   17.401 -3.448761 23.47731 
1 1 1   15   25    5 o  430.156   9.9670  141.922   6.5623  137.880   8.6882  147.291   10.013  423.608   13.400  437.615   14.949 -14.00607 20.07556 
1 1 1   15   25    6 o  301.478   9.4095   69.698   4.3420   72.695   5.2052   62.841   7.8729  307.776   11.049  284.927   18.147 22.84869 21.24603 
1 1 1   15   25    7 o  684.855   7.1725  359.379   7.5186  354.975   8.5949  373.734   15.518  680.515   8.2515  697.115   14.543 -16.59949 16.72079 
1 1 1   15   25    8 o  434.686   7.4520  144.797   4.9581  144.948   5.6348  144.280   10.435  434.830   8.4662  432.928   15.748 1.901123 17.87922 
1 1 1   15   25    9 f  474.601   7.3527  172.609   5.3413  170.766   6.0931  178.726   11.100  471.963   8.4345  481.935   15.047 -9.972137 17.24998 
1 1 1   15   25   10 o  511.568   8.7298  200.663   6.8356  203.680   8.4175  194.820   11.714  515.158   10.675  503.099   15.211 12.05920 18.58349 
1 1 1   15   25   11 o  384.642   9.6049  113.495   5.6548  109.701   6.7918  122.068   10.209  377.939   11.741  397.949   16.761 -20.01019 20.46419 
1 1 1   15   25   12 o  385.659   9.7177  114.110   5.7364  110.823   6.8812  121.598   10.386  379.836   11.836  397.084   17.088 -17.24747 20.78646 
1 1 1   15   25   13 o  814.692   9.1872  509.119   11.456  518.576   14.225  491.661   19.327  821.741   11.310  798.817   15.807 22.92395 19.43595 
1 1 1   15   25   14 o  488.739   11.909  183.534   8.9092  192.561   12.839  175.150   12.373  499.638   16.788  476.474   16.966 23.16364 23.86777 
1 1 1   15   25   15 o  430.138   9.9812  142.007   6.5714  135.325   7.7410  159.244   12.433  419.619   12.052  454.048   17.890 -34.42926 21.57113 
1 1 1   15   25   16 o  294.695   11.581   66.733   5.2238   68.547   6.1195   61.862   10.029  298.469   13.395  281.033   23.531 17.43539 27.07651 
1 1 1   15   25   17 o  536.948   9.2251  221.242   7.5818  219.423   9.0275  225.596   13.968  534.429   11.036  540.511   16.883 -6.081909 20.17007 
1 1 1   15   25   18 o  223.514   14.266   38.643   4.8551   34.849   5.5678   50.681   9.9183  211.660   17.338  253.315   25.946 -41.65485 31.20623 
1 1 1   15   25   19 o  214.864   15.320   35.793   5.0055   30.720   5.7104   52.620   10.400  198.237   19.055  257.780   26.747 -59.54301 32.84030 
1 1 1   15   25   20 f  416.627   10.373  133.357   6.6150  131.873   7.6863  137.597   12.990  414.008   12.129  420.945   20.161 -6.937439 23.52861 
1 1 1   15   25   21 o  203.721   18.776   32.446   5.7889   32.446   5.7889   0.0000   0.0000  203.721   18.776  ?   ?  0.000000 18.77608 
1 1 1   15   25   22 o  298.716   14.113   68.831   6.4530   68.831   6.4530   0.0000   0.0000  298.716   14.113  ?   ?  0.000000 14.11340 
1 1 1   15   25   23 o   66.313   27.801   0.7509   4.7524   2.1044   5.3927  -3.9557   10.056   74.805   30.298   83.140   37.462 -8.334892 48.18060 
1 1 1   15   25   24 o  181.591   16.120   25.720   4.4340   28.409   6.1404   22.791   6.4096  189.585   21.543  168.376   25.683 21.20796 33.52219 
1 1 1   15   25   25 o  312.316   11.328   75.097   5.4154   80.017   7.6214   70.080   7.6961  321.554   15.485  300.178   16.818 21.37579 22.86106 
1 1 1   15   25   26 o  132.970   22.798   14.240   4.4731   14.637   6.4190   13.865   6.2367  132.459   32.015  128.956   31.797 3.502960 45.12259 
1 1 1   15   25   27 o  284.389   12.278   62.386   5.3446   62.085   7.4240   62.709   7.7003  282.118   17.276  283.360   17.845 -1.241211 24.83762 
1 1 1   15   25   28 o  194.991   16.012   29.699   4.7368   30.011   6.6693   29.382   6.7287  194.015   22.900  191.773   23.409 2.242096 32.74716 
1 1 1   15   25   29 o  154.271   20.257   18.937   4.6678   21.553   6.6274   16.362   6.5753  162.312   27.669  139.777   31.489 22.53510 41.91785 
1 1 1   15   25   30 o  147.715   25.808   17.804   5.6228   28.630   10.849   13.829   6.5747  181.958   40.040  127.911   33.268 54.04677 52.05731 
1 1 1   15   25   31 o  151.959   13.638   18.016   3.1382   18.587   3.5013   15.683   7.0771  154.055   15.040  135.764   34.102 18.29144 37.27134 
1 1 1   15   25   32 o  115.577   30.977   11.241   5.5913   14.240   10.305   9.9903   6.6562  129.792   43.763  109.989   35.070 19.80237 56.08169 
1 1 1   15   25   33 o  428.898   12.270  142.233   8.0553  145.786   14.323  140.590   9.7421  428.974   21.886  425.358   14.963 3.615540 26.51256 
1 1 1   15   25   34 o  130.980   17.245   13.624   3.3733   12.032   3.7481   20.411   7.7390  121.952   20.827  154.592   33.660 -32.64065 39.58283 
1 1 1   15   25   35 o  199.737   12.425   31.002   3.7799   30.376   4.2418   33.416   8.3289  197.260   14.143  201.658   27.717 -4.397873 31.11633 
1 1 1   15   25   36 o  417.247   9.0603  134.105   5.7864  138.047   6.5088  119.245   12.637  423.019   10.052  387.228   21.405 35.79156 23.64775 
1 1 1   15   25   37 o  233.177   9.4991   41.924   3.3903   38.729   4.6803   45.451   4.9177  222.794   13.792  241.560   13.352 -18.76572 19.19678 
1 1 1   15   25   38 o  197.819   11.173   30.368   3.3692   28.073   4.6257   32.962   4.9172  188.738   16.168  204.735   15.814 -15.99763 22.61610 
1 1 1   15   25   39 o  145.625   14.502   16.699   3.1895   11.137   4.5215   22.208   4.5000  114.947   26.272  167.026   17.880 -52.07887 31.77900 
1 1 1   15   25   40 o  276.318   9.6210   58.968   4.0691   59.579   5.8385   58.392   5.6742  276.421   13.799  273.747   13.542 2.673981 19.33424 
1 1 1   15   25   41 o   94.926   22.177   7.5235   3.1640   10.326   4.5601   4.9216   4.3938  109.855   27.251   80.395   28.503 29.46072 39.43396 
1 1 1   15   25   42 o   43.203   20.221  -2.9875   3.3407  -7.4473   4.4939   2.5215   4.9946   43.245   21.066   72.007   29.160 -28.76157 35.97334 
1 1 1   15   25   43 o   52.569   22.792  -0.0877   3.3910  -7.9904   4.9011   7.1690   4.6966   45.122   21.984   91.776   29.479 -46.65425 36.77438 
1 1 1   15   25   44 o   54.132   23.125   0.3470   3.3936   4.2193   4.9073  -3.2021   4.6980   77.856   29.675   52.634   24.413 25.22269 38.42702 
1 1 1   15   25   45 o  219.230   16.763   38.466   5.5822   23.042   11.263   43.489   6.4272  149.117   45.328  232.269   18.225 -83.15236 48.85442 
1 1 1   15   25   46 o  127.978   19.990   13.586   3.7877   8.3080   5.5651   18.142   5.1699   96.416   32.161  146.002   23.966 -49.58570 40.10891 
1 1 1   15   25   47 o  171.737   15.335   23.678   3.9886   29.455   5.8957   18.803   5.4162  188.169   20.819  147.431   24.888 40.73784 32.44703 
1 1 1   15   25   48 o   60.018   25.239   1.2635   3.9369   4.0938   5.3049  -2.2064   5.8737   76.520   30.368   60.581   27.810 15.93853 41.17784 
1 1 1   15   25   49 o   65.059   27.195   1.9212   4.5277   2.7156   5.8382   0.7223   7.1719   72.971   30.714   72.458   32.215 0.5124359 44.51023 
1 1 1   15   26    0 o  352.705   15.163   95.998   8.1514   95.998   8.1514   95.998   8.1514  352.705   15.163  352.705   15.163 0.000000 0.000000 
1 1 1   15   26    1 o  438.573   10.088  147.572   6.7723  155.009   9.5190  139.950   9.6370  448.992   13.851  426.491   14.763 22.50180 20.24316 
1 1 1   15   26    2 o  464.935   10.074  165.848   7.1688  152.468   9.7035  181.926   10.637  445.233   14.239  486.338   14.290 -41.10483 20.17257 
1 1 1   15   26    3 o  736.014   14.499  416.745   16.334   0.0000   0.0000  416.745   16.334  ?   ?   736.014   14.499 0.000000 14.49900 
1 1 1   15   26    4 o  389.652   15.454  116.892   9.2169   0.0000   0.0000  116.892   9.2169  ?   ?   389.652   15.454 0.000000 15.45388 
1 1 1   15   26    5 o  754.996   14.828  438.674   17.136   0.0000   0.0000  438.674   17.136  ?   ?   754.996   14.828 0.000000 14.82839 
1 1 1   15   26    6 o   87.862   34.250   3.8983   6.6425   0.0000   0.0000   3.8983   6.6425  ?   ?    87.862   34.250 0.000000 34.24995 
1 1 1   15   26    7 o  218.670   13.368   36.901   4.4529   43.944   5.5584   24.282   7.4401  238.413   15.313  174.061   28.942 64.35194 32.74333 
1 1 1   15   26    8 o  446.031   9.0300  152.584   6.1648  151.364   7.6102  154.915   10.514  443.985   11.199  448.515   15.316 -4.530060 18.97291 
1 1 1   15   26    9 o  328.031   10.486   82.597   5.2647   84.553   6.5603   79.057   8.8240  331.638   12.924  319.484   18.119 12.15387 22.25597 
1 1 1   15   26   10 f  281.638   11.379   60.923   4.9052   66.241   6.0423   50.644   8.4004  293.464   13.452  254.680   21.758 38.78407 25.58064 
1 1 1   15   26   11 o  530.710   8.8991  216.040   7.2290  215.311   8.8501  217.502   12.531  529.513   10.920  531.308   15.409 -1.795105 18.88546 
1 1 1   15   26   12 o  584.281   11.098  262.211   9.9255  267.760   14.422  257.219   13.681  589.289   15.989  577.710   15.471 11.57855 22.24913 
1 1 1   15   26   13 o  101.228   31.930   8.0185   5.5290   11.501   7.9356   4.7331   7.7077  120.480   38.279   94.812   36.912 25.66812 53.17733 
1 1 1   15   26   14 o  575.211   9.0487  253.867   7.9668  257.312   9.6892  246.678   13.998  578.759   10.938  565.422   16.174 13.33704 19.52490 
1 1 1   15   26   15 f  326.712   10.748   81.997   5.3745   82.149   6.4127   81.636   9.8524  326.757   12.822  323.921   19.969 2.836670 23.73099 
1 1 1   15   26   16 o  387.726   9.9879  115.438   5.9275  107.098   6.8457  140.421   11.848  373.182   11.985  425.981   18.172 -52.79871 21.76810 
1 1 1   15   26   17 o  318.381   11.252   77.922   5.4832   74.795   6.3275   87.349   10.987  311.659   13.264  334.456   21.577 -22.79642 25.32797 
1 1 1   15   26   18 o  109.707   26.654   9.8159   4.4316   7.7716   5.0288   16.922   9.3757   98.867   30.335  142.451   40.870 -43.58379 50.89727 
1 1 1   15   26   19 o  238.608   13.985   44.044   5.0851   44.315   5.8517   43.209   10.277  238.931   16.094  232.083   29.605 6.847397 33.69675 
1 1 1   15   26   20 o  235.140   17.046   43.022   6.0934   43.022   6.0934   0.0000   0.0000  235.140   17.046  ?   ?  0.000000 17.04602 
1 1 1   15   26   21 o  161.138   20.392   20.521   4.9170   22.800   5.4792   11.096   11.144  169.669   21.587  123.778   45.198 45.89087 50.08840 
1 1 1   15   26   22 o  335.324   12.235   86.621   6.2796   84.630   7.2705   92.469   12.460  331.041   14.349  342.538   23.915 -11.49713 27.88942 
1 1 1   15   26   23 o  364.120   10.133  101.951   5.6475  106.104   7.8357   97.460   8.1469  370.712   13.809  355.014   14.993 15.69827 20.38318 
1 1 1   15   26   24 o  117.443   25.412   11.281   4.4354   5.5766   5.9508   18.411   6.6530   90.431   33.027  149.416   30.131 -58.98466 44.70609 
1 1 1   15   26   25 o  224.805   14.352   39.241   4.9128   41.504   6.8090   36.783   7.0953  229.845   19.540  215.590   21.801 14.25496 29.27621 
1 1 1   15   26   26 o  286.057   12.246   63.132   5.3620   58.102   7.1790   69.479   8.0638  272.819   17.281  298.277   17.743 -25.45734 24.76750 
1 1 1   15   26   27 o  234.838   14.454   42.857   5.1703   35.295   6.9239   52.387   7.7734  210.940   21.757  258.090   19.829 -47.14941 29.43762 
1 1 1   15   26   28 o  192.791   17.443   29.171   5.0915   27.089   7.0882   31.391   7.3181  182.958   26.047  197.676   24.728 -14.71812 35.91510 
1 1 1   15   26   29 o  160.689   24.818   20.918   5.9074   17.007   10.146   22.924   7.2659  140.051   43.108  166.589   29.579 -26.53780 52.27991 
1 1 1   15   26   30 o  159.977   24.076   20.703   5.7127   14.400   9.3017   24.520   7.2388  129.896   41.462  172.718   28.367 -42.82164 50.23698 
1 1 1   15   26   31 o   77.825   31.368   2.6961   5.7502  -2.5769   9.3795   5.8713   7.2784   81.277   36.438   94.938   36.151 -13.66111 51.32863 
1 1 1   15   26   32 o  283.945   9.4127   62.082   4.0909   64.056   4.6687   55.554   8.4891  288.193   10.584  264.597   21.137 23.59589 23.63894 
1 1 1   15   26   33 o  258.597   10.018   51.550   3.9654   51.478   4.4854   51.806   8.4849  258.153   11.351  254.927   21.959 3.225922 24.71993 
1 1 1   15   26   34 o  164.662   14.095   21.211   3.5183   22.894   3.8774   13.366   8.3705  170.885   14.975  124.335   39.294 46.55058 42.05112 
1 1 1   15   26   35 o  296.991   10.556   68.103   4.7984   67.517   5.2855   70.850   11.443  295.417   11.689  295.751   25.528 -0.3346558 28.07690 
1 1 1   15   26   36 o  104.536   22.329   9.0121   3.4642   8.6365   3.8305   10.699   8.1174  101.718   24.822  113.177   38.836 -11.45825 46.09075 
1 1 1   15   26   37 o  328.979   10.058   83.561   5.0647   87.034   5.8633   73.353   10.052  335.320   11.424  302.647   21.847 32.67322 24.65375 
1 1 1   15   26   38 o  170.408   12.835   22.686   3.3232   22.783   4.5851   22.579   4.8235  169.144   17.986  167.964   19.102 1.180466 26.23691 
1 1 1   15   26   39 o  215.685   10.930   36.113   3.5965   35.475   5.0267   36.783   5.1479  212.225   15.584  216.087   15.671 -3.862045 22.10023 
1 1 1   15   26   40 o  141.251   16.732   15.924   3.5471   17.105   4.8367   14.549   5.2177  144.137   22.672  130.891   26.942 13.24544 35.21183 
1 1 1   15   26   41 o   34.895   17.175  -6.5015   3.2302  -3.7397   4.5388  -9.3357   4.5980   50.606   23.648   41.191   20.315 9.414829 31.17570 
1 1 1   15   26   42 o  195.907   12.424   30.052   3.7063   25.352   5.4562   34.080   5.0503  176.383   20.598  207.147   16.054 -30.76389 26.11505 
1 1 1   15   26   43 o  328.517   9.5761   83.606   4.8152   80.668   6.5047   87.167   7.1622  320.930   13.242  333.130   14.046 -12.20044 19.30404 
1 1 1   15   26   44 o  112.861   26.196   11.068   4.4381   10.942   10.160   11.097   4.9337  110.658   42.575  111.924   28.671 -1.266533 51.32922 
1 1 1   15   26   45 o   72.791   25.793   4.1633   3.5974   5.5391   5.1703   2.8722   5.0087   83.362   30.733   72.012   29.188 11.34947 42.38454 
1 1 1   15   26   46 o  182.471   15.596   26.745   4.3141   22.209   5.7868   32.420   6.4728  160.957   24.241  196.762   21.862 -35.80511 32.64287 
1 1 1   15   26   47 o  192.150   15.784   29.783   4.6012   28.284   6.5377   31.254   6.4769  181.251   24.168  192.031   22.460 -10.78038 32.99266 
1 1 1   15   26   48 o   87.551   29.279   6.9433   4.6121   6.8939   6.1761   7.0056   6.9345   88.566   33.402   89.971   35.016 -1.405266 48.39259 
1 1 1   15   27    0 o   79.273   40.294   7.2149   6.1240   7.2149   6.1240   7.2149   6.1240   79.273   40.294   79.273   40.294 0.000000 0.000000 
1 1 1   15   27    1 o  404.682   10.530  125.717   6.5228  127.150   9.2975  124.327   9.1534  406.355   14.948  401.829   14.882 4.526215 21.09343 
1 1 1   15   27    2 o  426.702   10.321  139.755   6.7411  138.915   9.2576  140.703   9.8354  424.855   14.236  427.444   15.033 -2.588623 20.70394 
1 1 1   15   27    3 o  373.622   11.008  107.193   6.2951  102.680   8.6106  112.374   9.2266  365.085   15.409  381.867   15.786 -16.78293 22.05938 
1 1 1   15   27    4 o  436.866   10.231  146.491   6.8416  145.597   9.4392  147.480   9.9304  434.945   14.178  437.633   14.825 -2.688019 20.51347 
1 1 1   15   27    5 o  216.754   14.653   36.338   4.8329   36.884   6.4768   35.651   7.2597  217.482   19.669  213.150   22.596 4.331863 29.95791 
1 1 1   15   27    6 o  146.089   17.206   16.694   3.7736   16.473   4.5436   17.186   6.7752  144.306   21.203  145.158   31.406 -0.8525543 37.89340 
1 1 1   15   27    7 o  366.547   8.1929  103.027   4.5966  102.603   5.2696  104.374   9.4004  365.677   9.4147  367.800   16.698 -2.122559 19.16928 
1 1 1   15   27    8 o  417.695   7.7164  133.761   4.9334  134.298   5.6531  132.045   10.104  418.418   8.8269  413.805   15.952 4.612823 18.23110 
1 1 1   15   27    9 o  389.739   8.0635  116.479   4.8103  112.603   5.4215  130.821   10.428  383.080   9.2461  411.731   16.547 -28.65106 18.95515 
1 1 1   15   27   10 o  682.554   11.173  357.932   11.673  336.276   16.423  380.040   16.593  660.155   16.253  702.079   15.441 -41.92334 22.41859 
1 1 1   15   27   11 o  406.566   12.089  127.095   7.5232  105.975   10.319  151.056   10.991  370.157   18.214  442.410   16.231 -72.25272 24.39661 
1 1 1   15   27   12 o   57.523   24.967  -0.5303   4.0778   2.4641   4.7862  -8.4601   7.7887   73.251   28.917   64.047   30.254 9.204445 41.85099 
1 1 1   15   27   13 o  205.437   14.841   32.706   4.6353   31.176   5.3839   37.091   9.1126  199.998   17.773  215.549   28.305 -15.55063 33.42181 
1 1 1   15   27   14 o  306.542   11.442   72.245   5.3685   69.157   6.3133   80.309   10.202  299.613   13.766  320.844   20.889 -21.23120 25.01691 
1 1 1   15   27   15 o  369.799   10.382  105.066   5.8763  111.509   7.0623   90.568   10.594  380.700   12.120  340.864   20.400 39.83551 23.72840 
1 1 1   15   27   16 o  377.953   10.445  109.772   6.0426  101.130   7.0410  133.927   11.771  362.418   12.693  415.662   18.502 -53.24420 22.43720 
1 1 1   15   27   17 o  145.277   21.501   16.778   4.6367   15.661   5.3144   20.338   9.4884  139.157   25.904  155.396   39.736 -16.23895 47.43369 
1 1 1   15   27   18 o  136.526   26.111   15.114   5.2577   15.114   5.2577   0.0000   0.0000  136.526   26.111  ?   ?  0.000000 26.11149 
1 1 1   15   27   19 o  173.158   22.532   23.807   5.8305   23.807   5.8305   0.0000   0.0000  173.158   22.532  ?   ?  0.000000 22.53215 
1 1 1   15   27   20 o  421.616   10.607  136.721   6.8453  131.017   7.9959  152.374   13.245  412.290   12.671  442.466   19.557 -30.17609 23.30311 
1 1 1   15   27   21 o  379.752   11.467  111.042   6.6654  108.305   7.7560  118.774   13.036  374.597   13.527  389.022   21.983 -14.42490 25.81118 
1 1 1   15   27   22 o   68.509   28.557   1.0494   4.9731   0.4728   5.6614   2.9976   10.406   70.596   30.006   98.855   41.267 -28.25938 51.02239 
1 1 1   15   27   23 o  137.601   26.584   15.473   5.3965   17.053   6.2385   10.776   10.756  143.784   29.340  120.917   44.365 22.86701 53.18918 
1 1 1   15   27   24 o  237.359   13.833   43.701   5.0037   44.985   6.8051   42.190   7.3828  239.527   18.710  231.169   21.098 8.358124 28.19873 
1 1 1   15   27   25 o  207.687   15.147   33.600   4.7818   35.102   6.5293   31.862   7.0226  210.806   20.494  199.802   23.407 11.00343 31.11100 
1 1 1   15   27   26 o  174.220   18.454   23.929   4.8462   28.807   6.5990   18.218   7.1401  189.844   23.192  147.320   32.533 42.52357 39.95359 
1 1 1   15   27   27 f  150.423   32.490   19.013   7.2619   0.0000   0.0000   19.013   7.2619  ?   ?   150.423   32.490 0.000000 32.49025 
1 1 1   15   27   28 o   98.616   35.400   7.1658   6.7978   0.0000   0.0000   7.1658   6.7978  ?   ?    98.616   35.400 0.000000 35.40044 
1 1 1   15   27   29 o  362.570   13.074  101.713   7.2554  102.116   12.032  101.483   9.0948  359.120   21.996  361.013   16.459 -1.893158 27.47203 
1 1 1   15   27   30 o  289.988   13.525   65.149   6.0031   64.514   8.2531   65.863   8.7479  286.326   18.938  288.905   19.904 -2.578674 27.47409 
1 1 1   15   27   31 o  247.747   15.102   47.893   5.6993   56.411   8.0039   39.132   8.1173  267.211   19.709  220.360   24.480 46.85048 31.42764 
1 1 1   15   27   32 o  284.903   9.7420   62.553   4.2483   66.821   4.8772   49.131   8.6488  294.223   10.830  247.630   23.084 46.59286 25.49838 
1 1 1   15   27   33 o  139.639   16.322   15.421   3.4228   16.760   3.7651   9.0490   8.2151  145.380   17.257  107.789   38.890 37.59151 42.54711 
1 1 1   15   27   34 o  392.306   9.7225  118.678   5.8381  120.815   6.5801  110.774   12.655  395.450   10.871  372.505   22.298 22.94485 24.80702 
1 1 1   15   27   35 o  244.448   11.003   46.197   4.1170   45.229   4.6080   50.027   9.1663  241.204   12.524  248.507   24.413 -7.303513 27.43862 
1 1 1   15   27   36 o  277.857   10.838   59.699   4.6095   65.555   5.3421   42.631   9.1200  290.829   12.001  227.719   26.670 63.11017 29.24605 
1 1 1   15   27   37 o   55.827   23.753   0.3353   3.5542   0.8661   3.9356  -2.0117   8.2760   60.440   25.317   75.993   34.137 -15.55268 42.50023 
1 1 1   15   27   38 o   92.592   26.629   7.2200   3.9758   9.2199   4.4217  -1.2239   9.0857  104.020   27.393   80.816   36.073 23.20366 45.29487 
1 1 1   15   27   39 o   91.253   23.508   6.9989   3.3037   4.7722   4.3368   10.078   5.0997   79.445   28.301  107.831   29.871 -28.38645 41.14879 
1 1 1   15   27   40 o  109.773   20.097   9.9168   3.2523   6.4528   4.6417   13.257   4.5582   88.331   29.368  125.449   24.618 -37.11807 38.32119 
1 1 1   15   27   41 o  269.172   20.603   58.679   8.4239   0.0000   0.0000   58.679   8.4239  ?   ?   269.172   20.603 0.000000 20.60261 
1 1 1   15   27   42 o   62.046   24.173   2.2421   3.3075   1.5878   4.6220   2.9289   4.7351   66.228   27.562   71.883   28.640 -5.655205 39.74793 
1 1 1   15   27   43 o   78.476   28.337   4.7865   4.3629 -19.2305   9.6480   10.960   4.8916   57.554   28.571  111.255   28.575 -53.70153 40.40826 
1 1 1   15   27   44 o  212.783   14.645   35.992   4.7408   40.029   5.8858   28.535   7.9994  222.782   17.399  178.933   30.288 43.84830 34.92976 
1 1 1   15   27   45 o  140.671   29.050   17.819   6.0477   17.698   9.0863   17.915   8.1033  130.729   40.886  134.120   37.832 -3.390991 55.70388 
1 1 1   15   27   46 o  109.790   25.923   10.752   4.2866   12.449   6.1479   9.1470   5.9799  113.768   33.227   98.675   33.337 15.09256 47.06823 
1 1 1   15   27   47 o  102.987   27.219   9.6834   4.3554   12.949   5.4248   3.7604   7.3060  117.490   30.047   80.804   34.203 36.68668 45.52624 
1 1 1   15   28    0 o  398.775   14.946  122.633   9.0936  122.633   9.0936  122.633   9.0936  398.775   14.946  398.775   14.946 0.000000 0.000000 
1 1 1   15   28    1 o  467.483   10.205  167.794   7.3024  167.338   10.168  168.279   10.495  466.135   14.251  467.356   14.671 -1.221405 20.45255 
1 1 1   15   28    2 o  435.096   10.312  145.361   6.8678  151.903   9.6125  138.539   9.8158  444.134   14.140  423.957   15.126 20.17679 20.70627 
1 1 1   15   28    3 o  544.509   10.033  227.625   8.3622  221.266   11.443  234.913   12.251  536.064   13.946  552.213   14.494 -16.14948 20.11352 
1 1 1   15   28    4 o  468.054   10.243  168.218   7.3383  164.703   9.9968  172.326   10.806  462.448   14.123  472.855   14.931 -10.40674 20.55208 
1 1 1   15   28    5 o  477.839   10.300  175.339   7.5332  174.491   10.388  176.279   10.940  475.944   14.260  478.224   14.946 -2.279877 20.65738 
1 1 1   15   28    6 o  337.751   9.9492   87.584   5.1435   92.071   6.4220   79.556   8.5899  346.026   12.125  320.344   17.586 25.68149 21.36096 
1 1 1   15   28    7 o  456.447   8.9603  159.870   6.2601  152.328   7.4861  177.408   11.416  445.255   10.984  479.560   15.552 -34.30536 19.04023 
1 1 1   15   28    8 o  354.926   9.6696   96.711   5.2531   98.891   6.3491   91.979   9.3529  358.664   11.565  344.405   17.803 14.25830 21.22980 
1 1 1   15   28    9 o  107.469   20.744   9.2621   3.2888   10.341   3.6569   4.6992   7.5210  113.482   21.846   93.731   36.471 19.75060 42.51287 
1 1 1   15   28   10 f   64.666   26.371   1.3233   4.1186   3.0550   4.8985  -2.8536   7.6079   76.191   29.492   73.453   32.881 2.737877 44.16984 
1 1 1   15   28   11 f  217.730   13.791   36.671   4.5723   34.728   5.4373   41.364   8.4488  211.273   16.957  228.813   24.505 -17.53940 29.79970 
1 1 1   15   28   12 f  184.931   16.441   26.636   4.6051   31.953   5.6085   15.633   8.0679  202.289   18.312  137.127   37.403 65.16199 41.64540 
1 1 1   15   28   13 o  309.652   11.583   73.755   5.4899   75.292   6.5472   70.116   10.076  312.547   13.686  299.133   22.163 13.41370 26.04823 
1 1 1   15   28   14 o  463.901   9.7560  165.313   6.9273  158.746   8.2096  181.549   12.909  454.201   11.809  484.185   17.418 -29.98370 21.04368 
1 1 1   15   28   15 o  351.765   11.039   95.167   5.9436   94.110   7.0421   97.786   11.082  349.441   13.166  353.867   20.548 -4.425476 24.40458 
1 1 1   15   28   16 o  358.909   11.246   99.109   6.1779  101.442   7.2202   92.732   11.936  362.786   13.003  343.645   22.823 19.14178 26.26681 
1 1 1   15   28   17 o  136.818   26.883   15.247   5.4290   15.247   5.4290   0.0000   0.0000  136.818   26.883  ?   ?  0.000000 26.88310 
1 1 1   15   28   18 o  157.237   21.005   19.618   4.9290   18.755   5.5764   22.701   10.539  152.665   24.708  162.826   42.009 -10.16087 48.73648 
1 1 1   15   28   19 o  173.096   19.660   23.632   5.1164   23.768   5.8841   23.209   10.360  172.733   22.813  164.596   41.213 8.137253 47.10590 
1 1 1   15   28   20 o  260.014   13.936   52.382   5.5262   52.177   6.4636   52.940   10.654  258.895   16.396  256.951   27.518 1.943909 32.03203 
1 1 1   15   28   21 o  342.328   12.105   90.362   6.3427   85.235   7.4615  103.716   12.043  331.890   14.688  363.130   21.767 -31.23965 26.25941 
1 1 1   15   28   22 o  280.018   13.823   60.619   5.9246   62.073   6.9040   56.554   11.539  282.432   16.037  264.639   28.960 17.79330 33.10413 
1 1 1   15   28   23 o  193.606   19.392   29.551   5.6693   27.956   6.4729   34.804   11.747  187.121   23.090  202.057   39.399 -14.93562 45.66679 
1 1 1   15   28   24 o  161.314   23.460   20.918   5.6228   19.252   6.3473   26.992   12.119  153.095   28.123  174.834   45.018 -21.73868 53.08040 
1 1 1   15   28   25 o  253.759   15.355   50.138   5.9359   43.839   9.0789   54.841   7.8448  233.557   25.828  264.070   19.548 -30.51303 32.39160 
1 1 1   15   28   26 o  147.022   33.186   18.267   7.2909   0.0000   0.0000   18.267   7.2909  ?   ?   147.022   33.186 0.000000 33.18571 
1 1 1   15   28   27 f  250.807   14.028   48.886   5.3638   50.594   7.4085   47.006   7.7759  253.490   19.238  243.607   21.061 9.882874 28.52473 
1 1 1   15   28   28 o   71.914   28.867   2.2944   4.8481   15.443   6.6773 -12.3651   7.0505  134.883   32.685   53.463   26.118 81.41989 41.83866 
1 1 1   15   28   29 o  149.549   23.401   18.130   5.1811   18.131   6.9980   18.128   7.7076  146.341   32.123  145.256   35.066 1.085571 47.55499 
1 1 1   15   28   30 o  276.484   13.819   59.300   5.8480   65.645   8.0847   52.337   8.4694  288.871   18.380  256.373   21.789 32.49811 28.50645 
1 1 1   15   28   31 o  101.573   31.307   8.5645   5.3496   0.3985   7.2918   18.083   7.8724   77.870   33.592  144.311   35.810 -66.44102 49.09931 
1 1 1   15   28   32 o   85.274   32.047   4.8660   5.6746   5.2438   7.4291   4.3369   8.7922   92.566   36.183   94.373   38.512 -1.807091 52.84330 
1 1 1   15   28   33 o  173.249   13.600   23.452   3.5774   22.494   3.8668   29.148   9.4242  169.249   15.084  184.079   34.721 -14.83073 37.85622 
1 1 1   15   28   34 o  108.752   20.973   9.6740   3.3647   9.5275   3.7333   10.308   7.7659  107.209   23.407  111.170   37.988 -3.960709 44.62058 
1 1 1   15   28   35 o   68.663   24.845   3.2927   3.3564   2.4269   3.6824   7.5438   8.1595   65.767   25.539  101.481   38.364 -35.71354 46.08719 
1 1 1   15   28   36 o  340.520   9.9432   89.577   5.1825  105.701   6.1308   49.210   9.7004  369.575   10.838  244.494   26.337 125.0811 28.47950 
1 1 1   15   28   37 o  207.011   14.639   33.668   4.6086   33.226   4.8519   37.740   14.736  205.303   15.556  195.862   49.215 9.440155 51.61476 
1 1 1   15   28   38 o  230.141   12.914   41.396   4.5307   42.203   5.3710   39.405   8.4361  231.442   15.247  217.951   25.788 13.49158 29.95803 
1 1 1   15   28   39 o   82.647   26.424   5.6479   3.7768   3.0248   4.4165   12.788   7.2864   71.315   27.892  118.628   36.533 -47.31271 45.96362 
1 1 1   15   28   40 o  239.817   13.009   45.075   4.7574   53.575   5.9585   30.129   7.9016  260.519   15.006  187.661   28.396 72.85854 32.11745 
1 1 1   15   28   41 o  197.194   12.137   30.453   3.6456   31.840   5.1884   29.101   5.1234  199.429   17.164  190.285   17.797 9.144318 24.72584 
1 1 1   15   28   42 o  101.055   27.655   8.9848   4.4019   14.893   9.8811   7.5220   4.9168  122.843   42.808   92.944   30.193 29.89884 52.38452 
1 1 1   15   28   43 o   85.564   25.184   6.3410   3.5196   17.671   5.1810  -3.3685   4.7961  143.732   24.424   52.442   24.440 91.28988 34.55184 
1 1 1   15   28   44 o  209.768   13.032   34.810   4.1635   51.010   6.7218   24.725   5.3034  250.845   17.619  172.508   20.486 78.33780 27.01990 
1 1 1   15   28   45 o   46.142   21.604  -3.0036   3.8196  -1.4200   5.5875  -4.3929   5.2333   60.972   27.656   52.526   24.808 8.445831 37.15273 
1 1 1   15   28   46 o   71.154   27.202   3.7449   4.1312   4.4242   5.1435   2.5101   6.9345   77.007   30.105   76.331   32.843 0.6763077 44.55358 
1 1 1   15   29    0 o   59.184   36.044   2.5477   6.1353   2.5477   6.1353   2.5477   6.1353   59.184   36.044   59.184   36.044 0.000000 0.000000 
1 1 1   15   29    1 o  212.219   14.750   34.893   4.7614   33.891   6.6281   35.962   6.8445  207.800   21.133  214.107   21.162 -6.307144 29.90730 
1 1 1   15   29    2 o  168.265   18.297   22.172   4.6365   26.974   6.4903   17.167   6.6258  184.558   23.509  144.806   30.839 39.75230 38.77779 
1 1 1   15   29    3 o  395.512   10.918  120.222   6.6095  120.845   9.1036  119.527   9.6116  395.795   15.027  393.432   15.961 2.362915 21.92174 
1 1 1   15   29    4 o  274.303   12.653   57.912   5.3125   52.639   7.2395   64.065   7.8202  260.096   18.301  287.162   17.881 -27.06631 25.58615 
1 1 1   15   29    5 o  362.131   11.504  100.840   6.3763  100.704   8.8540  100.986   9.1902  361.084   16.020  361.466   16.611 -0.3817444 23.07707 
1 1 1   15   29    6 o  352.966   10.273   95.713   5.5499   99.650   6.8319   88.074   9.5167  359.836   12.404  336.644   18.541 23.19272 22.30725 
1 1 1   15   29    7 o  270.144   11.821   56.140   4.8880   56.087   6.0052   56.244   8.4145  269.261   14.626  268.226   20.654 1.035187 25.30835 
1 1 1   15   29    8 o  293.237   11.308   66.125   5.0757   63.136   6.1418   72.563   9.0145  286.166   14.022  305.174   19.399 -19.00836 23.93626 
1 1 1   15   29    9 o  266.125   10.518   54.432   4.2844   56.045   4.8817   49.025   8.9384  269.888   11.817  249.367   23.703 20.52103 26.48567 
1 1 1   15   29   10 o   87.933   28.516   5.9568   4.3867   2.5863   5.3151   13.157   7.7687   76.276   30.358  126.406   37.472 -50.12990 48.22613 
1 1 1   15   29   11 o  358.371   10.783   98.750   5.9150   99.802   7.1497   96.469   10.530  359.897   12.979  351.787   19.634 8.110168 23.53573 
1 1 1   15   29   12 o  342.293   11.124   90.127   5.8281   87.415   6.9635   96.469   10.649  336.697   13.512  351.643   19.867 -14.94659 24.02649 
1 1 1   15   29   13 o  116.910   25.678   11.150   4.4694   10.012   5.1814   14.456   8.8341  110.429   29.914  132.013   40.148 -21.58370 50.06682 
1 1 1   15   29   14 o  368.665   11.044  104.572   6.2323  100.830   7.1993  115.762   12.449  361.637   13.006  384.596   21.230 -22.95831 24.89750 
1 1 1   15   29   15 o  379.984   12.780  111.320   7.4332  111.320   7.4332   0.0000   0.0000  379.984   12.780  ?   ?  0.000000 12.78033 
1 1 1   15   29   16 o  420.212   10.533  135.842   6.7749  136.482   8.0616  134.303   12.500  420.752   12.518  415.156   19.671 5.595367 23.31606 
1 1 1   15   29   17 o  318.482   12.228   78.191   5.9610   75.911   7.0297   84.027   11.246  313.310   14.659  326.579   22.638 -13.26901 26.96968 
1 1 1   15   29   18 o  384.028   11.124  113.570   6.5386  104.975   7.6150  137.691   12.757  368.672   13.495  420.021   19.843 -51.34875 23.99659 
1 1 1   15   29   19 o   87.599   29.989   5.7476   4.8398   1.7344   5.5462   18.560   9.9098   73.970   30.433  146.884   41.979 -72.91315 51.84983 
1 1 1   15   29   20 o  152.579   23.413   18.720   5.2933   17.813   6.1847   21.204   10.235  147.176   28.484  156.458   41.899 -9.281647 50.66441 
1 1 1   15   29   21 o  285.039   16.794   63.349   7.2947   70.229   9.3518   52.658   11.657  298.822   20.572  254.346   30.556 44.47609 36.83521 
1 1 1   15   29   22 o  442.247   13.166  151.145   8.9126  154.068   11.644  147.009   13.850  445.029   17.094  432.982   20.898 12.04639 26.99868 
1 1 1   15   29   23 o  226.750   20.298   40.593   6.9702   42.042   8.5588   37.740   12.011  229.102   24.803  210.479   38.708 18.62250 45.97306 
1 1 1   15   29   24 o  242.174   16.765   45.855   6.1762   43.938   6.9767   52.799   13.279  236.161   19.474  251.335   35.508 -15.17400 40.49747 
1 1 1   15   29   25 o  146.176   35.285   18.257   7.8049   7.1613   9.6415   39.350   13.294  106.272   41.309  212.344   42.386 -106.0720 59.18634 
1 1 1   15   29   26 o  149.000   22.778   17.921   5.0299   17.294   6.6591   18.753   7.6753  143.396   31.224  148.264   34.474 -4.867691 46.51245 
1 1 1   15   29   27 o  197.176   17.286   30.570   5.1642   33.082   6.8347   27.228   7.8836  203.430   22.316  181.505   29.381 21.92491 36.89536 
1 1 1   15   29   28 o   72.731   29.021   2.5103   4.8686   5.7064   6.5252  -1.5034   7.3124   91.745   34.387   73.500   32.611 18.24442 47.39143 
1 1 1   15   29   29 o  189.993   18.883   28.600   5.4185   31.077   7.1841   25.333   8.2525  195.949   24.488  173.205   32.317 22.74370 40.54654 
1 1 1   15   29   30 o   77.603   29.882   3.6039   5.0081  -0.8343   6.8082   8.8374   7.3930   72.271   31.793  105.549   37.014 -33.27807 48.79406 
1 1 1   15   29   31 o   77.388   31.021   2.9162   5.5904  -1.8838   7.4488   9.1067   8.4593   72.959   32.607  108.287   39.403 -35.32806 51.14518 
1 1 1   15   29   32 o  433.201   11.290  145.131   7.4862  150.192   10.475  139.846   10.703  438.620   15.602  422.726   16.542 15.89380 22.73908 
1 1 1   15   29   33 o  289.699   14.941   65.634   6.6027   68.540   9.4491   62.860   9.2299  292.931   21.218  280.208   21.689 12.72241 30.34190 
1 1 1   15   29   34 o  202.048   13.634   31.911   4.1918   31.459   4.3458   37.957   15.887  200.408   14.260  195.898   52.084 4.510834 54.00102 
1 1 1   15   29   35 o  301.664   11.468   70.536   5.2953   73.114   5.6342   51.020   15.502  306.947   11.992  234.165   44.884 72.78169 46.45805 
1 1 1   15   29   36 o   40.905   19.601  -4.6385   3.5148  -5.3632   3.9251  -1.7062   7.8958   42.752   20.547   74.445   33.399 -31.69255 39.21347 
1 1 1   15   29   37 o  143.679   18.211   16.612   3.9151   15.225   4.5785   20.384   7.5516  135.594   22.874  151.676   33.429 -16.08122 40.50560 
1 1 1   15   29   38 o  175.670   15.412   24.458   4.1022   26.570   4.8407   19.078   7.7269  182.236   17.572  145.005   35.174 37.23105 39.31900 
1 1 1   15   29   39 f  138.090   20.394   15.635   4.1809   14.813   5.0312   17.468   7.5155  131.818   25.860  137.980   35.409 -6.161209 43.84652 
1 1 1   15   29   40 o  154.287   17.816   19.218   4.1300   18.204   4.9927   21.415   7.3501  147.742   22.813  154.781   32.079 -7.039185 39.36325 
1 1 1   15   29   41 o   83.237   28.422   5.7661   4.3470   2.7361   9.6738   6.5327   4.8660   88.300   38.390   87.845   30.070 0.4553680 48.76456 
1 1 1   15   29   42 o   46.308   21.021  -1.4232   3.2357  -0.2591   4.6429  -2.5226   4.5118   59.497   26.212   52.515   24.205 6.982574 35.67817 
1 1 1   15   29   43 f  166.154   18.822   22.689   4.7024   34.467   6.0743   5.0731   7.4287  204.546   19.643   86.303   35.331 118.2426 40.42394 
1 1 1   15   29   44 o  130.243   19.904   14.209   3.8419   17.251   5.1202   10.290   5.8118  140.732   24.669  104.062   32.724 36.66989 40.98095 
1 1 1   15   29   45 o  156.142   30.723   22.651   7.0812   17.221   8.8112   32.555   11.900  126.862   40.339  170.784   44.920 -43.92138 60.37430 
1 1 1   15   30    0 o   58.326   36.357   1.8240   6.5956   1.8240   6.5956   1.8240   6.5956   58.326   36.357   58.326   36.357 0.000000 0.000000 
1 1 1   15   30    1 o   88.428   29.196   5.9540   4.5905   19.510   6.5194  -7.3759   6.4648  154.954   28.539   57.742   27.362 97.21179 39.53659 
1 1 1   15   30    2 o  234.638   14.746   42.661   5.2691   38.908   7.1529   47.114   7.7913  222.529   21.259  245.139   20.967 -22.61038 29.85870 
1 1 1   15   30    3 o  527.762   10.483  214.100   8.4679  195.196   11.181  239.525   12.967  502.916   14.525  556.877   15.213 -53.96085 21.03379 
1 1 1   15   30    4 o  181.661   18.096   25.831   4.9647   27.378   6.6392   23.868   7.4775  185.593   23.929  171.423   29.566 14.17050 38.03603 
1 1 1   15   30    5 o  394.046   11.385  119.457   6.8669  118.210   9.1902  121.033   10.332  391.147   15.350  395.347   17.075 -4.199890 22.96027 
1 1 1   15   30    6 o  140.505   19.962   15.645   4.1724   17.434   5.1206   12.113   7.1971  147.578   23.454  121.437   36.083 26.14070 43.03564 
1 1 1   15   30    7 o  461.239   9.4616  163.421   6.6798  160.337   8.0647  170.161   11.921  456.452   11.543  468.845   16.612 -12.39301 20.22883 
1 1 1   15   30    8 o  188.978   16.087   27.824   4.6089   24.577   5.4558   35.915   8.6128  176.498   20.582  211.772   27.200 -35.27361 34.10915 
1 1 1   15   30    9 o  411.258   8.4021  129.834   5.2890  126.479   6.0042  141.456   11.174  405.709   9.6688  427.243   17.087 -21.53348 19.63259 
1 1 1   15   30   10 o  221.639   14.516   38.102   4.8974   42.034   5.9426   29.778   8.6461  232.327   16.825  191.273   30.561 41.05475 34.88634 
1 1 1   15   30   11 o  229.352   14.388   40.789   5.0254   37.927   5.9288   48.093   9.4715  220.374   17.727  245.878   25.539 -25.50357 31.08847 
1 1 1   15   30   12 f  214.045   17.920   35.823   5.8170   35.823   5.8170   0.0000   0.0000  214.045   17.920  ?   ?  0.000000 17.92017 
1 1 1   15   30   13 o   93.956   31.600   6.7409   5.3728   6.7409   5.3728   0.0000   0.0000   93.956   31.600  ?   ?  0.000000 31.60031 
1 1 1   15   30   14 o  418.805   10.602  134.973   6.7965  132.274   8.1061  141.362   12.471  414.081   12.790  425.984   19.127 -11.90271 23.00863 
1 1 1   15   30   15 o  223.329   15.722   38.829   5.3400   35.205   6.2475   48.658   10.288  211.613   19.508  246.028   27.809 -34.41435 33.96872 
1 1 1   15   30   16 o   92.250   30.274   6.6288   4.9386   6.9105   5.7642   5.8512   9.5766   95.508   32.728  103.249   40.858 -7.741440 52.34949 
1 1 1   15   30   17 o  232.056   17.964   42.150   6.3309   37.769   8.0243   49.373   10.304  217.484   24.534  247.711   27.647 -30.22659 36.96334 
1 1 1   15   30   18 o  203.083   20.536   32.585   6.2958   32.225   8.1692   33.110   9.8800  199.552   27.474  199.822   33.488 -0.2693481 43.31607 
1 1 1   15   30   19 o  215.243   20.854   36.620   6.7844   34.879   8.6147   39.463   11.009  207.495   27.825  218.091   34.095 -10.59628 44.00835 
1 1 1   15   30   20 o  273.538   14.249   58.076   5.9450   63.224   6.9347   43.802   11.548  284.935   15.965  229.905   33.826 55.02968 37.40452 
1 1 1   15   30   21 o  656.212   10.115  331.542   10.160  325.724   11.929  346.911   19.388  649.638   11.997  666.212   19.013 -16.57379 22.48156 
1 1 1   15   30   22 f  180.111   20.294   25.740   5.4972   27.224   6.2281   20.508   11.695  184.560   22.514  152.234   46.170 32.32526 51.36658 
1 1 1   15   30   23 o  474.490   14.436  174.544   10.484  166.962   13.983  184.279   15.844  461.466   19.797  483.839   21.394 -22.37292 29.14854 
1 1 1   15   30   24 o  154.812   33.302   20.291   7.6571   21.374   9.7528   18.550   12.363  156.173   40.470  145.180   47.912 10.99278 62.71660 
1 1 1   15   30   25 o  134.619   29.113   15.149   5.8243   14.092   6.4569   19.764   13.492  128.773   32.699  148.865   50.075 -20.09169 59.80585 
1 1 1   15   30   26 o  247.933   14.373   47.870   5.4309   46.298   7.4340   49.669   7.9532  241.762   20.276  250.180   20.963 -8.417511 29.16437 
1 1 1   15   30   27 o  226.876   16.138   40.322   5.5676   43.976   7.5535   35.975   8.2385  235.064   21.223  210.321   26.157 24.74283 33.68351 
1 1 1   15   30   28 o  409.356   10.848  129.374   6.7970  135.402   9.4971  123.044   9.7321  417.188   14.873  397.182   16.008 20.00601 21.85093 
1 1 1   15   30   29 o  180.488   20.246   26.010   5.4968   34.137   7.8317   18.120   7.7168  204.748   25.546  144.453   35.219 60.29514 43.50850 
1 1 1   15   30   30 o   97.189   32.270   7.6542   5.6052   3.6018   7.2501   13.675   8.8372   86.496   35.096  125.248   40.459 -38.75213 53.56011 
1 1 1   15   30   31 o  125.862   29.115   13.445   5.4974   16.989   7.8588   10.049   7.6928  138.846   36.498  110.112   37.805 28.73403 52.54838 
1 1 1   15   30   32 o  117.047   36.324   11.910   7.1875   10.370   8.0993   17.618   15.593  111.486   38.762  139.977   53.006 -28.49107 65.66660 
1 1 1   15   30   33 o  138.303   34.907   16.885   7.3900   17.207   8.4909   15.877   15.006  138.092   38.647  134.426   51.735 3.666046 64.57677 
1 1 1   15   30   34 o  175.140   22.828   25.042   5.9742   26.579   8.8832   23.772   8.0725  174.014   34.570  165.215   33.076 8.798431 47.84462 
1 1 1   15   30   35 o  183.527   14.851   26.543   4.1361   29.712   4.7826   17.140   8.2383  193.689   16.283  136.941   37.977 56.74724 41.32069 
1 1 1   15   30   36 o  304.407   22.685   75.448   10.494   75.448   10.494   0.0000   0.0000  304.407   22.685  ?   ?  0.000000 22.68471 
1 1 1   15   30   37 o  232.938   12.257   42.394   4.3547   45.208   5.1290   35.129   8.2424  239.810   14.034  204.071   27.055 35.73851 30.47807 
1 1 1   15   30   38 o  149.454   17.693   17.996   3.9689   19.392   4.7193   14.621   7.3356  153.935   20.542  125.757   36.171 28.17838 41.59729 
1 1 1   15   30   39 o   65.468   28.966  -0.4958   5.7301   4.6223   9.6027  -3.3259   7.1407   93.175   39.313   66.232   30.499 26.94308 49.75639 
1 1 1   15   30   40 o  160.322   25.564   21.998   6.0625   27.827   9.6555   18.205   7.7893  170.646   37.948  138.320   36.325 32.32652 52.53150 
1 1 1   15   30   41 o  124.791   20.672   13.030   3.8103   11.257   5.4043   14.782   5.3731  110.764   30.774  128.862   28.038 -18.09811 41.63150 
1 1 1   15   30   42 o  134.438   17.114   14.755   3.4419   19.551   4.9332   10.206   4.8045  152.308   21.781  105.827   28.863 46.48111 36.15916 
1 1 1   15   30   43 o  102.243   28.010   9.5353   4.5129   9.3713   4.9596   10.325   10.881  100.552   29.971  104.788   42.812 -4.235672 52.26018 
1 1 1   15   31    0 o  496.682   15.252  190.302   11.570  190.302   11.570  190.302   11.570  496.682   15.252  496.682   15.252 0.000000 0.000000 
1 1 1   15   31    1 o   91.546   29.568   6.5307   4.7198   2.8734   6.4296   10.804   6.9504   82.483   33.196  115.263   35.712 -32.77922 48.75778 
1 1 1   15   31    2 f  484.630   10.852  180.691   8.0499  185.408   11.235  175.714   11.539  489.756   14.988  476.510   15.821 13.24536 21.79303 
1 1 1   15   31    3 o  139.943   24.223   15.787   5.0007   10.541   6.7970   21.976   7.3833  113.913   35.319  163.698   30.592 -49.78487 46.72587 
1 1 1   15   31    4 o  251.401   15.066   49.036   5.7708   48.093   7.9608   50.079   8.3774  247.317   21.236  252.189   21.921 -4.872070 30.52002 
1 1 1   15   31    5 o  260.306   14.873   52.547   5.9011   46.465   7.9236   60.121   8.8428  242.949   21.531  276.747   21.033 -33.79797 30.09897 
1 1 1   15   31    6 o  488.468   9.5074  183.368   7.1084  175.868   8.7217  198.208   12.268  477.804   11.926  505.982   15.840 -28.17841 19.82758 
1 1 1   15   31    7 o  273.851   12.107   57.789   5.0749   60.629   6.2028   52.037   8.8264  279.714   14.538  256.747   22.693 22.96701 26.95081 
1 1 1   15   31    8 o  590.438   16.154  270.113   14.599   0.0000   0.0000  270.113   14.599  ?   ?   590.438   16.154 0.000000 16.15355 
1 1 1   15   31    9 o  168.882   20.813   22.597   5.2663   27.105   6.8589   16.122   8.2199  183.906   25.015  138.102   37.789 45.80423 45.31865 
1 1 1   15   31   10 o  242.904   14.607   45.789   5.4056   45.789   5.4056   0.0000   0.0000  242.904   14.607  ?   ?  0.000000 14.60712 
1 1 1   15   31   11 o  278.178   19.714   60.658   8.3394   60.658   8.3394   0.0000   0.0000  278.178   19.714  ?   ?  0.000000 19.71352 
1 1 1   15   31   12 o  173.851   22.431   24.081   5.8296   25.534   7.6502   22.070   9.0026  176.794   29.296  161.330   37.216 15.46342 47.36327 
1 1 1   15   31   13 o  253.883   16.637   50.241   6.4295   55.387   8.4100   43.002   9.9742  265.276   20.881  230.549   28.900 34.72667 35.65427 
1 1 1   15   31   14 o  128.794   28.242   13.699   5.4142   9.3730   6.8716   20.781   8.7923  108.425   35.717  156.292   37.276 -47.86717 51.62591 
1 1 1   15   31   15 o  357.622   11.691   98.597   6.3998   95.901   7.5912  105.221   11.899  352.121   14.085  365.770   21.346 -13.64987 25.57444 
1 1 1   15   31   16 o   74.331   29.711   2.4841   5.1119   5.7558   5.9854  -6.3359   9.8273   90.998   33.140   77.189   35.628 13.80991 48.65818 
1 1 1   15   31   17 o  296.919   13.493   68.163   6.1323   72.088   7.2258   58.060   11.594  304.457   15.558  267.963   28.715 36.49408 32.65876 
1 1 1   15   31   18 o  126.566   27.946   13.270   5.2692   12.873   6.1386   14.381   10.271  123.761   32.125  131.120   43.689 -7.359337 54.22828 
1 1 1   15   31   19 o  116.070   29.704   11.250   5.2991   6.9047   6.0801   24.978   10.807   95.874   33.570  168.953   41.977 -73.07928 53.74971 
1 1 1   15   31   20 o  199.111   19.090   31.277   5.7467   26.988   6.5520   45.580   11.964  183.235   23.933  233.788   34.467 -50.55292 41.96135 
1 1 1   15   31   21 o  350.524   17.437   95.829   9.3555   93.965   12.925   97.881   13.560  343.052   24.781  349.730   25.506 -6.677948 35.56209 
1 1 1   15   31   22 o  335.093   17.768   87.921   9.0805   91.236   12.223   83.838   13.565  338.408   23.748  322.007   27.795 16.40149 36.55842 
1 1 1   15   31   23 o  261.665   15.901   53.469   6.3384   50.179   7.2538   64.093   13.035  252.407   18.913  279.187   31.027 -26.78000 36.33719 
1 1 1   15   31   24 o   97.686   32.513   7.6113   5.6887   7.7072   6.4985   7.2968   11.768   99.703   34.717  111.610   44.913 -11.90669 56.76683 
1 1 1   15   31   25 o  105.405   33.128   9.2130   5.9572   13.425   6.7868  -4.9251   12.434  125.111   34.380   89.335   40.804 35.77612 53.35711 
1 1 1   15   31   26 o   83.313   32.548   3.9960   6.0090   6.4944   6.7912  -5.0136   12.897   95.300   35.206   90.710   41.480 4.589943 54.40670 
1 1 1   15   31   27 o  103.046   30.347   8.8994   5.1092   18.767   7.2456  -0.8596   7.2057  148.106   32.824   74.207   32.675 73.89940 46.31506 
1 1 1   15   31   28 o  147.015   24.345   17.709   5.2864   18.104   7.4906   17.316   7.4618  144.589   34.354  141.210   34.757 3.379074 48.86996 
1 1 1   15   31   29 o  260.268   16.870   53.270   6.6844   60.801   8.5961   41.750   10.631  276.428   20.462  222.546   32.141 53.88252 38.10179 
1 1 1   15   31   30 f   75.562   32.372   0.8151   6.6844   1.4263   7.6976  -1.0588   13.479   81.778   34.879   97.765   43.766 -15.98753 55.96413 
1 1 1   15   31   31 o  290.706   17.778   66.773   7.8723   69.645   9.0431   57.787   15.997  295.634   20.104  252.421   42.942 43.21233 47.41504 
1 1 1   15   31   32 o  375.642   12.561  109.650   7.2224  120.026   10.546  100.483   9.9119  390.144   17.659  356.204   18.241 33.94012 25.38864 
1 1 1   15   31   33 o  248.669   25.115   50.810   9.4282   50.810   9.4282   0.0000   0.0000  248.669   25.115  ?   ?  0.000000 25.11470 
1 1 1   15   31   34 o  145.719   27.468   18.048   5.9018   27.457   8.6956   10.012   8.0362  176.829   33.351  108.369   38.534 68.45998 50.96180 
1 1 1   15   31   35 f  232.988   17.827   43.313   6.3092   41.446   9.5288   44.771   8.4190  220.853   28.880  233.190   23.926 -12.33746 37.50349 
1 1 1   15   31   36 o  325.196   12.258   82.439   6.1017   82.439   6.1017   0.0000   0.0000  325.196   12.258  ?   ?  0.000000 12.25838 
1 1 1   15   31   37 o  112.807   23.509   10.770   3.9276   15.762   4.6412  -1.8235   7.3719  137.377   22.877   70.649   31.932 66.72850 39.28110 
1 1 1   15   31   38 o  248.731   27.103   52.755   10.152   52.755   10.152   0.0000   0.0000  248.731   27.103  ?   ?  0.000000 27.10323 
1 1 1   15   31   39 o  173.209   16.503   24.131   4.3224   28.770   5.2355   14.200   7.6603  188.174   18.413  121.195   37.481 66.97914 41.76011 
1 1 1   15   31   40 o  166.293   16.744   22.363   4.2039   24.570   4.9818   16.905   7.8347  173.004   19.133  131.153   37.271 41.85056 41.89565 
1 1 1   15   31   41 o  131.158   21.691   14.572   4.2022   14.089   5.0065   15.724   7.7305  125.869   26.808  125.375   37.429 0.4938583 46.03904 
1 1 1   15   31   42 o   78.252   27.975   5.0975   4.2409   4.1281   4.6295   10.155   10.574   74.669   28.736  104.030   42.320 -29.36127 51.15395 
1 1 1   15   32    0 o  364.105   17.195  102.869   9.5344  102.869   9.5344  102.869   9.5344  364.105   17.195  364.105   17.195 0.000000 0.000000 
1 1 1   15   32    1 o  212.430   16.557   35.205   5.3409   31.604   7.5746   38.766   7.5320  198.586   25.509  221.246   22.557 -22.66003 34.05226 
1 1 1   15   32    2 o  394.865   11.870  120.157   7.1742  128.939   10.247  111.716   10.047  407.753   16.419  379.267   17.307 28.48602 23.85636 
1 1 1   15   32    3 o  405.198   11.516  126.480   7.1424  133.174   10.110  119.810   10.092  414.546   15.933  392.929   16.780 21.61713 23.13939 
1 1 1   15   32    4 o   46.754   22.410  -6.3010   4.6006  -3.6988   6.1848  -9.5245   6.8837   62.840   28.732   56.660   27.225 6.180405 39.58201 
1 1 1   15   32    5 o  227.798   16.349   40.444   5.6625   44.846   7.7683   35.453   8.2713  238.415   21.519  210.163   26.288 28.25240 33.97260 
1 1 1   15   32    6 o  241.440   13.545   45.164   4.9853   49.001   6.2683   38.559   8.2240  250.817   16.418  219.781   24.886 31.03651 29.81360 
1 1 1   15   32    7 o  123.693   29.723   12.697   5.5574   12.697   5.5574   0.0000   0.0000  123.693   29.723  ?   ?  0.000000 29.72301 
1 1 1   15   32    8 o  197.575   19.857   30.767   5.9236   30.767   5.9236   0.0000   0.0000  197.575   19.857  ?   ?  0.000000 19.85656 
1 1 1   15   32    9 o  102.929   28.151   8.7175   4.5631   13.511   5.5884  -0.8714   7.9039  127.688   29.225   78.746   34.458 48.94277 45.18225 
1 1 1   15   32   10 o  246.980   13.784   47.293   5.1899   48.356   6.3113   45.072   9.1205  249.020   16.654  237.429   25.496 11.59125 30.45339 
1 1 1   15   32   11 o  103.584   28.737   8.8394   4.7161   7.4693   5.6543   11.972   8.5491   97.733   32.409  121.113   39.836 -23.38091 51.35444 
1 1 1   15   32   12 o  190.395   18.134   28.480   5.2209   29.087   6.1957   26.992   9.6967  191.445   21.516  178.620   36.694 12.82474 42.53738 
1 1 1   15   32   13 o  237.611   15.369   43.951   5.5596   37.443   6.5666   60.422   10.447  217.958   19.903  275.197   25.077 -57.23872 32.01548 
1 1 1   15   32   14 o  130.063   26.751   13.917   5.1477   11.392   6.0285   20.715   9.8910  116.698   32.531  154.462   41.111 -37.76429 52.42481 
1 1 1   15   32   15 o  287.987   13.885   64.181   6.1205   68.909   7.3857   53.815   10.935  297.367   16.289  258.013   28.146 39.35339 32.51990 
1 1 1   15   32   16 o  349.341   12.399   94.246   6.6299   88.384   7.7400  110.398   12.849  337.607   14.978  373.609   22.574 -36.00195 27.09124 
1 1 1   15   32   17 o  323.821   13.037   81.075   6.4616   82.352   7.6351   77.853   12.130  325.732   15.314  311.884   25.636 13.84756 29.86192 
1 1 1   15   32   18 o  313.794   13.587   76.221   6.5258   77.255   7.7624   73.730   12.051  314.783   16.165  302.991   26.245 11.79147 30.82357 
1 1 1   15   32   19 o   79.254   30.547   3.6612   5.2377   0.1012   6.0340   14.541   10.549   71.083   30.611  131.232   44.277 -60.14858 53.82831 
1 1 1   15   32   20 o  331.094   17.942   85.894   9.0588   70.756   12.136  104.939   13.613  295.995   27.087  362.412   24.687 -66.41724 36.64939 
1 1 1   15   32   21 o  156.861   24.886   20.031   5.7755   16.015   6.6045   33.082   11.906  137.507   31.983  194.177   41.328 -56.67033 52.25834 
1 1 1   15   32   22 o  332.469   13.770   85.709   7.0075   82.942   8.1508   93.551   13.720  325.785   16.398  340.514   26.534 -14.72849 31.19172 
1 1 1   15   32   23 o  297.504   14.783   68.798   6.7318   63.337   7.7819   85.034   13.418  283.870   18.003  323.812   27.328 -39.94202 32.72538 
1 1 1   15   32   24 o   82.930   32.541   3.8718   6.0268   17.023   7.0548 -31.6512   11.594  140.965   33.238   58.455   29.360 82.50989 44.34834 
1 1 1   15   32   25 f  105.852   33.417   9.3459   6.0550   12.542   7.0124  -0.0202   12.005  120.715   35.553   95.753   42.168 24.96222 55.15558 
1 1 1   15   32   26 o  237.002   19.530   44.550   7.0217   46.914   8.0921   37.345   14.127  242.093   22.081  201.119   46.774 40.97417 51.72421 
1 1 1   15   32   27 f  115.353   36.390   11.403   7.1813   11.403   7.1813   0.0000   0.0000  115.353   36.390  ?   ?  0.000000 36.38981 
1 1 1   15   32   28 o  272.522   18.497   58.758   7.6701   68.282   8.8275   29.411   15.495  293.193   19.786  172.472   53.302 120.7213 56.85598 
1 1 1   15   32   29 o  171.567   22.273   23.869   5.7110   17.356   7.8690   31.117   8.3015  139.879   36.402  192.792   29.032 -52.91296 46.56166 
1 1 1   15   32   30 o  403.826   11.888  126.491   7.3481  135.677   10.432  117.445   10.352  415.742   16.394  386.116   17.516 29.62595 23.99080 
1 1 1   15   32   31 o  127.669   30.787   14.146   5.9463   22.625   8.5328   6.1411   8.2912  159.382   35.846   96.494   38.070 62.88811 52.29023 
1 1 1   15   32   32 o  248.758   17.410   49.120   6.5870   63.450   9.8615   37.576   8.8511  279.076   23.299  211.433   28.042 67.64282 36.45797 
1 1 1   15   32   33 o  103.281   32.920   9.2595   5.8655   0.2221   8.8314   16.392   7.8458   82.064   36.152  133.752   37.050 -51.68879 51.76565 
1 1 1   15   32   34 o  110.908   33.194   10.946   6.0746   11.598   9.2369   10.450   8.0636  114.233   41.235  109.272   38.627 4.960960 56.50047 
1 1 1   15   32   35 o  123.327   32.100   13.626   6.1182   12.588   9.5850   14.339   7.9480  117.075   42.035  123.926   38.155 -6.851517 56.76887 
1 1 1   15   32   36 o  109.382   36.318   10.908   7.0997   8.7076   15.388   11.503   8.0024  113.090   48.791  111.824   38.549 1.265572 62.18206 
1 1 1   15   32   37 o  125.151   21.753   13.126   4.0158   10.767   4.6157   20.471   8.1458  110.543   27.414  147.098   36.381 -36.55548 45.55324 
1 1 1   15   32   38 o  106.524   24.754   9.8678   3.9592   10.143   4.5781   9.0502   7.8853  106.666   27.769  100.953   37.808 5.713371 46.91052 
1 1 1   15   32   39 o  163.095   17.253   21.611   4.2417   24.840   5.0047   13.378   7.9922  173.853   19.123  116.064   38.533 57.78975 43.01754 
1 1 1   15   32   40 o  173.564   16.148   24.346   4.2408   22.463   4.9631   29.441   8.1630  164.289   20.160  179.636   30.797 -15.34726 36.80845 
1 1 1   15   33    0 o   42.867   29.824  -6.0149   6.9657  -6.0149   6.9657  -6.0149   6.9657   42.867   29.824   42.867   29.824 0.000000 0.000000 
1 1 1   15   33    1 o  380.365   12.329  111.611   7.1779  114.539   10.169  108.704   10.134  383.842   17.308  373.799   17.712 10.04248 24.76411 
1 1 1   15   33    2 o  176.032   21.278   24.607   5.6168   29.825   7.6583   18.531   8.2629  192.180   26.761  147.677   36.713 44.50220 45.43096 
1 1 1   15   33    3 o  437.239   16.476  148.421   11.026  148.421   11.026   0.0000   0.0000  437.239   16.476  ?   ?  0.000000 16.47560 
1 1 1   15   33    4 o  397.825   16.642  122.915   10.134  122.915   10.134   0.0000   0.0000  397.825   16.642  ?   ?  0.000000 16.64223 
1 1 1   15   33    5 o  283.184   15.702   62.371   6.7794   62.371   6.7794   0.0000   0.0000  283.184   15.702  ?   ?  0.000000 15.70215 
1 1 1   15   33    6 o  254.392   13.829   50.185   5.3643   51.186   6.6316   48.291   9.1239  256.071   17.016  246.100   24.549 9.970764 29.86998 
1 1 1   15   33    7 o  222.098   15.503   38.427   5.2372   37.358   6.3921   40.611   9.1345  217.900   19.367  224.436   27.142 -6.535889 33.34319 
1 1 1   15   33    8 o  139.098   23.697   15.654   4.8644   17.720   5.8624   11.087   8.7155  147.139   27.026  117.818   40.244 29.32128 48.47689 
1 1 1   15   33    9 o  122.541   26.499   12.367   4.8256   13.145   5.8234   10.663   8.6207  125.418   30.605  116.067   40.011 9.351067 50.37400 
1 1 1   15   33   10 o  259.276   14.031   52.170   5.5477   56.376   6.7113   43.096   9.8580  268.889   16.385  230.512   28.551 38.37636 32.91814 
1 1 1   15   33   11 f  107.327   28.658   9.5546   4.7963   5.3853   5.7107   19.538   8.8370   88.429   32.345  150.755   38.239 -62.32565 50.08394 
1 1 1   15   33   12 o  285.118   13.651   62.893   5.9573   65.633   7.1202   56.498   10.877  290.230   16.091  264.809   27.223 25.42099 31.62317 
1 1 1   15   33   13 o  439.520   10.890  148.888   7.3263  141.113   8.6536  168.561   13.766  427.176   13.235  464.139   19.377 -36.96353 23.46554 
1 1 1   15   33   14 o   98.527   30.465   7.8994   5.0610   4.5099   5.9776   16.480   9.5108   85.712   32.732  138.051   41.584 -52.33939 52.92113 
1 1 1   15   33   15 o  201.321   18.321   31.908   5.5837   26.966   6.6303   43.962   10.355  182.976   24.273  231.742   29.889 -48.76576 38.50330 
1 1 1   15   33   16 f  118.160   29.503   11.693   5.3195   16.218   6.3347   0.8717   9.7970  139.076   30.590   90.460   38.980 48.61599 49.54953 
1 1 1   15   33   17 o  202.015   19.118   32.236   5.8412   25.533   6.8303   50.484   11.270  177.206   25.951  248.045   30.314 -70.83948 39.90490 
1 1 1   15   33   18 o  260.094   20.186   53.470   7.9731   42.813   10.722   66.653   11.925  227.309   31.677  286.857   27.497 -59.54816 41.94693 
1 1 1   15   33   19 o  279.589   15.241   60.947   6.4977   55.970   7.6410   73.947   12.349  266.591   18.847  302.389   26.963 -35.79779 32.89676 
1 1 1   15   33   20 o   62.422   27.942  -1.8416   5.4928  -0.9597   6.3368  -4.5063   11.015   69.635   30.652   84.543   38.534 -14.90714 49.23857 
1 1 1   15   33   21 o  250.844   17.082   49.380   6.5195   43.878   7.6098   64.563   12.640  234.716   21.417  280.266   29.929 -45.54924 36.80254 
1 1 1   15   33   22 o  183.941   22.125   27.172   6.1041   30.483   7.0934   17.722   11.983  194.010   24.429  140.975   47.193 53.03459 53.14100 
1 1 1   15   33   23 o  226.875   18.845   40.715   6.4849   42.843   7.5182   34.531   12.817  231.681   21.444  195.529   43.901 36.15269 48.85806 
1 1 1   15   33   24 o  303.546   15.720   72.073   7.2787   73.022   8.5443   69.561   13.897  304.323   18.430  288.711   31.986 15.61139 36.91542 
1 1 1   15   33   25 o  232.170   22.097   43.248   7.7576   43.248   7.7576   0.0000   0.0000  232.170   22.097  ?   ?  0.000000 22.09655 
1 1 1   15   33   26 o  210.857   25.003   36.264   7.9124   36.264   7.9124   0.0000   0.0000  210.857   25.003  ?   ?  0.000000 25.00329 
1 1 1   15   33   27 o  229.841   20.267   42.209   7.0568   35.787   8.0210   64.206   14.846  208.882   25.625  272.195   36.556 -63.31279 44.64304 
1 1 1   15   33   28 o  109.278   35.601   10.233   6.8341   6.9395   7.7450   21.816   14.525   98.093   37.306  149.546   51.913 -51.45327 63.92745 
1 1 1   15   33   29 o  188.061   20.649   28.510   5.8460   25.889   8.0584   31.423   8.4938  173.537   31.498  192.623   29.769 -19.08574 43.33918 
1 1 1   15   33   30 o  152.842   26.274   19.608   5.9252   20.479   8.3572   18.727   8.4019  150.584   36.613  143.269   37.775 7.315460 52.60722 
1 1 1   15   33   31 o  217.996   19.077   38.103   6.3013   34.910   9.0364   41.126   8.7915  202.001   30.149  222.127   26.373 -20.12677 40.05626 
1 1 1   15   33   32 o  151.660   27.122   19.551   6.0649   27.093   8.7388   12.544   8.4239  174.689   33.906  117.473   39.568 57.21608 52.10752 
1 1 1   15   33   33 o   79.444   32.033   3.5096   5.9993   4.3483   8.8821   2.8059   8.1355   91.528   38.159   85.111   36.063 6.417130 52.50398 
1 1 1   15   33   34 o   84.700   36.176   2.6166   8.3022   0.0000   0.0000   2.6166   8.3022  ?   ?    84.700   36.176 0.000000 36.17615 
1 1 1   15   33   35 o   93.090   37.377   6.1093   8.1302   0.0000   0.0000   6.1093   8.1302  ?   ?    93.090   37.377 0.000000 37.37685 
1 1 1   15   33   36 o   55.050   26.168  -5.8490   6.0045  -9.8993   8.9245  -2.4992   8.1162   63.721   30.714   71.617   32.807 -7.895691 44.94054 
1 1 1   15   33   37 o   76.850   31.167   3.5520   5.7148  -0.3838   8.5254   6.7638   7.7013   76.880   34.581   92.750   36.660 -15.87062 50.39647 
1 1 1   15   33   38 f  214.833   13.528   36.605   4.4258   41.675   5.3158   25.151   7.9902  228.176   15.309  164.396   32.902 63.78040 36.28930 
1 1 1   15   33   39 o   51.085   22.874  -0.8769   3.6838  -1.2675   4.2299   0.3497   7.4958   53.583   24.206   73.711   32.843 -20.12812 40.79978 
1 1 1   15   34    1 o  263.717   25.370   55.622   10.114   0.0000   0.0000   55.622   10.114  ?   ?   263.717   25.370 0.000000 25.36996 
1 1 1   15   34    2 o  454.908   17.442  161.126   12.145   0.0000   0.0000  161.126   12.145  ?   ?   454.908   17.442 0.000000 17.44230 
1 1 1   15   34    3 o  545.289   16.805  231.243   14.026   0.0000   0.0000  231.243   14.026  ?   ?   545.289   16.805 0.000000 16.80525 
1 1 1   15   34    4 o  365.043   19.404  104.469   10.803   0.0000   0.0000  104.469   10.803  ?   ?   365.043   19.404 0.000000 19.40439 
1 1 1   15   34    5 o  355.066   12.037   97.296   6.5419   90.320   8.0882  110.492   11.124  341.169   15.489  375.408   19.427 -34.23843 24.84532 
1 1 1   15   34    6 o  149.620   21.661   17.933   4.8164   19.276   6.0569   15.623   7.9430  153.570   26.739  135.205   37.210 18.36485 45.82091 
1 1 1   15   34    7 o  128.082   25.215   13.434   4.7674   11.358   5.9010   17.336   8.0897  116.415   32.086  142.280   36.852 -25.86535 48.86266 
1 1 1   15   34    8 f  282.984   13.561   61.960   5.8739   60.641   7.0899   64.846   10.489  278.704   16.697  285.193   24.259 -6.489410 29.44993 
1 1 1   15   34    9 o  160.392   21.476   20.562   5.1400   20.605   6.2253   20.470   9.1107  158.867   26.537  153.876   38.715 4.991577 46.93702 
1 1 1   15   34   10 f  330.207   12.217   84.210   6.1748   87.401   7.5452   77.740   10.744  335.729   14.683  313.132   22.569 22.59799 26.92467 
1 1 1   15   34   11 o   89.079   34.200   4.8617   6.5474  -2.8301   9.6944   11.313   8.8782   82.415   36.989  118.283   40.614 -35.86819 54.93349 
1 1 1   15   34   12 o   56.459   25.643  -2.5122   4.8238  -9.2430   5.7744   13.035   8.7760   49.906   24.211  124.477   40.330 -74.57117 47.03970 
1 1 1   15   34   13 o  308.042   13.302   73.446   6.2719   72.759   7.5750   74.944   11.185  305.338   16.267  306.459   24.037 -1.120636 29.02371 
1 1 1   15   34   14 o  325.526   12.970   81.993   6.4625   74.273   7.6270  101.645   12.168  308.474   16.210  358.009   22.317 -49.53470 27.58282 
1 1 1   15   34   15 o  220.720   22.262   38.868   7.4184   37.882   10.532   39.839   10.451  212.660   33.462  218.877   32.153 -6.217316 46.40602 
1 1 1   15   34   16 o  256.141   20.117   51.889   7.8236   44.385   10.868   59.961   11.272  231.423   31.499  271.814   27.470 -40.39128 41.79417 
1 1 1   15   34   17 o  179.809   21.533   25.868   5.8085   27.225   6.8859   22.522   10.815  183.100   25.241  158.575   43.326 24.52524 50.14251 
1 1 1   15   34   18 o   75.752   30.816   2.3590   5.6068   9.5482   6.6370 -15.5574   10.478  107.646   35.085   67.113   32.572 40.53317 47.87354 
1 1 1   15   34   19 o  128.182   29.522   13.852   5.6726   13.061   6.6468   15.971   10.884  123.399   34.070  135.025   44.974 -11.62621 56.42226 
1 1 1   15   34   20 o  285.941   15.178   63.826   6.6192   64.037   7.8782   63.321   12.206  285.224   18.140  277.684   29.154 7.540283 34.33632 
1 1 1   15   34   21 o  403.318   12.420  125.975   7.6671  125.755   9.1542  126.492   14.033  401.936   14.880  397.801   23.147 4.135071 27.51747 
1 1 1   15   34   22 o  159.070   26.968   20.955   6.3316   21.434   7.4171   19.670   12.156  158.824   31.622  146.300   47.473 12.52357 57.04061 
1 1 1   15   34   23 o  196.831   22.287   31.216   6.5962   29.587   7.5261   36.611   13.699  189.568   26.676  198.916   45.923 -9.348145 53.10841 
1 1 1   15   34   24 o  170.027   29.621   24.331   7.4287   24.331   7.4287   0.0000   0.0000  170.027   29.621  ?   ?  0.000000 29.62121 
1 1 1   15   34   25 o  258.875   18.231   53.070   7.1777   56.217   8.3042   43.773   14.272  265.255   20.615  218.108   44.265 47.14647 48.82973 
1 1 1   15   34   26 o  181.081   25.355   27.039   6.8350   24.515   7.8933   34.606   13.665  169.005   31.677  190.231   47.166 -21.22609 56.81573 
1 1 1   15   34   27 o  340.637   15.454   90.927   8.0575   89.057   9.3815   96.186   15.732  335.059   18.363  337.860   30.757 -2.801117 35.82188 
1 1 1   15   34   28 o  278.070   18.079   61.458   7.6531   60.828   9.0419   63.048   14.371  274.419   21.704  267.833   35.964 6.585480 42.00528 
1 1 1   15   34   29 o  169.136   29.257   24.456   7.3002   26.458   8.6064   19.322   13.783  173.283   33.662  139.883   50.388 33.39917 60.59741 
1 1 1   15   34   30 o  237.240   18.037   44.925   6.5007   45.744   9.1306   44.083   9.2574  234.462   25.873  229.426   26.871 5.036423 37.30246 
1 1 1   15   34   31 o   87.626   33.403   5.5464   6.2183   6.9597   8.6973   4.0685   8.8940   98.495   38.949   90.952   38.075 7.542953 54.46760 
1 1 1   15   34   32 o  271.642   18.090   59.103   7.4785   63.669   12.549   56.589   9.3128  271.081   30.791  261.850   23.485 9.230194 38.72554 
1 1 1   15   34   33 o  154.296   36.957   22.378   8.6130   0.0000   0.0000   22.378   8.6130  ?   ?   154.296   36.957 0.000000 36.95658 
1 1 1   15   34   34 o   96.136   33.905   8.0604   6.2093   20.871   9.2636  -2.3906   8.3671  145.172   40.275   73.038   33.404 72.13347 52.32497 
1 1 1   15   34   35 o  243.393   24.013   49.922   8.8292   0.0000   0.0000   49.922   8.8292  ?   ?   243.393   24.013 0.000000 24.01277 
1 1 1   15   34   36 o   93.858   32.770   7.8549   5.7917   12.603   9.0324   4.5395   7.5475  112.703   40.761   85.328   35.341 27.37483 53.94889 
1 1 1   15   34   37 o   61.119   27.920  -1.9891   5.8239   0.8720   8.5470  -4.4690   7.9571   78.833   35.102   66.470   31.141 12.36320 46.92448 
1 1 1   15   35    0 o  327.577   19.977   84.027   9.9309   84.027   9.9309   84.027   9.9309  327.577   19.977  327.577   19.977 0.000000 0.000000 
1 1 1   15   35    1 o  201.410   19.356   32.031   5.8937   38.493   8.6027   26.315   8.0907  218.321   26.271  178.194   30.776 40.12720 40.46420 
1 1 1   15   35    2 o  288.629   15.180   64.832   6.6828   70.916   9.3935   58.597   9.5093  299.861   20.591  271.387   23.113 28.47418 30.95447 
1 1 1   15   35    3 f   81.352   31.510   3.7894   5.5945   6.4159   7.9023   1.1501   7.9215   98.994   37.675   83.345   35.461 15.64890 51.73844 
1 1 1   15   35    4 o  302.731   14.742   71.086   6.8308   85.184   9.7990   57.759   9.5270  329.205   19.534  269.288   23.345 59.91745 30.43944 
1 1 1   15   35    5 o  166.504   20.743   22.094   5.1718   26.220   6.4500   14.663   8.6552  180.489   23.938  130.791   39.731 49.69861 46.38502 
1 1 1   15   35    6 o  326.155   12.473   82.212   6.2267   91.353   7.8832   67.048   10.153  343.063   15.013  290.343   23.035 52.71973 27.49546 
1 1 1   15   35    7 o  327.464   20.447   84.554   10.197   0.0000   0.0000   84.554   10.197  ?   ?   327.464   20.447 0.000000 20.44674 
1 1 1   15   35    8 o  307.665   12.714   73.198   5.9872   71.941   7.4134   75.556   10.153  303.698   16.004  308.902   21.610 -5.204407 26.89089 
1 1 1   15   35    9 o  374.678   11.642  108.389   6.6765  103.505   8.1193  118.586   11.733  365.250   14.523  388.226   19.810 -22.97571 24.56360 
1 1 1   15   35   10 o  426.686   19.053  142.680   12.444   0.0000   0.0000  142.680   12.444  ?   ?   426.686   19.053 0.000000 19.05335 
1 1 1   15   35   11 o  364.527   15.621  103.360   8.7158   84.422   12.348  122.162   12.304  324.519   25.054  393.530   20.497 -69.01074 32.37040 
1 1 1   15   35   12 o  214.129   23.587   36.803   7.6024   33.524   10.667   40.187   10.838  198.103   36.524  219.077   33.376 -20.97464 49.47679 
1 1 1   15   35   13 o  170.017   29.913   24.049   7.5000   23.378   10.625   24.715   10.589  162.023   42.364  166.976   41.586 -4.952942 59.36439 
1 1 1   15   35   14 o  172.627   30.009   24.813   7.6414   36.028   10.574   12.555   11.055  206.259   34.727  124.574   45.089 81.68451 56.91194 
1 1 1   15   35   15 o  416.329   12.013  134.027   7.6551  131.836   9.1100  139.292   14.121  411.969   14.447  418.808   22.106 -6.838745 26.40841 
1 1 1   15   35   16 o  220.079   17.806   38.158   5.9468   38.306   7.0099   37.778   11.232  219.243   21.151  210.122   36.233 9.121399 41.95510 
1 1 1   15   35   17 o  392.417   12.336  119.193   7.4095  112.779   8.7658  135.245   13.867  380.670   15.044  412.422   22.046 -31.75204 26.69042 
1 1 1   15   35   18 o  208.129   19.549   34.398   6.1546   33.064   7.2292   37.910   11.732  202.283   23.804  208.895   38.096 -6.612030 44.92113 
1 1 1   15   35   19 o  289.368   15.197   65.429   6.7075   68.197   7.9749   58.738   12.400  294.334   17.785  265.632   31.087 28.70224 35.81481 
1 1 1   15   35   20 o   93.314   33.425   6.5878   6.0573   2.2703   7.0583   18.654   11.800   81.629   34.023  142.782   46.793 -61.15306 57.85437 
1 1 1   15   35   21 o   67.193   29.511  -0.6729   5.8451   2.0763   6.7099  -9.3241   11.903   79.407   33.141   80.044   37.686 -0.6374817 50.18517 
1 1 1   15   35   22 o  344.453   16.922   93.105   8.9219   93.105   8.9219   0.0000   0.0000  344.453   16.922  ?   ?  0.000000 16.92224 
1 1 1   15   35   23 o  404.104   13.575  127.105   8.3967  128.045   9.7580  124.421   16.482  404.418   15.764  388.688   27.889 15.72995 32.03578 
1 1 1   15   35   24 o  103.524   35.273   8.9315   6.6950   7.8461   7.8285   11.887   12.918  101.312   37.725  121.924   47.697 -20.61198 60.81300 
1 1 1   15   35   25 o  308.373   16.549   74.998   7.7825   80.511   9.0785   59.717   15.114  318.234   18.720  258.016   39.531 60.21756 43.73947 
1 1 1   15   35   26 o  102.772   35.852   8.8247   6.9315   15.055   8.1554  -7.3862   13.155  128.467   38.465   85.749   40.131 42.71783 55.58777 
1 1 1   15   35   27 o  257.966   19.379   53.305   7.5960   50.725   8.8887   60.291   14.626  248.969   23.607  259.292   37.979 -10.32307 44.71820 
1 1 1   15   35   28 o   96.115   35.344   7.3107   6.8316   13.802   8.0249  -9.7786   13.021  122.669   38.434   81.676   38.740 40.99255 54.57054 
1 1 1   15   35   29 o  189.003   30.386   30.894   8.4927   32.649   10.875   28.150   13.598  187.624   39.133  164.506   49.761 23.11867 63.30505 
1 1 1   15   35   30 o  183.266   31.837   29.592   8.6065   39.529   11.276   15.727   13.320  208.117   36.743  127.266   48.799 80.85098 61.08526 
1 1 1   15   35   31 o  166.954   29.466   24.370   7.2545   20.150   14.248   25.847   8.4290  136.992   50.917  168.861   33.791 -31.86861 61.10984 
1 1 1   15   35   32 o   97.521   35.466   8.1965   6.8518   16.771   13.647   5.3065   7.9227  126.914   49.198   89.855   36.601 37.05945 61.31948 
1 1 1   15   35   33 o  157.365   26.006   21.361   6.0452   22.854   8.9545   20.111   8.1944  153.217   38.290  144.576   36.904 8.640884 53.17930 
1 1 1   15   35   34 o  174.476   22.584   25.605   5.8898   12.849   8.4782   37.503   8.1883  114.126   39.659  208.504   26.238 -94.37825 47.55327 
1 1 1   15   35   35 o  108.423   32.553   11.045   5.8352   18.395   8.7563   5.1727   7.8263  134.143   39.787   87.589   36.107 46.55355 53.72817 
1 1 1   15   36    0 o   83.228   44.907   8.1881   7.9559   8.1881   7.9559   8.1881   7.9559   83.228   44.907   83.228   44.907 0.000000 0.000000 
1 1 1   15   36    1 o  434.488   12.833  146.060   8.5346  143.527   11.843  148.797   12.310  428.432   18.060  436.028   18.444 -7.596375 25.81397 
1 1 1   15   36    2 f   84.848   32.490   4.4304   5.8995   9.0492   8.1391  -0.6827   8.5635  108.448   38.756   81.544   35.770 26.90342 52.74018 
1 1 1   15   36    3 o  203.059   20.975   32.796   6.4252   27.171   8.7703   39.312   9.4396  179.656   33.114  219.065   28.854 -39.40875 43.92134 
1 1 1   15   36    4 o  215.127   19.304   36.572   6.2887   42.446   8.9160   30.757   8.8712  229.155   25.873  192.297   31.210 36.85818 40.53965 
1 1 1   15   36    5 o  152.182   27.199   19.085   6.1030   27.999   8.6974   10.437   8.5661  182.778   32.268  114.165   39.854 68.61288 51.27896 
1 1 1   15   36    6 o   83.770   32.480   4.1125   5.9489   1.1143   8.4480   7.0615   8.3784   85.207   36.445  102.049   38.804 -16.84210 53.23534 
1 1 1   15   36    7 o  369.606   11.942  105.573   6.7559  105.503   8.5038  105.692   11.124  368.422   15.080  366.164   19.923 2.258179 24.98637 
1 1 1   15   36    8 o  285.122   14.131   63.078   6.1669   61.513   7.5219   66.286   10.770  279.981   17.642  287.340   24.730 -7.358795 30.37776 
1 1 1   15   36    9 o  360.411   15.777  101.148   8.7034  109.269   13.019   94.586   11.703  370.359   23.081  344.953   22.283 25.40649 32.08260 
1 1 1   15   36   10 o   86.471   34.607   3.8064   6.9451  -1.0390   10.128   8.1071   9.5418   87.208   38.551  108.073   41.335 -20.86494 56.52257 
1 1 1   15   36   11 f  257.452   15.510   51.782   6.0835   50.334   7.2679   55.171   11.118  252.556   18.939  259.766   28.428 -7.210709 34.15855 
1 1 1   15   36   12 o  165.739   29.994   22.957   7.3289   10.739   9.9844   37.232   10.792  116.984   42.772  209.365   34.905 -92.38100 55.20671 
1 1 1   15   36   13 o  279.160   20.096   61.722   8.5293   58.220   12.181   65.091   11.947  265.367   30.546  282.354   28.014 -16.98691 41.44679 
1 1 1   15   36   14 o   75.645   30.912   2.2840   5.6738   2.0083   6.6995   2.9835   10.670   79.541   33.150   97.417   41.289 -17.87569 52.95001 
1 1 1   15   36   15 o  221.159   18.839   38.725   6.3164   32.448   7.5195   53.768   11.641  199.691   25.160  254.558   30.484 -54.86658 39.52615 
1 1 1   15   36   16 o  231.290   17.936   42.228   6.3001   36.753   7.4176   56.404   11.936  213.555   23.058  260.552   30.506 -46.99725 38.24028 
1 1 1   15   36   17 o  142.095   28.082   16.932   5.8912   7.6700   6.8424   43.472   11.582   99.494   35.538  225.597   34.651 -126.1035 49.63448 
1 1 1   15   36   18 o  124.865   31.813   13.426   6.0975   14.560   7.0656   10.117   12.069  129.075   34.918  117.527   46.068 11.54777 57.80631 
1 1 1   15   36   19 o  250.768   17.807   49.699   6.7905   51.502   7.9085   44.639   13.248  254.003   20.517  224.022   40.108 29.98167 45.05067 
1 1 1   15   36   20 o  168.415   30.168   24.047   7.4911   24.047   7.4911   0.0000   0.0000  168.415   30.168  ?   ?  0.000000 30.16786 
1 1 1   15   36   21 o  264.201   17.624   55.219   7.0862   56.398   8.1846   51.688   14.162  265.633   20.283  240.519   39.864 25.11374 44.72711 
1 1 1   15   36   22 o  114.459   34.523   11.481   6.5518   13.389   7.6562   6.2644   12.663  122.451   37.406  107.985   45.331 14.46538 58.77166 
1 1 1   15   36   23 o   69.624   30.849  -0.9041   6.5219   0.7567   7.5947  -5.5688   12.728   78.807   34.138   86.963   40.283 -8.155899 52.80280 
1 1 1   15   36   24 o  148.808   30.741   19.187   6.7702   14.547   7.8293   32.941   13.480  126.549   37.642  182.936   47.663 -56.38700 60.73479 
1 1 1   15   36   25 o  308.259   20.597   76.449   9.6623   81.326   12.778   69.938   14.766  312.675   26.962  282.471   34.894 30.20447 44.09753 
1 1 1   15   36   26 o   75.114   33.350  -0.6777   7.6598  -2.8931   9.4785   3.4926   13.005   78.374   35.731  101.478   44.307 -23.10451 56.91983 
1 1 1   15   36   27 o   85.073   35.568   3.2653   7.7473   1.9811   9.7768   5.4324   12.701   88.758   38.591  103.852   44.560 -15.09470 58.94819 
1 1 1   15   36   28 o  128.039   33.960   14.949   6.7646   12.412   8.0506   21.044   12.477  115.820   38.683  142.467   48.154 -26.64679 61.76696 
1 1 1   15   36   29 o  156.669   29.319   21.499   6.7723   29.177   8.2441   5.5670   11.876  182.053   30.676  100.552   43.115 81.50128 52.91454 
1 1 1   15   36   30 o  201.072   31.405   35.950   9.3495   23.077   14.462   45.194   12.255  142.818   51.588  219.309   37.877 -76.49130 64.00033 
1 1 1   15   36   31 o  118.742   35.213   13.353   6.8594   16.784   8.7557   7.9020   11.037  129.756   40.062  102.441   42.608 27.31476 58.48487 
1 1 1   15   36   32 o   48.258   23.529  -8.7124   5.6431  -6.7817   8.4150 -10.2901   7.6070   65.379   31.049   56.821   27.618 8.557613 41.55444 
1 1 1   15   36   33 o  132.669   29.227   15.905   5.7749   19.009   8.6770   13.436   7.7374  137.131   39.310  116.581   37.876 20.55013 54.58799 
1 1 1   15   37    0 o  444.066   19.055  153.691   12.898  153.691   12.898  153.691   12.898  444.066   19.055  444.066   19.055 0.000000 0.000000 
1 1 1   15   37    1 o  157.285   28.053   20.495   6.5059   26.484   9.1638   14.409   9.2381  175.866   35.270  129.065   41.333 46.80070 54.33606 
1 1 1   15   37    2 o  228.839   20.090   41.523   6.9657   80.300   10.444   10.456   9.3486  317.990   21.586  115.117   41.494 202.8727 46.77293 
1 1 1   15   37    3 o  264.047   17.241   54.715   6.9298   65.909   10.083   44.696   9.5398  287.161   23.137  234.243   27.108 52.91861 35.63970 
1 1 1   15   37    4 o  186.657   20.074   27.727   5.6450   20.194   6.9311   42.569   9.7290  155.133   30.276  227.777   28.531 -72.64433 41.60150 
1 1 1   15   37    5 o  232.741   17.056   42.547   6.0338   36.752   7.5168   53.044   10.117  213.815   23.348  255.800   26.211 -41.98457 35.10135 
1 1 1   15   37    6 o   81.922   36.416  -1.5576   9.1599   0.0000   0.0000  -1.5576   9.1599  ?   ?    81.922   36.416 0.000000 36.41599 
1 1 1   15   37    7 o  334.215   21.900   88.874   11.141   0.0000   0.0000   88.874   11.141  ?   ?   334.215   21.900 0.000000 21.89951 
1 1 1   15   37    8 o  234.947   21.724   44.078   7.7239   38.635   11.709   48.272   10.277  211.469   37.549  242.641   28.198 -31.17177 46.95797 
1 1 1   15   37    9 o  140.964   26.665   16.482   5.5425   15.464   6.5815   18.964   10.278  134.387   32.379  145.171   43.116 -10.78459 53.92026 
1 1 1   15   37   10 o   99.162   31.407   8.1104   5.3453   7.2732   6.4287   9.9857   9.6216   97.261   34.478  113.464   41.907 -16.20226 54.26715 
1 1 1   15   37   11 o  447.878   11.473  155.118   7.8653  157.917   9.5891  149.362   13.750  450.817   13.897  434.483   20.676 16.33411 24.91187 
1 1 1   15   37   12 o  393.027   15.767  120.590   9.4853  108.892   13.513  131.951   13.317  367.985   24.125  407.240   21.440 -39.25516 32.27543 
1 1 1   15   37   13 o  329.988   17.685   85.712   8.9000   85.213   12.538   86.220   12.636  324.276   25.465  326.163   25.514 -1.886292 36.04748 
1 1 1   15   37   14 o  236.188   23.675   45.092   8.4436   56.366   12.408   35.369   11.523  258.979   31.981  200.078   39.029 58.90089 50.45807 
1 1 1   15   37   15 o  251.301   17.204   49.789   6.5778   49.685   7.8641   50.032   12.002  249.376   20.792  242.733   33.171 6.643204 39.14879 
1 1 1   15   37   16 o   79.785   31.693   3.4595   5.7824   2.3167   6.7003   6.7942   11.446   79.885   33.210  107.364   43.892 -27.47868 55.04045 
1 1 1   15   37   17 o  244.424   20.945   47.876   7.7604   47.876   7.7604   0.0000   0.0000  244.424   20.945  ?   ?  0.000000 20.94529 
1 1 1   15   37   18 o  312.331   17.670   77.112   8.4126   77.112   8.4126   0.0000   0.0000  312.331   17.670  ?   ?  0.000000 17.66965 
1 1 1   15   37   19 o  187.973   22.867   28.793   6.4436   28.144   7.4742   30.672   12.716  183.445   27.463  178.874   46.142 4.571411 53.69676 
1 1 1   15   37   20 o   95.273   33.869   7.2294   6.2081   4.8187   7.1774   14.390   12.370   88.923   35.313  127.098   47.403 -38.17442 59.11085 
1 1 1   15   37   21 o  100.717   35.103   8.4087   6.6445   4.6733   7.8437   17.901   12.504   90.409   36.567  136.782   48.126 -46.37301 60.44241 
1 1 1   15   37   22 o  217.425   25.961   39.260   8.4689   39.143   10.957   39.435   13.346  210.545   35.247  203.934   44.045 6.610657 56.41217 
1 1 1   15   37   23 o  220.094   26.331   40.406   8.6945   50.531   11.594   27.397   13.142  241.837   32.117  164.572   48.727 77.26561 58.35964 
1 1 1   15   37   24 o  253.912   19.373   51.797   7.4725   47.800   8.8962   61.373   13.771  240.502   24.509  263.335   35.034 -22.83350 42.75574 
1 1 1   15   37   25 o  100.937   35.379   8.7241   6.7538   11.461   8.0081   1.9821   12.569  112.560   38.576   96.656   42.826 15.90427 57.63833 
1 1 1   15   37   26 o  250.950   18.891   50.741   7.2030   61.516   8.8516   29.618   12.393  274.677   21.218  170.242   46.325 104.4357 50.95316 
1 1 1   15   37   27 o  166.481   27.646   23.930   6.7978   17.286   8.2182   38.324   12.096  134.322   38.173  199.277   41.025 -64.95520 56.03761 
1 1 1   15   37   28 o   83.293   35.845   2.4987   8.2629   6.9250   13.495  -0.1557   10.451  105.277   45.556   84.822   38.208 20.45450 59.45769 
1 1 1   15   37   29 o   83.693   36.097   2.6369   8.4166   24.828   14.266  -9.2102   10.424  146.276   51.411   70.661   33.833 75.61433 61.54496 
1 1 1   15   37   30 o  106.999   35.070   10.756   6.6279   12.275   8.4228   8.2860   10.741  112.325   39.502  102.169   42.226 10.15599 57.82201 
1 1 1   15   37   31 o   57.858   27.281  -4.9295   6.2804  -9.3246   7.8209   3.0512   10.539   58.948   28.497   89.634   39.490 -30.68663 48.69807 
1 1 1   15   38    0 o   86.803   47.465   9.0850   9.0020   9.0850   9.0020   9.0850   9.0020   86.803   47.465   86.803   47.465 0.000000 0.000000 
1 1 1   15   38    1 o  202.001   22.100   32.772   6.7217   32.065   9.4216   33.505   9.5926  194.549   32.806  199.062   32.613 -4.513504 46.25865 
1 1 1   15   38    2 o   80.959   32.692   3.1056   6.2585   5.3477   8.5731   0.5476   9.1575   96.433   38.500   86.119   37.396 10.31439 53.67241 
1 1 1   15   38    3 o  324.747   15.181   82.195   7.5458   76.535   10.444   88.375   10.914  309.508   22.194  333.097   21.521 -23.58966 30.91471 
1 1 1   15   38    4 o  260.336   19.717   53.764   7.7986   61.646   11.648   47.359   10.499  274.045   28.169  239.252   29.281 34.79312 40.63127 
1 1 1   15   38    5 o   57.157   27.296  -7.9835   6.6914 -13.0068   9.8583  -3.6922   9.1118   66.797   32.218   77.153   35.120 -10.35606 47.65898 
1 1 1   15   38    6 o  218.942   17.904   37.878   5.9476   37.280   7.3100   39.049   10.230  215.260   22.520  215.282   32.021 -0.2215576E-01 39.14690 
1 1 1   15   38    7 o  106.363   34.690   9.4527   6.4882   5.7674   8.4372   14.786   10.150   97.046   38.367  129.518   43.433 -32.47230 57.95198 
1 1 1   15   38    8 o   69.989   30.717  -0.6131   6.3220   5.6121   8.3245  -9.0963   9.7177   96.145   38.078   71.076   33.642 25.06837 50.81048 
1 1 1   15   38    9 o  289.135   17.297   65.833   7.6196   59.481   9.7319   75.895   12.249  271.476   23.657  304.928   26.507 -33.45224 35.52874 
1 1 1   15   38   10 o  222.647   17.644   39.188   5.9637   41.178   7.0210   34.032   11.300  227.058   20.420  195.841   39.067 31.21732 44.08218 
1 1 1   15   38   11 o  305.791   14.092   72.825   6.5957   66.941   7.7297   88.582   12.649  291.376   17.411  330.217   25.217 -38.84045 30.64392 
1 1 1   15   38   12 o  463.483   11.323  166.314   8.0330  161.414   9.4475  179.102   15.262  455.474   13.551  474.348   21.021 -18.87427 25.01037 
1 1 1   15   38   13 o  275.712   20.673   60.787   8.6606   55.133   12.141   66.643   12.357  255.284   31.759  283.146   28.919 -27.86186 42.95253 
1 1 1   15   38   14 o  136.053   36.947   16.576   7.8928   5.5227   10.515   30.842   11.946  101.263   41.809  182.008   43.476 -80.74463 60.31760 
1 1 1   15   38   15 o  154.268   31.140   20.498   7.0997   20.498   7.0997   0.0000   0.0000  154.268   31.140  ?   ?  0.000000 31.14046 
1 1 1   15   38   16 o  101.992   40.516   6.9947   9.4507   6.9947   9.4507   0.0000   0.0000  101.992   40.516  ?   ?  0.000000 40.51579 
1 1 1   15   38   17 o  111.868   37.036   10.912   7.3849   5.8465   9.4915   18.682   11.756   98.701   40.117  139.773   46.744 -41.07181 61.59818 
1 1 1   15   38   18 o  253.003   21.458   51.690   8.2312   40.291   10.562   69.326   13.137  215.665   33.048  286.068   30.470 -70.40263 44.95134 
1 1 1   15   38   19 o   59.812   28.531  -7.9169   7.2674  -5.0390   9.3144 -12.3951   11.619   74.339   34.444   73.816   35.442 0.5230331 49.42202 
1 1 1   15   38   20 o  115.573   33.611   11.879   6.3025   3.9280   7.3035   35.068   12.473   85.973   35.095  191.917   43.469 -105.9437 55.86742 
1 1 1   15   38   21 o  166.595   27.198   23.521   6.6959   21.780   7.9544   27.755   12.404  155.939   34.262  166.643   46.737 -10.70415 57.95021 
1 1 1   15   38   22 o  180.879   24.299   27.237   6.5573   32.594   7.8978   15.350   11.765  196.344   26.994  126.618   46.409 69.72612 53.68819 
1 1 1   15   38   23 o  241.981   19.356   47.268   7.1090   50.067   8.6377   41.392   12.516  246.373   23.178  209.286   40.535 37.08754 46.69317 
1 1 1   15   38   24 o  138.762   31.151   17.210   6.4540   23.014   8.0159   6.5119   10.882  159.053   33.959  100.674   42.128 58.37852 54.11073 
1 1 1   15   38   25 o  245.385   19.278   48.820   7.1823   49.931   9.0323   46.907   11.845  244.081   24.508  226.607   35.299 17.47363 42.97226 
1 1 1   15   38   26 o  117.101   39.451   13.246   8.3744   16.367   13.420   11.256   10.717  125.556   48.755  111.165   43.457 14.39158 65.31128 
1 1 1   15   38   27 o  113.249   39.682   12.384   8.4963   35.877   14.011  -1.2790   10.685  180.263   49.341   83.004   37.879 97.25905 62.20431 
1 1 1   15   38   28 o  175.396   25.730   26.483   6.7023   35.373   8.5565   12.367   10.781  200.534   28.695  112.878   43.737 87.65577 52.30949 
1 1 1   15   39    0 o  168.747   40.700   26.456   9.1144   26.456   9.1144   26.456   9.1144  168.747   40.700  168.747   40.700 0.000000 0.000000 
1 1 1   15   39    1 o  297.117   17.527   69.639   7.9354   50.456   10.858   91.631   11.626  246.079   29.411  337.714   22.622 -91.63452 37.10427 
1 1 1   15   39    2 o  334.330   23.047   89.984   11.722   0.0000   0.0000   89.984   11.722  ?   ?   334.330   23.047 0.000000 23.04653 
1 1 1   15   39    3 o   97.448   39.698   5.1820   9.3211   0.0000   0.0000   5.1820   9.3211  ?   ?    97.448   39.698 0.000000 39.69767 
1 1 1   15   39    4 o   77.993   30.951   3.2950   5.5103   0.0630   6.6534   10.353   9.8320   73.220   31.835  113.701   42.290 -40.48109 52.93297 
1 1 1   15   39    5 o  154.990   24.811   19.818   5.6874   14.393   6.6618   34.399   10.922  128.302   33.545  197.398   37.521 -69.09543 50.32935 
1 1 1   15   39    6 o  203.896   20.056   33.283   6.1783   22.640   7.3684   58.484   11.338  162.952   30.668  265.547   28.332 -102.5953 41.75176 
1 1 1   15   39    7 o  128.618   34.116   14.542   6.8265   18.870   9.0576   8.8497   10.386  144.006   39.777  109.909   42.832 34.09709 58.45359 
1 1 1   15   39    8 o  187.944   23.947   28.888   6.7324   36.639   8.8141   18.033   10.431  209.544   28.197  139.311   43.846 70.23322 52.12968 
1 1 1   15   39    9 o  339.531   15.895   90.389   8.2606   94.210   10.996   85.438   12.516  343.000   21.045  323.263   25.503 19.73682 33.06500 
1 1 1   15   39   10 o  283.087   18.120   63.542   7.8103   68.366   9.9978   55.990   12.511  290.896   22.632  255.966   32.679 34.93031 39.75061 
1 1 1   15   39   11 o  163.942   27.799   22.620   6.7265   20.197   8.4017   26.945   11.226  149.937   36.867  169.483   43.160 -19.54626 56.76196 
1 1 1   15   39   12 o  229.448   27.922   43.952   9.6042   43.952   9.6042   0.0000   0.0000  229.448   27.922  ?   ?  0.000000 27.92241 
1 1 1   15   39   14 o  393.342   17.143  122.084   10.321  106.257   14.105  140.327   15.143  359.446   25.809  415.263   23.926 -55.81677 35.19324 
1 1 1   15   39   15 o   89.369   36.730   4.1166   8.0686   19.463   11.202 -12.4327   11.632  142.039   45.517   73.866   35.466 68.17229 57.70259 
1 1 1   15   39   16 o  138.222   29.729   16.545   6.1030   11.750   6.9663   32.376   12.657  114.760   35.785  182.633   45.458 -67.87332 57.85296 
1 1 1   15   39   17 o   65.290   29.240  -1.4438   6.0235  -4.0386   7.0111   5.8700   11.771   64.935   30.015  103.390   43.569 -38.45541 52.90663 
1 1 1   15   39   18 o  123.349   32.621   13.599   6.2534   14.653   7.4630   11.115   11.458  126.336   36.527  115.017   44.942 11.31841 57.91327 
1 1 1   15   39   19 o  148.242   28.696   19.019   6.2760   23.397   7.5307   9.0634   11.355  163.149   31.295  108.948   44.021 54.20113 54.01165 
1 1 1   15   39   20 o   75.926   31.764   2.3122   6.1847   1.1845   7.5606   4.5929   10.752   78.418   34.016   96.596   41.211 -18.17867 53.43620 
1 1 1   15   39   21 o  237.814   18.989   45.678   6.8545   55.218   8.8622   31.472   10.814  258.867   22.593  181.474   40.009 77.39290 45.94701 
1 1 1   15   39   22 o  209.149   21.644   36.028   6.8286   34.443   8.5529   38.813   11.341  199.209   28.893  203.676   37.768 -4.466797 47.55273 
1 1 1   15   39   23 o  161.590   27.531   22.654   6.5652   24.937   8.3490   18.955   10.627  164.654   34.244  135.483   44.407 29.17093 56.07697 
1 1 1   15   39   24 o  141.941   36.751   19.294   8.0472   13.412   12.167   23.868   10.729  117.391   46.181  151.817   43.767 -34.42605 63.62553 
1 1 1   15   39   25 o  108.745   38.612   11.186   8.0661   7.6921   12.452   13.713   10.588  103.866   44.332  117.214   43.828 -13.34754 62.33941 
1 1 1   15   39   26 o   65.000   29.563  -1.8421   6.4395   8.0650   8.0779 -19.1149   10.666   97.608   37.847   61.176   30.312 36.43142 48.48942 
1 1 1   15   40    1 o   85.901   37.961  -0.1261   9.8123  -0.1261   9.8123   0.0000   0.0000   85.901   37.961  ?   ?  0.000000 37.96099 
1 1 1   15   40    2 o  136.379   32.810   16.313   6.7655   14.164   9.0062   19.096   10.250  125.164   40.874  142.667   43.213 -17.50240 59.48147 
1 1 1   15   40    3 o  108.641   31.394   10.219   5.5143   6.9312   6.5452   18.258   10.236   94.866   34.639  139.601   43.352 -44.73544 55.49101 
1 1 1   15   40    4 o  153.085   25.820   19.559   5.8349   16.764   6.9988   25.929   10.566  137.907   33.490  167.140   41.494 -29.23358 53.32317 
1 1 1   15   40    5 o   58.724   26.774  -2.5971   5.3229  -0.3794   6.2290  -8.6003   10.248   69.507   30.498   73.307   34.652 -3.799927 46.16120 
1 1 1   15   40    6 o   98.915   32.354   8.2416   5.6423   10.859   6.7395   2.1082   10.317  111.441   35.263   92.193   39.863 19.24832 53.22144 
1 1 1   15   40    7 o   90.632   32.618   6.3623   5.7745   5.7695   6.9040   7.7429   10.535   91.263   35.100  106.242   42.587 -14.97855 55.18712 
1 1 1   15   40    8 o  266.226   19.244   56.611   7.7892   56.611   7.7892   0.0000   0.0000  266.226   19.244  ?   ?  0.000000 19.24443 
1 1 1   15   40    9 o  131.871   33.681   15.447   6.8226   15.447   6.8226   0.0000   0.0000  131.871   33.681  ?   ?  0.000000 33.68095 
1 1 1   15   40   10 o   95.594   38.194   5.8907   8.4441   5.8907   8.4441   0.0000   0.0000   95.594   38.194  ?   ?  0.000000 38.19417 
1 1 1   15   40   11 o  209.877   24.099   36.257   7.6012   44.536   9.8267   23.924   11.994  229.755   28.559  155.634   46.657 74.12070 54.70327 
1 1 1   15   40   12 f  160.509   30.543   22.329   7.2296   16.160   9.0826   32.997   11.944  131.290   40.848  186.428   42.765 -55.13783 59.13849 
1 1 1   15   40   13 o  178.529   30.869   27.642   8.1302   30.456   11.404   24.734   11.594  178.753   42.333  158.143   45.471 20.60970 62.12616 
1 1 1   15   40   14 o  166.697   32.020   24.459   7.8731   21.195   10.318   29.007   12.180  147.534   43.035  170.791   45.697 -23.25635 62.77084 
1 1 1   15   40   15 o  259.244   21.672   54.789   8.5209   51.434   11.409   59.020   12.814  243.330   31.363  259.192   33.050 -15.86163 45.56250 
1 1 1   15   40   16 o  301.279   19.573   73.201   8.9770   76.008   12.722   70.418   12.669  299.156   28.114  286.704   29.279 12.45166 40.59189 
1 1 1   15   40   17 o  168.188   25.998   24.015   6.4769   25.912   7.9242   20.197   11.242  171.169   31.403  140.679   45.653 30.49022 55.41032 
1 1 1   15   40   18 o   90.111   33.750   6.3846   6.2835   8.9047   7.7186   1.4334   10.819  101.828   37.549   89.619   39.720 12.20824 54.65918 
1 1 1   15   40   19 o  138.713   30.545   17.190   6.3097   21.680   7.9959   9.7786   10.272  153.083   34.900  107.389   42.373 45.69366 54.89529 
1 1 1   15   40   20 o  117.070   33.731   12.698   6.3742   10.658   8.1084   16.000   10.313  107.741   38.664  125.853   43.740 -18.11273 58.37922 
1 1 1   15   40   21 o   87.576   32.920   6.0788   5.9888   8.3778   7.4579   1.9049   10.049   98.638   36.803   87.251   38.494 11.38718 53.25642 
1 1 1   15   40   22 o  114.685   37.576   12.641   7.6093   20.480   11.435   6.4112   10.194  137.972   46.102   97.245   40.740 40.72681 61.52320 
1 1 1   15   41    0 o  196.170   36.118   34.051   9.7613   34.051   9.7613   34.051   9.7613  196.170   36.118  196.170   36.118 0.000000 0.000000 
1 1 1   15   41    1 o  192.126   23.697   30.414   6.8210   30.729   9.2668   30.042   10.077  186.795   33.649  181.883   37.443 4.912170 50.34133 
1 1 1   15   41    2 o  317.902   22.483   82.154   10.869   82.154   10.869   0.0000   0.0000  317.902   22.483  ?   ?  0.000000 22.48280 
1 1 1   15   41    3 o  201.992   25.171   33.894   7.6134   33.894   7.6134   0.0000   0.0000  201.992   25.171  ?   ?  0.000000 25.17087 
1 1 1   15   41    4 o  223.868   23.148   41.087   7.8172   41.087   7.8172   0.0000   0.0000  223.868   23.148  ?   ?  0.000000 23.14768 
1 1 1   15   41    5 f  113.898   35.740   11.646   6.9365   11.646   6.9365   0.0000   0.0000  113.898   35.740  ?   ?  0.000000 35.73973 
1 1 1   15   41    6 o   80.712   33.628   2.7780   6.8918   2.7780   6.8918   0.0000   0.0000   80.712   33.628  ?   ?  0.000000 33.62843 
1 1 1   15   41    7 o  179.219   23.400   26.552   6.2657   21.556   7.4701   38.409   11.508  156.124   32.324  204.906   38.093 -48.78140 49.95964 
1 1 1   15   41    8 o  108.749   32.366   10.499   5.7872   7.0981   7.0041   17.816   10.274   95.214   35.638  135.269   43.617 -40.05531 56.32540 
1 1 1   15   41    9 o  208.626   19.489   35.154   6.1512   36.784   7.2734   31.058   11.527  211.438   22.837  179.330   42.622 32.10748 48.35467 
1 1 1   15   41   10 o  185.361   21.817   28.204   6.0715   33.496   7.2406   15.670   11.143  200.796   24.036  127.061   45.355 73.73507 51.33030 
1 1 1   15   41   11 o  181.660   23.595   27.441   6.4056   24.144   7.5566   35.858   12.075  165.692   30.933  192.939   42.073 -27.24608 52.22093 
1 1 1   15   41   12 o  178.443   29.087   27.583   7.6708   23.896   9.9629   32.950   12.021  156.945   41.017  182.822   43.574 -25.87625 59.84225 
1 1 1   15   41   13 o  401.178   15.596  127.291   9.5766  131.197   12.613  121.974   14.715  402.083   20.564  382.141   25.301 19.94214 32.60350 
1 1 1   15   41   14 o  197.666   28.189   33.668   8.2871   35.519   11.403   31.595   12.064  192.891   39.937  176.941   44.569 15.94984 59.84426 
1 1 1   15   41   15 o   75.955   33.821  -0.2558   7.9343   4.6945   10.867  -5.9067   11.611   96.038   41.214   79.950   37.508 16.08805 55.72587 
1 1 1   15   41   16 o  224.988   25.017   42.695   8.4691   37.044   11.766   48.771   12.200  195.464   40.653  230.309   35.768 -34.84543 54.14806 
1 1 1   15   41   17 o  193.517   28.306   32.558   8.1364   27.491   11.543   37.562   11.471  162.701   44.889  197.863   39.261 -35.16203 59.63574 
1 1 1   15   41   18 o   79.741   32.437   3.7655   6.2119  -1.1775   7.5016   14.550   11.081   71.691   32.325  120.339   44.868 -48.64769 55.29956 
1 1 1   15   41   19 o  201.871   22.032   33.891   6.6972   34.953   8.3024   31.915   11.332  200.546   27.794  178.035   42.222 22.51053 50.54937 
1 1 1   15   42    2 o  125.216   43.480   15.247   10.190   0.0000   0.0000   15.247   10.190  ?   ?   125.216   43.480 0.000000 43.48028 
1 1 1   15   42    3 f  166.590   31.914   24.661   7.8414   26.202   11.963   23.501   10.383  159.724   46.265  154.256   42.579 5.467590 62.87631 
1 1 1   15   42    4 o  209.508   27.543   37.460   8.6183   37.872   12.234   37.053   12.143  198.350   41.622  195.998   41.755 2.352158 58.95689 
1 1 1   15   42    5 o   98.402   37.176   7.8898   7.6588   7.8898   7.6588   0.0000   0.0000   98.402   37.176  ?   ?  0.000000 37.17582 
1 1 1   15   42    6 o  117.004   36.482   12.739   7.2403   12.739   7.2403   0.0000   0.0000  117.004   36.482  ?   ?  0.000000 36.48151 
1 1 1   15   42    7 o   92.342   33.019   7.1002   5.9085   7.0110   7.2415   7.2780   10.219   94.397   36.032  101.123   41.423 -6.726921 54.90128 
1 1 1   15   42    8 o  120.460   31.959   13.157   5.9897   13.442   7.3704   12.602   10.279  119.613   36.728  115.943   43.217 3.669991 56.71569 
1 1 1   15   42    9 o   80.851   31.946   4.2814   5.8467   4.4577   7.1890   3.9369   10.048   85.628   34.871   92.393   39.639 -6.765602 52.79401 
1 1 1   15   42   10 o  234.643   18.649   44.503   6.6427   53.466   8.0868   25.910   11.647  255.653   20.847  157.846   45.630 97.80710 50.16699 
1 1 1   15   42   11 o  189.365   22.620   29.833   6.4266   27.263   7.6162   36.188   11.976  176.424   29.227  191.770   41.965 -15.34558 51.13950 
1 1 1   15   42   12 o   78.744   31.732   3.7368   5.8829   2.2198   6.9376   7.6196   11.099   77.880   33.161  102.591   42.704 -24.71134 54.06780 
1 1 1   15   42   13 o  189.281   27.114   30.887   7.6309   29.110   9.6909   33.788   12.380  175.302   37.265  181.223   44.868 -5.921661 58.32459 
1 1 1   15   42   14 o  124.867   46.030   16.122   11.597   0.0000   0.0000   16.122   11.597  ?   ?   124.867   46.030 0.000000 46.02955 
1 1 1   15   43    0 o   84.308   48.114   9.2676   9.7469   9.2676   9.7469   9.2676   9.7469   84.308   48.114   84.308   48.114 0.000000 0.000000 
1 1 1   15   43    1 o  101.925   35.299   9.3148   6.7137   22.353   9.7653  -2.3708   9.2451  149.842   41.266   76.698   35.091 73.14407 54.16859 
1 1 1   15   43    2 o   66.817   29.190   0.2589   5.6515   1.5869   6.7219  -2.9439   10.439   75.331   32.373   80.042   36.865 -4.710762 49.06128 
1 1 1   15   43    3 o   71.635   30.212   1.8516   5.6672  -2.6413   6.7816   12.254   10.319   65.487   29.995  114.040   43.135 -48.55296 52.53918 
1 1 1   15   43    4 o  111.264   31.677   11.272   5.6538   8.3967   6.8076   17.666   10.150   98.218   35.408  131.626   43.412 -33.40829 56.02063 
1 1 1   15   43    5 o   54.665   25.927  -5.5576   5.8309 -10.0095   7.0229   4.3218   10.462   54.551   26.519   93.711   40.331 -39.16029 48.26868 
1 1 1   16    0    1 o  539.041   10.235  222.678   8.4375  222.678   8.4375  222.678   8.4375  539.041   10.235  539.041   10.235 0.000000 0.000000 
1 1 1   16    0    2 o  165.108   11.913   21.195   2.9747   21.195   2.9747   21.195   2.9747  165.108   11.913  165.108   11.913 0.000000 0.000000 
1 1 1   16    0    3 o  220.347   10.844   37.439   3.6370   37.439   3.6370   37.439   3.6370  220.347   10.844  220.347   10.844 0.000000 0.000000 
1 1 1   16    0    4 f  195.589   12.008   29.618   3.5640   29.618   3.5640   29.618   3.5640  195.589   12.008  195.589   12.008 0.000000 0.000000 
1 1 1   16    0    5 o   43.959   21.073   2.1739   1.6337   2.1739   1.6337   2.1739   1.6337   43.959   21.073   43.959   21.073 0.000000 0.000000 
1 1 1   16    0    6 o  533.877   7.3797  218.290   6.0278  218.290   6.0278  218.290   6.0278  533.877   7.3797  533.877   7.3797 0.000000 0.000000 
1 1 1   16    0    8 o  1001.82   10.236  768.557   15.692  768.557   15.692  768.557   15.692  1001.82   10.236  1001.82   10.236 0.000000 0.000000 
1 1 1   16    0    9 o  1544.23   14.330  1826.53   33.864  1826.53   33.864  1826.53   33.864  1544.23   14.330  1544.23   14.330 0.000000 0.000000 
1 1 1   16    0   10 o  1439.07   13.526  1586.15   29.788  1586.15   29.788  1586.15   29.788  1439.07   13.526  1439.07   13.526 0.000000 0.000000 
1 1 1   16    0   11 o  1941.17   14.339  2885.99   42.599  2885.99   42.599  2885.99   42.599  1941.17   14.339  1941.17   14.339 0.000000 0.000000 
1 1 1   16    0   12 o  160.013   9.5771   19.810   2.3264   19.810   2.3264   19.810   2.3264  160.013   9.5771  160.013   9.5771 0.000000 0.000000 
1 1 1   16    0   13 o  845.653   7.7624  547.536   10.046  547.536   10.046  547.536   10.046  845.653   7.7624  845.653   7.7624 0.000000 0.000000 
1 1 1   16    0   14 o   50.611   21.744   2.7955   1.7261   2.7955   1.7261   2.7955   1.7261   50.611   21.744   50.611   21.744 0.000000 0.000000 
1 1 1   16    0   15 o  467.950   6.4604  167.704   4.6253  167.704   4.6253  167.704   4.6253  467.950   6.4604  467.950   6.4604 0.000000 0.000000 
1 1 1   16    0   16 o  1027.44   7.6284  808.185   11.995  808.185   11.995  808.185   11.995  1027.44   7.6284  1027.44   7.6284 0.000000 0.000000 
1 1 1   16    0   17 o   83.974   19.515   6.1999   2.1815   6.1999   2.1815   6.1999   2.1815   83.974   19.515   83.974   19.515 0.000000 0.000000 
1 1 1   16    0   18 o   46.016   26.297   2.0744   2.9168   2.0744   2.9168   2.0744   2.9168   46.016   26.297   46.016   26.297 0.000000 0.000000 
1 1 1   16    0   19 o  365.012   7.7612  102.127   4.3318  102.127   4.3318  102.127   4.3318  365.012   7.7612  365.012   7.7612 0.000000 0.000000 
1 1 1   16    0   20 o  564.784   8.8707  244.378   7.6643  244.378   7.6643  244.378   7.6643  564.784   8.8707  564.784   8.8707 0.000000 0.000000 
1 1 1   16    0   21 o  748.012   7.8926  428.465   9.0342  428.465   9.0342  428.465   9.0342  748.012   7.8926  748.012   7.8926 0.000000 0.000000 
1 1 1   16    0   22 o  615.534   6.6756  290.123   6.2878  290.123   6.2878  290.123   6.2878  615.534   6.6756  615.534   6.6756 0.000000 0.000000 
1 1 1   16    0   23 f  866.888   7.3964  575.401   9.8125  575.401   9.8125  575.401   9.8125  866.888   7.3964  866.888   7.3964 0.000000 0.000000 
1 1 1   16    0   24 o  659.265   7.0313  332.824   7.0934  332.824   7.0934  332.824   7.0934  659.265   7.0313  659.265   7.0313 0.000000 0.000000 
1 1 1   16    0   25 o   44.369   26.941   1.3768   3.4048   1.3768   3.4048   1.3768   3.4048   44.369   26.941   44.369   26.941 0.000000 0.000000 
1 1 1   16    0   26 o  229.465   11.322   40.620   3.9545   40.620   3.9545   40.620   3.9545  229.465   11.322  229.465   11.322 0.000000 0.000000 
1 1 1   16    0   27 o  556.192   10.422  237.159   8.8658  237.159   8.8658  237.159   8.8658  556.192   10.422  556.192   10.422 0.000000 0.000000 
1 1 1   16    0   28 o  683.392   8.5088  357.764   8.8973  357.764   8.8973  357.764   8.8973  683.392   8.5088  683.392   8.5088 0.000000 0.000000 
1 1 1   16    0   29 o  105.189   27.215   10.029   3.7868   10.029   3.7868   10.029   3.7868  105.189   27.215  105.189   27.215 0.000000 0.000000 
1 1 1   16    0   30 o  256.384   11.267   50.652   4.4022   50.652   4.4022   50.652   4.4022  256.384   11.267  256.384   11.267 0.000000 0.000000 
1 1 1   16    0   31 f  286.312   10.293   63.043   4.4977   63.043   4.4977   63.043   4.4977  286.312   10.293  286.312   10.293 0.000000 0.000000 
1 1 1   16    0   32 o  321.054   9.4937   79.168   4.6561   79.168   4.6561   79.168   4.6561  321.054   9.4937  321.054   9.4937 0.000000 0.000000 
1 1 1   16    0   34 o   64.585   31.522   4.7532   3.6764   4.7532   3.6764   4.7532   3.6764   64.585   31.522   64.585   31.522 0.000000 0.000000 
1 1 1   16    0   35 f  270.442   10.483   56.316   4.3246   56.316   4.3246   56.316   4.3246  270.442   10.483  270.442   10.483 0.000000 0.000000 
1 1 1   16    0   36 o  246.233   11.570   46.808   4.3386   46.808   4.3386   46.808   4.3386  246.233   11.570  246.233   11.570 0.000000 0.000000 
1 1 1   16    0   37 o  375.348   9.1725  108.175   5.2626  108.175   5.2626  108.175   5.2626  375.348   9.1725  375.348   9.1725 0.000000 0.000000 
1 1 1   16    0   38 o  513.631   8.0964  202.310   6.3617  202.310   6.3617  202.310   6.3617  513.631   8.0964  513.631   8.0964 0.000000 0.000000 
1 1 1   16    0   39 o  233.066   12.617   42.076   4.4708   42.076   4.4708   42.076   4.4708  233.066   12.617  233.066   12.617 0.000000 0.000000 
1 1 1   16    0   40 f   60.936   34.870   3.8085   5.1376   3.8085   5.1376   3.8085   5.1376   60.936   34.870   60.936   34.870 0.000000 0.000000 
1 1 1   16    0   41 o  211.400   14.486   34.862   4.6368   34.862   4.6368   34.862   4.6368  211.400   14.486  211.400   14.486 0.000000 0.000000 
1 1 1   16    0   42 o   30.786   21.703  -4.6642   4.0591  -4.6642   4.0591  -4.6642   4.0591   30.786   21.703   30.786   21.703 0.000000 0.000000 
1 1 1   16    0   43 o   92.818   32.890   8.8614   4.2519   8.8614   4.2519   8.8614   4.2519   92.818   32.890   92.818   32.890 0.000000 0.000000 
1 1 1   16    0   44 o  256.165   12.970   50.887   5.0558   50.887   5.0558   50.887   5.0558  256.165   12.970  256.165   12.970 0.000000 0.000000 
1 1 1   16    0   45 o  241.324   21.704   46.364   7.8678   46.364   7.8678   46.364   7.8678  241.324   21.704  241.324   21.704 0.000000 0.000000 
1 1 1   16    0   46 o  176.007   18.519   24.783   4.8626   24.783   4.8626   24.783   4.8626  176.007   18.519  176.007   18.519 0.000000 0.000000 
1 1 1   16    0   47 o  104.665   33.724   10.933   4.7705   10.933   4.7705   10.933   4.7705  104.665   33.724  104.665   33.724 0.000000 0.000000 
1 1 1   16    0   48 o  159.454   21.730   20.876   5.0249   20.876   5.0249   20.876   5.0249  159.454   21.730  159.454   21.730 0.000000 0.000000 
1 1 1   16    0   49 f   39.888   26.847  -1.7333   4.6920  -1.7333   4.6920  -1.7333   4.6920   39.888   26.847   39.888   26.847 0.000000 0.000000 
1 1 1   16    0   50 o  162.387   21.844   21.684   5.1533   21.684   5.1533   21.684   5.1533  162.387   21.844  162.387   21.844 0.000000 0.000000 
1 1 1   16    0   51 o   65.135   36.846   4.8041   5.6500   4.8041   5.6500   4.8041   5.6500   65.135   36.846   65.135   36.846 0.000000 0.000000 
1 1 1   16    0   52 o  117.787   34.927   13.638   5.4777   13.638   5.4777   13.638   5.4777  117.787   34.927  117.787   34.927 0.000000 0.000000 
1 1 1   16    0   53 o   86.732   39.440   9.0274   5.6694   9.0274   5.6694   9.0274   5.6694   86.732   39.440   86.732   39.440 0.000000 0.000000 
1 1 1   16    0   54 o  145.915   26.935   18.540   5.4123   18.540   5.4123   18.540   5.4123  145.915   26.935  145.915   26.935 0.000000 0.000000 
1 1 1   16    0   55 o  224.651   16.429   40.034   5.5797   40.034   5.5797   40.034   5.5797  224.651   16.429  224.651   16.429 0.000000 0.000000 
1 1 1   16    0   56 o   95.840   41.855   11.205   6.3855   11.205   6.3855   11.205   6.3855   95.840   41.855   95.840   41.855 0.000000 0.000000 
1 1 1   16    0   57 o   64.284   39.664   4.1464   7.6505   4.1464   7.6505   4.1464   7.6505   64.284   39.664   64.284   39.664 0.000000 0.000000 
1 1 1   16    0   58 o   29.477   21.431 -10.8578   5.4654 -10.8578   5.4654 -10.8578   5.4654   29.477   21.431   29.477   21.431 0.000000 0.000000 
1 1 1   16    0   59 o   36.645   25.161  -2.3946   4.5676  -2.3946   4.5676  -2.3946   4.5676   36.645   25.161   36.645   25.161 0.000000 0.000000 
1 1 1   16    1    0 o  436.366   9.5637  145.974   6.3808  145.974   6.3808  145.974   6.3808  436.366   9.5637  436.366   9.5637 0.000000 0.000000 
1 1 1   16    1    1 o  374.829   9.2176  107.574   5.2884   0.0000   0.0000  107.574   5.2884  ?   ?   374.829   9.2176 0.000000 9.217641 
1 1 1   16    1    2 o  515.178   5.8593  203.159   4.6204  186.538   7.6926  212.539   5.7788  493.560   10.183  526.913   7.1652 -33.35260 12.45101 
1 1 1   16    1    3 o  145.051   9.6976   16.182   2.1406   18.098   3.0394   14.296   3.0155  153.150   13.091  135.798   14.744 17.35234 19.71752 
1 1 1   16    1    4 o  672.774   8.2276  346.529   8.4725  351.429   12.048  341.735   11.917  677.390   11.620  667.980   11.655 9.409424 16.45830 
1 1 1   16    1    5 o  1353.87   10.453  1403.63   21.662  1374.09   36.811  1419.28   26.791  1338.77   17.964  1361.19   12.859 -22.41736 22.09197 
1 1 1   16    1    6 o  1058.61   7.4823  857.921   12.124  869.415   17.431  847.149   16.875  1065.51   10.688  1051.79   10.482 13.72021 14.96973 
1 1 1   16    1    7 o   83.896   10.128   5.4681   1.2743   4.7029   1.9044   6.0884   1.7147   76.852   16.669   88.194   13.101 -11.34229 21.20086 
1 1 1   16    1    8 o  1153.45   8.0027  1018.57   14.129  1037.74   20.460  1001.08   19.535  1164.04   11.483  1143.31   11.163 20.72314 16.01462 
1 1 1   16    1    9 o  151.667   6.4316   17.608   1.4931   15.801   2.3611   18.813   1.9273  143.231   10.850  156.550   8.0708 -13.31894 13.52276 
1 1 1   16    1   10 o  848.146   5.8841  550.638   7.6387  554.673   12.171  548.016   9.8117  851.122   9.3427  846.070   7.5765 5.051208 12.02869 
1 1 1   16    1   11 o  859.313   5.9739  565.238   7.8573  575.839   12.639  558.561   10.031  867.196   9.5222  854.166   7.6726 13.03064 12.22871 
1 1 1   16    1   12 o  383.695   4.0108  112.682   2.3555  112.184   3.5557  113.071   3.1445  382.824   6.0681  384.343   5.3453 -1.518646 8.086651 
1 1 1   16    1   13 o  669.292   4.9015  342.874   5.0213  353.583   9.0470  338.106   6.0364  679.558   8.6978  664.600   5.9340 14.95752 10.52917 
1 1 1   16    1   14 o  597.763   5.1982  273.509   4.7561  275.036   7.7596  272.590   6.0193  599.346   8.4585  596.727   6.5902 2.619019 10.72275 
1 1 1   16    1   15 o  437.144   4.2732  146.265   2.8592  147.934   4.3008  144.943   3.8276  439.599   6.3917  435.143   5.7468 4.456177 8.595350 
1 1 1   16    1   16 o  823.484   4.7600  519.059   5.9997  515.616   8.4267  522.598   8.5443  820.687   6.7082  826.224   6.7563 -5.536499 9.520926 
1 1 1   16    1   17 o  1608.22   7.5239  1980.18   18.521  1965.34   25.963  1995.55   26.428  1601.87   10.589  1614.13   10.697 -12.25366 15.05147 
1 1 1   16    1   18 o  734.157   4.6429  412.558   5.2173  405.237   7.3186  420.124   7.4398  727.556   6.5719  740.800   6.5613 -13.24414 9.286557 
1 1 1   16    1   19 o  289.775   5.4202   64.278   2.4040   68.001   3.6495   61.423   3.1953  298.012   8.0006  283.240   7.3704 14.77161 10.87806 
1 1 1   16    1   20 o  361.568   5.2426  100.073   2.9014  103.567   4.6138   97.786   3.7316  367.769   8.1962  357.387   6.8216 10.38251 10.66354 
1 1 1   16    1   21 o  617.874   5.3661  292.243   5.0749  289.595   6.2247  297.492   8.7639  615.030   6.6123  623.253   9.1868 -8.223328 11.31901 
1 1 1   16    1   22 o  547.017   4.7157  229.048   3.9484  229.780   5.6297  228.339   5.5391  547.836   6.7138  546.117   6.6264 1.718262 9.433139 
1 1 1   16    1   23 o  142.093   10.292   15.548   2.2232   15.767   3.2321   15.351   3.0629  142.599   15.035  140.760   14.420 1.839218 20.83185 
1 1 1   16    1   24 o  684.394   4.9960  358.558   5.2335  354.886   7.3940  362.245   7.4086  680.795   7.0957  687.820   7.0371 -7.025330 9.993492 
1 1 1   16    1   25 f  458.144   5.2560  160.683   3.6857  160.742   5.3204  160.629   5.1108  458.155   7.5868  458.005   7.2904 0.1495972 10.52184 
1 1 1   16    1   26 o  550.718   5.5325  232.193   4.6636  227.293   6.1918  238.617   7.0897  544.800   7.4252  558.162   8.2985 -13.36206 11.13549 
1 1 1   16    1   27 o  740.962   6.0641  420.369   6.8775  421.087   8.5150  419.023   11.665  741.504   7.5025  739.455   10.306 2.048950 12.74764 
1 1 1   16    1   28 o  297.484   7.9263   67.787   3.6092   65.094   6.3778   69.055   4.3775  291.230   14.308  300.197   9.5268 -8.966522 17.18920 
1 1 1   16    1   29 o  394.474   5.9665  119.156   3.6025  120.285   5.2474  118.149   4.9546  396.218   8.6525  392.707   8.2427 3.511810 11.95024 
1 1 1   16    1   30 o  656.619   5.3155  330.125   5.3423  330.788   7.6164  329.484   7.4953  657.111   7.5726  655.824   7.4668 1.286499 10.63468 
1 1 1   16    1   31 o  366.409   6.3065  102.827   3.5369   99.849   5.0312  105.737   4.9731  360.914   9.1075  371.425   8.7476 -10.51099 12.62805 
1 1 1   16    1   32 o  265.526   7.6927   54.027   3.1265   53.489   4.5298   54.516   4.3207  264.012   11.209  266.574   10.589 -2.562622 15.42024 
1 1 1   16    1   33 o  107.124   22.833   9.2230   3.6293   2.1286   5.9449   13.438   4.5824   78.441   31.797  129.632   23.978 -51.19182 39.82403 
1 1 1   16    1   34 o  224.159   9.2197   38.542   3.1633   37.879   4.1983   39.413   4.8112  221.673   12.424  225.920   13.982 -4.247391 18.70401 
1 1 1   16    1   35 o  386.313   6.2416  114.345   3.6906  110.438   5.1998  118.312   5.2391  379.424   8.9535  392.742   8.7152 -13.31793 12.49484 
1 1 1   16    1   36 o  188.173   9.9976   27.263   2.8692   27.862   4.1004   26.689   4.0163  189.658   14.229  185.598   14.247 4.060120 20.13493 
1 1 1   16    1   37 o  374.910   6.3939  107.727   3.6691  108.528   5.2944  106.987   5.0895  376.011   9.1991  373.366   8.9058 2.644531 12.80373 
1 1 1   16    1   38 o  334.547   6.7181   85.806   3.4401   88.098   4.9660   83.691   4.7701  338.679   9.5796  330.116   9.4404 8.562347 13.44950 
1 1 1   16    1   39 o  222.718   10.095   38.127   3.4412   37.941   4.3847   38.426   5.5530  221.486   12.990  222.206   16.443 -0.7195282 20.95564 
1 1 1   16    1   40 o  258.315   9.0979   51.265   3.5972   55.531   5.9901   48.859   4.4987  267.630   14.679  251.866   11.669 15.76436 18.75201 
1 1 1   16    1   41 o  257.536   8.4548   50.947   3.3328   53.220   4.6642   48.575   4.7640  262.792   11.596  250.938   12.403 11.85390 16.97932 
1 1 1   16    1   42 o  227.628   9.4494   39.855   3.2923   40.591   4.6543   39.117   4.6578  228.771   13.350  224.505   13.619 4.266266 19.07062 
1 1 1   16    1   43 o  130.903   15.352   13.480   3.0175   14.267   4.2030   12.643   4.3349  133.134   21.346  124.510   23.610 8.624474 31.82935 
1 1 1   16    1   44 o  131.808   18.008   13.819   3.5380   25.770   5.9455   7.2678   4.4022  179.348   22.128   94.179   28.274 85.16984 35.90339 
1 1 1   16    1   45 o  163.764   15.669   21.065   3.8797   21.336   5.2731   20.744   5.7287  162.974   21.676  159.767   24.182 3.207291 32.47533 
1 1 1   16    1   46 o   90.602   24.132   6.7931   3.4064   10.013   4.6134   2.9328   5.0512  109.183   27.593   75.063   29.683 34.12019 40.52711 
1 1 1   16    1   47 o  147.546   15.499   17.162   3.4480   12.172   4.9602   21.828   4.7964  120.269   27.538  165.364   19.313 -45.09512 33.63562 
1 1 1   16    1   48 o   53.651   22.887   0.1971   3.3155  -2.3508   4.6207   2.9008   4.7600   55.010   25.029   73.244   28.862 -18.23397 38.20260 
1 1 1   16    1   49 o   61.733   24.273   1.9774   3.3600   2.4393   4.6007   1.4494   4.9187   70.422   28.173   68.347   28.437 2.075760 40.02983 
1 1 1   16    1   50 o   74.746   24.977   4.3800   3.3564   3.9981   4.7377   4.7649   4.7558   77.407   29.240   80.938   29.531 -3.530960 41.55776 
1 1 1   16    1   51 o   89.087   27.393   6.6457   4.0983   4.3997   5.4268   9.6268   6.2520   81.348   31.159  105.536   34.024 -24.18872 46.13593 
1 1 1   16    1   52 o   62.018   25.470   1.4623   3.8760   1.9712   5.2324   0.8434   5.7700   71.099   29.435   70.117   30.059 0.9816818 42.07090 
1 1 1   16    1   53 o  163.041   15.359   21.123   3.7877   26.173   5.3708   16.126   5.3424  179.529   19.879  137.396   26.362 42.13300 33.01701 
1 1 1   16    1   54 o  148.749   19.509   18.093   4.3347   19.845   8.1700   17.406   5.1138  145.196   36.734  143.526   24.135 1.670349 43.95272 
1 1 1   16    1   55 o   59.734   25.234   0.9505   3.9642  -4.7774   6.6263   4.1432   4.9471   60.372   28.327   76.920   29.676 -16.54747 41.02528 
1 1 1   16    1   56 o   56.749   25.547  -1.2204   4.6636  -2.3571   7.5216  -0.5106   5.9441   68.823   31.547   65.606   29.238 3.216850 43.01291 
1 1 1   16    1   57 o  176.635   14.845   25.042   3.9762   23.412   5.2424   27.251   6.1012  167.001   20.971  178.958   22.791 -11.95622 30.97146 
1 1 1   16    1   58 o   52.337   22.833   0.1011   3.4477   3.5528   4.8563  -3.4065   4.8955   72.242   28.929   52.019   24.388 20.22269 37.83754 
1 1 1   16    1   59 o   96.381   24.326   8.4128   3.5888   13.139   4.7550   2.1565   5.4707  119.362   26.695   68.810   29.377 50.55219 39.69452 
1 1 1   16    2    0 o  790.810   12.148  479.144   14.697  479.144   14.697  479.144   14.697  790.810   12.148  790.810   12.148 0.000000 0.000000 
1 1 1   16    2    1 o  199.089   7.3660   30.343   2.2446   29.515   3.3103   31.049   3.0540  196.003   11.080  201.366   9.9085 -5.363342 14.86387 
1 1 1   16    2    2 o  839.596   12.445  539.943   15.994   0.0000   0.0000  539.943   15.994  ?   ?   839.596   12.445 0.000000 12.44548 
1 1 1   16    2    3 o  174.121   7.4525   23.210   1.9862   22.400   3.2794   23.680   2.4961  170.537   12.653  175.612   9.3196 -5.074265 15.71509 
1 1 1   16    2    4 o  158.469   6.6770   19.224   1.6196   19.162   3.3229   19.243   1.8548  157.537   13.924  158.542   7.6432 -1.005081 15.88377 
1 1 1   16    2    5 o  764.889   6.9979  447.871   8.1929  453.544   14.673  445.300   9.8758  769.497   12.458  762.644   8.4602 6.852417 15.05881 
1 1 1   16    2    6 o  561.878   5.3023  241.652   4.5601  250.706   6.7631  234.104   6.1749  572.259   7.7211  552.995   7.2953 19.26373 10.62249 
1 1 1   16    2    7 o  860.529   5.8651  566.830   7.7253  602.511   13.025  547.467   9.5951  887.060   9.5931  845.656   7.4129 41.40381 12.12347 
1 1 1   16    2    8 o  887.346   9.5196  602.897   12.929  602.897   12.929   0.0000   0.0000  887.346   9.5196  ?   ?  0.000000 9.519587 
1 1 1   16    2    9 o  740.787   8.4810  420.147   9.6164   0.0000   0.0000  420.147   9.6164  ?   ?   740.787   8.4810 0.000000 8.481034 
1 1 1   16    2   10 o  1230.76   7.5677  1159.66   14.256  1187.82   23.188  1142.54   18.076  1245.30   12.165  1221.52   9.6681 23.77722 15.53896 
1 1 1   16    2   11 o  892.893   6.1128  610.284   8.3543  625.478   13.568  601.006   10.603  903.786   9.8078  886.019   7.8181 17.76709 12.54256 
1 1 1   16    2   12 o  1316.18   7.2921  1326.19   14.691  1351.88   21.152  1302.25   20.419  1328.65   10.401  1304.05   10.230 24.60266 14.58853 
1 1 1   16    2   13 o  941.354   5.7304  678.317   8.2567  679.893   11.720  676.763   11.634  942.352   8.1257  940.182   8.0841 2.169617 11.46207 
1 1 1   16    2   14 f  402.071   4.5025  123.737   2.7710  125.205   3.9617  122.331   3.8771  404.422   6.4000  399.755   6.3364 4.666107 9.006108 
1 1 1   16    2   15 o  806.557   5.9040  497.977   7.2888  505.120   16.377  496.212   8.1393  811.955   13.178  805.104   6.6049 6.850891 14.74018 
1 1 1   16    2   16 f  443.356   4.1804  150.451   2.8368  148.512   4.0574  152.305   3.9679  440.462   6.0182  446.055   5.8117 -5.592987 8.366304 
1 1 1   16    2   17 o  272.189   5.7708   56.713   2.4042   60.431   3.3310   52.670   3.4736  280.943   7.7462  262.268   8.6530 18.67477 11.61370 
1 1 1   16    2   18 o  741.841   4.9509  421.249   5.6216  421.817   8.6093  420.828   7.4224  742.251   7.5779  741.419   6.5405 0.8311768 10.01016 
1 1 1   16    2   19 o  210.212   6.1962   33.828   1.9937   33.488   2.9125   34.129   2.7348  209.116   9.0994  211.116   8.4632 -2.000137 12.42674 
1 1 1   16    2   20 o  247.253   6.4029   46.802   2.4232   48.002   3.9203   46.060   3.0826  250.339   10.231  245.259   8.2115 5.080383 13.11886 
1 1 1   16    2   21 o  509.079   5.3971  198.388   4.2055  195.240   5.2152  204.242   7.1111  504.988   6.7472  516.422   8.9963 -11.43375 11.24534 
1 1 1   16    2   22 o  142.108   10.468   15.554   2.2610   14.176   3.1397   17.039   3.2586  135.079   15.464  148.365   14.536 -13.28618 21.22346 
1 1 1   16    2   23 f  581.303   4.8128  258.666   4.2822  261.761   6.2173  255.873   5.9065  584.701   6.9471  578.098   6.6751 6.603760 9.634265 
1 1 1   16    2   24 o   59.147   20.513   2.4085   2.2677   4.1097   3.4121   1.0627   3.0349   75.326   25.183   56.473   22.779 18.85291 33.95727 
1 1 1   16    2   25 o  164.192   11.077   20.753   2.7674   23.068   3.8206   18.198   4.0140  172.806   14.581  152.969   17.456 19.83698 22.74485 
1 1 1   16    2   26 o   95.653   19.334   7.2846   2.7334   7.7865   3.7398   6.7089   4.0049   98.613   24.801   92.324   26.777 6.288994 36.49738 
1 1 1   16    2   27 o  440.334   5.8731  148.455   3.9584  149.153   5.4769  147.690   5.7275  441.283   8.1086  439.094   8.5220 2.188538 11.76323 
1 1 1   16    2   28 o  248.203   8.7414   47.197   3.3209   44.176   5.9438   48.569   4.0042  239.259   16.328  251.727   10.392 -12.46860 19.35449 
1 1 1   16    2   29 o  506.902   5.4077  196.737   4.1957  200.328   6.2182  193.735   5.6849  511.373   7.9443  502.921   7.3851 8.451965 10.84673 
1 1 1   16    2   30 f  537.884   5.4364  221.535   4.4758  227.056   6.6030  216.841   6.0877  544.387   7.9244  532.033   7.4756 12.35431 10.89402 
1 1 1   16    2   31 o  253.070   7.9177   49.074   3.0670   53.673   4.6016   45.399   4.1140  264.489   11.366  243.267   11.049 21.22240 15.85155 
1 1 1   16    2   32 o  277.870   8.3893   59.182   3.5681   58.285   6.6733   59.541   4.2224  274.754   15.937  278.628   9.9006 -3.873932 18.76162 
1 1 1   16    2   33 o  418.908   6.4178  134.434   4.1151  132.139   5.5344  137.273   6.1540  415.142   8.7097  423.056   9.5036 -7.914093 12.89097 
1 1 1   16    2   34 o  387.058   6.5352  114.787   3.8718  110.720   5.1827  119.922   5.8243  379.953   8.9115  395.357   9.6247 -15.40326 13.11678 
1 1 1   16    2   35 o  456.843   5.7656  159.883   4.0317  158.146   5.7627  161.549   5.6424  454.116   8.2907  459.003   8.0312 -4.887573 11.54281 
1 1 1   16    2   36 f  177.066   10.629   24.169   2.8674   25.925   4.3026   22.765   3.8460  182.689   15.534  171.232   14.820 11.45615 21.46986 
1 1 1   16    2   37 o  476.122   5.8372  173.702   4.2539  176.919   6.1827  170.811   5.8620  480.196   8.4119  471.875   8.1161 8.320801 11.68892 
1 1 1   16    2   38 o  186.503   10.283   26.811   2.9242   26.863   4.2224   26.763   4.0538  185.952   14.962  185.708   14.373 0.2438507 20.74708 
1 1 1   16    2   39 o   75.324   23.786   4.4012   3.0676   4.0292   3.9964   4.9348   4.7860   76.356   27.171   83.827   29.745 -7.471092 40.28690 
1 1 1   16    2   40 o   64.884   23.450   2.7909   2.9886   8.2808   5.1736   0.0415   3.6613  101.215   30.711   56.244   24.023 44.97128 38.99074 
1 1 1   16    2   41 o  251.143   8.7865   48.465   3.3776   52.843   5.2945   45.460   4.3860  261.242   13.285  242.844   11.800 18.39804 17.76828 
1 1 1   16    2   42 o  215.704   9.7099   35.800   3.2058   28.218   4.5417   43.329   4.5258  190.052   15.755  236.560   12.544 -46.50755 20.13871 
1 1 1   16    2   43 o   70.091   23.398   3.7093   2.9453   5.2807   4.2433   2.2484   4.0914   83.196   28.082   67.769   26.741 15.42735 38.77775 
1 1 1   16    2   44 o   97.225   24.464   7.8101   3.6376  -2.1385   7.7039   10.665   4.1266   74.154   33.149  113.767   24.428 -39.61308 41.17756 
1 1 1   16    2   45 o  208.747   12.611   33.848   4.0104   37.753   5.4433   29.211   5.9312  219.444   16.323  191.491   20.558 27.95282 26.24977 
1 1 1   16    2   46 o  255.921   10.111   50.520   3.9609   49.982   5.3639   51.166   5.8737  253.315   13.887  255.914   15.061 -2.599258 20.48653 
1 1 1   16    2   47 o  161.922   14.195   20.545   3.4825   18.887   4.9350   22.189   4.9151  152.829   21.707  166.618   19.651 -13.78867 29.28001 
1 1 1   16    2   48 o  190.967   12.221   28.386   3.5536   31.234   5.1903   25.873   4.8754  198.761   17.231  180.548   17.877 18.21375 24.82936 
1 1 1   16    2   49 o  157.424   14.702   19.509   3.5015   14.316   5.0499   24.317   4.8592  130.649   26.165  174.596   18.463 -43.94748 32.02318 
1 1 1   16    2   50 o  148.604   16.873   17.585   3.7698   18.084   4.9346   16.886   5.8423  148.628   22.386  141.044   28.049 7.584457 35.88702 
1 1 1   16    2   51 o  129.982   24.016   14.086   4.6021   16.793   5.6327   8.6521   7.9817  140.762   27.127  103.654   38.190 37.10873 46.84385 
1 1 1   16    2   52 o  202.847   15.383   32.530   4.7406   43.648   9.3158   28.645   5.5070  227.939   27.241  188.521   19.360 39.41833 33.41946 
1 1 1   16    2   53 o  225.353   12.948   39.823   4.4473   40.591   7.7078   39.440   5.4450  221.931   23.026  222.827   16.073 -0.8965759 28.08042 
1 1 1   16    2   54 o  160.163   16.967   20.632   4.0961   18.805   6.7309   21.707   5.1620  144.934   31.260  162.148   21.315 -17.21414 37.83545 
1 1 1   16    2   55 o   54.342   24.418  -1.1992   4.2373  -1.8943   7.6864  -0.8957   5.0788   70.957   32.282   60.363   26.955 10.59337 42.05622 
1 1 1   16    2   56 o   71.613   27.077   3.7045   4.0650  -2.2251   5.3729   11.642   6.2165   58.380   26.725  111.091   33.655 -52.71096 42.97505 
1 1 1   16    2   57 o   87.036   26.227   6.7413   3.7826   10.757   4.8988   0.8124   5.9526  108.031   29.012   68.398   29.917 39.63332 41.67422 
1 1 1   16    2   58 o   51.771   22.563   0.1132   3.3584  -2.0793   4.7264   2.3490   4.7728   53.986   24.843   67.400   28.025 -13.41380 37.45111 
1 1 1   16    2   59 o   48.917   22.172  -1.1078   3.5831   1.2855   5.3911  -3.0015   4.7955   65.837   28.641   51.869   24.260 13.96871 37.53502 
1 1 1   16    3    0 o  992.051   14.078  754.057   21.367  754.057   21.367  754.057   21.367  992.051   14.078  992.051   14.078 0.000000 0.000000 
1 1 1   16    3    1 o  368.663   6.6479  104.041   3.7513  101.551   5.4071  106.351   5.2088  364.176   9.7002  372.694   9.1310 -8.518097 13.32176 
1 1 1   16    3    2 o  688.094   7.9326  362.480   8.3548  353.217   11.811  371.758   11.820  679.123   11.362  696.731   11.083 -17.60797 15.87285 
1 1 1   16    3    3 o  668.205   10.681  341.923   10.924   0.0000   0.0000  341.923   10.924  ?   ?   668.205   10.681 0.000000 10.68088 
1 1 1   16    3    4 o  728.676   11.980  406.675   13.361  406.675   13.361   0.0000   0.0000  728.676   11.980  ?   ?  0.000000 11.97951 
1 1 1   16    3    5 o  920.437   7.7762  648.590   10.956  676.317   20.184  637.010   13.044  939.557   14.035  912.117   9.3432 27.44043 16.86078 
1 1 1   16    3    6 o  490.402   7.5326  184.111   5.6541   0.0000   0.0000  184.111   5.6541  ?   ?   490.402   7.5326 0.000000 7.532552 
1 1 1   16    3    7 o  549.799   5.5057  231.377   4.6332  226.978   6.4594  236.039   6.6495  544.503   7.7503  555.263   7.8239 -10.75970 11.01274 
1 1 1   16    3    8 o  318.598   7.6601   77.709   3.7355   0.0000   0.0000   77.709   3.7355  ?   ?   318.598   7.6601 0.000000 7.660099 
1 1 1   16    3    9 o  936.436   8.1499  671.364   11.682  679.576   14.408  655.611   19.955  942.057   9.9924  925.041   14.094 17.01624 17.27645 
1 1 1   16    3   10 o  316.190   4.8476   76.524   2.3461   89.891   4.1286   70.148   2.8511  342.659   7.8718  302.721   6.1532 39.93832 9.991359 
1 1 1   16    3   11 o  339.905   4.2641   88.430   2.2185   91.791   3.1100   84.949   3.1655  346.288   5.8676  333.127   6.2082 13.16061 8.542246 
1 1 1   16    3   12 o   88.207   9.3108   6.0240   1.2381   6.8726   1.6359   4.8864   1.8942   94.013   11.615   78.390   16.317 15.62257 20.02936 
1 1 1   16    3   13 o  315.566   4.9357   76.223   2.3840   79.890   3.1279   71.141   3.6826  323.051   6.3258  304.829   7.8927 18.22250 10.11487 
1 1 1   16    3   14 o  826.988   4.9891  523.487   6.3153  522.346   9.6070  524.356   8.3804  825.999   7.5987  827.624   6.6155 -1.624573 10.07494 
1 1 1   16    3   15 o  672.119   4.9672  345.782   5.1100  329.268   8.5393  354.994   6.3781  655.770   8.5075  680.985   6.1190 -25.21478 10.47952 
1 1 1   16    3   16 o  1442.96   9.7162  1594.52   21.460   0.0000   0.0000  1594.52   21.460  ?   ?   1442.96   9.7162 0.000000 9.716194 
1 1 1   16    3   17 o  684.714   4.7778  358.864   5.0073  360.041   7.7380  358.015   6.5678  685.760   7.3721  683.864   6.2745 1.895630 9.680757 
1 1 1   16    3   18 o  1229.07   6.5551  1156.47   12.332  1190.61   19.437  1133.46   15.954  1246.80   10.185  1216.65   8.5670 30.15161 13.30911 
1 1 1   16    3   19 o  368.533   5.0226  103.963   2.8332  105.184   4.5646  103.198   3.6135  370.634   8.0461  367.151   6.4301 3.482910 10.29980 
1 1 1   16    3   20 o  649.136   4.5895  322.541   4.5601  324.768   6.5886  320.493   6.3177  651.313   6.6090  647.020   6.3793 4.292480 9.185531 
1 1 1   16    3   21 o  614.631   4.9530  289.174   4.6596  290.926   6.3606  287.146   6.8455  616.434   6.7412  612.397   7.3030 4.037781 9.938719 
1 1 1   16    3   22 o  643.123   5.1222  316.615   5.0422  317.167   6.7955  315.938   7.5211  643.623   6.8980  642.343   7.6497 1.279480 10.30052 
1 1 1   16    3   23 o  243.851   6.6212   45.527   2.4713   44.198   3.7300   46.567   3.2994  240.197   10.146  246.583   8.7419 -6.386047 13.39221 
1 1 1   16    3   24 o  702.273   5.3653  377.553   5.7673  372.618   7.7019  383.852   8.7016  697.587   7.2132  707.980   8.0299 -10.39337 10.79395 
1 1 1   16    3   25 o  522.641   5.5166  209.117   4.4131  204.267   5.9205  215.181   6.6201  516.473   7.4893  530.061   8.1596 -13.58783 11.07562 
1 1 1   16    3   26 f  238.035   9.2332   43.406   3.3641   29.657   5.3818   52.223   4.3098  195.645   18.180  261.046   10.786 -65.40041 21.13865 
1 1 1   16    3   27 o  511.896   5.6561  200.624   4.4317  213.645   6.2984  187.856   6.2368  528.150   7.7911  495.227   8.2279 32.92307 11.33135 
1 1 1   16    3   28 o  606.028   6.0222  281.222   5.5863  294.247   8.3473  270.657   7.5180  619.722   8.7999  594.400   8.2633 25.32251 12.07145 
1 1 1   16    3   29 o  210.307   9.3734   33.896   3.0173   34.362   4.9433   33.620   3.8092  210.939   15.417  209.016   11.956 1.922256 19.51011 
1 1 1   16    3   30 o  108.270   16.304   9.2124   2.6181   8.2691   3.8743   10.005   3.5519  101.399   25.097  112.037   21.494 -10.63872 33.04355 
1 1 1   16    3   31 o  219.798   9.0862   37.034   3.0569   41.580   4.8364   34.010   3.9447  232.260   13.665  210.131   12.319 22.12892 18.39744 
1 1 1   16    3   32 o  399.061   6.5234  121.991   3.9846  132.612   7.0604  117.027   4.8267  415.700   11.096  390.761   8.0700 24.93896 13.72057 
1 1 1   16    3   33 o  667.576   5.6987  341.341   5.8230  341.027   7.8732  341.719   8.6517  667.049   7.7113  667.625   8.4664 -0.5763550 11.45181 
1 1 1   16    3   34 o  267.981   8.0180   55.057   3.2888   56.009   4.5162   53.981   4.7989  270.086   10.924  265.079   11.828 5.007690 16.10072 
1 1 1   16    3   35 o  308.886   6.9041   73.124   3.2642   80.648   4.8533   66.909   4.4109  324.155   9.7817  295.257   9.7602 28.89716 13.81824 
1 1 1   16    3   36 o  137.458   12.945   14.667   2.6915   14.164   4.1015   15.047   3.5669  133.591   20.730  138.517   17.193 -4.925888 26.93231 
1 1 1   16    3   37 o  255.085   7.7882   49.907   3.0408   49.173   4.4831   50.532   4.1383  252.869   11.583  256.443   10.543 -3.574371 15.66251 
1 1 1   16    3   38 o  505.273   6.1220  195.676   4.7346  199.656   6.6991  191.703   6.6925  510.022   8.5814  499.731   8.7495 10.29031 12.25533 
1 1 1   16    3   39 o  183.529   11.255   26.016   3.1465   21.326   4.3648   31.090   4.5401  164.934   17.560  200.044   14.935 -35.10956 23.05213 
1 1 1   16    3   40 o  404.949   6.6595  125.764   4.1277  132.232   6.6840  121.777   5.2481  414.575   10.533  398.195   8.6107 16.37979 13.60485 
1 1 1   16    3   41 o  162.800   12.225   20.555   3.0240   18.469   4.6778   22.053   3.9635  152.379   20.583  167.987   15.592 -15.60849 25.82209 
1 1 1   16    3   42 o  261.310   8.4416   52.472   3.3764   49.887   4.8945   54.820   4.6637  254.157   12.582  266.638   11.427 -12.48106 16.99629 
1 1 1   16    3   43 o  107.150   18.826   9.2295   2.9750   6.6175   4.2147   11.823   4.1998   90.455   27.774  120.272   23.657 -29.81777 36.48289 
1 1 1   16    3   44 o  327.102   8.8992   82.326   4.4556   83.512   8.7915   81.917   5.1685  326.442   17.661  325.977   10.359 0.4656372 20.47436 
1 1 1   16    3   45 o   65.391   24.630   2.6242   3.3556   4.2143   4.4713   0.5740   5.0774   78.284   28.623   66.862   28.417 11.42239 40.33371 
1 1 1   16    3   46 o   86.775   24.999   6.1943   3.5013   5.0221   4.8037   7.5229   5.1141   83.074   29.765   95.972   30.755 -12.89811 42.80012 
1 1 1   16    3   47 o   56.655   23.321   0.9880   3.2591  -3.0907   4.6826   4.8200   4.5388   53.670   24.708   81.100   28.946 -27.42977 38.05765 
1 1 1   16    3   48 o   86.605   24.401   6.2181   3.3731  -2.2599   4.7090   15.152   4.8339   55.839   25.352  135.506   24.194 -79.66660 35.04357 
1 1 1   16    3   49 o  185.788   13.709   27.024   3.8710   23.060   5.1294   32.269   5.9000  169.292   20.194  200.948   19.425 -31.65532 28.01956 
1 1 1   16    3   50 o   73.367   30.109   2.2339   5.4121   1.8323   7.0957   2.7924   8.3686   79.650   33.710   87.229   36.746 -7.578407 49.86671 
1 1 1   16    3   51 o   89.286   28.617   6.6281   4.4275  -1.2375   8.7819   9.3087   5.1267   79.130   35.382  103.790   30.351 -24.66000 46.61617 
1 1 1   16    3   52 o  136.049   22.130   15.294   4.4499   15.167   8.7980   15.337   5.1583  127.364   40.289  134.477   26.001 -7.113289 47.95050 
1 1 1   16    3   53 o  136.346   18.352   15.074   3.7326   17.045   5.4606   13.345   5.1139  141.355   26.203  124.022   27.645 17.33356 38.08979 
1 1 1   16    3   54 o  190.155   12.950   28.459   3.7468   30.477   5.2799   26.413   5.3179  194.403   17.947  179.987   19.621 14.41583 26.59063 
1 1 1   16    3   55 o  165.380   16.547   22.022   4.1324   17.109   6.5480   25.273   5.3272  136.789   31.866  175.219   20.235 -38.42960 37.74817 
1 1 1   16    3   56 o  101.877   25.981   9.1787   4.0641   13.587   5.5752   4.1803   5.9368  121.955   30.059   79.598   31.947 42.35640 43.86517 
1 1 1   16    3   57 o   61.183   24.846   1.9420   3.6370   0.8505   5.4296   2.8302   4.8983   66.096   28.748   70.334   28.729 -4.238419 40.64263 
1 1 1   16    3   58 f   52.665   23.293  -0.2735   3.7022   4.3401   5.5270  -4.0285   4.9862   77.078   30.863   51.243   24.206 25.83504 39.22377 
1 1 1   16    3   59 o   68.401   24.808   3.8247   3.3491   6.1447   4.8786   1.7568   4.6060   82.430   29.934   63.955   27.119 18.47561 40.39173 
1 1 1   16    4    0 o  753.582   11.837  435.098   13.646  435.098   13.646  435.098   13.646  753.582   11.837  753.582   11.837 0.000000 0.000000 
1 1 1   16    4    1 o  160.358   9.0483   19.751   2.2118   21.618   3.3607   18.324   2.9378  167.471   13.218  154.161   12.559 13.31041 18.23319 
1 1 1   16    4    2 o  152.668   6.9335   17.842   1.6202   21.195   3.4766   16.912   1.8312  165.755   13.829  148.408   8.0920 17.34758 16.02271 
1 1 1   16    4    3 o  1194.71   11.426  1093.14   20.895   0.0000   0.0000  1093.14   20.895  ?   ?   1194.71   11.426 0.000000 11.42644 
1 1 1   16    4    4 o  398.106   7.1422  121.327   4.3521  130.727   6.5931  114.068   5.7937  413.176   10.425  385.966   9.8070 27.20911 14.31305 
1 1 1   16    4    5 o  590.072   7.7812  266.559   7.0278  276.230   10.371  258.348   9.5563  600.571   11.282  580.826   10.749 19.74591 15.58327 
1 1 1   16    4    6 o  399.962   6.1114  122.452   3.7413  125.572   4.7194  117.174   6.1380  405.003   7.6130  391.175   10.252 13.82809 12.76919 
1 1 1   16    4    7 o  1265.30   10.016  1225.94   19.398  1280.89   24.930  1141.63   30.880  1293.14   12.595  1220.43   16.531 72.70923 20.78243 
1 1 1   16    4    8 o  841.418   6.6558  541.965   8.5720  591.539   13.040  504.242   11.375  878.937   9.6929  811.517   9.1578 67.41992 13.33479 
1 1 1   16    4    9 o  1013.43   8.6113  786.347   13.358  818.510   16.956  733.727   21.688  1033.83   10.715  978.566   14.479 55.26862 18.01294 
1 1 1   16    4   10 o  649.328   5.9917  322.744   5.9551  329.938   8.5209  315.875   8.3260  656.457   8.4803  642.315   8.4687 14.14203 11.98473 
1 1 1   16    4   11 o  523.515   4.9069  209.778   3.9319  220.866   6.7097  203.979   4.8523  537.105   8.1616  516.208   6.1413 20.89703 10.21403 
1 1 1   16    4   12 o  270.429   4.8134   55.977   1.9924   53.704   2.6631   58.866   3.0027  264.865   6.5690  277.298   7.0744 -12.43216 9.653971 
1 1 1   16    4   13 o  955.390   5.8124  698.703   8.4997  712.690   14.957  692.032   10.330  964.698   10.129  950.769   7.0982 13.92920 12.36885 
1 1 1   16    4   14 o  780.856   5.2239  466.722   6.2436  458.572   10.650  470.990   7.7068  773.875   8.9913  784.383   6.4192 -10.50861 11.04760 
1 1 1   16    4   15 o  253.835   4.8834   49.319   1.8973   48.930   3.0202   49.572   2.4386  252.803   7.8051  254.472   6.2609 -1.669617 10.00598 
1 1 1   16    4   16 o  1025.21   6.7807  804.640   10.640  794.150   23.601  807.316   11.921  1017.85   15.148  1026.87   7.5843 -9.014954 16.94098 
1 1 1   16    4   17 o  490.595   4.9774  184.231   3.7377  188.081   7.1159  182.764   4.3923  495.581   9.3810  488.620   5.8729 6.960815 11.06769 
1 1 1   16    4   18 o  674.914   4.8365  348.669   4.9963  345.865   7.7347  350.676   6.5450  672.111   7.5185  676.812   6.3179 -4.700806 9.820599 
1 1 1   16    4   19 o  541.078   4.7611  224.097   3.9431  223.369   6.2663  224.575   5.0734  540.124   7.5797  541.622   6.1198 -1.498718 9.741804 
1 1 1   16    4   20 f  434.140   4.9730  144.274   3.3046  141.636   5.4061  145.848   4.1755  430.078   8.2123  436.476   6.2500 -6.397858 10.32009 
1 1 1   16    4   21 o  253.475   6.4491   49.189   2.5021   49.532   3.6772   48.893   3.4144  254.306   9.4469  252.671   8.8285 1.634766 12.93000 
1 1 1   16    4   22 o  202.975   8.1116   31.549   2.5201   29.637   3.5515   33.489   3.5766  196.302   11.876  208.762   11.234 -12.46045 16.34762 
1 1 1   16    4   23 o  710.031   5.3356  385.935   5.7986  388.555   7.8354  382.761   8.6220  712.358   7.1861  706.987   7.9676 5.371033 10.72949 
1 1 1   16    4   24 o  330.146   6.2418   83.449   3.1542   85.417   4.4535   81.469   4.4679  333.953   8.7126  326.135   8.9503 7.817444 12.49065 
1 1 1   16    4   25 o  346.527   5.7759   91.934   3.0635   98.569   4.7465   87.196   4.0109  358.733   8.6443  337.430   7.7657 21.30267 11.62028 
1 1 1   16    4   26 o  459.543   5.7851  161.684   4.0692  158.376   5.5992  165.386   5.9240  454.734   8.0445  464.675   8.3291 -9.940857 11.57960 
1 1 1   16    4   27 o  209.495   8.5603   33.621   2.7449   32.314   4.2169   34.581   3.6159  204.794   13.529  212.102   11.177 -7.308304 17.54883 
1 1 1   16    4   28 o  532.305   5.5642  216.949   4.5335  228.219   7.4236  210.246   5.7250  545.766   8.8867  523.941   7.1388 21.82507 11.39893 
1 1 1   16    4   29 o  232.581   8.4733   41.447   3.0165   37.379   4.8538   44.008   3.8502  220.152   14.485  239.582   10.499 -19.43008 17.89014 
1 1 1   16    4   30 o  330.686   6.7393   83.759   3.4112   84.401   5.4761   83.352   4.3605  331.737   10.785  329.794   8.6383 1.943207 13.81767 
1 1 1   16    4   31 o  945.760   6.0880  685.061   8.8130  687.733   13.712  683.180   11.504  947.099   9.4589  944.209   7.9597 2.890320 12.36238 
1 1 1   16    4   32 o  385.382   6.6748  113.779   3.9373  128.834   6.9989  106.808   4.7623  409.717   11.160  373.285   8.3351 36.43149 13.92931 
1 1 1   16    4   33 o  311.312   7.3690   74.272   3.5114   72.487   4.9067   76.145   5.0271  307.339   10.431  315.000   10.426 -7.660217 14.74805 
1 1 1   16    4   34 o  490.686   5.6039  184.428   4.2088  187.235   6.1917  182.016   5.7385  494.162   8.1859  487.280   7.6940 6.882660 11.23419 
1 1 1   16    4   35 o  472.018   6.1735  170.712   4.4603  174.079   6.0832  166.797   6.5592  476.420   8.3421  466.244   9.1911 10.17673 12.41236 
1 1 1   16    4   36 o  292.892   7.1668   65.766   3.2129   66.942   4.7962   64.808   4.3274  295.198   10.615  290.541   9.7308 4.657288 14.40014 
1 1 1   16    4   37 o  336.732   7.0846   86.937   3.6515   90.077   5.2489   83.993   5.0831  342.444   10.014  330.674   10.043 11.77029 14.18240 
1 1 1   16    4   38 o  238.954   9.0992   43.845   3.3280   46.908   4.7397   40.866   4.6741  246.468   12.606  229.877   13.342 16.59100 18.35498 
1 1 1   16    4   39 f  441.554   6.5064  149.492   4.3974  154.078   5.9945  144.149   6.4705  447.940   8.7430  433.087   9.7610 14.85297 13.10409 
1 1 1   16    4   40 o   75.255   22.582   4.4936   2.8087   1.9866   4.4002   6.2174   3.6486   68.741   27.534   87.811   25.584 -19.07019 37.58483 
1 1 1   16    4   41 o  120.381   16.083   11.433   2.8893   13.305   4.4267   10.044   3.8137  128.147   23.432  111.040   23.187 17.10723 32.96498 
1 1 1   16    4   42 o   70.802   22.641   3.8865   2.7726   4.0268   4.0641   3.7643   3.7922   76.189   27.370   73.739   26.444 2.450592 38.05742 
1 1 1   16    4   43 o   47.950   20.866  -0.3884   2.8633  -3.9890   4.2694   2.5549   3.8602   48.806   22.848   67.879   26.207 -19.07335 34.76813 
1 1 1   16    4   44 o  289.298   9.1771   64.422   4.0637   65.395   7.5576   64.025   4.8197  288.934   17.166  288.062   10.931 0.8723450 20.35107 
1 1 1   16    4   45 o  244.452   10.039   46.068   3.7563   46.084   5.1412   46.049   5.5015  243.317   13.862  242.921   14.868 0.3961334 20.32725 
1 1 1   16    4   46 o  133.299   17.966   14.171   3.5723   7.5109   4.7512   22.833   5.4185   95.453   29.518  168.506   21.498 -73.05351 36.51707 
1 1 1   16    4   47 o  154.130   16.110   18.761   3.7444   26.996   5.1458   9.4928   5.4588  184.372   18.483  105.873   31.417 78.49803 36.45090 
1 1 1   16    4   48 o  106.685   27.158   9.6199   4.4463   9.4077   7.6686   9.7274   5.4572  107.281   37.694  106.782   31.339 0.4988556 49.02006 
1 1 1   16    4   49 o  168.161   16.351   22.385   4.1555   28.508   7.5411   19.714   4.9797  184.895   27.482  155.862   21.441 29.03297 34.85704 
1 1 1   16    4   50 o   62.009   27.007  -0.2062   4.8051 -13.7940   7.6196   8.7650   6.1914   54.193   26.614  101.924   33.919 -47.73148 43.11387 
1 1 1   16    4   51 o  232.559   11.289   41.965   4.0185   39.109   6.0852   44.174   5.3512  221.479   18.109  237.001   14.826 -15.52161 23.40367 
1 1 1   16    4   52 o  172.062   14.398   23.364   3.7571   25.248   5.3255   21.498   5.3011  176.488   20.071  161.812   21.972 14.67586 29.75919 
1 1 1   16    4   53 o  190.328   13.507   28.517   3.9094   22.046   5.7337   34.138   5.3441  162.510   23.752  206.686   17.045 -44.17632 29.23489 
1 1 1   16    4   54 f  190.009   12.954   28.425   3.7449   27.349   5.2307   29.556   5.3639  183.525   18.890  191.021   18.581 -7.496017 26.49701 
1 1 1   16    4   55 o   67.728   26.825   2.7259   4.1313   3.8988   7.2172   2.1543   5.0384   83.237   34.524   69.558   28.848 13.67903 44.99029 
1 1 1   16    4   56 o   84.285   26.931   6.1795   3.9237   5.8022   5.3822   6.6075   5.7321   84.369   31.307   88.370   32.393 -4.001480 45.04939 
1 1 1   16    4   57 o  109.477   23.880   10.515   3.8889   19.571   6.7092   5.9327   4.7724  144.696   31.210   83.008   29.676 61.68764 43.06666 
1 1 1   16    4   58 o   96.093   25.993   8.4266   3.9156   8.7142   5.2854   8.0768   5.8293   95.468   31.319   92.353   32.821 3.115227 45.36612 
1 1 1   16    4   59 o   50.001   22.071  -0.1824   3.3077  -4.7984   4.6569   4.5178   4.6991   47.346   22.655   74.867   28.912 -27.52100 36.73071 
1 1 1   16    5    0 o  738.640   8.1880  417.777   9.2546  417.777   9.2546  417.777   9.2546  738.640   8.1880  738.640   8.1880 0.000000 0.000000 
1 1 1   16    5    1 o  616.437   11.010  291.006   10.388  291.006   10.388   0.0000   0.0000  616.437   11.010  ?   ?  0.000000 11.00986 
1 1 1   16    5    2 o  666.590   6.3712  340.137   6.5005  354.064   12.101  334.488   7.7069  679.926   11.628  661.000   7.6174 18.92517 13.90085 
1 1 1   16    5    3 o  990.712   14.166  751.986   21.482   0.0000   0.0000  751.986   21.482  ?   ?   990.712   14.166 0.000000 14.16631 
1 1 1   16    5    4 o  1965.14   24.995  2965.59   75.183   0.0000   0.0000  2965.59   75.183  ?   ?   1965.14   24.995 0.000000 24.99513 
1 1 1   16    5    5 o  233.267   8.5442   41.660   3.0507   40.159   4.8626   42.634   3.9175  228.523   13.969  235.950   10.847 -7.426697 17.68596 
1 1 1   16    5    6 o  882.920   9.5987  596.905   12.972  608.271   18.823  586.624   17.902  891.044   13.801  875.074   13.365 15.96985 19.21224 
1 1 1   16    5    7 o  211.029   10.102   34.101   3.2631   32.037   5.1135   35.519   4.2383  203.776   16.537  214.943   12.943 -11.16753 20.99976 
1 1 1   16    5    8 o  370.503   8.2799  105.097   4.6956  112.563   7.2737   99.763   6.1483  383.344   12.396  360.922   11.129 22.42267 16.65939 
1 1 1   16    5    9 o  935.308   14.376  670.293   20.581  670.293   20.581   0.0000   0.0000  935.308   14.376  ?   ?  0.000000 14.37637 
1 1 1   16    5   10 o  154.504   10.643   18.368   2.5016   17.929   5.1543   18.503   2.8612  151.118   23.010  154.947   12.162 -3.829697 26.02656 
1 1 1   16    5   11 o  522.596   8.5122  209.103   6.8089  202.255   9.8635  215.337   9.4108  513.836   12.541  530.230   11.596 -16.39374 17.08039 
1 1 1   16    5   12 o  406.685   4.2549  126.592   2.6486  127.170   3.7866  126.037   3.7061  407.590   6.0696  405.772   5.9671 1.818237 8.511486 
1 1 1   16    5   13 o  660.387   4.4958  333.804   4.5444  349.003   7.1634  323.568   5.8788  675.194   6.9314  650.152   5.9075 25.04187 9.107306 
1 1 1   16    5   14 o  630.588   4.4548  304.360   4.2998  299.927   6.5270  307.759   5.7152  625.924   6.8127  634.068   5.8888 -8.144287 9.005049 
1 1 1   16    5   15 o  580.065   4.4192  257.543   3.9236  261.088   6.1181  255.067   5.1137  583.988   6.8445  577.242   5.7877 6.746155 8.963497 
1 1 1   16    5   16 o  443.242   4.6664  150.379   3.1659  139.143   5.3186  156.546   3.9399  426.293   8.1511  452.221   5.6921 -25.92767 9.941829 
1 1 1   16    5   17 o  680.983   5.2189  354.976   5.4398  348.007   9.7955  358.084   6.5412  674.109   9.4935  683.928   6.2485 -9.818909 11.36529 
1 1 1   16    5   18 o  148.528   8.1884   16.943   1.8544   15.396   3.3429   17.631   2.2287  140.827   15.780  151.419   9.6666 -10.59181 18.50539 
1 1 1   16    5   19 o  413.680   4.9126  130.995   3.1106  121.962   5.0806  136.411   3.9342  399.092   8.3171  422.124   6.0890 -23.03217 10.30776 
1 1 1   16    5   20 o  640.295   4.9283  313.826   4.8300  313.107   7.6817  314.296   6.2114  639.461   7.8482  640.732   6.3335 -1.270874 10.08502 
1 1 1   16    5   21 o  796.448   5.7109  485.601   6.9620  488.226   10.214  483.323   9.5146  798.467   8.3574  794.478   7.8241 3.988953 11.44831 
1 1 1   16    5   22 o  505.994   5.5968  196.000   4.3346  200.152   6.6516  192.935   5.7147  511.228   8.5004  501.966   7.4379 9.262268 11.29510 
1 1 1   16    5   23 o  167.332   11.405   21.556   2.9037   16.035   4.6731   25.028   3.7059  142.754   22.101  180.170   13.537 -37.41612 25.91744 
1 1 1   16    5   24 o  1089.84   5.9109  909.332   9.8601  883.727   13.756  936.385   14.140  1074.19   8.3668  1105.73   8.3547 -31.54114 11.82389 
1 1 1   16    5   25 o  600.429   5.8642  276.014   5.3894  267.412   8.0952  282.862   7.2227  590.847   8.9512  607.743   7.7644 -16.89600 11.84951 
1 1 1   16    5   26 o  441.565   5.7983  149.282   3.9189  146.301   5.4938  152.371   5.5917  437.043   8.2126  446.018   8.1907 -8.974609 11.59893 
1 1 1   16    5   27 f   46.807   19.848   0.0523   2.4675  -2.3484   3.8374   1.7446   3.2219   50.261   22.845   61.128   23.846 -10.86695 33.02323 
1 1 1   16    5   28 f  125.186   13.781   12.172   2.5969   7.9410   4.3089   14.586   3.2543   99.746   27.388  136.894   15.823 -37.14804 31.62975 
1 1 1   16    5   29 f  615.094   5.8736  289.717   5.5299  296.536   10.085  286.786   6.6125  621.883   10.595  611.895   7.0602 9.987549 12.73222 
1 1 1   16    5   30 o  636.729   5.5112  310.453   5.3712  313.216   8.5239  308.634   6.9173  639.282   8.7111  634.740   7.1198 4.542603 11.25058 
1 1 1   16    5   31 o  362.350   6.6959  100.578   3.7137   90.319   6.5943  105.343   4.4942  342.968   12.562  370.766   7.9192 -27.79736 14.84955 
1 1 1   16    5   32 o  469.637   5.5301  168.917   3.9753  177.059   6.1070  162.930   5.2366  480.609   8.3016  461.109   7.4195 19.49982 11.13402 
1 1 1   16    5   33 o   90.576   20.418   6.5940   2.7630   15.871   4.0223  -1.6950   3.8020  142.132   18.962   51.740   23.197 90.39265 29.96084 
1 1 1   16    5   34 o  535.589   5.4362  219.719   4.4565  223.980   6.6659  216.275   5.9926  540.486   8.0575  531.187   7.3706 9.298523 10.92013 
1 1 1   16    5   35 o  210.523   9.5621   34.016   3.0812   33.837   4.2256   34.219   4.5026  209.281   13.260  210.340   14.066 -1.059875 19.33094 
1 1 1   16    5   36 o  421.247   5.9326  135.967   3.8252  145.592   5.9835  129.315   4.9745  435.566   8.9749  410.621   7.9147 24.94504 11.96628 
1 1 1   16    5   37 o  425.239   6.3803  138.601   4.1528  142.726   6.0079  134.827   5.7467  431.180   9.1032  419.100   8.9584 12.07965 12.77188 
1 1 1   16    5   38 o  212.602   9.7058   34.726   3.1584   33.957   4.4518   35.504   4.4817  209.351   13.973  214.128   13.747 -4.777512 19.60158 
1 1 1   16    5   39 o  132.826   13.413   13.746   2.6896   12.995   4.1780   14.278   3.5148  127.156   22.278  134.591   17.474 -7.435188 28.31337 
1 1 1   16    5   40 o  159.512   12.253   19.730   2.9688   18.748   4.8675   20.311   3.7462  153.447   21.298  161.270   15.362 -7.823318 26.26064 
1 1 1   16    5   41 o  373.152   6.9665  106.844   3.9790  115.625   6.4822  101.535   5.0403  387.442   10.931  363.435   9.0606 24.00742 14.19769 
1 1 1   16    5   42 o   69.665   22.705   3.7184   2.7795   2.4630   4.1882   4.7065   3.7158   69.310   27.147   78.630   26.280 -9.320244 37.78340 
1 1 1   16    5   43 o  133.759   16.893   14.153   3.3814   20.449   7.4848   12.539   3.7902  155.743   32.451  124.794   20.559 30.94893 38.41512 
1 1 1   16    5   44 o  188.111   10.899   27.393   3.1246   25.465   4.6556   28.972   4.2148  179.835   17.120  192.678   14.396 -12.84299 22.36810 
1 1 1   16    5   45 o  181.616   12.564   25.654   3.4711   23.408   4.7547   28.216   5.0790  171.870   18.358  189.056   17.760 -17.18625 25.54261 
1 1 1   16    5   46 o   88.748   25.793   6.4944   3.7127   4.7843   7.2917   7.0929   4.3137   90.540   35.708   92.726   28.022 -2.186493 45.39041 
1 1 1   16    5   47 o  100.038   27.548   8.4126   4.3521   15.135   7.5347   5.0468   5.3314  131.245   36.291   84.619   31.207 46.62612 47.86292 
1 1 1   16    5   48 o  208.814   13.244   34.024   4.2109   36.688   7.9049   32.969   4.9757  211.965   24.836  204.631   16.014 7.333939 29.55075 
1 1 1   16    5   49 o   47.933   21.699  -1.6228   3.4193  -8.3043   4.6547   6.2088   5.0394   43.265   21.154   88.622   30.589 -45.35661 37.19111 
1 1 1   16    5   50 o  109.606   22.899   10.004   3.7178   13.857   4.8838   4.6938   5.7333  128.331   25.758   83.734   32.038 44.59607 41.10834 
1 1 1   16    5   51 o  218.089   11.969   37.081   3.9802   39.443   6.0287   35.256   5.2992  222.505   17.852  210.882   16.550 11.62238 24.34343 
1 1 1   16    5   52 o   80.218   25.845   5.2862   3.6079   4.6833   5.1858   5.8518   5.0228   81.210   30.612   85.967   30.475 -4.756989 43.19551 
1 1 1   16    5   53 o  104.152   23.906   9.2392   3.7303   10.266   5.6789   8.4597   4.9472  107.182   32.099   98.323   30.074 8.858986 43.98629 
1 1 1   16    5   54 o   84.379   25.136   6.0942   3.4892   7.3222   4.9981   4.9269   4.8732   91.929   30.470   80.382   29.798 11.54749 42.61821 
1 1 1   16    5   55 o   73.672   28.400   3.7457   4.5280  -0.2533   10.686   4.6208   4.9990   84.676   38.343   78.933   29.983 5.742950 48.67451 
1 1 1   16    5   56 o  148.486   18.523   18.117   4.1184   29.150   5.7742   6.6941   5.8757  187.484   20.453   88.817   32.760 98.66703 38.62044 
1 1 1   16    5   57 o   76.366   25.080   5.0188   3.3891   5.5320   4.8576   4.5321   4.7308   81.153   29.809   76.443   29.137 4.710136 41.68336 
1 1 1   16    5   58 o   64.858   25.366   2.8711   3.6528   1.0172   4.8412   5.3217   5.5661   63.038   27.282   80.659   31.377 -17.62105 41.57902 
1 1 1   16    5   59 o   90.384   24.511   7.4477   3.4765   8.5044   5.0526   6.4977   4.7909   93.551   30.618   83.860   29.760 9.690170 42.69767 
1 1 1   16    6    0 o  354.179   6.4726   96.110   3.5062   96.110   3.5062   96.110   3.5062  354.179   6.4726  354.179   6.4726 0.000000 0.000000 
1 1 1   16    6    1 o  511.650   4.8665  200.374   3.8112  205.654   5.5168  195.554   5.2712  518.312   6.9538  505.427   6.8137 12.88483 9.735629 
1 1 1   16    6    2 o  504.904   5.6794  195.135   4.3891  219.949   8.7616  186.822   5.0714  535.926   10.681  494.015   6.7068 41.91138 12.61205 
1 1 1   16    6    3 o  989.651   14.174  750.386   21.471   0.0000   0.0000  750.386   21.471  ?   ?   989.651   14.174 0.000000 14.17412 
1 1 1   16    6    4 o  864.073   13.077  571.942   17.295   0.0000   0.0000  571.942   17.295  ?   ?   864.073   13.077 0.000000 13.07652 
1 1 1   16    6    5 o  1263.40   12.197  1222.58   23.586  1199.98   32.720  1247.04   34.029  1251.16   17.086  1275.42   17.431 -24.25452 24.40808 
1 1 1   16    6    6 o  2156.19   19.298  3565.51   63.690  3574.52   90.438  3556.64   89.708  2156.64   27.397  2151.29   27.244 5.350586 38.63683 
1 1 1   16    6    7 o  1413.22   10.966  1529.52   23.721  1565.97   29.868  1467.27   39.037  1429.69   13.649  1383.30   18.437 46.39038 22.93941 
1 1 1   16    6    8 o  157.208   10.271   19.007   2.4580   20.288   3.0290   16.536   4.2062  162.281   12.285  145.564   19.359 16.71696 22.92777 
1 1 1   16    6    9 o  626.121   8.5188  300.152   8.1641  300.152   8.1641   0.0000   0.0000  626.121   8.5188  ?   ?  0.000000 8.518848 
1 1 1   16    6   10 o  296.516   7.4281   67.310   3.3713   64.744   4.1266   72.460   5.8460  290.782   9.2715  307.559   12.418 -16.77643 15.49762 
1 1 1   16    6   11 o  341.048   6.3125   89.038   3.2953   92.885   4.7312   85.414   4.5923  348.296   8.8748  333.994   8.9830 14.30225 12.62757 
1 1 1   16    6   12 o  360.102   6.1846   99.265   3.4088  109.515   5.0562   90.724   4.6156  378.191   8.7345  344.219   8.7604 33.97217 12.37077 
1 1 1   16    6   13 o  737.678   5.6925  416.548   6.4275  424.733   8.2737  404.089   10.208  744.841   7.2572  726.439   9.1803 18.40192 11.70228 
1 1 1   16    6   14 o  279.679   5.3289   59.874   2.2812   61.456   3.1652   58.165   3.2907  283.325   7.2986  275.627   7.8001 7.697327 10.68230 
1 1 1   16    6   15 o  594.727   4.4927  270.730   4.0897  271.952   6.3975  269.886   5.3183  596.007   7.0127  593.770   5.8518 2.236877 9.133519 
1 1 1   16    6   16 o  673.688   5.4775  347.417   5.6482  373.564   9.3461  332.373   7.0892  698.461   8.7421  658.894   7.0293 39.56757 11.21764 
1 1 1   16    6   17 o  313.044   5.4273   75.015   2.6005   71.489   5.3958   76.082   2.9680  305.480   11.540  315.252   6.1508 -9.772430 13.07679 
1 1 1   16    6   18 o  139.090   8.8420   14.875   1.8726   9.4657   3.4865   17.068   2.2200  109.115   21.640  148.960   9.7914 -39.84431 23.75203 
1 1 1   16    6   19 o  281.370   5.6520   60.605   2.4342   65.839   4.4440   58.361   2.9094  293.190   9.9027  276.095   6.8846 17.09515 12.06071 
1 1 1   16    6   20 o  566.889   5.3567  246.005   4.6479  244.246   6.9621  247.418   6.2429  564.772   8.0537  568.460   7.1750 -3.688354 10.78621 
1 1 1   16    6   21 o  692.039   6.0263  366.643   6.3834  366.559   8.5984  366.745   9.5281  691.868   8.1194  691.996   8.9957 -0.1283569 12.11801 
1 1 1   16    6   22 o  301.311   6.1422   69.507   2.8328   67.157   5.0515   70.584   3.4214  296.053   11.147  303.614   7.3622 -7.561310 13.35922 
1 1 1   16    6   23 o  261.953   8.0806   52.550   3.2399   51.347   5.1788   53.323   4.1530  258.466   13.134  263.820   10.285 -5.353943 16.68134 
1 1 1   16    6   24 o  241.819   7.7109   44.781   2.8541   39.611   5.3513   46.837   3.3740  226.682   15.517  247.279   8.9143 -20.59731 17.89487 
1 1 1   16    6   25 o  280.189   7.7195   60.123   3.3106   59.684   5.7088   60.346   4.0637  278.970   13.370  280.659   9.4597 -1.688568 16.37778 
1 1 1   16    6   26 o  263.894   7.5736   53.335   3.0591   42.879   5.8036   57.358   3.5998  235.759   16.181  273.637   8.5949 -37.87764 18.32169 
1 1 1   16    6   27 o  166.113   11.384   21.255   2.8770   18.860   5.6121   22.109   3.3507  154.469   24.558  169.266   13.033 -14.79749 27.80244 
1 1 1   16    6   28 o  325.545   6.7106   81.165   3.3438   86.782   6.0094   78.646   4.0244  336.383   11.671  320.397   8.2062 15.98560 14.26759 
1 1 1   16    6   29 o  494.953   5.9294  187.601   4.4920  201.683   8.5419  182.217   5.2813  512.820   10.882  487.736   7.0743 25.08420 12.97958 
1 1 1   16    6   30 o  354.967   6.1046   96.501   3.3167  100.748   5.1675   93.526   4.3253  362.520   9.3128  349.357   8.0886 13.16296 12.33505 
1 1 1   16    6   31 o   36.998   17.625  -3.5864   2.7538 -10.9699   5.6501  -1.2860   3.1537   47.277   23.156   47.638   21.259 -0.3609848 31.43474 
1 1 1   16    6   32 f  189.276   9.3954   27.476   2.7220   31.547   4.3088   24.772   3.5113  202.076   14.017  179.097   12.895 22.97911 19.04652 
1 1 1   16    6   33 o  244.537   8.1876   45.846   3.0646   51.699   4.5056   40.806   4.1805  259.468   11.345  230.174   11.907 29.29448 16.44627 
1 1 1   16    6   34 o  385.550   5.9943  113.883   3.5374  112.340   5.3090  115.114   4.7439  382.672   9.0640  387.470   7.9988 -4.797791 12.08871 
1 1 1   16    6   35 o   58.554   22.365   1.8527   2.7912   0.0835   3.9340   3.6461   3.9607   58.662   24.975   74.522   26.986 -15.85920 36.76930 
1 1 1   16    6   36 o  208.468   9.3241   33.361   2.9752   40.026   4.3840   27.670   4.0508  227.713   12.628  188.975   14.106 38.73790 18.93258 
1 1 1   16    6   37 o  141.184   12.258   15.456   2.6228   18.002   4.1049   13.700   3.4094  151.393   18.072  131.956   17.297 19.43764 25.01553 
1 1 1   16    6   38 o  188.283   10.425   27.337   2.9928   23.338   4.1619   31.619   4.3066  173.005   15.895  201.955   14.019 -28.95016 21.19344 
1 1 1   16    6   39 o  192.942   9.6137   28.611   2.8391   32.523   4.4090   25.839   3.7109  204.732   14.156  182.521   13.376 22.21104 19.47645 
1 1 1   16    6   40 o  193.543   10.021   28.889   2.9585   29.128   4.7620   28.739   3.7756  193.149   16.259  192.557   12.885 0.5928955 20.74493 
1 1 1   16    6   41 o  177.837   11.391   24.475   3.0844   25.702   5.0958   23.766   3.8748  180.611   18.704  174.599   14.634 6.012253 23.74869 
1 1 1   16    6   42 o  432.883   6.6027  143.790   4.3749  138.507   6.7719  147.574   5.7314  424.018   10.434  438.151   8.5461 -14.13281 13.48728 
1 1 1   16    6   43 o  255.887   9.4446   50.406   3.6992   44.640   6.9908   52.648   4.3595  237.861   19.370  261.263   10.902 -23.40207 22.22671 
1 1 1   16    6   44 o   49.226   21.858  -1.0037   3.2912   3.0094   6.5324  -2.3690   3.8102   82.229   33.331   49.219   22.522 33.01025 40.22682 
1 1 1   16    6   45 o  112.924   27.218   10.680   4.6493   16.617   7.3141   6.6549   6.0227  138.732   34.570   93.891   33.362 44.84047 48.04236 
1 1 1   16    6   46 o  171.943   16.972   23.352   4.4085   27.481   7.5099   21.181   5.4454  182.290   27.795  161.738   22.615 20.55159 35.83263 
1 1 1   16    6   47 o   67.803   25.656   2.8555   3.6513   0.1123   4.8988   6.2842   5.4767   63.978   27.566   90.435   31.848 -26.45703 42.12100 
1 1 1   16    6   48 o  242.357   10.095   45.369   3.7449   43.040   5.5483   47.318   5.0755  234.094   15.573  246.261   13.517 -12.16678 20.62134 
1 1 1   16    6   49 o  167.804   14.607   22.152   3.7143   24.703   5.1718   19.435   5.3376  175.451   19.593  153.852   23.404 21.59875 30.52243 
1 1 1   16    6   50 o  185.940   13.685   27.111   3.8674   28.859   5.2131   24.971   5.7673  190.198   18.126  175.128   22.001 15.07048 28.50635 
1 1 1   16    6   51 o   71.171   25.564   3.6994   3.5455   2.9108   5.3688   4.3094   4.7215   75.219   30.313   78.352   29.274 -3.133339 42.14013 
1 1 1   16    6   52 o  226.257   11.895   39.959   4.1050   33.611   5.5067   47.900   6.1587  204.993   17.724  245.639   16.476 -40.64563 24.19931 
1 1 1   16    6   53 o  144.747   17.214   16.878   3.7390   14.800   5.7317   18.418   4.9332  129.503   29.566  148.894   22.335 -19.39153 37.05398 
1 1 1   16    6   54 o   78.229   28.455   4.7470   4.4109   5.7919   10.838   4.5396   4.8289   97.898   41.561   78.443   29.546 19.45495 50.99282 
1 1 1   16    6   55 o  111.838   21.807   10.594   3.5989   7.4659   5.0447   13.836   5.1357   92.040   30.617  125.006   27.581 -32.96629 41.20779 
1 1 1   16    6   56 o  238.795   10.440   44.500   3.8157   42.331   5.1947   47.041   5.6233  230.241   14.819  242.478   15.229 -12.23730 21.24883 
1 1 1   16    6   57 o  147.762   15.707   17.726   3.4979   15.625   4.9655   19.795   4.9282  132.837   25.346  152.478   21.731 -19.64134 33.38660 
1 1 1   16    6   58 o  135.991   19.482   15.617   3.9394   21.654   4.7162   1.6839   7.1648  160.341   19.627   73.867   32.551 86.47412 38.00994 
1 1 1   16    6   59 o   47.048   21.503  -1.4082   3.4594  -1.7216   4.4209  -0.9133   5.5562   52.487   24.106   60.528   27.503 -8.041027 36.57187 
1 1 1   16    7    0 o  906.006   9.2742  628.553   12.858  628.553   12.858  628.553   12.858  906.006   9.2742  906.006   9.2742 0.000000 0.000000 
1 1 1   16    7    1 o  483.287   6.8443  178.798   5.0629  178.798   5.0629   0.0000   0.0000  483.287   6.8443  ?   ?  0.000000 6.844275 
1 1 1   16    7    2 o  809.683   8.6726  501.940   10.748  501.940   10.748   0.0000   0.0000  809.683   8.6726  ?   ?  0.000000 8.672594 
1 1 1   16    7    3 o  1218.40   16.591  1137.86   30.942   0.0000   0.0000  1137.86   30.942  ?   ?   1218.40   16.591 0.000000 16.59132 
1 1 1   16    7    4 o  1560.11   14.446  1864.92   34.497  1819.26   47.429  1916.20   50.267  1540.05   20.121  1580.43   20.780 -40.37915 28.92473 
1 1 1   16    7    5 o  1088.54   10.913  907.450   18.182  889.677   25.256  926.571   26.196  1077.48   15.314  1099.57   15.565 -22.08960 21.83562 
1 1 1   16    7    6 o  607.012   8.1728  282.098   7.5934  285.736   11.070  278.865   10.436  610.785   11.841  603.419   11.299 7.366150 16.36666 
1 1 1   16    7    7 o  1137.01   9.3156  989.881   16.212  999.980   20.137  971.276   27.332  1142.64   11.514  1125.73   15.863 16.90820 19.60069 
1 1 1   16    7    8 o  326.505   7.0927   81.611   3.5446   83.814   4.3714   77.382   6.0568  330.859   8.6319  317.835   12.450 13.02374 15.14974 
1 1 1   16    7    9 o  1288.78   12.578  1272.37   24.812  1272.37   24.812   0.0000   0.0000  1288.78   12.578  ?   ?  0.000000 12.57792 
1 1 1   16    7   10 o  577.570   6.9822  255.376   6.1726  242.415   7.3532  286.301   11.358  562.681   8.5378  611.357   12.138 -48.67572 14.83986 
1 1 1   16    7   11 o  675.319   7.3305  349.144   7.5773  347.758   9.2893  351.899   13.099  673.919   9.0055  677.753   12.627 -3.833313 15.50894 
1 1 1   16    7   12 o  719.055   7.5441  395.844   8.3031  392.145   10.159  403.286   14.411  715.620   9.2745  725.520   12.977 -9.900391 15.95052 
1 1 1   16    7   13 o  131.114   9.8747   13.240   1.9672   13.649   2.4520   12.500   3.2953  132.924   12.188  126.480   17.490 6.443672 21.31720 
1 1 1   16    7   14 o  439.434   4.9046  147.808   3.2989  147.059   4.5759  148.619   4.7602  438.284   6.8210  440.598   7.0585 -2.313568 9.815728 
1 1 1   16    7   15 o  938.587   5.9843  674.373   8.5972  679.995   12.196  668.821   12.120  942.370   8.4555  934.595   8.4728 7.775879 11.97010 
1 1 1   16    7   16 f  1183.86   7.5407  1073.06   13.664  1073.34   21.289  1072.87   17.819  1183.66   11.751  1183.58   9.8358 0.7763672E-01 15.32398 
1 1 1   16    7   17 o  771.069   6.1964  455.151   7.3131  443.863   11.649  462.492   9.3952  761.267   9.9974  777.191   7.8978 -15.92395 12.74065 
1 1 1   16    7   18 o  468.520   5.1415  168.030   3.6871  169.829   5.6145  166.666   4.8892  470.956   7.7886  466.576   6.8461 4.380341 10.36977 
1 1 1   16    7   19 o  469.723   5.3256  168.899   3.8289  167.877   5.8649  169.659   5.0548  468.223   8.1835  470.737   7.0155 -2.513794 10.77897 
1 1 1   16    7   20 o  405.515   5.1114  125.879   3.1726  130.418   5.5258  123.647   3.8749  412.669   8.7483  401.880   6.2993 10.78900 10.78030 
1 1 1   16    7   21 o  757.872   5.6413  439.703   6.5440  447.121   9.8150  433.766   8.7804  764.101   8.3920  752.646   7.6218 11.45551 11.33657 
1 1 1   16    7   22 o  253.919   6.7786   49.366   2.6345   54.327   5.0153   47.475   3.0961  266.236   12.307  248.985   8.1241 17.25081 14.74678 
1 1 1   16    7   23 o  360.713   6.6808   99.624   3.6886  100.181   5.6760   99.217   4.8530  361.606   10.255  359.914   8.8093 1.692657 13.51920 
1 1 1   16    7   24 o  104.757   16.700   8.6327   2.5878   7.4766   4.9155   9.0759   3.0437   98.200   29.966  107.060   19.283 -8.859955 35.63449 
1 1 1   16    7   25 o  415.742   5.7300  132.330   3.6462  139.996   6.4917  128.797   4.4071  427.444   9.9222  410.113   7.0207 17.33127 12.15483 
1 1 1   16    7   26 o  243.539   7.7071   45.428   2.8729   40.190   5.5489   47.346   3.3581  228.217   15.986  248.598   8.8252 -20.38052 18.26027 
1 1 1   16    7   27 o  321.869   6.9985   79.343   3.4479   75.129   6.9931   80.697   3.9631  312.825   14.605  324.568   7.9773 -11.74277 16.64163 
1 1 1   16    7   28 o  365.595   6.6628  102.366   3.7284  105.025   7.7646  101.569   4.2505  369.877   13.715  364.128   7.6263 5.749542 15.69261 
1 1 1   16    7   29 o  741.120   6.1288  420.645   6.9524  434.234   13.738  415.966   8.0607  752.278   11.931  736.897   7.1466 15.38068 13.90784 
1 1 1   16    7   30 o  569.258   5.6885  248.166   4.9565  253.693   8.4569  245.274   6.1173  575.213   9.6054  565.831   7.0633 9.382263 11.92278 
1 1 1   16    7   31 o  370.786   5.9672  105.301   3.3866  108.948   5.3039  102.791   4.4004  376.944   9.1928  366.233   7.8499 10.71161 12.08841 
1 1 1   16    7   32 o   55.146   20.949   1.6620   2.4404   0.8063   3.9012   2.2121   3.1281   61.351   25.409   62.778   23.749 -1.426949 34.77972 
1 1 1   16    7   33 o  164.483   11.119   20.870   2.7829   16.316   4.0219   25.053   3.8546  144.155   18.666  179.893   14.112 -35.73720 23.40042 
1 1 1   16    7   34 o   41.447   18.597  -1.1297   2.4485  -6.3226   3.8685   2.3410   3.1626   41.179   19.939   63.587   23.919 -22.40789 31.13982 
1 1 1   16    7   35 o  248.176   9.0320   47.263   3.4310   45.336   4.4059   50.233   5.4689  242.829   11.854  254.988   14.067 -12.15929 18.39524 
1 1 1   16    7   36 o   59.163   21.428   2.2669   2.4976   6.5835   3.9145  -0.6968   3.2436   90.709   26.520   50.346   22.051 40.36304 34.48995 
1 1 1   16    7   37 o  403.467   6.5013  124.789   4.0149  124.564   5.5495  125.036   5.8159  402.796   9.0011  403.498   9.4168 -0.7019348 13.02673 
1 1 1   16    7   38 o  258.693   7.6231   51.345   3.0185   50.187   4.5625   52.246   4.0253  255.330   11.674  260.709   10.087 -5.378555 15.42855 
1 1 1   16    7   39 o  149.219   11.788   17.257   2.6704   20.831   4.0273   14.453   3.5675  163.170   16.345  135.346   17.640 27.82481 24.04833 
1 1 1   16    7   40 o  145.872   12.794   16.546   2.8277   26.470   4.4274   9.7080   3.6748  184.125   15.865  109.266   22.714 74.85944 27.70558 
1 1 1   16    7   41 o  304.040   7.8842   70.995   3.6691   71.194   6.1601   70.886   4.5677  303.493   13.261  303.510   9.8322 -0.1748657E-01 16.50823 
1 1 1   16    7   42 o  248.822   9.6006   47.654   3.6564   43.984   7.0302   49.015   4.2811  236.168   19.626  252.109   11.094 -15.94098 22.54437 
1 1 1   16    7   43 o  140.165   15.493   15.453   3.2683   24.294   6.6144   12.597   3.7593  172.725   25.810  125.109   20.329 47.61580 32.85488 
1 1 1   16    7   44 o   53.786   23.673  -0.7889   3.7791   4.4472   6.7258  -3.2046   4.5684   87.807   34.399   52.776   24.336 35.03049 42.13688 
1 1 1   16    7   45 o  293.655   9.7153   66.469   4.3668   64.946   5.4823   69.113   7.2227  289.632   12.366  297.253   15.933 -7.621155 20.16870 
1 1 1   16    7   46 f   89.147   22.321   6.5651   3.0388   4.3669   4.4258   8.5256   4.1798   78.581   28.515  100.870   26.666 -22.28935 39.04141 
1 1 1   16    7   47 o  263.382   10.184   53.565   4.1055   52.975   5.5088   54.301   6.1574  260.595   13.861  263.289   15.345 -2.693604 20.67856 
1 1 1   16    7   48 o   97.343   23.071   7.8912   3.3851   9.4190   4.7073   6.2553   4.8713  105.216   28.517   88.648   30.088 16.56901 41.45465 
1 1 1   16    7   49 o  189.916   13.529   28.234   3.9071   28.788   5.2378   27.540   5.8664  190.079   18.226  184.639   21.138 5.440109 27.91130 
1 1 1   16    7   50 o  282.540   10.913   61.859   4.7194   55.924   8.6243   64.396   5.6385  263.191   21.599  287.606   12.808 -24.41418 25.11098 
1 1 1   16    7   51 o  113.377   21.167   10.625   3.5381   14.371   5.3781   7.7666   4.6979  129.295   27.987   95.373   29.329 33.92175 40.53975 
1 1 1   16    7   52 o  135.725   17.575   14.852   3.5654   14.709   5.2533   14.975   4.8547  130.810   27.127  133.191   24.724 -2.380875 36.70353 
1 1 1   16    7   53 o   69.704   25.657   3.4946   3.6013   0.2186   5.4646   6.0097   4.7882   66.078   28.790   85.595   29.801 -19.51712 41.43610 
1 1 1   16    7   54 o   97.295   26.751   8.3080   4.1077   8.0106   7.4518   8.4378   4.9233   97.463   36.705   97.391   30.037 0.7144928E-01 47.42809 
1 1 1   16    7   55 o   68.783   25.959   3.3400   3.7320   10.414   4.9130  -6.3104   5.7383  107.370   29.147   52.546   25.144 54.82433 38.49369 
1 1 1   16    7   56 o   70.052   26.643   3.5369   3.9504   3.7533   4.7959   3.0803   6.9669   73.866   29.014   78.822   33.384 -4.956558 44.22979 
1 1 1   16    7   57 o   77.297   25.740   5.1868   3.5653   5.4128   4.7362   4.8913   5.4160   80.072   29.431   79.263   30.919 0.8083878 42.68644 
1 1 1   16    7   58 o   79.234   26.178   5.6100   3.6902   6.2577   4.3510   3.9501   6.9655   82.989   28.434   79.023   33.420 3.966019 43.87923 
1 1 1   16    7   59 o   86.462   23.693   6.7745   3.2286   10.369   4.4426   2.7513   4.7002  104.791   27.391   67.613   27.937 37.17825 39.12516 
1 1 1   16    8    1 o  1085.95   7.4988  902.814   12.464  896.946   17.505  908.849   17.752  1082.25   10.567  1089.40   10.646 -7.151978 15.00037 
1 1 1   16    8    2 o  351.184   4.6419   94.398   2.4952   99.244   3.6377   90.092   3.4290  360.062   6.6005  343.061   6.5302 17.00125 9.284958 
1 1 1   16    8    3 f  723.896   8.1794  401.197   9.0629  399.710   12.388  402.910   13.294  722.432   11.203  725.281   11.975 -2.848938 16.39832 
1 1 1   16    8    4 o  940.515   9.8693  677.352   14.208  682.152   20.192  672.646   19.994  943.575   13.981  936.980   13.941 6.594421 19.74422 
1 1 1   16    8    5 o  256.380   5.8761   50.315   2.3059   49.444   2.6083   53.430   4.9340  254.145   6.7051  264.109   12.205 -9.963547 13.92573 
1 1 1   16    8    6 o  1091.40   11.035  912.264   18.434  919.794   26.326  905.018   25.822  1095.49   15.700  1086.68   15.525 8.817505 22.07949 
1 1 1   16    8    7 o  824.244   7.6998  520.122   9.7142  517.082   11.897  526.202   16.827  821.758   9.4583  828.759   13.265 -7.000793 16.29194 
1 1 1   16    8    8 o  363.986   8.5285  101.438   4.7515  101.438   4.7515   0.0000   0.0000  363.986   8.5285  ?   ?  0.000000 8.528519 
1 1 1   16    8    9 o  575.388   8.5492  253.488   7.5293  253.488   7.5293   0.0000   0.0000  575.388   8.5492  ?   ?  0.000000 8.549154 
1 1 1   16    8   10 o  815.634   7.8430  509.331   9.7915  512.253   12.071  503.708   16.743  817.888   9.6420  810.810   13.491 7.078979 16.58267 
1 1 1   16    8   11 f  1205.93   9.8962  1113.68   18.267  1113.34   22.398  1114.33   31.567  1205.55   12.138  1205.52   17.108 0.3613281E-01 20.97612 
1 1 1   16    8   12 o  576.043   5.9761  254.011   5.2692  259.188   6.0580  237.925   10.679  581.863   6.8021  557.278   12.519 24.58441 14.24768 
1 1 1   16    8   13 o  278.188   6.8049   59.246   2.8976   59.548   3.2268   57.985   6.5843  278.888   7.5592  274.573   15.733 4.314789 17.45431 
1 1 1   16    8   14 o  363.113   6.3669  100.937   3.5387   99.887   3.9486  105.221   7.9759  361.206   7.1420  370.532   14.063 -9.326233 15.77273 
1 1 1   16    8   15 o  1121.93   7.2599  963.697   12.467  967.736   19.426  960.869   16.257  1123.97   11.292  1120.13   9.4821 3.839600 14.74477 
1 1 1   16    8   16 o   73.432   19.728   4.2797   2.2646   1.4131   2.8918   8.8252   3.6414   57.209   22.511  105.124   23.248 -47.91469 32.36068 
1 1 1   16    8   17 o  769.033   7.0143  452.793   8.2566  458.946   11.893  447.069   11.471  774.081   10.038  764.014   9.8093 10.06769 14.03512 
1 1 1   16    8   18 o  1182.01   7.0023  1069.69   12.669  1103.67   18.428  1039.24   17.445  1200.38   10.030  1164.84   9.7846 35.54224 14.01182 
1 1 1   16    8   19 o  366.871   5.9731  103.039   3.3542  103.393   4.9422  102.737   4.5669  367.435   8.7877  366.284   8.1459 1.150940 11.98244 
1 1 1   16    8   20 o   64.963   18.251   3.3270   1.8898   2.5666   3.9853   3.5475   2.1465   69.921   26.721   67.352   19.623 2.569557 33.15176 
1 1 1   16    8   21 o  499.162   5.9148  190.752   4.5191  212.404   6.7634  173.288   6.0740  526.642   8.3903  475.685   8.3423 50.95636 11.83175 
1 1 1   16    8   22 o  869.600   5.5892  578.917   7.4394  594.859   11.969  568.879   9.4968  881.280   8.8728  861.938   7.1983 19.34174 11.42549 
1 1 1   16    8   23 o  279.560   8.7841   59.862   3.7587   52.417   5.1373   68.439   5.5139  261.475   12.836  298.806   12.056 -37.33057 17.61005 
1 1 1   16    8   24 o  552.546   5.8227  233.748   4.9245  224.876   7.2388  241.391   6.7189  541.825   8.7284  561.417   7.8188 -19.59259 11.71835 
1 1 1   16    8   25 o  522.423   5.4381  208.953   4.3485  206.291   7.3379  210.393   5.3986  518.901   9.2388  524.169   6.7289 -5.267700 11.42949 
1 1 1   16    8   26 o  324.815   6.6822   80.795   3.3222   79.862   7.0525   81.061   3.7663  322.574   14.284  325.320   7.5636 -2.746063 16.16274 
1 1 1   16    8   27 o  574.750   5.4955  252.930   4.8345  256.845   8.2163  250.857   5.9791  578.929   9.2721  572.317   6.8255 6.612488 11.51344 
1 1 1   16    8   28 o  342.843   6.7787   90.027   3.5572   82.219   7.0772   92.667   4.1148  327.202   14.131  347.791   7.7297 -20.58917 16.10696 
1 1 1   16    8   29 o  267.730   8.0095   54.925   3.2823   53.477   8.0536   55.213   3.5943  262.558   20.195  268.399   8.7491 -5.841736 22.00849 
1 1 1   16    8   30 o  430.584   6.0036  142.000   3.9568  136.119   6.8722  144.916   4.8394  421.227   10.659  434.905   7.2698 -13.67822 12.90201 
1 1 1   16    8   31 o  229.403   8.5503   40.344   3.0023   37.038   5.7324   41.594   3.5243  218.559   17.276  232.862   9.8879 -14.30261 19.90583 
1 1 1   16    8   32 o  472.251   5.9727  170.839   4.3173  176.123   7.6332  168.353   5.2351  479.048   10.410  468.696   7.2973 10.35226 12.71306 
1 1 1   16    8   33 o  548.133   6.2323  230.193   5.2288  244.087   8.4907  221.705   6.6366  563.967   9.8360  537.731   8.0633 26.23645 12.71863 
1 1 1   16    8   34 o  255.922   8.8503   50.248   3.4668   50.611   6.1720   50.080   4.1904  255.679   15.849  255.349   10.721 0.3293152 19.13490 
1 1 1   16    8   35 o  346.763   6.8970   92.174   3.6607   90.732   5.0817   93.728   5.2778  343.775   9.6576  349.380   9.8693 -5.604919 13.80839 
1 1 1   16    8   36 o  320.168   6.5023   78.574   3.1865   78.386   5.0546   78.697   4.1049  319.402   10.339  320.254   8.3742 -0.8524780 13.30503 
1 1 1   16    8   37 o  182.270   10.586   25.626   2.9405   28.211   4.1906   23.119   4.1273  190.652   14.468  172.224   15.834 18.42732 21.44855 
1 1 1   16    8   38 o   93.571   18.343   7.0278   2.5332   10.339   4.0071   4.8238   3.2693  112.773   23.954   78.520   24.520 34.25359 34.27843 
1 1 1   16    8   39 o  371.469   6.5450  105.825   3.7213  111.051   5.9846  102.530   4.7517  379.950   10.291  365.380   8.4963 14.56921 13.34484 
1 1 1   16    8   40 o  228.563   8.7579   40.144   3.0639   37.974   5.0240   41.429   3.8661  220.956   14.943  231.935   10.890 -10.97853 18.49003 
1 1 1   16    8   41 o  137.949   16.460   14.993   3.4068   12.979   12.258   15.162   3.5466  129.182   47.368  138.585   17.081 -9.403137 50.35351 
1 1 1   16    8   42 o  191.614   11.667   28.445   3.4055   33.968   7.2032   26.855   3.8647  205.990   23.253  185.731   13.691 20.25885 26.98428 
1 1 1   16    8   43 o  343.962   7.6351   90.903   4.0197   93.088   5.5105   88.418   5.8766  347.495   10.360  338.423   11.345 9.072479 15.36358 
1 1 1   16    8   44 o   51.965   21.733   0.5141   2.8937  -0.1215   3.9839   1.2240   4.2101   57.544   24.826   64.002   26.443 -6.458324 36.27071 
1 1 1   16    8   45 o  214.853   9.9638   35.599   3.2767   39.402   4.7600   32.174   4.5174  224.822   13.901  202.863   14.647 21.95915 20.19317 
1 1 1   16    8   46 o  243.948   9.4666   45.880   3.5348   45.062   5.2231   46.571   4.8013  240.249   14.268  244.699   12.864 -4.449585 19.21076 
1 1 1   16    8   47 o  359.535   8.7608   99.593   4.8212   93.310   5.9562  111.533   8.2103  347.272   11.205  378.440   14.174 -31.16748 18.06840 
1 1 1   16    8   48 o  121.490   18.052   11.868   3.2549   8.5370   4.6968   14.946   4.5149  100.327   28.968  134.960   22.659 -34.63364 36.77757 
1 1 1   16    8   49 o  315.052   9.0240   76.582   4.3516   77.906   5.9032   75.007   6.4400  316.715   12.177  310.221   13.563 6.493958 18.22724 
1 1 1   16    8   50 o  182.048   12.618   25.911   3.4942   24.059   5.1478   27.494   4.7583  172.731   19.830  186.031   16.895 -13.30042 26.05124 
1 1 1   16    8   51 o  178.804   13.726   25.141   3.7279   28.908   6.1264   22.925   4.6977  188.252   21.656  168.871   18.476 19.38132 28.46678 
1 1 1   16    8   52 o   82.320   24.986   5.6935   3.4241  -0.0426   5.2309   9.9942   4.5294   64.335   28.095  107.238   27.472 -42.90383 39.29397 
1 1 1   16    8   53 o  148.069   16.943   17.656   3.7709   18.586   6.0632   17.070   4.8156  146.077   28.138  142.806   22.798 3.270996 36.21448 
1 1 1   16    8   54 o  161.373   18.336   21.191   4.4486   17.559   6.5784   24.252   6.0387  138.922   31.644  169.415   23.956 -30.49326 39.68913 
1 1 1   16    8   55 o  144.066   23.039   17.615   4.9093   11.722   6.5413   25.215   7.4284  111.133   34.680  167.639   30.054 -56.50535 45.89080 
1 1 1   16    8   56 o   87.316   25.644   6.7626   3.6528   3.7195   4.8715   10.671   5.5209   73.795   29.160  106.361   31.603 -32.56589 43.00079 
1 1 1   16    8   57 o   52.607   22.462   0.5911   3.1990   1.7688   4.4471  -0.6717   4.6050   63.972   26.860   57.003   25.545 6.968788 37.06752 
1 1 1   16    8   58 o  107.915   21.975   10.207   3.5064   9.6232   4.3793   11.249   5.8528  101.331   27.522  105.987   32.760 -4.655716 42.78660 
1 1 1   16    9    0 o  1765.21   15.975  2387.05   43.154  2387.05   43.154  2387.05   43.154  1765.21   15.975  1765.21   15.975 0.000000 0.000000 
1 1 1   16    9    1 o  194.056   8.3971   28.832   2.4942   28.832   2.4942   0.0000   0.0000  194.056   8.3971  ?   ?  0.000000 8.397125 
1 1 1   16    9    2 o  584.615   10.543  261.736   9.4341  261.736   9.4341   0.0000   0.0000  584.615   10.543  ?   ?  0.000000 10.54288 
1 1 1   16    9    3 o  796.672   8.8048  485.957   10.737  497.591   15.130  474.156   15.239  805.979   12.264  786.747   12.655 19.23102 17.62237 
1 1 1   16    9    4 o  991.965   8.2620  753.371   12.544  745.491   15.053  771.280   22.694  986.673   9.9675  1003.24   14.779 -16.56555 17.82607 
1 1 1   16    9    5 o  202.275   10.822   31.425   3.3383   25.665   4.5232   38.315   4.9474  182.247   16.390  223.133   14.566 -40.88620 21.92727 
1 1 1   16    9    6 o  832.375   9.4021  530.531   11.979  528.367   16.764  532.790   17.123  830.459   13.189  833.912   13.415 -3.453735 18.81207 
1 1 1   16    9    7 o  282.800   7.6127   61.229   3.2953   63.116   4.0014   57.251   5.8088  287.104   9.1055  272.988   13.948 14.11551 16.65742 
1 1 1   16    9    8 o  1729.79   15.988  2293.62   42.330  2293.62   42.330   0.0000   0.0000  1729.79   15.988  ?   ?  0.000000 15.98790 
1 1 1   16    9    9 o  663.457   7.2624  336.986   7.3750  339.149   9.0457  332.700   12.737  665.526   8.8799  658.997   12.627 6.528687 15.43678 
1 1 1   16    9   10 o  305.974   7.9730   71.679   3.7340   67.280   4.4267   82.530   6.9523  296.405   9.7572  328.180   13.840 -31.77548 16.93399 
1 1 1   16    9   11 o  362.059   5.8245  100.346   3.2278  102.472   3.5701   90.822   7.5546  365.868   6.3750  344.250   14.337 21.61758 15.69082 
1 1 1   16    9   12 o  238.742   6.7726   43.635   2.4749   43.542   2.6820   44.169   6.4222  238.480   7.3474  239.328   17.656 -0.8478394 19.12406 
1 1 1   16    9   13 o  456.660   5.9670  159.638   4.1708  160.745   4.6717  155.291   9.2581  458.226   6.6607  450.166   13.436 8.059448 14.99668 
1 1 1   16    9   14 o  879.106   7.0622  591.674   9.5028  596.471   10.898  576.460   19.410  882.613   8.0671  867.205   14.623 15.40814 16.70056 
1 1 1   16    9   15 o  935.811   8.3539  670.576   11.966  664.540   14.188  685.446   22.270  931.487   9.9511  945.528   15.388 -14.04089 18.32533 
1 1 1   16    9   16 o  538.837   6.7449  222.286   5.5629  215.194   7.8556  229.419   7.8787  530.071   9.6822  547.321   9.4047 -17.24994 13.49787 
1 1 1   16    9   17 o  795.210   10.239  484.372   12.462  484.372   12.462   0.0000   0.0000  795.210   10.239  ?   ?  0.000000 10.23880 
1 1 1   16    9   18 o  854.248   5.9060  558.648   7.7224  572.493   11.061  545.479   10.787  864.638   8.3575  843.993   8.3499 20.64520 11.81387 
1 1 1   16    9   19 o  419.824   5.7638  134.929   3.7038  127.567   5.2734  142.096   5.2032  408.140   8.4413  430.774   7.8914 -22.63382 11.55551 
1 1 1   16    9   20 o  387.666   6.0374  115.055   3.5824  119.612   5.2348  111.041   4.9130  395.198   8.6540  380.781   8.4295 14.41608 12.08097 
1 1 1   16    9   21 o  259.886   8.1770   51.724   3.2527   49.833   4.4906   53.812   4.7179  255.007   11.505  264.988   11.632 -9.981812 16.36050 
1 1 1   16    9   22 o  423.104   6.7760  137.071   4.3882  131.692   5.6508  145.244   6.9652  414.645   8.9035  435.390   10.452 -20.74438 13.72986 
1 1 1   16    9   23 o  223.845   10.060   38.391   3.4467   37.833   4.5940   39.110   5.2132  221.691   13.604  225.256   15.209 -3.564575 20.40583 
1 1 1   16    9   24 o  499.676   5.6225  191.155   4.3002  186.021   8.0890  193.177   5.0770  492.667   10.727  502.275   6.6038 -9.608551 12.59662 
1 1 1   16    9   25 f   76.810   19.597   4.7124   2.3115   10.515   5.4874   3.4606   2.5486  114.530   30.684   67.842   21.708 46.68798 37.58652 
1 1 1   16    9   26 o  320.091   6.2922   78.459   3.0828   79.156   5.6838   78.168   3.6694  321.285   11.558  319.458   7.5044 1.827332 13.78045 
1 1 1   16    9   27 o  418.309   6.0347  133.997   3.8639  138.028   7.6571  132.620   4.4754  424.194   11.793  416.110   7.0268 8.084015 13.72787 
1 1 1   16    9   28 o  137.002   12.434   14.523   2.5790   15.193   5.3827   14.323   2.9383  137.772   26.487  135.800   14.353 1.972107 30.12628 
1 1 1   16    9   29 f  325.093   7.0617   80.964   3.5139   84.660   8.3588   80.171   3.8727  331.688   16.464  323.460   7.8222 8.228119 18.22796 
1 1 1   16    9   30 o  273.533   7.3216   57.330   3.0654   62.568   6.0022   55.482   3.5654  285.324   13.744  269.023   8.6586 16.30072 16.24373 
1 1 1   16    9   31 o  818.430   5.8370  513.058   7.3121  546.803   12.410  495.112   9.0499  844.312   9.6026  803.790   7.3558 40.52155 12.09622 
1 1 1   16    9   32 o  457.919   5.9673  160.633   4.1825  161.134   7.4712  160.405   5.0476  458.149   10.654  457.491   7.2082 0.6570129 12.86342 
1 1 1   16    9   33 o  465.418   6.8773  166.011   4.8993  170.798   7.3599  162.202   6.5652  471.683   10.194  459.776   9.3289 11.90649 13.81847 
1 1 1   16    9   34 o  389.430   6.4532  116.221   3.8466  112.688   6.9543  117.778   4.6172  382.852   11.867  391.919   7.6968 -9.067810 14.14478 
1 1 1   16    9   35 o  542.049   6.6262  225.211   5.4976  229.328   8.4999  222.251   7.2082  546.409   10.163  538.165   8.7507 8.244446 13.41136 
1 1 1   16    9   36 f  138.934   15.307   15.081   3.2012   18.745   5.8055   13.481   3.8373  152.625   25.769  130.315   19.866 22.30978 32.53751 
1 1 1   16    9   37 f  346.623   6.9933   92.140   3.7103   91.748   6.7738   92.308   4.4347  345.048   12.826  346.786   8.3547 -1.738342 15.30696 
1 1 1   16    9   38 o  328.939   7.3304   83.012   3.6907   75.478   6.7643   86.206   4.4041  312.612   14.137  335.053   8.5876 -22.44064 16.54055 
1 1 1   16    9   39 o  218.296   10.228   36.662   3.4176   41.502   8.1171   35.619   3.7678  228.596   23.535  214.718   11.506 13.87872 26.19707 
1 1 1   16    9   40 o  430.337   6.9804  142.108   4.5979  138.582   8.9923  143.356   5.3502  423.298   13.879  432.025   8.0908 -8.727020 16.06503 
1 1 1   16    9   41 o  113.060   23.661   10.462   3.9631   26.057   8.8904   6.5940   4.4274  175.897   34.253   90.743   28.566 85.15443 44.60160 
1 1 1   16    9   42 o   61.358   25.044   1.2932   3.7190  -7.9919   6.6757   5.4716   4.4783   57.419   27.377   84.749   28.848 -27.33052 39.77118 
1 1 1   16    9   43 o  307.018   7.3084   72.405   3.4344   73.027   5.2016   71.924   4.5730  307.609   11.048  305.554   9.7779 2.055603 14.75313 
1 1 1   16    9   44 o  236.043   9.5322   42.926   3.4439   47.565   4.9775   38.666   4.7700  247.380   13.193  222.732   14.064 24.64761 19.28348 
1 1 1   16    9   45 o   55.856   22.061   1.4825   2.7870   0.2830   4.0735   2.5380   3.8213   59.477   25.370   67.271   26.046 -7.794308 36.35968 
1 1 1   16    9   46 o  269.037   9.0589   55.775   3.7304   55.205   5.2733   56.346   5.2779  266.719   12.917  269.497   12.795 -2.777710 18.18122 
1 1 1   16    9   47 o   46.023   21.308  -2.6975   3.5550  -0.2523   4.3425  -7.6663   6.1902   59.202   25.730   54.482   26.082 4.720562 36.63759 
1 1 1   16    9   48 o  149.233   15.176   17.585   3.4184   19.427   4.6405   15.400   5.0546  155.263   19.991  135.959   25.218 19.30447 32.18025 
1 1 1   16    9   49 o  120.773   18.109   11.762   3.2444   6.3869   4.7173   16.586   4.4692   88.657   29.611  142.696   21.098 -54.03938 36.35852 
1 1 1   16    9   50 o  286.413   9.3656   63.383   4.1058   66.934   6.5200   61.050   5.2854  292.359   14.570  280.119   12.327 12.24017 19.08537 
1 1 1   16    9   51 o  116.665   19.206   11.118   3.3102   7.2415   4.9574   14.238   4.4468   92.643   30.328  130.727   23.067 -38.08368 38.10373 
1 1 1   16    9   52 o  113.720   21.572   10.788   3.6176   11.324   4.9297   10.163   5.3252  113.690   28.409  107.007   30.830 6.682831 41.92352 
1 1 1   16    9   53 o  105.476   28.273   9.8383   4.6575  -8.9020   8.6481   17.494   5.5275   64.141   30.739  142.508   26.310 -78.36629 40.46125 
1 1 1   16    9   54 o   42.931   20.262  -3.3945   3.4800  -2.5500   4.6295  -4.4916   5.2766   53.315   24.554   53.184   25.055 0.1313095 35.08054 
1 1 1   16    9   55 o  199.911   12.194   31.484   3.7135   26.042   4.8530   39.171   5.7681  178.755   17.981  220.026   17.266 -41.27087 24.92870 
1 1 1   16    9   56 f   64.609   24.232   3.0240   3.2413   5.7873   4.4707  -0.0378   4.7060   81.906   28.780   59.777   26.359 22.12856 39.02708 
1 1 1   16    9   57 o  121.291   17.988   12.270   3.2382   10.912   4.4245   13.836   4.7521  109.154   26.702  123.885   25.895 -14.73106 37.19583 
1 1 1   16    9   58 o   50.601   22.222  -0.0342   3.3135   0.2077   4.0929  -0.4942   5.6445   56.218   24.693   62.155   28.031 -5.936672 37.35615 
1 1 1   16   10    0 o  1192.05   11.509  1088.24   20.995  1088.24   20.995  1088.24   20.995  1192.05   11.509  1192.05   11.509 0.000000 0.000000 
1 1 1   16   10    1 o  770.436   8.6030  454.473   10.145   0.0000   0.0000  454.473   10.145  ?   ?   770.436   8.6030 0.000000 8.603025 
1 1 1   16   10    2 o  610.059   7.9699  284.939   7.4420  284.983   10.238  284.889   10.837  610.001   10.965  609.873   11.609 0.1277466 15.96872 
1 1 1   16   10    3 o  664.282   6.6601  337.803   6.7718  329.463   7.9618  359.617   12.876  655.993   7.9294  685.172   12.278 -29.17841 14.61587 
1 1 1   16   10    4 o  246.515   7.0676   46.522   2.6668   45.144   3.0093   51.566   5.7555  242.823   8.0966  258.995   14.578 -16.17174 16.67540 
1 1 1   16   10    5 o  1056.75   8.7007  855.046   14.073  845.743   16.839  876.595   25.629  1050.87   10.469  1069.42   15.657 -18.54285 18.83480 
1 1 1   16   10    6 o  851.072   7.5936  554.538   9.8920  544.437   11.670  580.318   18.644  843.221   9.0419  870.250   13.997 -27.02881 16.66310 
1 1 1   16   10    7 f  1288.25   8.8504  1270.74   17.452  1307.23   20.641  1179.27   32.680  1306.49   10.322  1240.15   17.216 66.34912 20.07337 
1 1 1   16   10    8 o  593.336   6.5240  269.503   5.9250  269.503   5.9250   0.0000   0.0000  593.336   6.5240  ?   ?  0.000000 6.524033 
1 1 1   16   10    9 o  733.710   6.2952  412.101   7.0697  413.520   8.0534  407.333   14.762  734.943   7.1591  729.123   13.227 5.820374 15.04012 
1 1 1   16   10   10 o  360.927   5.8177   99.719   3.2139   99.526   3.5147  100.704   7.9411  360.569   6.3683  362.492   14.312 -1.923157 15.66528 
1 1 1   16   10   11 o  678.642   6.2279  352.565   6.4692  352.462   7.3210  352.935   13.818  678.516   7.0492  678.668   13.302 -0.1515503 15.05474 
1 1 1   16   10   12 o  438.634   5.9589  147.284   4.0007  146.107   4.3913  153.032   9.7038  436.866   6.5671  446.844   14.188 -9.978149 15.63401 
1 1 1   16   10   13 o  661.382   6.3041  334.868   6.3819  333.497   7.1641  340.135   14.045  660.002   7.0917  666.192   13.774 -6.189941 15.49238 
1 1 1   16   10   14 o  553.141   6.2018  234.228   5.2508  231.846   5.8324  244.419   12.063  550.300   6.9243  564.707   13.956 -14.40698 15.57890 
1 1 1   16   10   15 o  562.991   6.1981  242.647   5.3411  236.796   6.9505  251.085   8.3465  556.099   8.1657  572.577   9.5236 -16.47821 12.54501 
1 1 1   16   10   16 o  414.358   7.1198  131.454   4.5156  132.279   6.5005  130.684   6.2774  415.565   10.220  413.061   9.9287 2.504303 14.24855 
1 1 1   16   10   17 o  1075.05   7.2466  884.892   11.924  889.601   15.344  877.712   18.948  1077.75   9.3012  1070.30   11.566 7.443237 14.84194 
1 1 1   16   10   18 o  203.600   7.9251   31.742   2.4697   31.571   3.3957   31.935   3.5986  202.700   10.986  203.824   11.582 -1.124100 15.96380 
1 1 1   16   10   19 o  362.387   6.0504  100.539   3.3560  107.371   4.8185   94.101   4.6770  374.439   8.4073  350.528   8.7172 23.91037 12.11084 
1 1 1   16   10   20 o  441.588   6.1364  149.292   4.1476  153.777   5.5246  143.499   6.2787  448.112   8.0546  432.826   9.4773 15.28625 12.43773 
1 1 1   16   10   21 o  319.906   7.4188   78.367   3.6327   77.198   4.6480   80.203   5.8232  317.449   9.5659  323.490   11.761 -6.040894 15.15969 
1 1 1   16   10   22 o  688.909   7.0431  363.416   7.4267  369.751   10.462  356.982   10.544  694.705   9.8393  682.585   10.092 12.11938 14.09460 
1 1 1   16   10   23 o  240.999   8.9450   44.493   3.2996   48.517   5.4703   42.191   4.1370  251.070   14.294  234.608   11.521 16.46259 18.35846 
1 1 1   16   10   24 o  932.666   6.4336  666.082   9.1844  668.190   13.084  664.034   12.896  933.881   9.1530  930.983   9.0498 2.897644 12.87154 
1 1 1   16   10   25 o  333.913   7.0611   85.392   3.6089   84.321   5.4987   86.204   4.7833  331.650   10.832  335.406   9.3172 -3.756104 14.28785 
1 1 1   16   10   26 o  289.263   7.7542   64.098   3.4332   61.273   5.3293   66.101   4.4888  282.612   12.320  293.657   9.9866 -11.04526 15.85917 
1 1 1   16   10   27 o  231.256   7.9933   40.975   2.8294   40.739   5.6650   41.053   3.2658  229.621   16.223  231.434   9.2193 -1.812454 18.65926 
1 1 1   16   10   28 o   65.375   20.675   3.2466   2.3170   2.2037   4.5314   3.6158   2.6962   71.166   28.123   69.355   22.342 1.810440 35.91750 
1 1 1   16   10   29 f  561.443   6.0227  241.429   5.1757  247.744   11.000  239.633   5.8655  567.985   12.653  559.287   6.8518 8.697815 14.38913 
1 1 1   16   10   30 o  190.165   9.1263   27.730   2.6564   24.407   4.9819   29.050   3.1400  176.895   18.682  194.285   10.599 -17.39034 21.47957 
1 1 1   16   10   31 o  486.333   5.7150  181.165   4.2542  180.819   7.3095  181.343   5.2316  485.464   9.8370  486.466   7.0261 -1.001617 12.08854 
1 1 1   16   10   32 o   84.747   22.028   5.7783   2.8837   6.7607   5.0673   5.3078   3.5069   94.144   30.655   82.464   25.337 11.67956 39.77044 
1 1 1   16   10   33 o  185.703   10.349   26.561   2.9299   27.302   5.4476   26.260   3.4754  186.833   19.329  184.388   12.386 2.444504 22.95703 
1 1 1   16   10   34 o  179.636   10.282   24.864   2.8154   28.511   5.5789   23.618   3.2612  190.865   19.365  174.807   12.266 16.05824 22.92250 
1 1 1   16   10   35 o  617.657   6.4857  292.420   6.1316  317.476   9.4962  274.503   8.0300  642.973   9.6491  598.053   8.7721 44.91974 13.04050 
1 1 1   16   10   36 o   79.088   22.689   5.0025   2.8897   11.396   5.6046   2.6874   3.3726  117.662   30.770   66.447   24.758 51.21514 39.49374 
1 1 1   16   10   37 o  220.135   8.9625   37.217   3.0199   29.969   6.0879   39.583   3.4779  195.033   20.710  226.925   10.013 -31.89215 23.00380 
1 1 1   16   10   38 o   99.503   18.661   7.9430   2.7378   14.515   5.8517   6.1013   3.0977  132.544   29.593   86.663   22.979 45.88123 37.46658 
1 1 1   16   10   39 o  107.807   19.080   9.3182   3.0332   23.247   8.0128   6.9884   3.2771  167.268   32.468   92.496   23.190 74.77268 39.89925 
1 1 1   16   10   40 o  196.579   12.683   29.967   3.7959   35.964   6.6145   27.022   4.6352  213.316   20.511  185.773   16.472 27.54332 26.30639 
1 1 1   16   10   41 o  312.289   10.196   75.120   4.8739   71.337   10.267   76.221   5.5376  299.833   22.537  314.291   11.511 -14.45770 25.30622 
1 1 1   16   10   42 o  233.999   9.8199   42.174   3.5172   44.831   7.1986   41.341   4.0311  238.132   19.933  231.423   11.380 6.708862 22.95283 
1 1 1   16   10   43 o  345.093   6.9588   91.451   3.6757   88.106   5.6030   93.979   4.8702  337.906   10.833  349.407   9.1063 -11.50064 14.15214 
1 1 1   16   10   44 o  145.361   13.770   16.542   3.0271   20.945   4.4210   12.656   4.1535  162.514   18.079  124.485   22.632 38.02878 28.96687 
1 1 1   16   10   45 o  278.149   8.1841   59.528   3.4843   60.836   5.3243   58.547   4.6081  280.219   12.413  275.273   10.937 4.945862 16.54415 
1 1 1   16   10   46 o  353.272   7.7075   95.997   4.1677   95.972   6.0331   96.019   5.7641  352.244   11.190  352.495   10.683 -0.2509155 15.47090 
1 1 1   16   10   47 o  209.347   11.886   34.079   3.7929   36.980   5.1139   30.531   5.6548  216.932   15.504  195.650   19.127 21.28145 24.62155 
1 1 1   16   10   48 o  117.130   19.791   11.162   3.4217   4.6920   4.6404   18.873   5.0655   80.327   29.191  151.968   22.453 -71.64100 36.82735 
1 1 1   16   10   49 o   80.138   24.318   5.2884   3.2437   7.0292   4.9472   3.9758   4.2960   92.185   30.303   75.550   27.983 16.63543 41.24696 
1 1 1   16   10   50 o   51.639   22.875  -0.8101   3.5842  -0.6382   4.9248  -1.0038   5.2261   61.195   26.976   61.972   27.529 -0.7770844 38.54300 
1 1 1   16   10   51 o  114.008   21.196   10.778   3.5627   8.8337   4.8090   13.143   5.3041  100.759   29.376  122.841   28.723 -22.08133 41.08490 
1 1 1   16   10   52 f  117.301   20.731   11.412   3.5860   14.156   4.9325   8.3359   5.2228  128.433   25.983   97.610   31.059 30.82295 40.49449 
1 1 1   16   10   53 o   79.930   27.285   5.2549   4.0062   0.9833   8.5233   6.4663   4.5389   80.682   35.531   87.102   29.044 -6.419708 45.89158 
1 1 1   16   10   54 o  128.833   16.909   13.482   3.2539   10.738   4.6373   16.142   4.5669  109.868   27.609  138.431   22.312 -28.56293 35.49726 
1 1 1   16   10   55 o  111.630   21.213   10.576   3.4920   7.0471   4.6058   15.348   5.3555   89.057   29.237  131.102   27.563 -42.04447 40.18102 
1 1 1   16   10   56 o  162.760   14.571   21.306   3.5917   27.727   5.1526   15.238   5.0093  183.148   18.640  130.747   25.946 52.40120 31.94805 
1 1 1   16   10   57 o   83.356   23.773   6.2029   3.1815   6.7342   4.3393   5.5853   4.6785   85.704   28.390   80.194   29.285 5.510353 40.78728 
1 1 1   16   10   58 o  148.891   16.573   18.305   3.7129   16.065   4.4200   23.676   6.8437  135.744   22.028  158.493   29.289 -22.74930 36.64826 
1 1 1   16   11    0 o  700.110   8.3564  375.365   8.9519  375.365   8.9519  375.365   8.9519  700.110   8.3564  700.110   8.3564 0.000000 0.000000 
1 1 1   16   11    1 o  630.610   6.5377  304.424   6.3104  298.912   10.867  307.229   7.7513  624.703   11.365  633.466   7.9943 -8.762512 13.89465 
1 1 1   16   11    2 o  346.602   6.3057   91.963   3.3453   91.807   3.8915   92.403   6.5479  346.293   7.3418  347.306   12.317 -1.013794 14.33953 
1 1 1   16   11    3 o  689.518   6.8392  363.966   7.2181  358.661   8.5505  377.122   13.465  684.430   8.1620  701.620   12.538 -17.19019 14.96035 
1 1 1   16   11    4 o  123.963   11.849   11.879   2.2209   11.643   2.4636   12.903   5.1317  122.546   13.350  127.141   27.193 -4.595421 30.29321 
1 1 1   16   11    5 o  1117.80   9.0861  956.763   15.546  948.354   18.639  975.982   28.178  1112.74   10.944  1128.30   16.316 -15.55139 19.64630 
1 1 1   16   11    6 o  740.649   7.1415  419.964   8.0960  409.934   9.4382  447.897   15.751  731.703   8.4273  764.555   13.459 -32.85254 15.88004 
1 1 1   16   11    7 o  634.500   6.7552  308.203   6.5605  308.203   6.5605   0.0000   0.0000  634.500   6.7552  ?   ?  0.000000 6.755208 
1 1 1   16   11    8 o  738.003   6.3457  416.942   7.1682  420.531   8.1806  405.075   14.876  741.142   7.2113  727.079   13.367 14.06354 15.18828 
1 1 1   16   11    9 o  488.149   5.7951  182.409   4.3300  179.523   4.7750  195.761   10.271  484.259   6.4421  505.447   13.276 -21.18811 14.75638 
1 1 1   16   11   10 o  319.582   8.3907   78.203   4.1044   74.909   4.7562   87.810   8.1232  312.748   9.9356  338.431   15.682 -25.68280 18.56410 
1 1 1   16   11   11 o  1081.94   7.9169  896.281   13.111  894.435   14.964  902.383   27.200  1080.75   9.0458  1084.80   16.381 -4.049072 18.71306 
1 1 1   16   11   12 o  395.584   6.0870  119.795   3.6856  118.651   4.0299  125.645   9.1135  393.679   6.6877  404.854   14.707 -11.17499 16.15591 
1 1 1   16   11   13 o  426.187   6.2227  139.050   4.0593  141.311   4.4754  128.562   9.6396  429.625   6.8057  409.485   15.380 20.13959 16.81836 
1 1 1   16   11   14 o  393.565   7.0336  118.589   4.2371  117.191   4.6965  124.703   9.8221  391.219   7.8431  403.254   15.913 -12.03470 17.74100 
1 1 1   16   11   15 o  740.426   8.2263  419.805   9.3230  419.784   11.203  419.851   16.815  740.315   9.8862  739.997   14.845 0.3181763 17.83602 
1 1 1   16   11   16 o  535.196   5.8603  219.277   4.8006  212.140   5.8300  234.309   8.4607  526.373   7.2361  553.080   9.9942 -26.70673 12.33877 
1 1 1   16   11   17 o  1126.73   7.4969  972.067   12.929  977.429   16.574  963.731   20.665  1129.65   9.5854  1121.44   12.039 8.210571 15.38864 
1 1 1   16   11   18 o  308.685   7.0523   72.958   3.3321   76.548   4.0899   65.871   5.7465  316.156   8.4515  293.152   12.807 23.00470 15.34417 
1 1 1   16   11   19 o  962.773   6.3270  709.673   9.3238  700.338   12.852  720.045   13.547  956.246   8.7807  969.577   9.1284 -13.33124 12.66608 
1 1 1   16   11   20 o  484.915   7.7393  180.070   5.7443  173.334   6.8993  195.290   10.371  475.685   9.4758  504.678   13.426 -28.99216 16.43280 
1 1 1   16   11   21 o  555.872   6.9899  236.605   5.9473  231.984   8.0302  242.219   8.8511  550.290   9.5338  562.252   10.285 -11.96204 14.02389 
1 1 1   16   11   22 o  289.526   7.0725   64.191   3.1342   67.418   4.4955   61.138   4.3720  296.631   9.9013  282.469   10.112 14.16156 14.15237 
1 1 1   16   11   23 o  857.739   6.1776  563.331   8.1105  563.061   11.484  563.600   11.456  857.321   8.7513  857.734   8.7261 -0.4128418 12.35838 
1 1 1   16   11   24 o  604.595   5.8963  279.887   5.4565  289.588   7.9215  271.128   7.5270  614.827   8.4175  594.919   8.2660 19.90808 11.79748 
1 1 1   16   11   25 o  328.397   7.0829   82.599   3.5602   87.862   5.2749   78.196   4.8250  338.557   10.179  319.406   9.8693 19.15137 14.17813 
1 1 1   16   11   26 o  271.590   7.9365   56.512   3.2993   60.978   5.0086   53.088   4.3850  281.945   11.606  263.110   10.889 18.83578 15.91402 
1 1 1   16   11   27 o  263.222   8.5210   53.098   3.4331   58.851   5.6974   49.819   4.3018  276.831   13.446  254.846   11.028 21.98563 17.38998 
1 1 1   16   11   28 o  466.644   6.2559  166.788   4.4683  162.259   6.4600  170.942   6.1871  460.050   9.1740  472.252   8.5594 -12.20193 12.54695 
1 1 1   16   11   29 o  837.707   7.1464  537.687   9.1632  586.799   16.388  515.350   11.052  874.144   12.248  819.874   8.8071 54.26978 15.08600 
1 1 1   16   11   30 o  326.547   6.9645   81.707   3.4810   78.180   5.6815   83.826   4.4046  319.076   11.633  330.643   8.7031 -11.56665 14.52835 
1 1 1   16   11   31 o  668.337   6.0943  342.195   6.2343  348.524   9.5279  337.456   8.2440  674.044   9.2350  663.432   8.1184 10.61298 12.29613 
1 1 1   16   11   32 o  165.711   10.871   21.180   2.7421   24.228   5.1140   19.949   3.2486  175.926   19.309  160.479   13.346 15.44701 23.47270 
1 1 1   16   11   33 o  584.913   5.6562  262.103   5.0639  272.930   8.7470  256.646   6.2104  596.292   9.5837  578.630   7.0121 17.66187 11.87506 
1 1 1   16   11   34 o  455.757   5.9291  159.164   4.1361  177.393   7.4625  151.081   4.9693  480.573   10.145  443.890   7.3139 36.68341 12.50656 
1 1 1   16   11   35 o  306.082   9.6514   71.957   4.5217   80.174   6.1884   62.545   6.6229  322.691   12.529  284.201   15.281 38.49045 19.76067 
1 1 1   16   11   36 o  320.989   6.8886   79.010   3.3845   85.792   6.3908   76.367   3.9899  333.719   12.511  315.436   8.2638 18.28296 14.99419 
1 1 1   16   11   37 o  176.271   10.715   23.991   2.8773   13.055   6.3005   26.873   3.2342  125.301   32.556  186.492   11.385 -61.19106 34.48889 
1 1 1   16   11   38 o   95.594   23.399   7.4623   3.3961   13.020   6.4149   5.2979   4.0031  124.826   33.053   83.030   27.257 41.79591 42.84228 
1 1 1   16   11   39 o  147.347   16.093   17.040   3.5704   24.482   6.6765   14.060   4.2254  174.046   25.847  132.289   21.614 41.75667 33.69352 
1 1 1   16   11   40 o  212.824   9.7928   34.862   3.1900   38.234   6.6378   33.849   3.6377  220.092   19.920  209.195   11.404 10.89658 22.95277 
1 1 1   16   11   41 o  267.823   9.1509   55.191   3.7513   63.287   10.401   53.981   4.0220  281.298   24.400  264.745   9.9252 16.55295 26.34100 
1 1 1   16   11   42 o   84.153   22.651   5.8000   2.9821   9.2511   6.3780   4.8344   3.3736  106.237   34.378   78.293   24.967 27.94453 42.48764 
1 1 1   16   11   43 o  209.279   10.833   33.892   3.4582   41.531   7.0190   31.443   3.9741  228.764   20.255  201.068   12.982 27.69557 24.05840 
1 1 1   16   11   44 o   43.621   20.302  -2.8109   3.2924  -2.7241   6.4887  -2.8409   3.8207   66.018   29.888   47.941   22.159 18.07711 37.20632 
1 1 1   16   11   45 o  130.140   18.492   13.566   3.5799   17.663   7.1756   12.208   4.1307  142.996   33.390  121.911   22.979 21.08484 40.53325 
1 1 1   16   11   46 f  165.069   14.419   21.384   3.6066   25.831   7.4202   20.008   4.1268  175.784   28.558  158.777   17.259 17.00693 33.36825 
1 1 1   16   11   47 o  190.260   23.166   29.448   6.6072   21.447   11.750   33.147   7.9899  150.375   46.408  200.128   26.753 -49.75243 53.56709 
1 1 1   16   11   48 o  177.087   14.020   24.612   3.7691   18.380   5.4999   30.130   5.1755  148.741   25.048  194.741   17.552 -46.00066 30.58518 
1 1 1   16   11   49 o  122.535   22.271   12.413   4.0232   12.455   4.6440   12.284   8.0544  121.375   25.793  117.374   38.669 4.000664 46.48194 
1 1 1   16   11   50 o  207.992   12.310   33.799   3.9016   40.572   5.6696   27.707   5.3774  226.173   16.491  185.488   19.219 40.68565 25.32440 
1 1 1   16   11   51 o   70.889   24.644   3.8674   3.2738   12.204   5.0619  -2.1268   4.2923  118.288   28.331   52.642   24.017 65.64653 37.14148 
1 1 1   16   11   52 o   58.969   24.481   1.1825   3.6337   8.2893   6.8170  -1.6382   4.2947   98.411   35.437   53.766   24.331 44.64541 42.98582 
1 1 1   16   11   53 o   87.723   24.525   6.6391   3.4212   9.1459   5.4798   5.0379   4.3797  100.752   31.788   79.475   28.427 21.27647 42.64497 
1 1 1   16   11   54 o   47.750   21.269  -0.7505   3.1406  -5.6313   4.5017   3.8775   4.3835   45.812   22.014   73.592   28.048 -27.78024 35.65489 
1 1 1   16   11   55 o  124.829   18.362   12.898   3.4035   12.357   4.6190   13.541   5.0343  117.773   26.289  122.657   27.495 -4.884125 38.04066 
1 1 1   16   11   56 o   58.358   23.034   2.0536   3.0365   3.7156   4.1383   0.1152   4.4694   70.799   27.188   58.628   25.776 12.17114 37.46432 
1 1 1   16   11   57 o   67.661   23.767   3.7832   3.0487   4.4716   4.0735   2.9066   4.5969   73.626   27.253   68.368   27.868 5.258141 38.97869 
1 1 1   16   12    0 o  556.003   11.320  236.984   9.6246  236.984   9.6246  236.984   9.6246  556.003   11.320  556.003   11.320 0.000000 0.000000 
1 1 1   16   12    1 o  967.491   8.2162  716.687   12.167  707.507   14.607  737.492   21.990  961.176   9.9284  980.953   14.646 -19.77765 17.69373 
1 1 1   16   12    2 o  948.860   8.1246  689.344   11.800  693.596   14.398  680.646   20.591  951.681   9.8844  942.420   14.275 9.260620 17.36300 
1 1 1   16   12    3 o  826.530   7.5122  523.024   9.5038  515.861   11.302  540.319   17.561  820.782   8.9961  839.716   13.663 -18.93311 16.35877 
1 1 1   16   12    4 o  509.010   6.4207  198.342   5.0024  193.887   5.7633  211.949   10.073  503.236   7.4822  525.974   12.512 -22.73822 14.57854 
1 1 1   16   12    5 o  1118.92   9.1300  958.711   15.637  960.762   18.949  954.335   27.682  1119.97   11.054  1115.68   16.210 4.290894 19.62059 
1 1 1   16   12    6 o  653.644   8.1270  327.131   8.1310  327.131   8.1310   0.0000   0.0000  653.644   8.1270  ?   ?  0.000000 8.127021 
1 1 1   16   12    7 f  799.322   6.6161  489.122   8.0945  491.181   9.2426  482.344   16.769  800.966   7.5390  793.352   13.809 7.613220 15.73320 
1 1 1   16   12    8 o  510.229   5.8791  199.287   4.5914  195.914   5.0483  215.431   11.044  505.878   6.5198  530.207   13.609 -24.32843 15.08993 
1 1 1   16   12    9 o  510.586   5.9800  199.568   4.6735  199.257   5.1770  200.937   10.864  510.173   6.6296  512.041   13.862 -1.867981 15.36539 
1 1 1   16   12   10 o  861.444   8.2833  568.221   10.922  559.016   13.035  589.918   20.011  854.339   9.9678  877.232   14.903 -22.89325 17.92946 
1 1 1   16   12   11 o  719.336   7.9159  396.198   8.7157  388.113   10.316  416.369   16.293  711.884   9.4673  737.006   14.443 -25.12195 17.26924 
1 1 1   16   12   12 o  779.457   8.1408  465.213   9.7125  459.423   11.665  478.297   17.535  774.498   9.8402  789.893   14.504 -15.39478 17.52679 
1 1 1   16   12   13 o  659.948   7.9220  333.489   8.0022  333.710   9.5912  332.982   14.516  660.093   9.4928  659.059   14.390 1.034302 17.23914 
1 1 1   16   12   14 o  840.011   10.492  540.521   13.489  556.037   19.040  524.884   19.114  851.612   14.607  827.362   15.093 24.25024 21.00407 
1 1 1   16   12   15 o  479.508   6.5347  176.033   4.7961  175.472   5.2561  178.820   11.724  478.726   7.1730  482.850   15.863 -4.124481 17.40965 
1 1 1   16   12   16 o  407.585   6.0810  127.181   3.7937  130.330   4.6112  120.585   6.6738  412.570   7.3021  396.724   10.990 15.84552 13.19512 
1 1 1   16   12   17 o  728.271   10.331  406.315   11.516   0.0000   0.0000  406.315   11.516  ?   ?   728.271   10.331 0.000000 10.33105 
1 1 1   16   12   18 o  478.008   6.7877  174.948   4.9663  173.592   6.4982  176.852   7.7006  476.073   8.9177  480.453   10.471 -4.379181 13.75408 
1 1 1   16   12   19 o  256.608   9.3032   50.440   3.6540   49.258   4.3612   53.223   6.6934  253.532   11.238  262.800   16.727 -9.267700 20.15180 
1 1 1   16   12   20 f  648.581   6.7877  322.099   6.7384  322.421   7.7711  321.123   13.528  648.850   7.8247  647.095   13.658 1.755005 15.74090 
1 1 1   16   12   21 o  636.142   5.6839  309.824   5.5344  299.143   7.5381  322.314   8.1515  624.970   7.8802  648.703   8.2096 -23.73254 11.37954 
1 1 1   16   12   22 o  289.244   7.1315   64.070   3.1573   61.810   4.3753   66.524   4.5606  284.007   10.065  294.635   10.113 -10.62842 14.26772 
1 1 1   16   12   23 o  637.030   5.8222  310.718   5.6770  309.701   7.9835  311.758   8.0742  635.839   8.2031  637.941   8.2689 -2.102905 11.64761 
1 1 1   16   12   24 o  937.459   6.4665  673.011   9.2788  701.417   13.575  648.106   12.712  956.714   9.2704  919.669   9.0302 37.04498 12.94157 
1 1 1   16   12   25 o  445.414   6.2121  151.933   4.2352  156.233   6.1099  147.955   5.8759  451.523   8.8407  439.405   8.7365 12.11758 12.42917 
1 1 1   16   12   26 o  352.209   7.1381   95.028   3.8482   94.549   5.9561   95.371   5.0418  351.087   11.083  352.726   9.3385 -1.639648 14.49310 
1 1 1   16   12   27 o  313.994   7.3201   75.536   3.5181   79.584   5.1759   72.061   4.7965  322.112   10.498  306.527   10.223 15.58466 14.65337 
1 1 1   16   12   28 o  313.746   8.4178   75.454   4.0425   68.832   7.5404   78.125   4.7888  298.535   16.567  319.161   9.8028 -20.62585 19.24967 
1 1 1   16   12   29 o  273.649   9.0316   57.424   3.7829   59.711   5.1076   54.644   5.6302  278.838   11.967  266.229   13.864 12.60944 18.31498 
1 1 1   16   12   30 o  142.956   13.767   15.863   2.9751   21.249   4.7086   12.283   3.8383  164.774   19.019  124.328   20.912 40.44611 28.26701 
1 1 1   16   12   31 o  306.691   7.6028   72.106   3.5690   79.965   5.4925   66.363   4.6953  322.663   11.121  294.007   10.434 28.65643 15.24933 
1 1 1   16   12   32 o  359.909   7.6897   99.319   4.2362  102.623   5.9815   95.994   6.0002  365.529   10.691  353.479   11.090 12.05051 15.40409 
1 1 1   16   12   33 o  142.195   13.877   15.721   2.9818   9.6751   4.7294   19.710   3.8415  108.946   28.157  159.006   16.001 -50.05938 32.38630 
1 1 1   16   12   34 o  266.688   10.260   54.644   4.1880   53.584   5.5483   56.047   6.3849  263.320   13.814  268.970   15.576 -5.649963 20.81899 
1 1 1   16   12   35 o  238.651   7.8277   43.696   2.8593   51.537   5.6731   41.026   3.3106  258.027   14.422  231.122   9.3583 26.90582 17.19216 
1 1 1   16   12   36 o  194.731   9.3490   29.132   2.7866   29.844   5.7272   28.911   3.1896  194.943   19.454  193.569   10.808 1.373627 22.25480 
1 1 1   16   12   37 f  154.580   14.779   18.641   3.4541   24.225   6.3111   16.254   4.1271  173.915   24.378  143.238   19.317 30.67696 31.10377 
1 1 1   16   12   38 o  189.679   13.050   27.907   3.7658   20.328   6.3266   32.066   4.6865  157.988   27.140  202.924   15.199 -44.93561 31.10634 
1 1 1   16   12   39 o  445.329   6.4210  152.132   4.3768  152.280   7.8186  152.064   5.2819  444.400   11.494  444.991   7.7548 -0.5910950 13.86564 
1 1 1   16   12   40 o  173.496   10.895   23.295   2.8786   29.937   5.8672   21.189   3.3035  194.442   19.999  164.999   13.191 29.44308 23.95733 
1 1 1   16   12   41 o  158.733   13.286   19.639   3.1984   0.9614   9.8991   21.816   3.3797   90.884   39.172  167.353   13.304 -76.46912 41.36985 
1 1 1   16   12   42 o  501.815   6.4813  193.283   4.9783  202.020   8.8584  189.251   6.0186  511.507   11.315  496.194   7.9245 15.31244 13.81362 
1 1 1   16   12   43 o   99.434   21.619   8.1111   3.1965  -0.0965   6.0836   11.241   3.7569   70.432   30.532  117.465   21.694 -47.03339 37.45463 
1 1 1   16   12   44 o  267.699   9.8707   55.266   4.0445   58.058   7.2432   54.001   4.8753  271.638   17.514  264.121   12.060 7.516968 21.26451 
1 1 1   16   12   45 o  248.618   10.054   47.707   3.8260   51.229   7.6290   46.523   4.4223  253.888   19.788  245.128   11.787 8.759995 23.03221 
1 1 1   16   12   46 o   88.828   32.858   5.6814   5.9196  -2.1146   11.255   8.6629   6.9601   88.211   39.700  103.217   35.930 -15.00600 53.54522 
1 1 1   16   12   47 o  248.930   12.133   48.090   4.6227   42.441   7.7782   51.176   5.7480  229.093   22.471  255.546   14.758 -26.45357 26.88414 
1 1 1   16   12   48 o  287.222   11.112   63.929   4.8851   66.997   8.7264   62.529   5.8954  289.553   19.809  283.185   13.601 6.367920 24.02845 
1 1 1   16   12   49 o   50.389   22.660  -1.3830   3.6582  -1.8260   8.1479  -1.2712   4.0940   75.084   33.787   53.940   24.135 21.14354 41.52217 
1 1 1   16   12   50 o  138.202   19.704   15.553   4.0501   27.077   11.357   13.874   4.3351  166.731   43.899  129.129   22.765 37.60181 49.45093 
1 1 1   16   12   51 o  152.356   16.481   18.587   3.7821   14.486   6.9834   20.290   4.4990  125.497   35.023  158.164   18.962 -32.66760 39.82651 
1 1 1   16   12   52 o  208.532   12.623   34.168   4.0100   22.562   7.1758   39.438   4.8354  159.432   30.517  223.327   14.220 -63.89452 33.66716 
1 1 1   16   12   53 o   69.125   26.501   3.2165   3.9279  -3.2843   8.4574   5.0043   4.4352   71.563   33.039   79.301   28.581 -7.738968 43.68563 
1 1 1   16   12   54 o   71.743   24.796   4.1605   3.3121   2.1460   4.4851   6.5767   4.9121   66.613   27.382   87.179   30.194 -20.56621 40.76062 
1 1 1   16   12   55 o   67.093   24.321   3.4855   3.2183   8.7471   4.6290  -1.4373   4.4776   97.476   28.932   54.503   24.736 42.97332 38.06492 
1 1 1   16   12   56 o  110.483   19.864   10.387   3.2357   15.871   4.4186   4.0460   4.7514  135.702   22.028   73.839   28.916 61.86323 36.35083 
1 1 1   16   12   57 o   59.373   23.584   2.1879   3.2019   3.0454   4.2639   1.0791   4.8485   67.560   27.089   62.900   27.262 4.659359 38.43189 
1 1 1   16   13    0 o  224.947   9.2200   38.932   3.1624   38.932   3.1624   38.932   3.1624  224.947   9.2200  224.947   9.2200 0.000000 0.000000 
1 1 1   16   13    1 o  356.388   6.7666   97.236   3.6912   99.096   4.3390   92.365   7.0221  359.760   7.8797  347.191   13.214 12.56879 15.38483 
1 1 1   16   13    2 o  1071.08   8.8566  878.469   14.520  882.004   17.714  871.231   25.346  1073.09   10.785  1066.05   15.533 7.043213 18.91022 
1 1 1   16   13    3 o  991.569   8.4341  752.843   12.801  733.205   15.069  803.750   24.261  978.446   10.062  1023.93   15.480 -45.48706 18.46270 
1 1 1   16   13    4 o  695.562   7.0513  370.396   7.5071  363.370   8.8125  388.981   14.333  688.884   8.3577  712.485   13.143 -23.60168 15.57525 
1 1 1   16   13    5 f   79.736   20.214   5.0690   2.4704   5.0690   2.4704   0.0000   0.0000   79.736   20.214  ?   ?  0.000000 20.21384 
1 1 1   16   13    6 o  361.951   6.7328  100.296   3.7300   96.794   4.1833  113.880   8.2394  355.558   7.6866  385.473   13.965 -29.91498 15.94040 
1 1 1   16   13    7 o  878.270   6.9710  590.544   9.3712  585.073   10.598  610.153   20.064  874.146   7.9210  892.178   14.692 -18.03235 16.69152 
1 1 1   16   13    8 o  426.857   5.9954  139.483   3.9171  137.997   4.3051  146.633   9.4418  424.564   6.6248  437.390   14.103 -12.82651 15.58165 
1 1 1   16   13    9 o  898.306   7.1088  617.814   9.7744  609.481   10.982  649.588   21.443  892.179   8.0417  920.472   15.220 -28.29407 17.21364 
1 1 1   16   13   10 o  467.842   7.9250  167.592   5.6750  164.018   6.6033  177.691   11.100  462.783   9.3221  481.419   15.063 -18.63654 17.71449 
1 1 1   16   13   11 o  489.761   7.8739  183.665   5.9026  186.140   6.9300  177.126   11.266  493.005   9.1836  480.628   15.314 12.37704 17.85628 
1 1 1   16   13   12 o  441.763   8.1589  149.437   5.5168  152.489   6.4862  141.456   10.490  446.206   9.4970  429.468   15.958 16.73865 18.57034 
1 1 1   16   13   13 o  609.352   14.758  284.701   13.765   0.0000   0.0000  284.701   13.765  ?   ?   609.352   14.758 0.000000 14.75788 
1 1 1   16   13   14 o  1185.38   9.8873  1076.30   17.939  1067.04   21.382  1098.33   32.968  1180.05   11.838  1196.25   18.005 -16.20508 21.54835 
1 1 1   16   13   15 o  152.135   12.406   17.856   2.8637   17.998   3.0124   16.517   9.2290  152.683   13.014  143.818   40.307 8.865234 42.35551 
1 1 1   16   13   16 o  226.137   9.4379   39.170   3.2668   37.436   3.4637   53.128   9.8276  221.059   10.237  261.548   24.847 -40.48857 26.87323 
1 1 1   16   13   17 o  376.696   6.4010  108.642   3.6907  108.594   4.4192  108.755   6.7099  376.578   7.6669  376.712   11.637 -0.1344604 13.93553 
1 1 1   16   13   18 o  435.855   6.2721  145.447   4.1843  146.014   5.1095  144.293   7.2911  436.660   7.6448  433.937   10.977 2.723206 13.37698 
1 1 1   16   13   19 o  629.776   6.6991  303.689   6.4576  317.877   7.6411  268.230   12.080  644.265   7.7486  591.429   13.344 52.83594 15.43050 
1 1 1   16   13   20 o  347.198   7.0345   92.310   3.7383   91.930   4.5582   93.091   6.5337  346.431   8.5961  348.454   12.250 -2.022461 14.96535 
1 1 1   16   13   21 o   94.433   19.163   7.1038   2.6752   8.7985   3.2062   3.2206   4.8533  105.132   20.661   77.390   29.508 27.74231 36.02238 
1 1 1   16   13   22 o   74.839   20.625   4.4437   2.4385   1.8546   3.2975   7.5683   3.6225   62.174   24.161   97.159   24.394 -34.98528 34.33395 
1 1 1   16   13   23 o  187.758   9.5684   27.088   2.7407   29.785   3.7982   24.158   3.9587  196.629   12.688  176.762   14.767 19.86697 19.46902 
1 1 1   16   13   24 f  460.802   6.0592  162.606   4.2736  163.174   6.0349  162.033   6.0528  461.467   8.5439  459.847   8.5995 1.619873 12.12230 
1 1 1   16   13   25 o  236.270   8.2848   42.776   2.9961   39.391   4.2572   46.098   4.2174  226.222   12.341  245.142   11.240 -18.91972 16.69258 
1 1 1   16   13   26 o  164.376   11.406   20.831   2.8521   16.685   4.2659   24.182   3.8352  145.816   19.611  176.826   14.292 -31.00958 24.26605 
1 1 1   16   13   27 o  428.767   7.5343  140.871   4.9446  142.304   6.8141  139.277   7.1862  430.705   10.336  426.033   11.020 4.672394 15.10889 
1 1 1   16   13   28 o  210.238   13.259   34.102   4.2448   44.255   7.2159   28.730   5.2490  238.528   19.947  192.177   18.056 46.35094 26.90588 
1 1 1   16   13   29 o  281.674   7.9246   60.820   3.4166   61.155   5.0090   60.528   4.6721  282.186   11.597  280.795   10.871 1.391418 15.89530 
1 1 1   16   13   30 o  276.809   7.9908   58.747   3.3856   67.552   5.1334   51.969   4.5041  296.560   11.309  260.115   11.313 36.44525 15.99602 
1 1 1   16   13   31 o  437.902   6.9525  146.974   4.6600  153.386   6.5743  140.499   6.6064  447.051   9.6077  427.797   10.089 19.25430 13.93198 
1 1 1   16   13   32 o  252.327   8.6700   48.848   3.3485   52.718   5.1999   46.107   4.3767  261.726   12.980  244.895   11.676 16.83118 17.45900 
1 1 1   16   13   33 o  617.752   7.1185  292.591   6.7309  298.977   8.8125  283.651   10.428  624.069   9.2256  607.419   11.216 16.65027 14.52290 
1 1 1   16   13   34 o  181.585   11.430   25.463   3.1606   27.010   4.9896   24.425   4.0846  185.905   17.751  177.214   15.206 8.691193 23.37324 
1 1 1   16   13   35 o  388.009   7.4080  115.488   4.3996  119.933   7.2945  112.946   5.5158  394.647   12.076  383.444   9.3980 11.20282 15.30193 
1 1 1   16   13   36 o  328.283   7.7640   82.708   3.9013   93.905   6.1631   75.221   5.0394  349.215   11.530  312.709   10.529 36.50644 15.61398 
1 1 1   16   13   37 o   83.675   22.928   5.6762   3.0236   7.4273   5.0888   4.7207   3.7591   96.610   30.650   79.076   26.433 17.53425 40.47325 
1 1 1   16   13   38 o   46.550   20.083  -0.2017   2.6068   1.5286   5.8749  -0.6259   2.9088   74.909   31.116   47.516   20.845 27.39335 37.45288 
1 1 1   16   13   39 f  332.550   7.0314   84.885   3.5790   87.501   6.5510   83.772   4.2731  336.511   12.719  330.146   8.4561 6.365265 15.27311 
1 1 1   16   13   40 o  203.610   10.616   32.041   3.2969   23.051   9.6393   33.232   3.5085  162.821   39.158  207.277   11.099 -44.45541 40.70044 
1 1 1   16   13   41 o  571.445   7.7534  250.928   6.7816   0.0000   0.0000  250.928   6.7816  ?   ?   571.445   7.7534 0.000000 7.753358 
1 1 1   16   13   42 f  120.166   16.550   11.466   2.9633   14.666   5.9520   10.412   3.4169  131.816   30.154  113.354   20.446 18.46223 36.43204 
1 1 1   16   13   43 o   59.408   23.692   1.5826   3.2434   1.7197   6.3266   1.5338   3.7776   76.928   32.150   62.537   25.348 14.39116 40.94053 
1 1 1   16   13   44 o  163.034   17.461   21.064   4.2896   4.6391   11.202   23.886   4.6435  102.430   42.792  173.633   17.720 -71.20287 46.31629 
1 1 1   16   13   45 f  100.380   26.732   8.4745   4.1805  -1.6470   11.574   9.9932   4.4832   90.452   40.519  108.840   27.033 -18.38829 48.70908 
1 1 1   16   13   46 o  200.602   17.621   31.900   5.3555   36.573   7.2700   26.355   7.9192  212.579   22.694  176.275   30.452 36.30415 37.97834 
1 1 1   16   13   47 o  150.403   15.414   17.886   3.4984   29.665   7.1998   14.246   4.0027  189.594   25.453  132.409   20.405 57.18484 32.62239 
1 1 1   16   13   48 o  142.654   16.670   16.223   3.5712   29.000   7.5301   12.516   4.0564  186.074   27.246  123.066   22.358 63.00761 35.24529 
1 1 1   16   13   49 o   59.631   24.543   1.2632   3.6090 -12.0374   10.151   3.1879   3.8613   67.995   32.770   69.758   26.387 -1.763153 42.07249 
1 1 1   16   13   50 o   42.464   20.114  -3.7502   3.4870   3.0259   7.3589  -5.7121   3.9597   82.922   34.666   42.161   20.356 40.76105 40.20104 
1 1 1   16   13   51 o   90.349   24.512   6.9926   3.4759   14.310   6.6774   4.2729   4.0709  124.851   34.016   75.308   27.345 49.54308 43.64473 
1 1 1   16   13   52 o  168.671   15.549   22.731   3.9692   16.379   8.8711   24.321   4.4383  128.760   40.420  173.871   16.890 -45.11090 43.80692 
1 1 1   16   13   53 o  209.348   12.565   34.516   4.0077   16.334   7.0711   43.121   4.8645  131.337   34.667  233.479   13.672 -102.1421 37.26547 
1 1 1   16   13   54 o   62.868   25.299   2.1579   3.7339   7.6152   6.1748  -0.9880   4.6882   92.649   33.672   57.271   25.712 35.37783 42.36683 
1 1 1   16   13   55 o   86.614   25.058   6.6922   3.5113   9.5036   5.7281   4.9998   4.4443   99.651   32.600   77.754   28.520 21.89671 43.31413 
1 1 1   16   13   56 o   41.400   19.815  -4.0912   3.5683   1.4681   5.5649  -7.9729   4.6500   67.524   29.237   42.334   20.790 25.19004 35.87511 
1 1 1   16   13   57 o   56.682   23.639   1.3825   3.4100  -0.0901   5.3348   2.3998   4.4340   61.673   27.577   65.504   27.106 -3.831409 38.66788 
1 1 1   16   14    0 o  1088.57   11.006  907.570   18.334  907.570   18.334  907.570   18.334  1088.57   11.006  1088.57   11.006 0.000000 0.000000 
1 1 1   16   14    1 o  1170.02   9.4757  1048.37   16.970  1032.88   20.389  1083.27   30.611  1161.16   11.472  1188.48   16.828 -27.32166 20.36604 
1 1 1   16   14    2 o  1114.39   9.1532  951.003   15.613  948.976   18.959  955.276   27.521  1113.03   11.128  1116.16   16.109 -3.125732 19.57924 
1 1 1   16   14    3 o  1104.07   9.1187  933.475   15.410  936.620   18.758  926.947   27.025  1105.76   11.083  1099.48   16.058 6.279785 19.51169 
1 1 1   16   14    4 o  565.316   8.0111  244.700   6.9319  244.700   6.9319   0.0000   0.0000  565.316   8.0111  ?   ?  0.000000 8.011065 
1 1 1   16   14    5 o  150.177   11.535   17.379   2.6312   17.881   2.9257   15.256   6.0174  152.237   12.671  138.149   29.362 14.08723 31.97918 
1 1 1   16   14    6 o   95.739   17.410   7.2497   2.4573   7.4172   2.6852   6.3867   6.0954   96.666   18.825   96.382   33.620 0.2842255 38.53175 
1 1 1   16   14    7 o  674.469   7.1958  348.290   7.4287  350.327   8.8247  343.335   13.763  676.383   8.5239  669.316   13.434 7.067688 15.90980 
1 1 1   16   14    8 o  1010.27   8.7121  781.584   13.472  780.322   16.164  784.456   24.379  1009.32   10.463  1011.42   15.748 -2.109802 18.90674 
1 1 1   16   14    9 o  209.730   25.681   34.343   8.0719   0.0000   0.0000   34.343   8.0719  ?   ?   209.730   25.681 0.000000 25.68144 
1 1 1   16   14   10 o  289.978   12.010   64.431   5.3306   67.961   6.8664   59.077   8.4566  297.327   15.138  276.644   20.109 20.68317 25.16986 
1 1 1   16   14   11 o  483.928   10.102  179.383   7.4830  179.102   9.8696  179.761   11.476  483.393   13.339  484.153   15.487 -0.7599792 20.43935 
1 1 1   16   14   12 o  465.336   10.441  165.879   7.4369  155.574   9.5635  181.644   11.829  450.484   13.870  486.640   15.880 -36.15540 21.08437 
1 1 1   16   14   13 o  388.775   9.0009  115.759   5.3561  116.046   6.1996  114.915   10.636  389.208   10.407  386.931   17.959 2.277374 20.75613 
1 1 1   16   14   14 o  382.809   9.1772  112.240   5.3773  110.621   6.1178  117.739   11.275  379.991   10.518  391.578   18.812 -11.58658 21.55332 
1 1 1   16   14   15 o  543.234   8.4901  226.006   7.0594  219.693   8.1545  244.889   14.103  535.523   9.9484  564.938   16.309 -29.41541 19.10419 
1 1 1   16   14   16 o  506.431   6.7502  196.374   5.2325  196.108   5.6885  197.832   13.338  506.067   7.3438  507.661   17.165 -1.593567 18.66986 
1 1 1   16   14   17 o  287.759   7.1022   63.406   3.1282   63.560   3.6502   62.981   6.0702  288.080   8.2782  286.575   13.839 1.504608 16.12569 
1 1 1   16   14   18 o  372.301   6.9497  106.137   3.9603  106.104   4.4616  106.257   8.6000  372.216   7.8311  372.130   15.098 0.8593750E-01 17.00850 
1 1 1   16   14   19 o   96.104   17.152   7.3062   2.4305   8.5903   2.8071   3.4613   4.8574  104.228   18.261   78.469   29.616 25.75941 34.79313 
1 1 1   16   14   20 o  266.320   7.9221   54.326   3.2293   57.576   3.8646   46.804   5.8789  274.132   9.2104  246.408   15.669 27.72321 18.17513 
1 1 1   16   14   21 o  367.253   6.8444  103.290   3.8474  105.594   4.6745   98.453   6.7741  371.270   8.2258  358.282   12.353 12.98837 14.84087 
1 1 1   16   14   22 o  781.197   6.6341  467.365   7.9326  464.796   9.9838  471.764   13.064  778.890   8.3743  784.415   10.881 -5.524902 13.73041 
1 1 1   16   14   23 o  446.159   6.7695  152.459   4.6229  152.806   5.7641  151.834   7.7397  446.571   8.4328  444.931   11.365 1.640137 14.15165 
1 1 1   16   14   24 o  164.151   10.528   20.748   2.6312   21.352   3.6391   20.087   3.8088  166.092   14.459  160.894   15.665 5.197693 21.31756 
1 1 1   16   14   25 f  491.359   7.0517  184.956   5.3035  190.335   7.2242  178.668   7.8106  498.254   9.4726  482.636   10.573 15.61804 14.19568 
1 1 1   16   14   26 o  318.394   7.9614   77.691   3.8799   73.274   5.0400   84.116   6.0789  309.043   10.655  331.009   11.998 -21.96582 16.04621 
1 1 1   16   14   27 o  321.066   8.2780   79.019   4.0681   78.862   7.4812   79.085   4.8474  320.126   15.268  321.091   9.8631 -0.9646606 18.17668 
1 1 1   16   14   28 o   40.656   18.306  -1.2049   2.3959  -2.7745   3.5329   0.1317   3.2602   46.336   21.379   53.839   22.822 -7.503304 31.27090 
1 1 1   16   14   29 o  204.428   9.5599   32.065   2.9913   29.245   4.4055   34.476   4.0746  194.317   14.926  211.401   12.650 -17.08398 19.56579 
1 1 1   16   14   30 o  363.355   6.8539  101.185   3.8119  101.968   5.6141  100.516   5.1922  364.458   10.064  361.928   9.3727 2.530243 13.75232 
1 1 1   16   14   31 o  391.715   7.1418  117.626   4.2820  114.166   5.8983  121.480   6.2264  385.606   9.9934  397.735   10.228 -12.12894 14.29939 
1 1 1   16   14   32 o  494.533   7.3157  187.521   5.5376  188.324   7.1344  186.306   8.7828  495.284   9.4109  492.213   11.658 3.071075 14.98220 
1 1 1   16   14   33 o  162.756   14.412   20.590   3.5531   22.672   4.5900   17.477   5.6126  170.175   17.890  147.244   25.846 22.93092 31.43359 
1 1 1   16   14   34 o  107.872   18.772   9.2857   2.9869   8.7822   4.8532   9.5926   3.7895  103.816   29.276  108.725   23.460 -4.908073 37.51601 
1 1 1   16   14   35 o   40.574   18.754  -2.1886   2.7369  -1.8321   4.4404  -2.4071   3.4757   55.916   25.069   46.663   21.410 9.252773 32.96756 
1 1 1   16   14   36 o   39.445   18.478  -2.7693   2.8001  -5.5947   4.4342  -0.8953   3.6112   46.855   22.333   52.462   23.114 -5.606419 32.14084 
1 1 1   16   14   37 o  384.335   7.4512  113.379   4.3833  124.213   6.8984  106.043   5.6766  401.532   11.224  371.259   9.9894 30.27252 15.02576 
1 1 1   16   14   38 o  174.945   13.009   23.778   3.4586   26.759   6.2528   22.465   4.1514  182.971   22.823  169.307   16.218 13.66431 27.99836 
1 1 1   16   14   39 o  120.921   17.916   11.645   3.2156   13.998   5.4202   10.367   3.9946  129.816   28.094  112.412   23.949 17.40372 36.91648 
1 1 1   16   14   40 o   67.856   25.569   2.8177   3.6170   17.153   9.3554   0.2982   3.9220  140.097   41.009   58.738   24.970 81.35947 48.01335 
1 1 1   16   14   41 o  167.455   14.043   21.901   3.5661   21.055   5.5827   22.484   4.6350  161.387   23.273  168.541   18.259 -7.153595 29.58043 
1 1 1   16   14   42 o   88.497   27.191   6.3764   4.0390   3.9266   5.4995   9.2451   5.9511   81.009   31.279  105.407   33.109 -24.39835 45.54757 
1 1 1   16   14   43 o  151.247   19.582   18.304   4.4268   24.097   10.860   17.150   4.8478  162.991   42.935  145.326   22.522 17.66521 48.48359 
1 1 1   16   14   44 o  177.511   16.146   24.829   4.3389   7.6190   11.090   27.939   4.7148  109.198   43.720  188.258   16.529 -79.06000 46.74061 
1 1 1   16   14   45 o  114.974   18.942   10.687   3.2174   10.719   6.5897   10.676   3.6867  111.669   34.801  113.977   21.929 -2.307953 41.13406 
1 1 1   16   14   46 o  409.356   10.389  129.556   6.5095  130.898   8.6585  127.812   9.8722  409.889   13.801  403.815   15.972 6.074341 21.10862 
1 1 1   16   14   47 o  316.530   8.7193   77.265   4.2244   70.485   7.9022   79.978   4.9986  298.519   17.370  321.605   10.155 -23.08539 20.12004 
1 1 1   16   14   48 o   71.631   25.295   3.8256   3.4571   5.2793   8.1074   3.5026   3.8220   92.854   37.309   71.272   26.395 21.58168 45.70218 
1 1 1   16   14   49 o  268.479   10.343   55.862   4.2506   56.019   9.0866   55.818   4.8092  261.742   22.911  267.896   11.728 -6.153931 25.73880 
1 1 1   16   14   50 f   72.426   25.296   4.0505   3.4511   5.4676   6.5966   3.5164   4.0495   87.987   34.178   71.715   27.047 16.27235 43.58525 
1 1 1   16   14   51 o  107.399   21.727   9.7064   3.4489   13.666   6.3693   8.0639   4.1024  122.025   33.212   96.156   26.847 25.86891 42.70604 
1 1 1   16   14   52 o   47.088   21.781  -2.4520   3.7017  -2.1664   8.6071  -2.5168   4.1003   74.316   33.946   49.852   23.012 24.46395 41.01075 
1 1 1   16   14   53 o  117.185   20.066   11.477   3.4698   2.2064   6.4785   15.206   4.1088   75.281   32.050  134.998   20.532 -59.71632 38.06265 
1 1 1   16   14   54 o   66.861   25.296   3.2158   3.5494   8.4930   6.1520   0.5827   4.3456   95.734   33.750   59.854   25.876 35.88052 42.52767 
1 1 1   16   14   55 o   64.217   25.070   2.7636   3.5628   5.3788   5.5671   0.9494   4.6367   81.322   31.451   62.092   26.786 19.22982 41.31184 
1 1 1   16   14   56 o  123.244   19.070   12.840   3.4812   5.2431   5.5314   17.823   4.4797   79.904   31.225  144.283   20.892 -64.37971 37.56968 
1 1 1   16   15    0 f  995.310   14.917  759.327   22.714  759.327   22.714  759.327   22.714  995.310   14.917  995.310   14.917 0.000000 0.000000 
1 1 1   16   15    1 o  210.591   17.824   34.268   5.6916   0.0000   0.0000   34.268   5.6916  ?   ?   210.591   17.824 0.000000 17.82449 
1 1 1   16   15    2 o  571.455   8.2249  250.056   7.1942  250.056   7.1942   0.0000   0.0000  571.455   8.2249  ?   ?  0.000000 8.224885 
1 1 1   16   15    3 o  1226.31   12.020  1152.22   22.562  1152.22   22.562   0.0000   0.0000  1226.31   12.020  ?   ?  0.000000 12.01996 
1 1 1   16   15    4 o  662.116   7.1172  335.648   7.2129  330.973   8.5012  347.664   13.628  657.433   8.4481  673.528   13.220 -16.09399 15.68844 
1 1 1   16   15    5 o  802.778   7.6673  493.444   9.4212  497.532   11.393  484.603   16.756  806.010   9.2345  795.131   13.768 10.87811 16.57802 
1 1 1   16   15    6 o  1028.89   8.8292  810.688   13.905  822.070   17.008  787.750   24.145  1035.93   10.726  1013.54   15.564 22.38409 18.90204 
1 1 1   16   15    7 o  836.936   6.9699  536.291   8.9287  526.816   10.032  572.413   19.587  829.461   7.9014  864.046   14.810 -34.58490 16.78619 
1 1 1   16   15    8 o  410.455   6.5264  128.982   4.1003  132.047   4.5332  115.198   9.6140  415.289   7.1316  387.541   16.207 27.74744 17.70709 
1 1 1   16   15    9 o  609.667   6.3704  284.562   5.9447  288.279   6.7335  271.430   12.658  613.606   7.1694  595.039   13.898 18.56714 15.63821 
1 1 1   16   15   10 o  838.290   8.3963  538.146   10.773  537.839   13.020  538.813   19.186  837.930   10.151  838.239   14.953 -0.3095703 18.07366 
1 1 1   16   15   11 o  1104.85   11.960  935.442   20.226  939.653   28.522  931.182   28.686  1106.63   16.839  1101.60   17.013 5.028687 23.93699 
1 1 1   16   15   12 o  353.337   11.848   95.673   6.4080   92.874   8.3568   99.669   9.9830  347.956   15.691  359.863   18.183 -11.90674 24.01716 
1 1 1   16   15   13 o   86.861   26.679   5.8108   3.8887   5.2504   4.3303   8.1457   8.8393   84.981   28.370  111.757   40.338 -26.77673 49.31550 
1 1 1   16   15   14 o  1046.13   16.960  839.984   27.157   0.0000   0.0000  839.984   27.157  ?   ?   1046.13   16.960 0.000000 16.95990 
1 1 1   16   15   15 o  185.090   16.179   26.490   4.5375   28.175   5.0820   19.868   10.075  190.757   17.604  156.899   41.365 33.85706 44.95514 
1 1 1   16   15   16 o  874.375   8.9958  585.633   12.040  586.602   14.441  583.424   21.804  874.926   10.783  871.825   16.339 3.101257 19.57677 
1 1 1   16   15   17 o  197.988   10.014   30.112   3.0249   30.112   3.0249   0.0000   0.0000  197.988   10.014  ?   ?  0.000000 10.01425 
1 1 1   16   15   18 o  377.180   6.8820  108.942   3.9731  108.035   4.4803  112.280   8.5973  375.576   7.7935  382.512   14.684 -6.936401 16.62408 
1 1 1   16   15   19 o  397.888   6.5864  121.232   4.0112  120.566   4.8166  122.738   7.2460  396.742   7.9316  400.092   11.832 -3.349487 14.24476 
1 1 1   16   15   20 o  368.544   6.7219  104.017   3.7919   97.550   4.4681  120.663   7.1686  356.848   8.1803  396.668   11.807 -39.81967 14.36388 
1 1 1   16   15   21 o  207.486   9.1441   32.991   2.9040   37.169   3.4344   22.510   5.4396  220.198   10.190  169.573   21.436 50.62468 23.73494 
1 1 1   16   15   22 o  443.661   6.5303  150.751   4.4346  149.239   5.4001  153.881   7.7714  441.351   7.9937  447.915   11.335 -6.563904 13.87044 
1 1 1   16   15   23 o  443.228   7.5048  150.503   5.0914  152.942   5.5330  137.033   13.005  446.765   8.0912  421.564   20.155 25.20163 21.71886 
1 1 1   16   15   24 o  538.574   7.3989  222.232   6.0994  228.834   6.7809  194.255   13.960  546.454   8.1070  502.149   18.162 44.30566 19.88952 
1 1 1   16   15   25 o  433.908   6.4698  144.222   4.2969  141.448   6.3238  146.600   5.8566  429.478   9.6198  437.306   8.7496 -7.827362 13.00373 
1 1 1   16   15   26 o  468.013   7.1372  167.833   5.1127  176.412   9.0276  163.782   6.2035  479.257   12.307  462.189   8.7690 17.06854 15.11111 
1 1 1   16   15   27 o  149.861   11.552   17.348   2.6294   18.316   3.8058   16.464   3.6371  153.306   16.478  145.223   16.664 8.082275 23.43501 
1 1 1   16   15   28 o  391.939   6.4688  117.701   3.8807  115.210   5.4640  120.237   5.5127  387.538   9.2114  395.914   9.0969 -8.375641 12.94620 
1 1 1   16   15   29 f  470.821   6.2131  169.845   4.4775  183.469   6.5930  158.182   6.0999  489.056   8.8075  454.108   8.7759 34.94766 12.43340 
1 1 1   16   15   30 o  161.961   11.566   20.263   2.8483   20.709   4.0805   19.839   3.9775  162.957   16.591  159.471   16.536 3.485855 23.42409 
1 1 1   16   15   31 o  216.521   10.773   36.024   3.5702   39.968   4.4768   29.132   5.9175  227.508   12.909  192.691   20.372 34.81784 24.11798 
1 1 1   16   15   32 o  451.256   7.9111  156.209   5.4643  172.980   7.5530  137.792   7.9150  474.457   10.400  423.132   12.221 51.32578 16.04746 
1 1 1   16   15   33 o  124.889   14.864   12.209   2.7856   11.322   4.6273   12.714   3.4886  117.770   26.331  126.731   18.532 -8.961472 32.19879 
1 1 1   16   15   34 o  152.232   12.284   17.967   2.8379   16.610   4.3338   18.986   3.7549  144.734   20.106  155.850   15.966 -11.11613 25.67399 
1 1 1   16   15   35 o   57.279   22.172   1.6909   2.7687   6.0057   4.4740  -0.9869   3.5246   88.120   28.810   51.479   22.750 36.64101 36.70967 
1 1 1   16   15   36 f  207.268   10.541   33.151   3.3332   27.617   5.0873   37.313   4.4120  187.597   17.936  219.434   13.197 -31.83638 22.26802 
1 1 1   16   15   37 o  402.001   7.8080  124.102   4.8044  117.951   7.6599  128.090   6.1685  390.788   12.806  407.993   9.8778 -17.20462 16.17296 
1 1 1   16   15   38 o  263.699   9.2716   53.495   3.7422   54.561   5.7022   52.689   4.9598  265.048   14.106  261.169   12.407 3.878967 18.78626 
1 1 1   16   15   39 o  285.005   9.0889   62.495   3.9649   67.536   6.3671   59.303   5.0673  295.181   14.092  277.096   11.948 18.08502 18.47531 
1 1 1   16   15   40 o  153.269   17.693   18.586   4.0745   20.975   10.114   18.123   4.4517  153.885   41.839  150.718   19.774 3.166687 46.27624 
1 1 1   16   15   41 o  138.229   24.497   15.651   4.9933   14.129   5.6509   21.073   10.665  129.628   29.184  153.115   43.476 -23.48654 52.36313 
1 1 1   16   15   42 o   79.542   33.493   1.6276   6.9474   2.6703   10.517   0.8204   9.2539   96.178   40.888   87.319   37.754 8.859169 55.65293 
1 1 1   16   15   43 o   81.659   25.945   5.3495   3.6455   5.6261   6.0246   5.1897   4.5790   89.322   33.127   83.068   29.130 6.254326 44.11329 
1 1 1   16   15   44 o   95.864   25.216   7.6849   3.7497   6.6469   6.0897   8.3188   4.7587   93.421   33.509   99.442   29.288 -6.021149 44.50441 
1 1 1   16   15   45 o  192.143   17.139   29.226   4.9876   31.951   6.5896   25.572   7.6319  198.897   22.014  173.995   29.724 24.90227 36.98841 
1 1 1   16   15   46 o  137.038   20.570   15.250   4.1814   13.458   6.9654   16.260   5.2283  123.312   35.178  139.632   25.398 -16.31985 43.38820 
1 1 1   16   15   47 o  117.555   23.725   11.538   4.1218   7.8431   7.2276   13.320   5.0178   99.572   36.393  125.199   26.980 -25.62649 45.30310 
1 1 1   16   15   48 o  256.106   9.8680   50.750   3.8683   48.910   7.6636   51.379   4.4810  246.278   20.517  257.226   11.381 -10.94763 23.46200 
1 1 1   16   15   49 o   81.174   25.724   5.4661   3.5853   12.936   7.8437   3.4933   4.0311  118.549   38.099   71.681   26.996 46.86758 46.69376 
1 1 1   16   15   50 o  194.902   12.566   29.812   3.7287   23.242   6.6289   32.853   4.5097  164.581   27.269  203.794   14.553 -39.21306 30.90950 
1 1 1   16   15   51 o   93.461   24.496   7.5392   3.5467  -0.4565   6.3971   11.088   4.2618   68.603   30.467  113.258   25.230 -44.65529 39.55753 
1 1 1   16   15   52 o   92.445   25.202   7.4560   3.6640   3.5122   8.8267   8.2771   4.0274   86.870   37.207   96.948   26.419 -10.07879 45.63292 
1 1 1   16   15   53 o   82.739   25.528   5.9663   3.5558   3.5179   6.1324   7.2064   4.3644   77.614   31.975   89.869   28.371 -12.25498 42.74663 
1 1 1   16   15   54 o   68.546   25.521   3.5663   3.5826   3.3795   5.7286   3.6863   4.5913   74.948   30.893   72.359   28.399 2.589027 41.96296 
1 1 1   16   15   55 o   95.084   23.890   8.0811   3.4726   7.2262   5.7574   8.5700   4.3536   88.656   32.470   95.936   27.945 -7.279663 42.83905 
1 1 1   16   15   56 o  103.351   24.063   9.6192   3.7354   1.2493   5.5437   16.579   5.0553   66.376   28.956  135.645   25.279 -69.26939 38.43785 
1 1 1   16   16    1 o  1090.91   11.161  911.735   18.636  911.735   18.636   0.0000   0.0000  1090.91   11.161  ?   ?  0.000000 11.16086 
1 1 1   16   16    2 o  858.374   7.9330  564.188   10.423  564.035   12.667  564.507   18.342  858.149   9.6433  858.139   13.964 0.1037598E-01 16.97054 
1 1 1   16   16    3 o  336.838   7.5830   86.875   3.9096   86.448   4.5768   88.027   7.5198  335.978   8.8998  338.844   14.499 -2.865356 17.01254 
1 1 1   16   16    4 o  397.865   7.1956  121.200   4.3820  121.782   5.1702  119.715   8.2569  398.785   8.4703  395.193   13.650 3.592590 16.06469 
1 1 1   16   16    5 f  245.833   8.9929   46.283   3.3839   47.862   3.8513   40.940   7.0863  249.967   10.066  229.988   20.340 19.97913 22.69417 
1 1 1   16   16    6 o  814.614   7.8886  508.137   9.8361  516.629   11.925  490.061   17.397  821.293   9.4861  799.503   14.216 21.78973 17.09070 
1 1 1   16   16    7 o  923.974   7.3759  653.688   10.431  661.805   12.070  629.729   20.736  929.621   8.4826  906.200   14.949 23.42035 17.18834 
1 1 1   16   16    8 o  455.636   6.4566  158.942   4.5029  159.788   5.0362  155.574   10.054  456.824   7.2024  450.431   14.583 6.393188 16.26504 
1 1 1   16   16    9 o  992.009   7.7022  753.547   11.695  750.239   13.305  764.786   24.524  989.747   8.7828  998.460   16.047 -8.713196 18.29341 
1 1 1   16   16   10 o  1071.93   11.753  880.523   19.284  902.854   27.978  860.313   26.616  1084.68   16.852  1058.89   16.422 25.79016 23.52983 
1 1 1   16   16   11 o  319.643   9.7966   78.267   4.7931   75.339   5.5455   86.916   9.5300  313.548   11.555  335.919   18.608 -22.37048 21.90331 
1 1 1   16   16   12 o  261.603   11.100   52.441   4.4447   50.678   5.0767   58.229   9.1989  256.784   12.958  274.281   22.099 -17.49670 25.61783 
1 1 1   16   16   13 o  654.347   8.2782  327.921   8.2911  317.510   9.6923  356.323   16.009  643.780   9.8360  681.495   15.347 -37.71545 18.22848 
1 1 1   16   16   14 o  249.696   12.014   47.792   4.5915   47.176   5.1750   50.070   9.9535  247.647   13.706  253.534   26.018 -5.887497 29.40703 
1 1 1   16   16   15 o  382.096   9.4355  111.849   5.5183  110.207   6.3392  116.986   11.213  379.214   10.921  390.176   18.775 -10.96164 21.72031 
1 1 1   16   16   16 o  508.350   8.9650  197.967   6.9756  201.287   8.1636  188.985   13.428  512.507   10.407  495.976   17.688 16.53070 20.52240 
1 1 1   16   16   17 o  445.360   10.804  152.028   7.3651  152.028   7.3651   0.0000   0.0000  445.360   10.804  ?   ?  0.000000 10.80427 
1 1 1   16   16   18 o   64.597   25.201   1.9557   3.5984  -2.4914   5.0246   6.6379   5.1557   58.931   26.524   94.375   30.931 -35.44426 40.74598 
1 1 1   16   16   19 o  643.578   6.2525  317.174   6.1592  306.813   7.4255  340.022   11.027  632.886   7.6653  665.965   10.818 -33.07983 13.25827 
1 1 1   16   16   20 o  261.014   8.6738   52.203   3.4653   53.242   3.6548   42.954   10.904  263.584   9.0589  233.065   31.361 30.51955 32.64317 
1 1 1   16   16   21 o  322.825   8.0561   79.849   3.9807   80.347   4.2618   76.441   11.145  323.805   8.5989  313.699   23.379 10.10565 24.91033 
1 1 1   16   16   22 o  238.143   9.4985   43.476   3.4623   41.659   3.6519   59.622   10.885  233.080   10.236  276.171   26.058 -43.09085 27.99652 
1 1 1   16   16   23 o  430.256   6.7206  141.806   4.4259  143.791   5.3471  137.486   7.8875  433.169   8.0648  423.208   12.176 9.960663 14.60493 
1 1 1   16   16   24 o  302.959   8.2125   70.348   3.8083   71.961   4.7511   67.450   6.3691  306.294   10.134  296.230   14.047 10.06418 17.32103 
1 1 1   16   16   25 o  380.063   9.0741  110.765   5.2787  111.987   7.6671  109.662   7.2786  381.748   13.122  377.826   12.586 3.921722 18.18188 
1 1 1   16   16   26 o  386.182   7.5506  114.304   4.4632  107.374   7.5802  117.981   5.5218  373.724   13.251  392.206   9.1981 -18.48187 16.13083 
1 1 1   16   16   27 o  337.859   6.8174   87.472   3.5255   87.384   4.9849   87.560   4.9867  337.471   9.6505  337.811   9.6443 -0.3400269 13.64354 
1 1 1   16   16   28 o  351.300   6.6847   94.575   3.5944   95.223   5.0716   93.920   5.0951  352.274   9.4058  349.844   9.5150 2.430206 13.37921 
1 1 1   16   16   29 o  279.040   7.5488   59.698   3.2241   65.158   4.6381   54.593   4.4850  291.283   10.403  266.570   10.992 24.71280 15.13431 
1 1 1   16   16   30 o  262.282   10.683   52.855   4.2887   56.347   5.2077   45.496   7.5601  270.603   12.573  241.199   20.678 29.40488 24.20020 
1 1 1   16   16   31 o  914.525   8.2229  641.684   11.510  658.259   16.071  624.227   16.493  925.213   11.349  900.740   11.963 24.47284 16.48949 
1 1 1   16   16   32 o  484.375   6.4258  179.855   4.7641  189.268   7.0600  171.985   6.4553  496.442   9.2911  473.298   8.9107 23.14392 12.87343 
1 1 1   16   16   33 o  464.242   6.5442  165.246   4.6502  169.213   6.8415  161.840   6.3398  469.297   9.5243  459.051   9.0229 10.24524 13.11963 
1 1 1   16   16   34 o  211.076   9.6823   34.247   3.1281   38.557   4.8057   31.078   4.1206  222.976   14.154  200.213   13.525 22.76312 19.57756 
1 1 1   16   16   35 o  499.079   6.5569  191.040   5.0089  193.706   7.3754  188.758   6.8240  501.926   9.6001  495.615   8.9955 6.311310 13.15599 
1 1 1   16   16   36 o  105.434   18.460   8.9057   2.8705   4.2409   4.6398   11.798   3.6537   79.606   29.149  121.237   20.414 -41.63144 35.58696 
1 1 1   16   16   37 o  606.866   7.1540  282.710   6.6453  302.797   11.028  271.258   8.3269  626.555   11.499  593.872   9.1605 32.68317 14.70183 
1 1 1   16   16   38 o  190.088   11.511   27.984   3.3334   35.537   5.2752   22.963   4.3009  213.116   16.295  170.964   16.647 42.15181 23.29481 
1 1 1   16   16   39 o  105.745   35.913   8.9203   6.9402   9.6369   8.8573   7.7806   11.170  111.945   40.383  111.640   44.143 0.3054886 59.82782 
1 1 1   16   16   40 o   93.308   36.209   5.3656   7.3980   5.8107   9.6302   4.7246   11.556  101.677   40.730  104.716   43.580 -3.039528 59.65076 
1 1 1   16   16   41 o  270.912   11.574   56.730   4.7993   57.534   11.522   56.561   5.2791  264.794   28.897  270.220   12.764 -5.425507 31.59068 
1 1 1   16   16   42 o  260.043   10.969   52.246   4.3658   56.448   6.4820   48.757   5.9064  268.485   15.843  249.573   15.539 18.91188 22.19142 
1 1 1   16   16   43 o  273.825   10.251   57.890   4.2966   62.868   6.8758   54.701   5.5035  283.191   15.927  264.959   13.616 18.23166 20.95425 
1 1 1   16   16   44 o   40.052   19.772  -9.2640   4.3917  -9.6206   5.7612  -8.7693   6.7852   48.867   23.815   56.305   27.048 -7.437992 36.03786 
1 1 1   16   16   45 o   49.884   22.598  -1.7641   3.7160  -1.7723   5.9394  -1.7588   4.7635   64.600   28.976   57.406   25.833 7.194061 38.81960 
1 1 1   16   16   46 f  196.592   15.927   30.515   4.7515   21.201   7.0463   38.282   6.4346  157.240   30.377  218.782   19.417 -61.54199 36.05220 
1 1 1   16   16   47 o   77.433   27.670   4.4909   4.1487  -1.5423   6.6039   8.4245   5.3324   68.331   30.609   99.269   31.362 -30.93764 43.82290 
1 1 1   16   16   48 o  105.803   26.866   9.6339   4.3588   8.3650   7.4518   10.294   5.3741  100.980   36.946  108.246   30.906 -7.266571 48.16847 
1 1 1   16   16   49 o  202.730   14.216   32.424   4.3835   28.076   6.3542   36.372   6.0550  184.163   23.047  212.457   18.814 -28.29465 29.75100 
1 1 1   16   16   50 o   76.277   27.552   4.4660   4.1250   0.0443   5.9279   8.6172   5.7436   67.799   29.750   98.766   32.660 -30.96687 44.17851 
1 1 1   16   16   51 o   81.286   29.658   5.2175   4.7971   15.312   8.6527   0.7381   5.7639  124.590   40.013   68.588   29.726 56.00153 49.84637 
1 1 1   16   16   52 o  292.133   12.057   66.929   5.3911   63.099   8.7561   69.267   6.8416  276.487   20.843  294.747   15.217 -18.25961 25.80701 
1 1 1   16   16   53 o  174.286   19.104   25.111   5.0127   18.967   6.1416   37.373   8.6759  144.676   28.747  204.498   28.492 -59.82230 40.47429 
1 1 1   16   16   54 o   90.499   24.104   7.2977   3.3987   6.4391   5.7369   7.7620   4.2187   85.893   32.233   91.951   27.695 -6.057442 42.49711 
1 1 1   16   16   55 o   57.647   23.525   1.7102   3.2808  -2.3885   5.2128   4.3986   4.2217   55.784   25.819   73.649   27.648 -17.86526 37.82904 
1 1 1   16   17    0 o  497.042   12.329  189.549   9.3666  189.549   9.3666  189.549   9.3666  497.042   12.329  497.042   12.329 0.000000 0.000000 
1 1 1   16   17    1 o  1014.42   8.7592  788.089   13.600  792.248   16.747  780.032   23.309  1016.91   10.759  1008.53   15.099 8.380859 18.54053 
1 1 1   16   17    2 o  667.076   9.0085  340.809   9.1981  339.852   12.802  341.829   13.225  665.909   12.560  667.813   12.938 -1.904358 18.03163 
1 1 1   16   17    3 o  625.808   8.9445  299.943   8.5678  304.182   12.056  295.618   12.178  629.996   12.503  621.041   12.811 8.954529 17.90088 
1 1 1   16   17    4 o  651.012   9.1512  324.603   9.1188  327.429   12.699  321.594   13.103  653.607   12.693  647.717   13.216 5.890625 18.32435 
1 1 1   16   17    5 o  403.264   7.4606  124.521   4.6050  126.068   5.4126  120.468   8.7633  405.722   8.7158  396.365   14.445 9.357117 16.87038 
1 1 1   16   17    6 o  247.814   9.2895   47.038   3.5236   45.570   4.0199   51.905   7.3207  243.884   10.769  259.346   18.565 -15.46205 21.46188 
1 1 1   16   17    7 o  970.234   7.6262  720.835   11.325  720.624   13.013  721.492   22.993  970.005   8.7649  969.828   15.489 0.1766968 17.79740 
1 1 1   16   17    8 o  989.745   7.7009  750.136   11.666  747.328   13.330  759.327   24.113  987.801   8.8166  994.853   15.835 -7.052124 18.12432 
1 1 1   16   17    9 o  478.322   7.5011  175.197   5.4918  178.946   6.4803  165.644   10.345  483.362   8.7590  464.734   14.543 18.62823 16.97700 
1 1 1   16   17   10 o  475.968   8.2850  173.503   6.0358  173.676   7.1639  173.079   11.206  476.137   9.8298  474.971   15.414 1.165619 18.28142 
1 1 1   16   17   11 o  520.835   8.2344  207.758   6.5645  207.477   7.7569  208.467   12.323  520.407   9.7381  521.246   15.445 -0.8383789 18.25864 
1 1 1   16   17   12 o  783.411   8.4869  470.077   10.177  471.186   12.221  467.568   18.379  784.196   10.182  780.600   15.382 3.596375 18.44661 
1 1 1   16   17   13 o  603.580   8.2675  279.034   7.6380  281.029   9.0675  274.159   14.172  605.638   9.7814  597.686   15.492 7.951721 18.32125 
1 1 1   16   17   14 o  231.217   12.901   41.125   4.5475   45.489   5.2078   27.115   9.3310  243.102   14.056  184.033   34.390 59.06998 37.15149 
1 1 1   16   17   15 o  246.874   12.618   46.861   4.7521   50.116   5.4296   36.206   9.8244  255.197   13.953  214.067   30.877 41.13068 33.88308 
1 1 1   16   17   16 f  505.158   10.318  195.583   7.9778  195.583   7.9778   0.0000   0.0000  505.158   10.318  ?   ?  0.000000 10.31773 
1 1 1   16   17   17 o  264.849   12.513   53.807   5.0725   53.887   5.7293   53.514   10.912  264.583   14.199  261.552   27.676 3.031128 31.10619 
1 1 1   16   17   18 o  458.954   9.5149  161.435   6.6841  159.260   7.6992  168.091   13.468  455.739   11.037  467.349   18.827 -11.61050 21.82409 
1 1 1   16   17   19 o  649.262   8.9219  323.045   8.8664  319.807   10.447  331.382   16.763  645.826   10.569  656.488   16.683 -10.66254 19.74870 
1 1 1   16   17   20 o  286.667   7.5890   62.957   3.3299   65.497   3.9368   56.573   6.2425  292.338   8.7980  270.907   15.115 21.43063 17.48893 
1 1 1   16   17   21 f  583.102   6.3200  260.415   5.6407  264.049   6.9860  253.610   9.5608  587.039   7.7749  574.997   10.863 12.04242 13.35885 
1 1 1   16   17   22 o  194.872   9.8693   29.196   2.9342   31.134   3.4387   24.009   5.6269  201.120   11.215  175.010   21.455 26.11061 24.20944 
1 1 1   16   17   23 o   85.235   20.245   5.8347   2.6020   7.1284   3.0200   2.1078   5.1259   94.183   21.431   74.034   29.695 20.14954 36.62092 
1 1 1   16   17   24 o  397.846   10.047  121.430   6.1184  126.209   10.836  119.194   7.4132  404.599   17.497  393.927   12.295 10.67282 21.38508 
1 1 1   16   17   25 o  188.391   14.787   27.482   4.2296   28.271   6.1853   26.788   5.7967  189.857   21.673  184.916   20.844 4.941025 30.06985 
1 1 1   16   17   26 o  123.882   14.633   11.977   2.7210   14.780   3.2327   5.1634   5.0398  137.633   15.622   86.363   30.536 51.26965 34.30023 
1 1 1   16   17   27 o  566.893   5.9992  246.212   5.2056  246.638   7.2708  245.764   7.4563  567.094   8.3763  566.055   8.6059 1.039185 12.00932 
1 1 1   16   17   28 o  320.007   7.3312   78.506   3.5909   78.234   5.2496   78.746   4.9227  319.136   10.747  320.254   10.043 -1.118561 14.70879 
1 1 1   16   17   29 o  288.488   9.8435   63.906   4.3466   63.617   5.2030   64.573   7.9079  287.624   11.818  288.324   18.009 -0.7001648 21.54066 
1 1 1   16   17   30 o  265.395   7.7669   54.025   3.1551   58.175   4.6340   50.439   4.3077  275.091   11.006  256.150   10.987 18.94043 15.55115 
1 1 1   16   17   31 f  138.051   12.433   14.792   2.5990   16.732   3.8350   13.144   3.5343  145.967   17.515  128.933   18.434 17.03329 25.42774 
1 1 1   16   17   32 o  414.318   6.6192  131.620   4.1977  137.081   6.1191  126.766   5.7691  422.413   9.4642  406.240   9.2780 16.17276 13.25339 
1 1 1   16   17   33 o  242.042   8.7205   44.993   3.2307   46.684   4.7160   43.498   4.4348  245.767   12.579  237.272   12.253 8.494919 17.56031 
1 1 1   16   17   34 o  257.646   8.4420   50.984   3.3292   55.063   4.8882   47.454   4.5467  267.280   11.948  248.124   11.972 19.15642 16.91419 
1 1 1   16   17   35 o  166.189   11.523   21.389   2.9130   22.990   4.4676   20.204   3.8421  171.113   17.295  160.651   15.831 10.46194 23.44639 
1 1 1   16   17   36 o  304.156   8.3230   71.086   3.8747   75.567   6.1371   68.115   4.9965  312.733   12.821  297.291   10.980 15.44260 16.88031 
1 1 1   16   17   37 o   99.168   24.485   8.1032   3.6943   7.9264   4.5704   8.4365   6.2748   98.159   28.644  102.811   34.143 -4.652176 44.56715 
1 1 1   16   17   38 o  110.539   26.225   10.137   4.3703   7.6039   4.7109   25.778   11.706   96.402   29.318  169.750   44.508 -73.34751 53.29641 
1 1 1   16   17   39 f  101.771   25.406   8.5912   3.9454   11.839   9.3175   7.8816   4.3551  120.069   41.584   97.540   27.813 22.52905 50.02808 
1 1 1   16   17   40 o  202.082   12.036   31.693   3.7060   27.695   5.5020   35.013   5.0141  186.709   19.542  211.473   15.601 -24.76369 25.00559 
1 1 1   16   17   41 f  107.241   22.242   9.4461   3.5311   15.773   5.4626   4.9048   4.6280  137.711   26.881   81.959   29.232 55.75214 39.71218 
1 1 1   16   17   42 o  477.010   7.7065  174.986   5.6267  174.042   8.5884  175.696   7.4476  474.164   11.834  477.109   10.198 -2.944580 15.62179 
1 1 1   16   17   43 o   50.820   23.510  -3.1421   4.3144  -4.2066   5.6209  -1.6155   6.7312   57.317   26.627   69.566   31.050 -12.24818 40.90342 
1 1 1   16   17   44 o  109.453   27.161   10.152   4.5287   10.923   5.7417   8.8810   7.3669  112.501   31.885  104.546   36.924 7.955154 48.78550 
1 1 1   16   17   45 o  192.712   14.323   29.142   4.1945   27.803   6.8245   29.955   5.3175  183.745   24.907  193.984   18.119 -10.23843 30.80024 
1 1 1   16   17   46 o  262.742   11.211   53.533   4.5088   40.912   7.0125   62.427   5.8869  225.437   20.548  282.861   13.597 -57.42438 24.63961 
1 1 1   16   17   47 o  272.529   11.071   57.637   4.6183   56.512   7.3001   58.387   5.9634  266.309   18.015  272.678   14.338 -6.368683 23.02455 
1 1 1   16   17   48 o  135.638   21.671   15.204   4.3477  -0.1265   7.0911   24.438   5.5035   73.489   32.384  172.818   21.254 -99.32840 38.73529 
1 1 1   16   17   49 o  128.626   22.078   13.811   4.1902   8.2444   5.9851   19.163   5.8682   97.491   33.350  149.468   26.626 -51.97698 42.67495 
1 1 1   16   17   50 o   73.954   26.716   4.1814   3.8785   5.0233   5.6927   3.4522   5.2985   82.975   31.882   75.672   30.248 7.302315 43.94735 
1 1 1   16   17   51 o   89.516   29.993   6.9750   4.8399   20.447   8.9566   1.4190   5.7520  143.358   39.537   70.281   30.067 73.07659 49.67095 
1 1 1   16   17   52 o  103.964   28.156   9.8024   4.5909   10.091   6.0725   9.4181   7.0139  103.391   33.553  100.385   35.967 3.005486 49.18737 
1 1 1   16   17   53 o  148.583   19.342   18.415   4.2946   16.544   6.0861   20.271   6.0609  132.921   30.554  150.229   27.366 -17.30782 41.01763 
1 1 1   16   17   54 o   99.256   26.553   9.0433   4.1129   8.6283   5.6413   9.5143   6.0093   94.814   32.378   98.573   33.418 -3.758705 46.53054 
1 1 1   16   18    0 o  535.833   12.130  220.231   9.9368  220.231   9.9368  220.231   9.9368  535.833   12.130  535.833   12.130 0.000000 0.000000 
1 1 1   16   18    1 o  429.359   8.8944  141.195   5.8453  137.691   7.9940  145.221   8.5690  423.847   12.322  435.252   12.862 -11.40509 17.81217 
1 1 1   16   18    2 o  199.415   10.852   30.559   3.2998   31.104   3.9363   29.270   6.0526  201.027   12.860  194.068   20.695 6.959137 24.36532 
1 1 1   16   18    3 o  152.420   13.593   17.953   3.1379   21.110   3.6908   9.7222   5.9602  165.249   14.747  111.236   32.782 54.01286 35.94601 
1 1 1   16   18    4 o  893.707   8.2884  611.688   11.338  610.081   13.726  615.141   20.116  892.387   10.049  895.566   14.675 -3.179260 17.78584 
1 1 1   16   18    5 o  124.633   16.256   12.120   3.0272   11.689   3.4557   13.543   6.2765  121.903   19.152  129.808   31.833 -7.904640 37.15032 
1 1 1   16   18    6 o  606.638   7.4944  281.808   6.9588  286.123   8.4140  272.466   12.379  611.188   8.9942  596.104   13.568 15.08429 16.27818 
1 1 1   16   18    7 f  444.333   10.267  151.266   6.9828  161.691   10.131  141.833   9.6376  459.141   14.416  430.007   14.643 29.13348 20.54843 
1 1 1   16   18    8 o  259.006   13.688   51.588   5.4074   48.121   7.5607   55.218   7.7367  249.425   19.972  267.415   19.026 -17.98979 27.58338 
1 1 1   16   18    9 o  871.994   8.6363  582.410   11.527  577.302   13.951  593.401   20.463  867.988   10.501  879.414   15.202 -11.42578 18.47603 
1 1 1   16   18   10 o  211.409   12.766   34.394   4.1114   33.786   4.7159   36.319   8.3937  209.324   14.814  215.486   25.972 -6.161072 29.90023 
1 1 1   16   18   11 o  685.330   8.1929  359.741   8.5943  365.054   10.390  348.229   15.294  690.250   9.8341  673.656   14.832 16.59326 17.79625 
1 1 1   16   18   12 o  633.390   8.2107  307.291   7.9601  304.088   9.4046  315.382   14.947  629.971   9.7533  641.012   15.235 -11.04095 18.08918 
1 1 1   16   18   13 o  376.214   9.4667  108.448   5.4514  105.797   6.2747  116.610   11.009  371.508   11.035  389.468   18.467 -17.96017 21.51264 
1 1 1   16   18   14 o  242.644   12.365   45.271   4.5769   43.145   5.1699   52.978   9.8430  236.666   14.339  260.814   24.961 -24.14766 28.78658 
1 1 1   16   18   15 o  215.501   15.405   35.846   5.0478   35.846   5.0478   0.0000   0.0000  215.501   15.405  ?   ?  0.000000 15.40475 
1 1 1   16   18   16 o  500.327   8.9991  191.822   6.8916  200.983   8.1410  168.656   12.946  512.027   10.388  468.246   18.063 43.78082 20.83679 
1 1 1   16   18   17 o  440.402   9.4786  148.658   6.3895  150.583   7.4396  143.244   12.473  443.133   10.969  431.354   18.892 11.77933 21.84554 
1 1 1   16   18   18 f  451.684   9.5375  156.390   6.5939  157.748   7.6512  152.468   13.000  453.519   11.022  444.910   19.089 8.609436 22.04289 
1 1 1   16   18   19 o  339.483   9.0978   88.340   4.7274   93.834   6.6169   82.611   6.7565  349.651   12.364  327.987   13.458 21.66431 18.27538 
1 1 1   16   18   20 f  769.441   7.7628  453.647   9.1425  462.272   13.019  445.257   12.841  776.253   10.958  761.823   11.013 14.42981 15.53532 
1 1 1   16   18   21 f   64.556   20.350   3.1747   2.2460   2.7207   2.5016   5.0619   5.1005   62.379   21.551   86.366   30.700 -23.98684 37.50887 
1 1 1   16   18   22 o  520.667   6.4242  207.670   5.1197  200.556   6.1764  223.291   9.1527  511.548   7.8882  539.387   11.086 -27.83838 13.60609 
1 1 1   16   18   23 o  139.144   21.966   15.346   4.5230   11.774   7.8574   17.117   5.5313  121.949   38.001  146.327   25.630 -24.37747 45.83677 
1 1 1   16   18   24 o  466.206   7.3048  166.575   5.2126  159.256   6.5083  179.669   8.7055  455.646   9.3319  483.639   11.760 -27.99387 15.01264 
1 1 1   16   18   25 o  449.703   6.7763  154.973   4.6643  156.398   5.6871  152.046   8.1526  451.625   8.2270  444.821   11.974 6.804443 14.52799 
1 1 1   16   18   26 o  542.609   11.350  226.204   9.4262   0.0000   0.0000  226.204   9.4262  ?   ?   542.609   11.350 0.000000 11.34956 
1 1 1   16   18   27 f  347.769   8.1694   92.759   4.3486   95.519   5.5011   88.160   7.1002  352.695   10.190  338.379   13.709 14.31549 17.08129 
1 1 1   16   18   28 o  232.568   9.8833   41.534   3.5182   50.407   4.1028   16.884   6.8385  256.155   10.464  143.369   31.976 112.7860 33.64503 
1 1 1   16   18   29 o   44.837   18.920   0.1613   2.2244  -1.0533   3.0419   1.5570   3.2609   47.291   21.006   60.059   23.818 -12.76748 31.75732 
1 1 1   16   18   30 o  188.428   9.3590   27.267   2.6993   28.353   3.8091   26.173   3.8256  191.387   13.081  183.744   13.701 7.642822 18.94292 
1 1 1   16   18   31 o  259.418   7.9179   51.642   3.1440   54.121   4.5327   49.343   4.3646  265.223   11.165  253.232   11.260 11.99106 15.85754 
1 1 1   16   18   32 o  365.292   6.9276  102.348   3.8734  105.818   5.5785   99.118   5.3823  371.019   9.8232  359.087   9.7927 11.93219 13.87054 
1 1 1   16   18   33 o  288.779   7.7068   64.010   3.4065   66.658   4.9988   61.714   4.6547  294.227   11.100  283.162   10.740 11.06506 15.44479 
1 1 1   16   18   34 o  116.704   15.959   10.753   2.7761   13.053   4.0512   8.7167   3.8118  127.397   21.544  103.091   24.515 24.30593 32.63607 
1 1 1   16   18   35 o   68.081   24.793   3.0740   3.3501   3.8198   4.0044   1.3343   6.1159   74.918   27.133   75.419   31.573 -0.5008850 41.62977 
1 1 1   16   18   36 o  453.726   10.104  158.539   7.0170  154.079   7.8334  176.656   15.787  446.903   11.452  473.609   21.777 -26.70633 24.60476 
1 1 1   16   18   37 o   86.823   27.370   6.0252   4.0630   4.7189   8.5208   6.4096   4.6224   95.477   38.289   89.973   29.278 5.503250 48.19993 
1 1 1   16   18   38 o   75.390   25.730   4.2605   3.5625   6.4129   9.2246   3.8832   3.8621  102.414   40.235   74.402   26.686 28.01237 48.28039 
1 1 1   16   18   39 o  228.608   10.036   40.286   3.5116   39.362   5.2206   41.050   4.7457  224.415   15.290  229.699   13.558 -5.284134 20.43518 
1 1 1   16   18   40 o  279.521   9.4810   60.204   4.0564   54.781   6.0731   64.573   5.4504  264.868   15.042  288.807   12.330 -23.93863 19.44959 
1 1 1   16   18   41 o   80.999   25.007   5.3039   3.4116   10.655   5.4127   1.7767   4.3944  111.924   30.681   67.048   27.279 44.87579 41.05436 
1 1 1   16   18   42 o   65.416   24.528   2.7108   3.3206   3.4893   5.2594   2.1949   4.2819   77.875   30.443   68.006   27.189 9.869240 40.81675 
1 1 1   16   18   43 o  150.191   20.160   18.176   4.5174   19.260   5.6789   16.310   7.4546  152.653   25.183  135.960   35.454 16.69308 43.48785 
1 1 1   16   18   44 o  163.325   15.852   21.087   3.9129   19.657   6.3366   21.968   4.9748  152.642   28.159  165.192   20.089 -12.55009 34.58991 
1 1 1   16   18   45 o  272.265   10.748   57.403   4.4791   55.355   6.7183   59.041   6.0095  264.723   16.666  274.519   14.352 -9.796509 21.99372 
1 1 1   16   18   46 o   62.137   25.011   1.7686   3.6505   8.3779   6.0024  -2.1110   4.5987   99.525   33.401   55.067   25.021 44.45820 41.73326 
1 1 1   16   18   47 o  192.208   14.895   29.189   4.3479   38.534   7.3702   24.201   5.3847  216.893   22.529  172.320   20.839 44.57310 30.68906 
1 1 1   16   18   48 o  165.493   19.777   22.304   4.9105   25.810   5.9649   14.931   8.6500  176.642   22.578  125.159   39.987 51.48334 45.92072 
1 1 1   16   18   49 o  150.787   18.072   18.436   4.0880   18.616   6.1253   18.292   5.4894  145.887   28.453  146.385   25.422 -0.4979248 38.15546 
1 1 1   16   18   50 o  147.499   19.083   17.827   4.2073   20.337   6.2846   15.788   5.6636  152.375   27.977  133.479   28.583 18.89630 39.99625 
1 1 1   16   18   51 o   95.153   31.112   8.1816   5.2174   16.448   8.9561   3.9354   6.4190  126.566   40.715   80.210   32.840 46.35606 52.30796 
1 1 1   16   18   52 o   89.478   28.763   7.2282   4.4705   3.6217   5.8639   12.233   6.9080   76.538   31.368  111.175   35.757 -34.63699 47.56564 
1 1 1   16   18   53 o   91.689   27.682   7.7205   4.2111   6.8551   5.9907   8.5658   5.9207   87.820   32.942   94.907   33.133 -7.086334 46.72228 
1 1 1   16   18   54 o   73.595   27.241   4.4533   4.0701   5.1018   5.5327   3.6885   6.0085   79.499   31.183   75.744   31.466 3.754738 44.30003 
1 1 1   16   19    0 o   86.727   37.685   8.2822   5.1775   8.2822   5.1775   8.2822   5.1775   86.727   37.685   86.727   37.685 0.000000 0.000000 
1 1 1   16   19    1 o  992.933   10.710  755.482   16.278  749.256   22.713  762.056   23.340  988.235   15.016  996.593   15.301 -8.358398 21.43813 
1 1 1   16   19    2 o  602.081   7.3474  277.593   6.7711  275.455   8.1775  282.254   12.076  599.675   8.9092  606.731   13.003 -7.055969 15.76245 
1 1 1   16   19    3 o  838.458   8.0768  538.415   10.365  549.330   12.832  517.920   17.583  846.761   9.9008  821.753   13.980 25.00861 17.13049 
1 1 1   16   19    4 o  367.305   7.8533  103.322   4.4152  100.393   5.1930  110.963   8.3870  362.007   9.3719  380.332   14.407 -18.32446 17.18709 
1 1 1   16   19    5 o  468.393   7.3722  168.008   5.2854  163.400   6.2087  180.138   10.073  461.865   8.7824  484.647   13.579 -22.78177 16.17186 
1 1 1   16   19    6 o  696.487   9.2520  371.619   9.8632  370.723   13.345  372.699   14.643  695.356   12.538  697.081   13.724 -1.724915 18.58884 
1 1 1   16   19    7 o  568.112   7.6706  247.180   6.6701  256.612   8.0865  227.102   11.798  578.765   9.1282  544.090   14.167 34.67517 16.85296 
1 1 1   16   19    8 o  583.148   6.6186  260.394   5.9076  257.310   6.6639  271.713   12.767  579.640   7.5110  595.130   14.016 -15.49017 15.90165 
1 1 1   16   19    9 o  1019.28   7.9329  795.751   12.376  806.841   14.395  764.315   24.236  1026.22   9.1642  997.754   15.870 28.47156 18.32586 
1 1 1   16   19   10 o  681.453   8.2419  355.713   8.5967  353.228   10.357  361.217   15.415  678.929   9.9662  686.039   14.680 -7.110046 17.74369 
1 1 1   16   19   11 o  283.383   10.679   61.555   4.6319   61.887   5.3830   60.611   9.0910  284.069   12.380  279.740   21.394 4.328461 24.71790 
1 1 1   16   19   12 f  477.284   8.6279  174.525   6.3031  174.022   7.4342  175.809   11.887  476.496   10.193  478.389   16.234 -1.892853 19.16907 
1 1 1   16   19   13 o  327.227   11.639   82.115   5.8295   82.115   5.8295   0.0000   0.0000  327.227   11.639  ?   ?  0.000000 11.63889 
1 1 1   16   19   14 o  715.149   10.316  392.072   11.292  392.072   11.292   0.0000   0.0000  715.149   10.316  ?   ?  0.000000 10.31557 
1 1 1   16   19   15 o  306.583   10.911   72.077   5.1204   73.534   5.7787   66.756   11.046  309.588   12.195  292.807   24.883 16.78082 27.71040 
1 1 1   16   19   16 o  409.029   9.5248  128.246   5.9632  127.848   6.8417  129.503   12.164  408.289   10.948  409.998   19.384 -1.709229 22.26179 
1 1 1   16   19   17 o  434.938   9.5145  145.021   6.3341  144.893   7.3070  145.409   12.705  434.623   10.984  434.406   19.107 0.2174377 22.03918 
1 1 1   16   19   18 o  182.318   17.015   25.804   4.6934   22.993   5.3706   34.889   9.6552  171.351   20.911  209.374   31.071 -38.02298 37.45193 
1 1 1   16   19   19 o  267.969   12.651   55.141   5.1891   55.569   5.9440   53.768   10.639  268.478   14.518  261.742   26.942 6.735260 30.60461 
1 1 1   16   19   20 o  245.307   11.254   46.184   4.2254   43.468   5.7776   49.308   6.1956  237.108   16.013  252.589   16.109 -15.48122 22.71404 
1 1 1   16   19   21 o  346.688   9.1988   92.171   4.8814  102.483   6.9948   82.382   6.8152  365.253   12.512  327.369   13.601 37.88345 18.48050 
1 1 1   16   19   22 o  463.654   9.7030  164.919   6.8860  183.150   12.327  156.650   8.3020  487.500   16.520  451.593   12.011 35.90671 20.42505 
1 1 1   16   19   23 o  489.550   6.6451  183.635   4.9793  185.868   6.1004  179.177   8.6186  492.375   8.0945  482.969   11.659 9.406036 14.19314 
1 1 1   16   19   24 o  484.457   7.2910  179.894   5.4064  186.790   6.9642  169.435   8.5769  493.428   9.2211  469.559   11.934 23.86929 15.08105 
1 1 1   16   19   25 o  336.073   8.1780   86.616   4.2068   91.172   5.3680   79.364   6.7724  344.604   10.177  321.091   13.780 23.51291 17.13059 
1 1 1   16   19   26 o  421.910   7.0154  136.452   4.5305  132.864   5.4395  144.577   8.1860  416.166   8.5393  433.562   12.335 -17.39627 15.00264 
1 1 1   16   19   27 o  126.427   14.210   12.471   2.7022   13.366   3.0979   9.6214   5.5255  130.659   15.812  108.944   31.410 21.71513 35.16522 
1 1 1   16   19   28 o  444.447   7.5384  151.496   5.1283  152.653   5.8689  147.762   10.546  445.998   8.5972  437.376   15.753 8.622406 17.94599 
1 1 1   16   19   29 o  245.478   9.4053   46.281   3.5339   48.155   4.2295   41.945   6.4320  250.233   11.043  231.878   18.270 18.35545 21.34817 
1 1 1   16   19   30 o  379.436   6.7438  110.399   3.9166  109.079   5.4100  111.852   5.6775  376.820   9.3798  381.525   9.7223 -4.705414 13.50940 
1 1 1   16   19   31 o  415.828   6.5993  132.599   4.2003  132.587   5.8738  132.611   6.0087  415.411   9.2379  415.409   9.4500 0.1312256E-02 13.21520 
1 1 1   16   19   32 o  424.701   6.6227  138.340   4.3051  143.965   6.1530  132.945   6.0257  432.797   9.2883  415.868   9.4664 16.92892 13.26217 
1 1 1   16   19   33 o   65.972   23.483   2.9937   2.9852   4.5342   3.4388  -1.7171   6.0135   76.967   25.263   66.381   29.507 10.58628 38.84408 
1 1 1   16   19   34 o  162.783   13.879   20.647   3.4252   23.168   4.0574   14.394   6.3897  172.126   15.569  130.864   32.135 41.26184 35.70769 
1 1 1   16   19   35 o   63.331   25.869   1.3607   3.9715   0.5046   4.2027   8.5062   12.142   61.494   25.980  116.557   46.043 -55.06319 52.86698 
1 1 1   16   19   36 o  158.327   15.899   19.679   3.8008   10.365   8.4526   22.039   4.2553  114.057   39.602  167.396   16.836 -53.33868 43.03188 
1 1 1   16   19   37 o  183.754   15.192   26.412   4.2346   22.258   11.616   27.049   4.5476  157.280   45.598  185.710   16.159 -28.42967 48.37703 
1 1 1   16   19   38 f  111.466   18.001   9.9557   2.9666   11.440   4.3586   8.6749   4.0493  117.653   24.976  102.142   25.872 15.51080 35.96004 
1 1 1   16   19   39 o   94.083   22.008   7.2855   3.1129   4.3626   4.7581   9.4726   4.1159   79.947   29.482  106.659   25.548 -26.71263 39.01114 
1 1 1   16   19   40 o  293.340   9.3749   66.312   4.2093   64.346   6.0357   68.173   5.8733  287.834   13.700  296.502   12.941 -8.668243 18.84591 
1 1 1   16   19   41 o  295.020   9.0740   67.071   4.0975   75.675   6.2928   60.738   5.3989  312.188   13.169  279.855   12.604 32.33246 18.22865 
1 1 1   16   19   42 o  198.919   16.161   31.173   4.8781   29.162   6.3022   34.177   7.7044  190.031   22.079  204.393   25.157 -14.36241 33.47172 
1 1 1   16   19   43 o   52.785   23.178  -0.5938   3.6037   2.6694   5.7839  -2.6643   4.6072   76.825   31.281   53.998   24.729 22.82761 39.87518 
1 1 1   16   19   44 f   52.896   23.108  -0.4049   3.5418   1.5191   5.3477  -1.9083   4.7272   70.640   29.544   56.665   25.595 13.97528 39.08867 
1 1 1   16   19   45 o  143.154   18.122   16.465   3.8819   16.269   5.8981   16.615   5.1560  137.619   28.919  141.063   24.784 -3.443710 38.08659 
1 1 1   16   19   46 o  182.534   14.473   26.275   4.0106   27.615   6.3291   25.377   5.1842  183.155   23.090  177.304   19.420 5.850372 30.17084 
1 1 1   16   19   47 o   70.102   26.466   3.3136   3.8799  -0.8875   6.3790   5.7804   4.8881   68.121   30.329   85.044   30.073 -16.92347 42.71096 
1 1 1   16   19   48 o   89.739   25.972   6.9349   3.7715   4.5246   5.6787   8.8372   5.0449   81.374   31.683   99.961   30.326 -18.58658 43.85719 
1 1 1   16   19   49 o  165.322   16.371   21.943   4.0881   15.097   6.0072   27.848   5.5795  129.367   30.783  184.359   20.098 -54.99130 36.76320 
1 1 1   16   19   50 o   55.432   25.584  -2.7623   5.0660 -14.4722   8.7320   3.1789   6.2198   57.411   28.253   77.449   32.081 -20.03784 42.74828 
1 1 1   16   19   51 o  129.838   25.939   14.877   4.9746   23.893   6.0738  -3.4964   8.6703  166.344   24.597   70.829   32.959 95.51559 41.12518 
1 1 1   16   19   52 o   85.288   29.174   6.4992   4.5801   7.9108   5.9916   4.5148   7.1041   92.529   33.233   82.347   34.212 10.18221 47.69588 
1 1 1   16   19   53 o   57.063   24.752   0.5090   4.0030   3.5761   5.5320  -2.8620   5.7996   74.235   30.451   58.060   26.997 16.17493 40.69474 
1 1 1   16   20    0 o  704.718   13.199  380.887   14.226  380.887   14.226  380.887   14.226  704.718   13.199  704.718   13.199 0.000000 0.000000 
1 1 1   16   20    1 o  757.634   9.5729  439.800   11.101  449.874   15.777  429.921   15.623  765.835   13.459  748.637   13.634 17.19775 19.15835 
1 1 1   16   20    2 o  997.666   10.841  762.869   16.555  761.115   23.192  764.692   23.639  995.807   15.216  998.094   15.473 -2.287415 21.70131 
1 1 1   16   20    3 o  627.737   9.1864  301.898   8.8266  298.630   12.116  305.594   12.885  624.028   12.685  631.195   13.337 -7.166931 18.40577 
1 1 1   16   20    4 o  1091.66   11.424  913.574   19.088  924.783   27.063  902.477   26.928  1097.43   16.111  1084.09   16.228 13.34192 22.86749 
1 1 1   16   20    5 o  336.428   8.4663   86.702   4.3597   88.494   5.1704   82.295   8.1092  339.826   9.9404  327.359   16.184 12.46716 18.99298 
1 1 1   16   20    6 o  1012.51   8.9731  785.432   13.906  788.367   16.943  779.374   24.343  1014.14   10.915  1007.47   15.786 6.674927 19.19197 
1 1 1   16   20    7 o  573.536   6.6919  251.900   5.8746  252.770   6.7328  249.125   12.025  574.471   7.6570  569.802   13.788 4.669495 15.77114 
1 1 1   16   20    8 o  627.529   6.8135  301.572   6.5444  299.313   7.4039  309.641   13.995  625.115   7.7380  635.150   14.395 -10.03473 16.34301 
1 1 1   16   20    9 o  236.418   9.3210   42.830   3.3730   42.631   3.6918   43.839   8.2968  235.836   10.227  237.313   23.136 -1.477219 25.29532 
1 1 1   16   20   10 o  195.143   13.930   29.377   4.1333   25.522   4.8265   39.980   8.0050  181.348   17.610  226.442   23.435 -45.09322 29.31393 
1 1 1   16   20   11 o  315.880   10.094   76.486   4.8802   74.279   5.7151   82.427   9.3777  311.187   11.999  326.735   18.831 -15.54828 22.32891 
1 1 1   16   20   12 o  981.025   11.382  738.113   17.091  738.113   17.091   0.0000   0.0000  981.025   11.382  ?   ?  0.000000 11.38214 
1 1 1   16   20   13 f  227.546   15.126   39.955   5.2382   39.955   5.2382   0.0000   0.0000  227.546   15.126  ?   ?  0.000000 15.12604 
1 1 1   16   20   14 o  961.337   9.3850  708.403   13.810  700.608   16.560  726.198   25.021  955.688   11.321  971.632   16.824 -15.94403 20.27840 
1 1 1   16   20   15 o  277.790   11.442   59.204   4.8649   53.578   5.4879   79.848   10.513  263.776   13.639  320.898   21.528 -57.12128 25.48495 
1 1 1   16   20   16 o  363.588   21.046  102.398   11.662   0.0000   0.0000  102.398   11.662  ?   ?   363.588   21.046 0.000000 21.04560 
1 1 1   16   20   17 o  281.933   11.947   61.014   5.1555   63.079   5.8276   53.580   11.058  286.562   13.286  260.997   28.123 25.56467 31.10379 
1 1 1   16   20   18 o  774.745   9.0082  460.194   10.682  450.212   12.585  485.920   20.205  766.007   10.734  794.388   16.617 -28.38098 19.78221 
1 1 1   16   20   19 o  375.584   10.255  108.226   5.8952  106.963   6.8326  111.904   11.661  373.221   11.960  380.061   20.117 -6.840759 23.40435 
1 1 1   16   20   20 o  370.151   8.8477  105.062   5.0128  101.435   7.0318  108.810   7.1479  363.335   12.644  376.339   12.409 -13.00412 17.71596 
1 1 1   16   20   21 o  160.215   23.847   20.355   5.6696   0.0000   0.0000   20.355   5.6696  ?   ?   160.215   23.847 0.000000 23.84652 
1 1 1   16   20   22 o  349.506   10.990   93.804   5.8795   99.763   9.8442   90.499   7.3305  359.436   17.893  342.939   13.965 16.49719 22.69791 
1 1 1   16   20   23 o  139.691   18.940   15.359   3.9452   14.072   5.7297   16.519   5.4404  131.478   29.228  143.462   25.720 -11.98363 38.93371 
1 1 1   16   20   24 o  515.995   6.6466  204.049   5.2495  201.932   6.3346  208.688   9.3792  513.144   8.0651  521.059   11.760 -7.915222 14.25995 
1 1 1   16   20   25 o  152.540   11.603   17.990   2.6888   14.552   3.0421   30.271   5.7491  136.611   14.784  196.740   19.341 -60.12926 24.34448 
1 1 1   16   20   26 o   38.055   17.490  -1.7201   2.3325  -2.4977   2.6094   1.3715   5.2030   38.431   17.949   71.355   29.430 -32.92347 34.47201 
1 1 1   16   20   27 o  376.350   7.7607  108.646   4.4706  107.545   5.0883  112.374   9.3616  374.305   8.8813  381.332   16.039 -7.027313 18.33366 
1 1 1   16   20   28 o  273.566   8.5650   57.445   3.5864   60.270   4.2362   50.297   6.7388  280.074   9.8816  254.227   17.423 25.84656 20.02993 
1 1 1   16   20   29 o  165.404   12.120   21.182   3.0471   23.066   3.5094   15.410   6.1425  172.427   13.402  136.747   30.157 35.67960 33.00112 
1 1 1   16   20   30 o  229.978   9.7261   40.656   3.4237   38.206   3.9509   48.039   6.8600  222.434   11.645  248.002   18.199 -25.56787 21.60560 
1 1 1   16   20   31 o  505.506   6.4078  195.964   4.9580  203.943   7.0127  187.991   7.0105  515.209   8.8927  494.568   9.2608 20.64059 12.83915 
1 1 1   16   20   32 o  211.435   10.788   34.514   3.4798   31.656   4.0466   42.625   6.8178  202.031   13.158  232.945   19.295 -30.91371 23.35439 
1 1 1   16   20   33 o  144.523   16.397   16.428   3.5630   17.575   3.7324   4.6437   11.963  149.496   16.591  107.157   44.448 42.33907 47.44342 
1 1 1   16   20   34 o   39.983   19.218  -4.9261   3.4354  -6.4479   11.349  -4.7726   3.6045   83.447   38.435   41.755   19.966 41.69249 43.31205 
1 1 1   16   20   35 f  199.077   12.735   30.762   3.8602   27.630   8.4600   31.586   4.3382  182.258   31.463  201.405   14.162 -19.14624 34.50358 
1 1 1   16   20   36 o  250.037   11.174   48.244   4.2765   59.137   9.4120   45.411   4.8006  272.454   22.778  241.889   13.014 30.56502 26.23382 
1 1 1   16   20   37 o  170.308   15.215   22.729   3.9244   24.836   9.1250   22.250   4.3469  169.843   36.207  167.964   17.149 1.879059 40.06273 
1 1 1   16   20   38 o  209.747   10.777   34.046   3.4483   39.715   5.1165   29.328   4.6676  225.483   14.909  193.336   15.914 32.14735 21.80690 
1 1 1   16   20   39 o  157.023   14.269   19.319   3.3921   24.417   5.0749   15.202   4.5605  175.143   19.248  136.650   22.593 38.49373 29.68084 
1 1 1   16   20   40 o  111.846   19.521   10.134   3.2203   12.626   4.7361   7.9920   4.3917  123.001   25.971   97.691   27.955 25.30923 38.15706 
1 1 1   16   20   41 o  242.701   13.704   45.958   5.0702   56.615   6.6397   31.052   7.8526  268.452   16.235  193.736   27.233 74.71542 31.70493 
1 1 1   16   20   42 o   77.786   24.752   4.8613   3.3168   1.1756   5.0297   7.6974   4.4121   68.037   28.566   95.698   28.206 -27.66078 40.14419 
1 1 1   16   20   43 o  312.428   9.3295   75.340   4.4615   77.585   6.5124   73.355   6.1244  315.599   13.481  307.052   13.031 8.547913 18.74998 
1 1 1   16   20   44 f  348.492   9.3548   93.803   4.9899   91.391   7.0582   96.213   7.0554  342.306   13.471  351.391   13.118 -9.085846 18.80312 
1 1 1   16   20   45 o  130.208   18.689   13.730   3.6178   14.727   5.7161   13.063   4.6729  130.272   29.369  124.241   25.429 6.030891 38.84781 
1 1 1   16   20   46 o  220.267   13.049   38.042   4.3799   41.886   7.1685   35.752   5.5327  227.076   20.858  211.639   17.229 15.43700 27.05348 
1 1 1   16   20   47 o  230.701   12.344   41.689   4.3432   36.888   6.0802   46.692   6.2061  213.764   18.773  241.833   16.872 -28.06847 25.24054 
1 1 1   16   20   48 o   72.919   26.074   4.0836   3.6845   2.1057   5.5231   5.6698   4.9459   71.929   30.048   83.968   30.190 -12.03925 42.59509 
1 1 1   16   20   49 o   49.661   23.030  -2.7836   4.1772  -3.9996   5.8117  -1.4841   6.0082   57.307   26.772   63.845   28.845 -6.538055 39.35463 
1 1 1   16   20   50 o  182.590   20.036   27.607   5.5075   22.610   8.9040   30.704   7.0092  150.283   38.528  189.012   24.828 -38.72911 45.83482 
1 1 1   16   20   51 o  125.683   23.488   13.724   4.3524   15.510   5.6240   11.057   6.8724  129.956   29.008  105.918   35.739 24.03729 46.02958 
1 1 1   16   20   52 o   99.982   26.258   9.1148   4.0701   4.2323   5.7861   13.897   5.7263   77.501   31.385  120.559   30.892 -43.05801 44.03801 
1 1 1   16   21    0 o   91.412   38.295   9.0897   5.3762   9.0897   5.3762   9.0897   5.3762   91.412   38.295   91.412   38.295 0.000000 0.000000 
1 1 1   16   21    1 o  250.081   11.880   47.961   4.5473   48.874   6.2947   46.964   6.5763  251.688   16.430  246.558   17.540 5.130096 24.03319 
1 1 1   16   21    2 f  815.894   9.8816  510.180   12.340  511.332   17.272  508.979   17.638  816.261   13.824  814.327   14.151 1.934082 19.78270 
1 1 1   16   21    3 o  675.003   13.559  349.641   14.009   0.0000   0.0000  349.641   14.009  ?   ?   675.003   13.559 0.000000 13.55888 
1 1 1   16   21    4 o  219.468   10.963   36.928   3.6826   36.311   4.2971   38.635   7.1462  217.163   12.987  222.952   21.196 -5.788116 24.85824 
1 1 1   16   21    5 o  353.340   8.2248   95.647   4.4483   95.833   5.2172   95.151   8.5127  353.616   9.6391  351.939   15.803 1.677979 18.51046 
1 1 1   16   21    6 o  543.505   7.5369  226.271   6.2700  223.156   7.4439  233.878   11.632  539.649   9.0120  552.000   13.768 -12.35046 16.45487 
1 1 1   16   21    7 o  359.464   7.4623   98.977   4.1058   97.180   4.6365  105.504   8.8378  356.139   8.5055  370.579   15.581 -14.43951 17.75129 
1 1 1   16   21    8 o  481.460   6.8791  177.540   5.0695  178.297   5.7912  175.055   10.486  482.431   7.8426  477.466   14.349 4.965240 16.35212 
1 1 1   16   21    9 o  168.941   12.347   22.015   3.1706   22.598   3.5109   19.435   7.3826  171.046   13.520  155.263   32.124 15.78242 34.85368 
1 1 1   16   21   10 o  444.559   8.8601  151.458   6.0289  153.813   7.1384  145.597   11.260  447.887   10.413  435.092   16.907 12.79443 19.85648 
1 1 1   16   21   11 o  378.889   10.970  110.104   6.3618  110.104   6.3618   0.0000   0.0000  378.889   10.970  ?   ?  0.000000 10.96982 
1 1 1   16   21   12 o  255.023   11.786   49.903   4.6007   50.163   5.3882   49.204   8.8386  255.188   13.847  251.251   23.246 3.936905 27.05767 
1 1 1   16   21   13 f  156.424   17.820   19.082   4.1905   16.760   4.7309   27.538   9.0288  145.734   21.885  185.099   33.082 -39.36536 39.66566 
1 1 1   16   21   14 o  222.733   13.350   38.241   4.5303   37.423   5.1549   41.016   9.4949  220.067   15.401  228.112   27.767 -8.045181 31.75179 
1 1 1   16   21   15 o  164.750   17.462   21.138   4.3362   22.111   4.9518   17.938   8.9802  168.173   19.605  148.043   39.063 20.12949 43.70672 
1 1 1   16   21   16 o  303.982   11.184   70.918   5.2037   68.880   5.9849   77.231   10.534  299.430   13.058  315.227   21.970 -15.79626 25.55763 
1 1 1   16   21   17 o  275.148   15.174   58.428   6.3656   54.662   7.9206   65.298   10.697  265.341   19.642  289.086   24.404 -23.74557 31.32657 
1 1 1   16   21   18 o  273.465   15.353   57.747   6.4003   59.039   7.9849   55.425   10.704  275.868   19.027  265.500   26.702 10.36829 32.78771 
1 1 1   16   21   19 o  277.432   15.511   59.458   6.5604   58.672   8.3418   60.733   10.622  274.745   19.973  278.311   25.207 -3.566345 32.16103 
1 1 1   16   21   20 o  195.961   22.247   30.156   6.5546   25.760   8.4715   36.715   10.346  178.402   32.209  213.668   32.674 -35.26572 45.87993 
1 1 1   16   21   21 o  368.224   9.0229  104.013   5.0854  104.968   7.0341  102.968   7.3607  369.517   12.437  365.885   13.143 3.631348 18.09473 
1 1 1   16   21   22 o  340.398   9.5005   88.923   4.9500   90.850   6.9249   86.910   7.0782  343.630   13.166  336.014   13.762 7.616119 19.04599 
1 1 1   16   21   23 f  243.797   11.972   45.700   4.4673   41.595   6.1511   50.282   6.4988  231.342   17.501  254.625   16.769 -23.28308 24.23757 
1 1 1   16   21   24 o  105.462   25.226   9.0373   4.0172   2.2613   5.4591   17.040   5.9328   75.991   30.587  145.051   27.733 -69.06056 41.28736 
1 1 1   16   21   25 o  141.818   12.736   15.606   2.7351   17.354   3.1455   10.187   5.5384  149.424   13.913  111.727   31.193 37.69693 34.15517 
1 1 1   16   21   26 o  247.302   8.9510   46.951   3.3882   45.883   3.7777   51.340   7.6614  244.371   10.100  256.368   19.674 -11.99641 22.11517 
1 1 1   16   21   27 o  446.090   7.0093  152.604   4.7859  148.437   5.7352  162.160   8.6856  439.746   8.5207  458.867   12.366 -19.12076 15.01766 
1 1 1   16   21   28 o  246.850   9.2819   46.811   3.5070   46.226   4.0918   48.431   6.8073  245.125   10.906  249.175   17.969 -4.050064 21.01958 
1 1 1   16   21   29 o  242.742   9.3656   45.281   3.4798   47.064   4.1111   40.776   6.5350  247.300   10.861  228.177   18.881 19.12300 21.78175 
1 1 1   16   21   30 o  112.344   16.810   10.002   2.8018   11.277   3.2095   5.9191   5.7437  119.112   18.180   91.148   32.559 27.96416 37.29099 
1 1 1   16   21   31 o  420.329   8.5287  135.743   5.4871  138.125   5.9018  120.562   14.901  423.887   9.0963  389.606   25.121 34.28036 26.71747 
1 1 1   16   21   32 o  106.850   23.609   9.3477   3.7584   7.5499   7.0238   10.069   4.4489  100.985   36.012  110.365   26.640 -9.380577 44.79465 
1 1 1   16   21   33 o  159.475   15.516   19.924   3.7394   26.908   11.232   19.053   3.9656  175.148   42.359  155.576   16.926 19.57182 45.61600 
1 1 1   16   21   34 o  361.350   7.5657  100.290   4.1845   95.374   6.0907  104.685   5.7588  351.602   11.317  368.640   10.206 -17.03799 15.23965 
1 1 1   16   21   35 o  119.151   19.586   11.410   3.4478   22.598   8.2091   9.0136   3.7991  163.151   33.977  104.534   24.219 58.61738 41.72495 
1 1 1   16   21   36 o  329.546   9.5924   83.648   4.8385  101.822   10.386   78.609   5.4682  359.822   18.923  319.098   11.196 40.72406 21.98725 
1 1 1   16   21   37 o  195.955   11.066   29.743   3.3055   29.710   4.7474   29.774   4.6052  194.560   16.086  194.926   15.565 -0.3657532 22.38338 
1 1 1   16   21   38 o  302.842   8.7526   70.606   4.0572   65.576   5.7703   75.523   5.7056  290.836   12.962  312.421   11.931 -21.58499 17.61767 
1 1 1   16   21   39 o  257.860   10.397   51.338   4.1036   63.538   6.1567   41.585   5.5046  285.826   14.073  230.285   15.710 55.54175 21.09172 
1 1 1   16   21   40 o  144.612   20.547   16.878   4.4202   15.880   5.3333   19.066   7.8992  138.075   26.194  147.424   35.443 -9.349594 44.07178 
1 1 1   16   21   41 o  246.392   10.518   46.930   3.9666   47.427   5.9409   46.531   5.3281  245.651   15.885  243.902   14.335 1.748886 21.39716 
1 1 1   16   21   42 o  156.329   14.674   19.248   3.4702   20.147   5.0977   18.472   4.7374  157.431   21.735  150.891   21.088 6.540131 30.28381 
1 1 1   16   21   43 o   86.184   24.224   6.2118   3.3285   3.3917   5.1168   8.2806   4.3825   76.260   29.964   98.582   27.827 -22.32214 40.89252 
1 1 1   16   21   44 o  190.951   13.283   28.585   3.8580   28.962   5.9409   28.310   5.0734  188.995   20.886  188.262   17.818 0.7321930 27.45360 
1 1 1   16   21   45 o  110.332   22.275   10.179   3.6321   9.1148   5.5272   10.988   4.8185  102.125   31.880  112.475   28.077 -10.35033 42.48103 
1 1 1   16   21   46 o   54.330   23.649  -0.1356   3.6797   15.498   6.0406  -9.3594   4.6399  132.152   30.485   41.280   20.368 90.87144 36.66315 
1 1 1   16   21   47 o  184.235   15.265   27.007   4.2660   23.070   5.7239   31.927   6.3983  166.153   23.134  196.844   21.590 -30.69113 31.64389 
1 1 1   16   21   48 o   94.771   26.408   7.8708   3.9735   1.0371   5.5362   15.131   5.7065   68.334   29.373  130.126   29.350 -61.79170 41.52340 
1 1 1   16   21   49 o   98.659   29.163   8.8143   4.7108   6.3401   9.2367   9.6841   5.4766   94.046   39.036  102.386   31.696 -8.339882 50.28425 
1 1 1   16   21   50 o   46.375   22.030  -4.2425   4.2419  -3.4329   5.5145  -5.4159   6.6386   56.040   26.146   58.371   27.679 -2.330620 38.07591 
1 1 1   16   21   51 o  115.617   22.962   11.662   3.9202   9.7605   5.4847   13.647   5.6052  100.896   31.799  120.076   30.453 -19.18021 44.02890 
1 1 1   16   21   52 o   63.807   26.999   1.6648   4.5497  -0.0683   5.6528   4.8523   7.6662   63.712   28.445   83.537   35.180 -19.82508 45.24074 
1 1 1   16   22    0 o  264.052   16.663   54.117   6.6730   54.117   6.6730   54.117   6.6730  264.052   16.663  264.052   16.663 0.000000 0.000000 
1 1 1   16   22    1 o  497.768   9.2550  189.896   7.0513  186.161   9.7607  193.973   10.198  492.512   12.948  502.706   13.253 -10.19354 18.52825 
1 1 1   16   22    2 o  193.087   14.716   28.801   4.3163   36.997   5.9272   19.548   6.2982  218.564   17.874  156.663   27.255 61.90150 32.59290 
1 1 1   16   22    3 o  535.105   9.1460  219.449   7.4910  215.620   10.268  223.808   10.953  530.072   12.655  539.972   13.253 -9.900208 18.32449 
1 1 1   16   22    4 o  504.896   7.6069  195.288   5.8787  195.032   7.0801  195.855   10.549  504.452   9.1695  505.073   13.645 -0.6207886 16.43970 
1 1 1   16   22    5 o  711.184   7.8763  387.502   8.5739  380.682   10.233  403.569   15.707  704.727   9.4866  724.904   14.156 -20.17786 17.04055 
1 1 1   16   22    6 o  789.156   8.0961  477.168   9.7793  466.134   11.642  503.614   18.024  779.773   9.7541  809.680   14.543 -29.90710 17.51136 
1 1 1   16   22    7 o  213.997   10.079   35.112   3.3013   31.965   3.6600   48.846   7.6460  203.775   11.785  250.932   20.075 -47.15727 23.27864 
1 1 1   16   22    8 o  443.722   7.0245  150.821   4.7708  154.877   5.4772  138.068   9.7121  449.591   7.9593  423.858   14.970 25.73203 16.95440 
1 1 1   16   22    9 o  132.984   16.492   13.810   3.2850   13.810   3.2850   0.0000   0.0000  132.984   16.492  ?   ?  0.000000 16.49240 
1 1 1   16   22   10 o  371.143   9.4401  105.606   5.3628  109.758   6.3470   95.245   10.026  378.252   10.963  351.070   18.726 27.18256 21.69923 
1 1 1   16   22   11 o  255.452   11.652   50.080   4.5561   47.034   5.2876   58.860   8.9780  247.013   14.043  275.215   21.483 -28.20204 25.66564 
1 1 1   16   22   12 o  112.805   28.406   10.286   4.9018   9.8445   6.1884   11.030   8.0303  111.484   33.535  119.498   38.565 -8.014084 51.10619 
1 1 1   16   22   13 o  279.269   13.615   59.932   5.8198   55.462   7.4452   66.954   9.3314  267.605   18.286  293.645   20.898 -26.03976 27.76849 
1 1 1   16   22   14 o  426.445   11.198  139.578   7.3089  144.186   9.7758  133.739   11.006  432.967   14.751  416.604   17.260 16.36331 22.70459 
1 1 1   16   22   15 o  377.264   12.225  109.318   7.0594  100.516   8.9447  123.856   11.496  361.271   16.176  400.598   18.748 -39.32715 24.76176 
1 1 1   16   22   16 o   89.945   28.250   6.2614   4.3326   6.4812   4.9734   5.5698   8.8239   92.651   30.380  102.012   39.556 -9.361656 49.87576 
1 1 1   16   22   17 o  147.581   20.822   17.179   4.5727   17.267   5.2498   16.903   9.3091  147.251   24.128  143.481   40.576 3.769302 47.20792 
1 1 1   16   22   18 o   59.398   27.386  -4.3545   5.7821  -0.9119   7.3779  -9.8351   9.3089   77.070   33.517   70.422   33.208 6.647652 47.18170 
1 1 1   16   22   19 o  225.577   19.129   39.627   6.5425   45.910   8.5474   30.738   10.167  241.952   23.371  194.164   35.518 47.78847 42.51752 
1 1 1   16   22   20 o  268.069   13.005   55.278   5.3361   57.216   6.0670   48.658   11.214  272.161   14.617  247.049   30.290 25.11131 33.63245 
1 1 1   16   22   21 o  435.619   10.094  145.702   6.7307  147.428   7.7880  140.609   13.379  437.961   11.618  425.777   20.529 12.18420 23.58818 
1 1 1   16   22   22 o  114.179   22.847   10.498   3.8535   7.3120   5.1599   14.517   5.7946   96.885   30.876  133.367   29.196 -36.48233 42.49405 
1 1 1   16   22   23 o  196.965   13.826   30.036   4.1419   22.717   5.6508   38.534   6.0887  169.406   22.337  222.399   18.042 -52.99315 28.71356 
1 1 1   16   22   24 o  163.740   16.997   20.957   4.1979   14.381   5.6797   28.875   6.2322  132.611   28.806  191.403   21.654 -58.79150 36.03690 
1 1 1   16   22   25 o  382.753   10.402  112.601   6.0943  113.331   7.6567  111.339   10.067  383.521   13.043  379.155   17.347 4.365753 21.70328 
1 1 1   16   22   26 o  163.895   11.407   20.769   2.8438   22.289   3.2430   15.712   5.9162  169.633   12.580  138.481   28.848 31.15173 31.47142 
1 1 1   16   22   27 f  118.035   15.226   10.947   2.6867   10.172   3.0399   13.713   5.7433  113.089   18.177  128.888   29.720 -15.79939 34.83821 
1 1 1   16   22   28 o  441.408   7.2261  149.488   4.8822  145.998   5.7863  158.110   9.0958  435.987   8.6708  452.663   13.128 -16.67599 15.73291 
1 1 1   16   22   29 o  297.288   9.2603   67.935   4.2138   71.088   4.4460   40.103   13.211  304.065   9.5529  216.822   41.314 87.24263 42.40450 
1 1 1   16   22   30 o  115.470   17.788   10.608   3.0429   10.426   3.1410   13.383   12.267  114.260   18.600  130.907   47.478 -16.64703 50.99111 
1 1 1   16   22   31 o  564.709   9.0442  245.208   7.8174  249.655   11.231  241.029   10.888  568.423   12.908  558.587   12.735 9.835815 18.13288 
1 1 1   16   22   32 o  169.963   12.652   22.441   3.2679   19.859   3.7137   31.300   6.8788  159.233   15.431  197.846   23.153 -38.61269 27.82400 
1 1 1   16   22   33 o  501.630   7.1128  193.191   5.4613  190.007   8.0799  195.869   7.4104  496.509   10.632  504.439   9.5976 -7.929962 14.32305 
1 1 1   16   22   34 o  126.177   19.466   12.758   3.6385   22.118   8.0850   10.381   4.0744  161.434   33.804  112.254   24.409 49.18031 41.69507 
1 1 1   16   22   35 o  425.216   8.6168  139.090   5.6082  143.992   10.857  137.306   6.5497  429.708   16.507  422.064   10.138 7.644196 19.37209 
1 1 1   16   22   36 o  138.407   14.203   15.026   2.9664   9.7349   4.1710   20.441   4.2196  108.176   25.591  160.774   17.426 -52.59747 30.96037 
1 1 1   16   22   37 o  331.732   8.0623   84.641   4.0937   85.766   5.8826   83.585   5.7004  333.060   11.539  328.860   11.325 4.200012 16.16792 
1 1 1   16   22   38 o   88.648   26.795   6.4585   3.9438   11.042   4.4448 -10.5033   8.5506  114.948   25.885   63.610   30.506 51.33849 40.00811 
1 1 1   16   22   39 o  213.600   13.543   35.601   4.4047   34.896   5.2907   37.193   7.9515  210.474   16.556  213.712   24.767 -3.238419 29.79122 
1 1 1   16   22   40 o  310.145   9.0118   74.155   4.2780   68.540   6.1005   79.588   6.0008  296.857   13.426  320.322   12.239 -23.46494 18.16756 
1 1 1   16   22   41 o  211.100   11.482   34.632   3.6961   33.902   5.4376   35.259   5.0393  206.862   17.333  211.638   15.668 -4.775970 23.36464 
1 1 1   16   22   42 o  228.022   10.704   40.259   3.7360   43.714   5.5469   37.391   5.0545  235.655   15.464  217.959   15.247 17.69583 21.71617 
1 1 1   16   22   43 o  297.721   12.269   68.963   5.5912   37.557   11.139   79.542   6.4647  204.785   36.893  319.319   13.227 -114.5335 39.19204 
1 1 1   16   22   44 o   52.088   22.733  -0.2976   3.4198  -8.0797   5.0336   6.3742   4.6607   45.948   22.363   87.843   29.432 -41.89549 36.96444 
1 1 1   16   22   45 o  134.555   17.933   14.659   3.6015   11.441   5.7232   16.768   4.6340  113.009   31.765  142.226   21.997 -29.21707 38.63778 
1 1 1   16   22   46 o   47.719   21.910  -2.1351   3.6491  -3.4720   5.3750  -0.9921   4.9698   56.233   26.094   59.830   26.694 -3.597298 37.32912 
1 1 1   16   22   47 o   48.045   22.106  -2.2196   3.7410 -10.8003   5.1351   7.4853   5.4611   42.539   21.069   92.901   31.856 -50.36240 38.19281 
1 1 1   16   22   48 o  196.268   16.825   31.088   5.0057   20.242   9.6997   35.025   5.8440  139.612   41.982  207.225   18.623 -67.61345 45.92713 
1 1 1   16   22   49 o   71.185   26.431   3.8604   3.8372   1.8492   5.5698   5.6772   5.2940   69.926   29.743   83.077   31.006 -13.15101 42.96476 
1 1 1   16   22   50 o  110.371   25.324   10.887   4.1874   8.3496   5.1883   15.628   7.0918   94.514   31.031  124.835   35.455 -30.32168 47.11674 
1 1 1   16   22   51 o   68.023   27.513   2.8796   4.4406   1.9067   5.4564   4.7880   7.6417   68.595   29.313   83.582   35.157 -14.98682 45.77451 
1 1 1   16   23    0 o  129.398   33.934   15.284   5.8070   15.284   5.8070   15.284   5.8070  129.398   33.934  129.398   33.934 0.000000 0.000000 
1 1 1   16   23    1 o   85.205   26.724   5.5790   3.8788   5.5387   5.3555   5.6234   5.6253   89.558   31.498   90.893   32.248 -1.335373 45.07827 
1 1 1   16   23    2 o  324.313   10.462   80.665   5.1936   78.540   7.2721   82.878   7.4199  319.668   14.862  328.388   14.762 -8.720367 20.94764 
1 1 1   16   23    3 f  232.269   12.571   41.535   4.4524   43.576   6.1057   39.218   6.5068  237.364   16.916  224.781   19.093 12.58282 25.50849 
1 1 1   16   23    4 o  123.571   20.963   12.107   3.8233   11.313   5.1058   13.120   5.7685  118.311   28.527  127.305   30.081 -8.993652 41.45667 
1 1 1   16   23    5 o  767.048   8.1064  450.874   9.5175  450.857   11.586  450.909   16.691  766.790   9.8713  766.031   14.235 0.7590942 17.32274 
1 1 1   16   23    6 o  364.500   8.3497  101.824   4.6584  102.095   5.5468  101.175   8.5815  364.878   9.9318  362.712   15.457 2.165741 18.37296 
1 1 1   16   23    7 o  583.756   9.3230  261.268   8.3302  261.268   8.3302   0.0000   0.0000  583.756   9.3230  ?   ?  0.000000 9.323008 
1 1 1   16   23    8 o  799.750   10.007  490.538   12.250  490.538   12.250   0.0000   0.0000  799.750   10.007  ?   ?  0.000000 10.00744 
1 1 1   16   23    9 o  558.790   7.8577  239.289   6.7207  227.805   7.7592  273.783   13.448  545.069   9.3002  596.701   14.724 -51.63220 17.41507 
1 1 1   16   23   10 o  604.138   8.4117  279.771   7.7784  283.028   9.5634  273.407   13.370  607.404   10.286  596.264   14.650 11.14093 17.90025 
1 1 1   16   23   11 o  642.248   8.5188  316.211   8.3743  305.207   10.007  341.923   15.297  630.719   10.366  666.674   14.990 -35.95508 18.22535 
1 1 1   16   23   12 o   85.211   26.923   5.5824   3.9296   6.6456   4.5179   2.2795   7.9634   92.484   28.815   88.752   36.485 3.731743 46.49147 
1 1 1   16   23   13 o  214.233   13.966   35.443   4.5545   34.095   5.3442   39.020   8.7056  209.675   16.793  222.486   26.057 -12.81079 30.99969 
1 1 1   16   23   14 o  260.881   12.192   52.287   4.8683   53.142   5.7802   50.201   9.0300  262.410   14.447  253.255   23.565 9.154556 27.64112 
1 1 1   16   23   15 o  582.349   8.8248  260.085   7.8661  252.021   9.3305  279.901   14.626  572.978   10.639  602.723   15.854 -29.74530 19.09252 
1 1 1   16   23   16 o  237.745   13.735   43.628   4.9767   42.633   5.7487   46.606   9.9429  234.633   16.104  242.853   27.217 -8.220688 31.62426 
1 1 1   16   23   17 o  228.365   18.674   40.577   6.4704   39.077   8.3083   42.889   10.315  222.680   24.797  232.022   29.728 -9.342163 38.71238 
1 1 1   16   23   18 o  209.901   20.441   34.457   6.4841   37.769   8.4122   29.609   10.178  218.574   25.631  190.072   36.308 28.50221 44.44343 
1 1 1   16   23   19 o  311.087   23.954   75.839   11.318   0.0000   0.0000   75.839   11.318  ?   ?   311.087   23.954 0.000000 23.95364 
1 1 1   16   23   20 o  421.899   10.051  136.685   6.4905  142.611   7.5902  120.562   12.520  430.721   11.513  393.522   20.860 37.19916 23.82578 
1 1 1   16   23   21 o  233.211   14.495   42.089   5.1485   39.426   5.8557   51.161   10.807  225.182   17.117  253.560   28.331 -28.37863 33.10056 
1 1 1   16   23   22 o  147.809   17.839   17.153   3.9542   19.976   5.5572   14.258   5.6277  158.299   23.661  132.093   28.658 26.20601 37.16404 
1 1 1   16   23   23 o   89.187   26.548   6.3479   3.8933   5.4577   5.5427   7.2149   5.4700   88.995   31.964   96.829   31.866 -7.834259 45.13418 
1 1 1   16   23   24 o  280.852   12.077   60.729   5.1919   61.402   6.5828   59.622   8.4450  281.482   15.337  276.124   20.120 5.358215 25.29874 
1 1 1   16   23   25 o  197.805   14.629   30.385   4.3977   36.538   6.2525   24.361   6.1867  215.977   19.111  174.794   23.738 41.18259 30.47496 
1 1 1   16   23   26 o  189.941   16.120   28.136   4.6423   25.925   6.4832   30.462   6.6505  180.179   24.113  196.005   22.580 -15.82578 33.03466 
1 1 1   16   23   27 o  201.511   10.983   31.352   3.3748   31.153   3.5078   33.835   12.371  200.788   11.461  198.732   41.986 2.056549 43.52262 
1 1 1   16   23   28 o   96.459   20.222   7.5330   2.8902   7.5486   2.9801   7.2855   11.851   96.456   20.797  113.704   45.306 -17.24815 49.85134 
1 1 1   16   23   29 o  190.313   16.744   28.356   4.8279   24.755   6.9141   31.782   6.7445  174.668   26.710  199.870   22.434 -25.20181 34.88107 
1 1 1   16   23   30 o  376.055   10.459  108.917   6.0201  105.690   8.5567  112.080   8.4712  369.165   15.143  380.354   14.551 -11.18958 21.00103 
1 1 1   16   23   31 f  177.046   12.026   24.307   3.2396   25.226   3.6833   21.169   6.8085  180.082   13.460  160.230   28.821 19.85240 31.80909 
1 1 1   16   23   32 o  204.611   11.910   32.435   3.7138   35.612   4.4204   24.809   6.8475  214.057   13.562  174.519   26.464 39.53775 29.73685 
1 1 1   16   23   33 o  208.482   17.767   34.193   5.6154   32.984   8.3683   35.183   7.5737  200.813   27.986  209.187   24.094 -8.373718 36.92922 
1 1 1   16   23   34 o  320.245   9.6860   79.000   4.7478   75.810   9.4267   80.085   5.4958  309.869   19.982  322.096   11.147 -12.22681 22.88095 
1 1 1   16   23   35 o   73.249   21.853   4.3142   2.6358   2.4684   3.6418   6.3451   3.8199   66.096   25.473   88.087   26.314 -21.99091 36.62321 
1 1 1   16   23   36 o  142.035   14.011   15.817   3.0064   16.181   4.2415   15.448   4.2619  141.959   20.081  138.430   20.754 3.528595 28.87836 
1 1 1   16   23   37 f  117.916   21.584   11.350   3.7521   13.033   4.2153   4.9336   8.2328  126.198   22.655   94.008   37.659 32.19018 43.94847 
1 1 1   16   23   38 o  113.143   18.180   10.302   3.0419   10.462   4.1803   10.122   4.4347  111.965   25.022  109.673   26.674 2.292503 36.57330 
1 1 1   16   23   39 o  382.836   9.7509  113.124   5.7138  101.184   11.020  117.513   6.6822  356.584   20.274  389.667   11.204 -33.08261 23.16403 
1 1 1   16   23   40 f  127.159   16.074   12.862   3.0587   11.258   4.3624   14.413   4.2899  115.817   25.315  132.744   21.876 -16.92631 33.45746 
1 1 1   16   23   41 o  496.445   7.9142  189.818   6.0138  185.794   8.2363  194.412   8.8013  489.721   10.988  500.669   11.485 -10.94824 15.89461 
1 1 1   16   23   42 o   60.199   23.532   1.9766   3.1424  -0.7941   4.6509   4.3040   4.2626   59.108   26.127   76.855   27.970 -17.74704 38.27461 
1 1 1   16   23   43 o  282.001   12.697   62.024   5.4805   74.298   7.2325   45.472   8.3986  306.917   15.445  235.136   23.657 71.78142 28.25226 
1 1 1   16   23   44 o  131.602   18.800   14.097   3.6793   18.707   5.9318   11.215   4.6906  147.645   27.252  113.642   27.306 34.00301 38.57835 
1 1 1   16   23   45 o  247.609   16.403   48.858   6.1814   48.858   6.1814   0.0000   0.0000  247.609   16.403  ?   ?  0.000000 16.40277 
1 1 1   16   23   46 o  180.497   17.030   26.210   4.6493   33.227   5.7011   12.280   8.0333  202.475   18.604  113.822   38.638 88.65235 42.88362 
1 1 1   16   23   47 o  271.854   12.100   57.938   5.0348   46.081   7.0000   70.646   7.2470  237.390   19.435  297.194   15.990 -59.80457 25.16756 
1 1 1   16   23   48 o   61.161   26.330   0.7329   4.4613   8.7701   8.7259  -2.1116   5.1911   99.247   39.087   57.298   26.244 41.94989 47.08027 
1 1 1   16   23   49 o   69.105   26.799   3.3478   4.0505   5.1183   5.3271   0.9215   6.2364   80.303   30.845   69.599   30.527 10.70482 43.39710 
1 1 1   16   23   50 o   85.892   28.391   6.7024   4.3403   1.4170   5.3865   16.486   7.3287   66.943   28.875  126.981   36.035 -60.03750 46.17619 
1 1 1   16   24    0 o  320.361   14.621   79.217   7.1354   79.217   7.1354   79.217   7.1354  320.361   14.621  320.361   14.621 0.000000 0.000000 
1 1 1   16   24    1 o  128.825   20.644   13.132   3.9332   17.223   5.5566   9.0238   5.5682  146.911   25.644  106.652   31.749 40.25860 40.81190 
1 1 1   16   24    2 o  169.339   16.172   22.270   4.1406   19.953   5.7320   24.800   5.9878  158.661   24.383  177.650   22.527 -18.98857 33.19666 
1 1 1   16   24    3 o  259.160   11.498   51.553   4.5610   46.286   6.0889   58.286   6.8846  244.662   16.354  274.660   16.452 -29.99780 23.19710 
1 1 1   16   24    4 o  134.429   26.563   14.522   5.2719   14.522   5.2719   0.0000   0.0000  134.429   26.563  ?   ?  0.000000 26.56344 
1 1 1   16   24    5 o  205.648   13.961   32.658   4.3686   32.658   4.3686   0.0000   0.0000  205.648   13.961  ?   ?  0.000000 13.96126 
1 1 1   16   24    6 o  169.388   14.125   22.211   3.6288   17.789   4.2064   35.077   7.1747  150.739   18.628  211.700   22.486 -60.96086 29.19954 
1 1 1   16   24    7 o  461.690   7.2094  163.334   5.0947  164.432   5.8350  159.809   10.451  463.154   8.2309  455.753   14.982 7.401123 17.09382 
1 1 1   16   24    8 o  542.899   7.1024  225.843   5.9020  220.396   6.6611  245.737   12.730  536.212   8.1159  565.172   14.716 -28.95978 16.80551 
1 1 1   16   24    9 o  321.006   8.3056   78.997   4.0809   78.000   4.5780   82.850   9.0044  318.901   9.3790  327.220   18.048 -8.318665 20.33942 
1 1 1   16   24   10 o  213.617   13.440   35.220   4.3720   32.804   5.1235   41.693   8.3857  205.690   16.410  230.505   24.125 -24.81525 29.17741 
1 1 1   16   24   11 o  168.803   16.636   22.173   4.2425   22.878   5.0174   20.404   7.9464  170.971   19.523  158.089   33.860 12.88268 39.08496 
1 1 1   16   24   12 o  382.307   9.7076  112.141   5.6806  113.403   6.7823  109.174   10.398  384.252   11.532  376.046   18.064 8.206726 21.43132 
1 1 1   16   24   13 o  313.573   10.915   75.501   5.2390   76.706   6.2457   72.639   9.6235  315.858   12.919  305.591   20.696 10.26645 24.39726 
1 1 1   16   24   14 o  516.793   9.0748  204.880   7.1783  199.676   8.5788  217.031   13.109  509.906   10.992  530.545   16.143 -20.63858 19.52955 
1 1 1   16   24   15 o  396.193   9.8980  120.481   6.0024  116.328   7.1251  130.633   11.140  389.044   11.965  411.236   17.698 -22.19125 21.36352 
1 1 1   16   24   16 o  133.977   28.700   14.597   5.7083   9.3325   7.3149   22.795   9.1286  110.541   36.872  166.101   36.868 -55.56025 52.14188 
1 1 1   16   24   17 o  364.715   10.601  102.169   5.9182  106.583   6.9019   89.909   11.502  372.305   12.112  339.354   22.268 32.95074 25.34864 
1 1 1   16   24   18 o  255.350   13.238   50.328   5.1562   46.989   5.8018   62.879   11.247  246.321   15.467  282.216   26.342 -35.89450 30.54664 
1 1 1   16   24   19 f  361.512   10.772  100.428   5.9605   98.039   6.8525  107.857   12.082  356.926   12.543  371.861   21.316 -14.93445 24.73226 
1 1 1   16   24   20 o  140.930   22.315   15.836   4.6533   14.574   5.2491   20.470   10.056  134.067   26.519  155.880   41.435 -21.81291 49.19492 
1 1 1   16   24   21 o  292.991   12.445   66.091   5.5810   59.965   6.2892   88.789   12.106  278.353   14.815  336.207   23.675 -57.85413 27.92826 
1 1 1   16   24   22 o  369.977   11.163  105.290   6.3214  107.361   7.1922   98.257   13.254  373.343   12.586  353.163   24.673 20.18005 27.69789 
1 1 1   16   24   23 o   75.383   27.992   3.5669   4.3041  -0.8201   5.4892   10.569   6.9350   65.905   28.780  114.315   35.714 -48.41015 45.86712 
1 1 1   16   24   24 o  181.384   19.767   25.910   5.3990   22.718   6.1614   36.470   11.205  168.365   24.638  209.665   36.226 -41.29951 43.81032 
1 1 1   16   24   25 o  145.630   24.598   17.117   5.2876   10.644   5.9912   39.924   11.246  113.583   32.695  220.020   34.531 -106.4370 47.55326 
1 1 1   16   24   26 o  244.570   13.017   46.298   4.8551   56.488   7.0400   37.056   6.7047  269.147   17.178  216.856   20.441 52.29170 26.70045 
1 1 1   16   24   27 o  121.632   25.246   12.108   4.5462   18.415   6.4912   6.0362   6.3691  149.373   29.438   93.402   34.160 55.97150 45.09382 
1 1 1   16   24   28 o  195.131   16.411   29.781   4.8559   31.323   6.7121   28.088   7.0338  198.333   22.509  186.742   25.256 11.59091 33.83075 
1 1 1   16   24   29 o  304.042   8.4195   71.041   3.9182   71.569   4.5488   69.522   7.7133  304.956   9.7453  298.433   16.956 6.522858 19.55690 
1 1 1   16   24   30 o  257.830   9.3432   51.146   3.6872   52.961   4.2425   45.543   7.4550  262.170   10.572  240.088   20.483 22.08171 23.05010 
1 1 1   16   24   31 o  238.607   10.546   43.882   3.8516   47.869   4.4962   32.890   7.4651  248.991   11.798  202.101   24.643 46.88931 27.32107 
1 1 1   16   24   32 o  187.971   18.455   27.902   5.2412   18.624   7.7804   35.611   7.0917  147.399   35.006  211.181   22.275 -63.78264 41.49238 
1 1 1   16   24   33 o  177.631   12.897   24.553   3.4825   24.181   3.9525   25.842   7.3635  175.811   14.826  177.116   28.100 -1.305084 31.77156 
1 1 1   16   24   34 o  171.212   14.230   22.917   3.6954   26.292   4.3044   13.456   7.2066  183.120   15.503  124.933   35.828 58.18777 39.03805 
1 1 1   16   24   35 o   98.428   18.537   7.8415   2.6903   9.0017   3.8031   6.6793   3.8061  104.151   24.301   89.979   26.105 14.17204 35.66532 
1 1 1   16   24   36 o  307.299   10.333   72.897   4.8603   71.542   5.4935   77.777   10.428  304.032   11.805  312.056   21.972 -8.024719 24.94213 
1 1 1   16   24   37 o  254.937   9.5529   50.126   3.7277   46.676   5.0236   54.353   5.5606  244.727   13.463  264.022   13.808 -19.29485 19.28481 
1 1 1   16   24   38 o  125.014   16.305   12.435   3.0457   17.950   4.3692   7.2218   4.2480  149.475   19.567   93.045   27.738 56.43022 33.94517 
1 1 1   16   24   39 o  129.965   15.898   13.417   3.0966   12.550   4.2001   14.451   4.5836  123.233   23.116  132.310   23.494 -9.077278 32.95917 
1 1 1   16   24   40 o   78.508   23.018   5.0796   2.9451   2.9153   4.2837   7.0196   4.0558   70.705   27.520   91.401   27.071 -20.69604 38.60310 
1 1 1   16   24   41 o   97.982   21.439   7.9839   3.1260   6.6301   4.5794   9.1651   4.2776   89.442   29.143  103.545   26.787 -14.10299 39.58353 
1 1 1   16   24   42 o  123.386   19.324   12.412   3.5297   16.610   5.4832   9.4425   4.6124  139.772   26.602  104.427   28.196 35.34528 38.76451 
1 1 1   16   24   43 o  207.505   13.515   33.858   4.2692   28.689   6.3591   38.100   5.7603  186.415   22.759  218.313   17.382 -31.89830 28.63780 
1 1 1   16   24   44 o   76.456   26.880   4.5892   3.9000   4.6433   5.7715   4.5438   5.2906   82.226   31.961   80.338   30.767 1.888000 44.36331 
1 1 1   16   24   45 o   78.278   25.586   5.0944   3.5289   5.2786   5.2632   4.9439   4.7564   82.928   30.922   80.141   29.488 2.786850 42.72830 
1 1 1   16   24   46 o  311.902   10.892   75.901   5.1998   69.587   7.3351   82.280   7.3724  294.772   16.321  322.031   14.957 -27.25906 22.13783 
1 1 1   16   24   47 o  329.440   16.375   87.126   8.2570   0.0000   0.0000   87.126   8.2570  ?   ?   329.440   16.375 0.000000 16.37485 
1 1 1   16   24   48 o  136.084   20.376   15.590   4.1137   18.342   5.4582   11.972   6.2589  144.232   25.664  110.861   33.811 33.37033 42.44799 
1 1 1   16   24   49 o   97.097   25.544   8.5167   3.8475   6.2072   5.4372   10.833   5.4453   84.525   31.447  106.182   31.345 -21.65690 44.40066 
1 1 1   16   25    0 o  581.235   13.612  259.572   12.095  259.572   12.095  259.572   12.095  581.235   13.612  581.235   13.612 0.000000 0.000000 
1 1 1   16   25    1 o  367.210   14.166  103.716   7.9621  103.716   7.9621   0.0000   0.0000  367.210   14.166  ?   ?  0.000000 14.16593 
1 1 1   16   25    2 o  197.148   20.638   30.381   6.1355   30.381   6.1355   0.0000   0.0000  197.148   20.638  ?   ?  0.000000 20.63841 
1 1 1   16   25    3 o  325.697   14.846   81.636   7.4013   81.636   7.4013   0.0000   0.0000  325.697   14.846  ?   ?  0.000000 14.84642 
1 1 1   16   25    4 o  578.549   9.6895  256.779   8.5804  258.442   11.730  254.866   12.584  579.822   13.218  575.581   14.283 4.240417 19.46062 
1 1 1   16   25    5 f  423.926   10.059  137.897   6.5272  138.068   8.8430  137.691   9.6747  423.726   13.635  422.945   14.945 0.7817383 20.22977 
1 1 1   16   25    6 o  650.908   8.0426  324.799   8.0128  316.805   9.5162  344.276   14.854  642.605   9.6750  668.865   14.509 -26.26062 17.43859 
1 1 1   16   25    7 o  446.195   7.4469  152.591   5.0860  147.397   5.7586  171.009   10.844  438.429   8.5812  471.289   15.033 -32.85938 17.30940 
1 1 1   16   25    8 o   89.494   22.997   6.4514   3.1671   5.0823   3.5232   12.216   7.2296   81.149   25.473  122.953   36.067 -41.80379 44.15549 
1 1 1   16   25    9 o  150.105   14.726   17.511   3.3398   17.194   3.7341   18.776   7.4672  148.396   16.732  151.570   33.113 -3.173889 37.09980 
1 1 1   16   25   10 o  136.386   20.508   14.714   4.1486   13.628   4.8935   17.487   7.8224  130.105   25.485  145.785   35.408 -15.68082 43.62529 
1 1 1   16   25   11 o  288.172   11.309   63.791   4.9884   62.475   5.9793   66.803   9.0475  284.936   13.710  293.019   20.298 -8.083130 24.49391 
1 1 1   16   25   12 o  589.685   8.8959  266.752   8.0293  268.730   9.8237  262.772   13.936  591.526   10.850  583.838   15.595 7.687866 18.99792 
1 1 1   16   25   13 o   53.305   24.009  -2.0017   4.1257  -3.2404   4.7341   1.9096   8.4125   54.589   25.025   89.339   37.182 -34.74959 44.81939 
1 1 1   16   25   14 o  609.892   11.523  285.880   10.757  310.677   15.571  263.242   14.878  634.538   16.032  583.906   16.647 50.63214 23.11214 
1 1 1   16   25   15 o  688.221   11.480  364.073   12.094  335.711   16.245  399.334   18.113  659.489   16.093  719.131   16.456 -59.64264 23.01688 
1 1 1   16   25   16 o  262.284   12.842   52.947   5.1556   57.525   6.0753   41.166   9.7456  272.781   14.604  227.096   28.676 45.68491 32.18055 
1 1 1   16   25   17 f  550.356   9.2619  232.519   7.8021  226.382   9.1594  248.748   14.894  542.697   11.027  567.132   17.158 -24.43433 20.39557 
1 1 1   16   25   18 o  377.311   10.600  109.409   6.1220  110.051   7.1141  107.574   12.019  378.146   12.291  371.234   21.240 6.912018 24.53962 
1 1 1   16   25   19 o   83.113   28.908   4.9593   4.5049   6.2773   5.0861   0.1613   9.7041   91.381   30.746   90.187   38.829 1.193535 49.52730 
1 1 1   16   25   20 o  238.004   14.534   43.884   5.2693   41.481   5.9220   53.015   11.545  230.880   16.875  257.015   29.906 -26.13525 34.33878 
1 1 1   16   25   21 o  262.857   15.741   53.625   6.3039   53.625   6.3039   0.0000   0.0000  262.857   15.741  ?   ?  0.000000 15.74057 
1 1 1   16   25   22 o  398.404   12.775  122.366   7.7903  122.366   7.7903   0.0000   0.0000  398.404   12.775  ?   ?  0.000000 12.77494 
1 1 1   16   25   23 o  264.614   14.313   54.259   5.7754   51.025   6.5597   65.411   12.180  255.970   16.837  285.798   28.212 -29.82779 32.85411 
1 1 1   16   25   24 o  146.073   20.266   16.960   4.4090   10.601   6.0548   24.137   6.4328  113.289   32.943  173.313   24.970 -60.02375 41.33683 
1 1 1   16   25   25 o  215.142   14.745   35.990   4.8261   36.877   6.5806   34.958   7.0992  216.353   20.101  209.866   22.449 6.487793 30.13299 
1 1 1   16   25   26 o  162.092   18.634   20.745   4.5390   19.825   6.4876   21.627   6.3529  155.420   28.314  163.187   26.330 -7.766998 38.66512 
1 1 1   16   25   27 f  132.182   23.226   14.151   4.5276   6.5357   6.3084   22.240   6.5019   95.047   34.104  165.331   26.595 -70.28426 43.24778 
1 1 1   16   25   28 o  214.661   14.796   35.885   4.8317   35.500   6.9058   36.255   6.7625  211.446   21.643  213.955   20.917 -2.509247 30.09880 
1 1 1   16   25   29 o   75.995   28.560   3.6252   4.5070   4.3174   6.5002   2.9843   6.2547   86.953   33.885   81.292   32.733 5.661179 47.11294 
1 1 1   16   25   30 o  169.671   22.835   23.138   5.7798   25.082   11.374   22.462   6.7109  167.797   43.812  165.436   27.465 2.361237 51.70944 
1 1 1   16   25   31 o  211.932   17.306   35.286   5.5647   36.949   8.1938   33.862   7.5813  213.762   25.549  204.899   24.669 8.863312 35.51508 
1 1 1   16   25   32 o  159.865   13.700   19.957   3.3199   20.460   3.8001   18.339   6.8228  161.417   15.574  147.407   31.211 14.01060 34.88120 
1 1 1   16   25   33 o  218.957   11.827   37.174   3.9489   34.968   4.5499   43.908   7.9501  211.754   14.119  234.258   22.447 -22.50360 26.51817 
1 1 1   16   25   34 o  361.009   8.9876  100.367   4.9663  102.950   5.8563   93.753   9.3712  365.217   10.476  345.364   17.788 19.85297 20.64365 
1 1 1   16   25   35 o  247.336   11.470   47.319   4.3424   50.713   4.8353   33.176   9.8719  255.836   12.348  197.119   33.944 58.71721 36.12023 
1 1 1   16   25   36 o  171.677   11.976   22.938   3.1273   25.030   4.3662   20.734   4.4814  178.188   16.185  161.309   18.484 16.87810 24.56882 
1 1 1   16   25   37 o   85.241   21.579   6.0086   2.8180   7.2559   3.9264   4.6834   4.0470   93.136   26.357   78.682   27.397 14.45396 38.01687 
1 1 1   16   25   38 o  350.716   8.0062   94.708   4.2979   89.473   6.0657   99.987   6.0905  339.731   11.665  359.366   11.073 -19.63440 16.08324 
1 1 1   16   25   39 o  132.302   15.857   13.916   3.1472   11.604   4.6523   15.867   4.2734  116.948   26.591  139.722   20.600 -22.77463 33.63701 
1 1 1   16   25   40 o  106.020   19.629   9.2145   3.0680   9.5249   4.4244   8.9270   4.2580  105.425   27.228  102.182   26.868 3.242958 38.25208 
1 1 1   16   25   41 o  286.327   9.8983   63.467   4.3380   60.991   6.1864   65.863   6.0846  278.488   14.564  290.168   13.700 -11.68039 19.99469 
1 1 1   16   25   42 o   56.042   23.681   0.6326   3.4927  -0.5787   4.9943   1.7921   4.8862   61.432   27.119   68.452   28.401 -7.019497 39.26855 
1 1 1   16   25   43 o  123.833   20.221   12.651   3.7004   16.943   5.9202   9.8988   4.7405  139.220   28.735  106.067   28.563 33.15331 40.51566 
1 1 1   16   25   44 o  195.077   12.979   29.965   3.8531   27.385   5.7083   32.124   5.2224  182.503   20.806  199.924   17.235 -17.42041 27.01734 
1 1 1   16   25   45 o   45.231   21.034  -2.5965   3.5228   1.8704   5.2340  -6.2958   4.7632   69.349   29.129   46.472   22.410 22.87642 36.75200 
1 1 1   16   25   46 o  140.354   21.989   16.673   4.5687   8.7188   8.8861   19.531   5.3267   99.633   39.379  150.902   23.855 -51.26822 46.04100 
1 1 1   16   25   47 o   72.693   25.748   4.3082   3.5847   6.2163   5.2554   2.6479   4.9022   85.043   31.041   69.654   28.629 15.38923 42.22719 
1 1 1   16   25   48 o   96.233   29.950   8.6772   4.8822   5.0364   5.3662   26.174   11.764   79.726   30.866  148.225   46.548 -68.49878 55.85195 
1 1 1   16   26    0 o  594.394   13.684  271.524   12.434  271.524   12.434  271.524   12.434  594.394   13.684  594.394   13.684 0.000000 0.000000 
1 1 1   16   26    1 o  475.425   13.953  173.926   10.154   0.0000   0.0000  173.926   10.154  ?   ?   475.425   13.953 0.000000 13.95316 
1 1 1   16   26    2 o  783.298   14.580  472.368   17.481   0.0000   0.0000  472.368   17.481  ?   ?   783.298   14.580 0.000000 14.58014 
1 1 1   16   26    3 o  552.721   14.012  235.102   11.854   0.0000   0.0000  235.102   11.854  ?   ?   552.721   14.012 0.000000 14.01210 
1 1 1   16   26    4 o  396.061   15.227  120.845   9.2310   0.0000   0.0000  120.845   9.2310  ?   ?   396.061   15.227 0.000000 15.22711 
1 1 1   16   26    5 o  260.175   19.515   52.658   7.7150   0.0000   0.0000   52.658   7.7150  ?   ?   260.175   19.515 0.000000 19.51540 
1 1 1   16   26    6 f  220.915   14.878   37.759   5.0015   33.759   6.6883   42.832   7.5332  207.597   21.353  234.107   21.255 -26.50949 30.12838 
1 1 1   16   26    7 o  335.553   8.3464   86.350   4.2868   83.451   4.8428   96.845   9.2144  329.763   9.5945  354.211   16.996 -24.44812 19.51668 
1 1 1   16   26    8 o  294.352   8.8974   66.469   4.0087   64.612   4.4879   73.796   8.9157  290.111   10.107  308.278   18.987 -18.16699 21.50954 
1 1 1   16   26    9 o  256.007   9.8782   50.310   3.8708   53.604   4.4250   39.576   7.9880  264.165   10.944  224.297   23.622 39.86768 26.03423 
1 1 1   16   26   10 o  687.846   7.4035  362.723   7.7947  359.655   8.9032  372.793   16.130  684.743   8.4947  695.408   15.154 -10.66547 17.37282 
1 1 1   16   26   11 o  532.356   9.0424  217.469   7.3681  212.535   8.8861  228.325   13.181  525.941   11.038  543.994   15.830 -18.05359 19.29853 
1 1 1   16   26   12 o  274.787   14.971   58.389   6.2731   53.063   8.8443   63.782   8.8990  260.218   22.424  285.990   20.465 -25.77209 30.35859 
1 1 1   16   26   13 o  429.372   12.104  141.806   7.9546  154.538   11.369  129.598   11.133  447.243   16.608  409.287   17.772 37.95630 24.32409 
1 1 1   16   26   14 o  199.002   15.691   30.758   4.7406   31.219   5.5916   29.581   8.9393  199.938   18.480  190.942   31.698 8.995804 36.69189 
1 1 1   16   26   15 o  419.383   9.9451  135.095   6.3840  135.241   7.4221  134.680   12.516  419.343   11.563  416.557   19.630 2.785553 22.78265 
1 1 1   16   26   16 o  600.293   9.2167  276.676   8.4685  264.560   9.8520  310.959   16.572  586.607   10.973  633.911   17.080 -47.30420 20.30053 
1 1 1   16   26   17 o  236.104   14.102   43.149   5.0728   38.173   5.8082   59.152   10.416  221.378   17.278  273.529   25.161 -52.15105 30.52198 
1 1 1   16   26   18 o  221.008   14.984   37.897   5.0389   38.605   5.7376   35.510   10.537  222.650   16.963  208.061   34.279 14.58911 38.24700 
1 1 1   16   26   19 o  354.490   11.397   96.712   6.1837   95.079   7.1511  101.551   12.312  351.129   13.306  359.705   22.474 -8.576202 26.11757 
1 1 1   16   26   20 f   95.038   32.385   6.8044   5.6438   6.8044   5.6438   0.0000   0.0000   95.038   32.385  ?   ?  0.000000 32.38528 
1 1 1   16   26   21 o  195.375   18.127   29.908   5.3592   33.420   6.1203   18.362   11.097  206.220   19.626  146.788   45.065 59.43227 49.15317 
1 1 1   16   26   22 o  254.554   14.517   50.267   5.6329   44.138   6.3845   71.801   11.967  237.688   17.675  300.149   26.313 -62.46085 31.69856 
1 1 1   16   26   23 o  191.755   18.849   28.920   5.4607   31.152   6.2418   21.637   11.274  198.505   20.855  157.583   44.684 40.92195 49.31093 
1 1 1   16   26   24 o  174.451   17.064   23.874   4.4982   29.587   6.3261   18.031   6.3973  193.014   21.795  147.774   29.318 45.23961 36.53178 
1 1 1   16   26   25 o  407.673   9.8893  127.894   6.1709  130.896   8.4844  124.521   8.9915  411.468   13.471  400.952   14.651 10.51657 19.90319 
1 1 1   16   26   26 f  182.810   16.950   26.214   4.6888   29.007   6.5636   23.304   6.7005  190.536   22.969  169.204   26.762 21.33215 35.26703 
1 1 1   16   26   27 o   85.640   28.557   5.6582   4.3878   6.6008   6.0621   4.6210   6.3590   94.481   33.482   87.583   33.686 6.898567 47.49461 
1 1 1   16   26   28 o  171.223   18.425   23.164   4.7527   22.798   6.6686   23.542   6.7754  166.954   27.019  169.721   26.985 -2.766891 38.18628 
1 1 1   16   26   29 o  150.372   31.418   19.006   6.9981   0.0000   0.0000   19.006   6.9981  ?   ?   150.372   31.418 0.000000 31.41751 
1 1 1   16   26   30 o  254.531   16.156   50.659   6.2618   63.660   10.458   43.394   7.8179  281.753   24.495  233.287   22.160 48.46584 33.03138 
1 1 1   16   26   31 o  411.634   9.0671  130.439   5.7128  129.606   6.0357  137.597   17.703  410.171   9.6138  411.626   28.269 -1.455444 29.85914 
1 1 1   16   26   32 o  197.719   11.834   30.336   3.5649   30.243   3.9882   30.704   7.9513  197.061   13.300  193.239   27.673 3.822311 30.70326 
1 1 1   16   26   33 o  212.923   11.749   35.174   3.8141   36.811   4.2855   28.940   8.3652  217.526   12.929  185.931   30.448 31.59537 33.07964 
1 1 1   16   26   34 o   87.735   23.500   6.3697   3.2192   5.7784   3.5426   9.1722   7.7121   84.101   25.390  106.978   37.780 -22.87626 45.51872 
1 1 1   16   26   35 o   72.279   25.440   3.8268   3.4940   0.5695   3.8063   21.270   8.8083   58.617   24.743  154.891   37.544 -96.27397 44.96394 
1 1 1   16   26   36 o  147.406   16.700   17.245   3.7015   18.076   4.1419   13.951   8.2488  150.409   18.373  125.421   38.912 24.98839 43.03163 
1 1 1   16   26   37 o  319.832   8.3304   78.805   4.0781   84.785   5.7697   72.836   5.7649  330.794   11.395  306.291   12.297 24.50266 16.76482 
1 1 1   16   26   38 o   56.084   22.142   1.5615   2.8063   0.6190   3.8632   2.6145   4.0834   58.881   24.894   68.391   26.800 -9.510902 36.57813 
1 1 1   16   26   39 o  185.112   12.040   26.748   3.3930   29.430   4.7668   23.994   4.8306  192.676   16.317  172.961   18.535 19.71515 24.69375 
1 1 1   16   26   40 o  105.963   22.079   9.3811   3.4649   7.7635   4.7251   11.263   5.0960   95.194   29.437  113.619   29.157 -18.42452 41.43282 
1 1 1   16   26   41 o  274.602   10.082   58.458   4.2375   57.708   5.8650   59.277   6.1290  270.794   14.200  274.215   14.656 -3.420898 20.40628 
1 1 1   16   26   42 o  163.484   14.708   21.208   3.6410   25.412   5.9246   18.656   4.6155  175.101   22.635  150.740   20.539 24.36118 30.56480 
1 1 1   16   26   43 o  121.066   19.014   12.046   3.4074   13.619   5.1020   10.779   4.5780  124.710   27.470  110.821   27.193 13.88985 38.65282 
1 1 1   16   26   44 f  138.470   22.821   16.223   4.6682  -0.3292   9.8203   21.055   5.3060   81.708   36.900  158.266   22.540 -76.55882 43.23964 
1 1 1   16   26   45 o   77.826   28.239   4.8837   4.3404  -4.5410   8.7961   7.9172   4.9903   69.926   32.754   93.587   30.419 -23.66125 44.70041 
1 1 1   16   26   46 o  205.125   12.813   33.350   4.0028   34.659   6.0556   32.335   5.3344  204.557   19.580  198.904   17.707 5.653320 26.39884 
1 1 1   16   26   47 o  143.353   25.663   18.223   5.4243   18.577   6.2682   17.167   10.824  141.398   29.897  122.041   44.546 19.35776 53.64874 
1 1 1   16   27    0 o  215.514   20.227   36.696   6.5372   36.696   6.5372   36.696   6.5372  215.514   20.227  215.514   20.227 0.000000 0.000000 
1 1 1   16   27    1 o  234.306   13.736   42.407   4.9048   41.166   6.8205   43.736   7.0584  229.742   19.583  236.837   19.648 -7.095459 27.74065 
1 1 1   16   27    2 o  673.930   9.9812  348.684   10.296  331.570   13.913  369.405   15.309  656.232   13.851  692.479   14.443 -36.24744 20.01132 
1 1 1   16   27    3 o  419.053   10.282  134.844   6.5948  135.527   9.1758  134.115   9.4848  419.459   14.292  417.161   14.854 2.298309 20.61328 
1 1 1   16   27    4 o  242.122   13.202   45.247   4.8743   43.510   6.4754   47.519   7.4040  236.545   18.020  246.881   19.759 -10.33614 26.74228 
1 1 1   16   27    5 o  391.781   10.524  117.892   6.3111  107.480   8.2466  132.609   9.8049  373.496   14.425  414.662   15.448 -41.16660 21.13604 
1 1 1   16   27    6 o   62.103   25.813   0.7862   4.0467   1.8503   5.1749  -0.8885   6.4923   73.004   29.641   72.012   31.378 0.9918976 43.16381 
1 1 1   16   27    7 o  415.694   7.7041  132.509   4.9019  129.430   5.5890  142.774   10.204  410.701   8.8908  430.202   15.497 -19.50104 17.86596 
1 1 1   16   27    8 o  650.779   7.3986  324.722   7.3698  322.365   8.4234  332.417   15.218  648.221   8.4897  656.506   15.144 -8.284119 17.36177 
1 1 1   16   27    9 o  360.675   8.2427   99.791   4.5505  101.374   5.1857   94.492   9.4887  363.405   9.3228  349.026   17.821 14.37885 20.11204 
1 1 1   16   27   10 o  314.617   10.040   76.025   4.8351   74.860   5.7188   78.944   9.0540  311.962   11.977  318.691   18.642 -6.728882 22.15779 
1 1 1   16   27   11 o  130.684   28.528   13.947   5.5464   16.593   7.6018   10.936   8.1103  141.406   35.247  118.001   38.800 23.40421 52.41920 
1 1 1   16   27   12 o  139.483   19.960   15.402   4.1399   14.560   4.8541   17.647   7.9288  134.475   24.485  145.638   35.817 -11.16302 43.38628 
1 1 1   16   27   13 o  186.152   15.877   26.965   4.4806   23.312   5.2378   36.931   8.6513  172.046   20.280  215.193   26.849 -43.14677 33.64753 
1 1 1   16   27   14 o  270.012   12.300   56.131   5.0835   50.922   5.9200   70.756   9.9195  256.347   15.155  300.527   21.710 -44.18045 26.47679 
1 1 1   16   27   15 o  496.988   9.6609  189.755   7.3491  179.114   8.5606  219.572   14.330  482.447   11.593  532.264   17.589 -49.81708 21.06581 
1 1 1   16   27   16 o  197.592   16.388   30.422   4.9118   32.173   5.6284   24.828   10.059  202.796   18.331  171.518   39.174 31.27797 43.25093 
1 1 1   16   27   17 o   42.398   20.740  -8.4369   4.4895  -6.3132   5.1154 -15.5574   9.3665   50.555   24.066   62.744   30.531 -12.18855 38.87555 
1 1 1   16   27   18 o  430.755   12.213  142.976   8.0525  142.976   8.0525   0.0000   0.0000  430.755   12.213  ?   ?  0.000000 12.21330 
1 1 1   16   27   19 o   97.230   32.060   7.3574   5.5361   7.3574   5.5361   0.0000   0.0000   97.230   32.060  ?   ?  0.000000 32.06044 
1 1 1   16   27   20 o  250.130   14.703   48.561   5.6044   45.556   6.3832   58.672   11.708  241.564   17.380  270.013   28.773 -28.44952 33.61471 
1 1 1   16   27   21 o  348.293   12.065   93.543   6.4320   90.541   7.4134  102.680   12.936  342.175   14.155  360.403   23.579 -18.22726 27.50165 
1 1 1   16   27   22 o  260.028   14.641   52.506   5.8037   49.145   6.5979   63.999   12.201  250.821   17.291  281.716   28.696 -30.89484 33.50317 
1 1 1   16   27   23 o  130.886   27.113   14.103   5.2531   13.375   5.9568   16.649   11.141  126.455   31.012  139.754   45.451 -13.29945 55.02348 
1 1 1   16   27   24 o  154.104   23.308   19.118   5.3261   14.616   5.9780   36.451   11.729  132.353   30.178  207.055   38.424 -74.70193 48.85826 
1 1 1   16   27   25 o  340.284   10.952   89.251   5.7044   93.634   7.7665   84.117   8.4059  347.582   14.598  328.379   16.780 19.20325 22.24133 
1 1 1   16   27   26 o  216.022   15.373   36.413   5.0499   42.479   6.9879   29.781   7.3060  231.977   19.872  191.957   25.497 40.02008 32.32611 
1 1 1   16   27   27 o  300.653   17.459   70.756   7.9997   0.0000   0.0000   70.756   7.9997  ?   ?   300.653   17.459 0.000000 17.45872 
1 1 1   16   27   28 o  130.148   34.877   14.504   7.0887   0.0000   0.0000   14.504   7.0887  ?   ?   130.148   34.877 0.000000 34.87722 
1 1 1   16   27   29 o  192.688   18.063   29.296   5.2653   31.679   7.2679   26.664   7.6383  198.049   24.498  179.713   28.736 18.33646 37.76152 
1 1 1   16   27   30 o  152.049   22.682   18.703   5.1173   15.561   7.2017   21.908   7.2727  134.356   34.756  161.632   30.515 -27.27542 46.25126 
1 1 1   16   27   31 o   74.137   29.844   2.5003   5.1980   4.7156   7.2259   0.1246   7.4828   90.246   35.561   78.019   33.841 12.22653 49.08984 
1 1 1   16   27   32 o  108.851   19.919   9.6184   3.1964   10.356   3.5523   6.4806   7.3267  112.614   21.390   96.421   36.377 16.19299 42.19997 
1 1 1   16   27   33 o   37.726   18.135  -4.3549   3.0618  -2.7076   3.2802 -15.5009   8.5326   43.740   20.327   57.499   28.223 -13.75898 34.78071 
1 1 1   16   27   34 o   66.010   24.346   2.8920   3.2449   1.5846   3.4879   11.303   8.8473   60.792   24.456  115.992   40.502 -55.20002 47.31272 
1 1 1   16   27   35 o  302.608   9.9766   70.717   4.6210   74.374   5.3705   60.290   9.0684  309.933   11.321  274.049   21.799 35.88416 24.56344 
1 1 1   16   27   36 o  173.005   14.774   23.548   3.8748   22.385   4.3796   27.740   8.3136  167.803   17.300  180.144   31.286 -12.34140 35.75023 
1 1 1   16   27   37 o  187.969   23.436   28.929   6.5963   20.031   9.7747   36.371   8.9385  146.429   41.637  207.770   28.889 -61.34166 50.67764 
1 1 1   16   27   38 o  164.144   13.421   21.163   3.3423   26.991   4.6920   15.158   4.7623  184.235   16.824  134.857   23.949 49.37872 29.26781 
1 1 1   16   27   39 o   91.880   23.469   7.1387   3.3125   6.2346   4.5228   8.1848   4.8651   86.909   28.993   97.405   29.828 -10.49580 41.59752 
1 1 1   16   27   40 f  109.116   20.029   9.8346   3.2219   11.577   4.7479   8.3473   4.3866  115.570   27.279   98.101   27.892 17.46889 39.01406 
1 1 1   16   27   41 o  246.317   13.017   47.623   4.8903   56.692   6.4214   35.101   7.5457  267.281   15.766  204.850   24.555 62.43102 29.18069 
1 1 1   16   27   42 o  246.430   29.650   52.937   10.959   52.937   10.959   0.0000   0.0000  246.430   29.650  ?   ?  0.000000 29.64969 
1 1 1   16   27   43 o  324.329   12.237   82.477   6.0748   64.767   10.403   91.640   7.4831  276.487   24.848  340.335   14.365 -63.84808 28.70135 
1 1 1   16   27   44 o   52.956   25.103  -4.9674   5.4515   4.3628   8.5231 -11.4274   7.0920   87.020   36.894   52.580   25.792 34.44015 45.01560 
1 1 1   16   27   45 o   83.680   27.742   6.1598   4.1430   11.959   5.1844  -4.0886   6.8918  113.635   29.535   61.910   28.997 51.72484 41.39037 
1 1 1   16   27   46 o  134.534   25.813   16.104   5.1220   19.246   5.8653   6.0102   10.513  146.286   27.196   93.059   40.239 53.22715 48.56702 
1 1 1   16   28    0 o   46.335   30.961  -1.9510   6.0384  -1.9510   6.0384  -1.9510   6.0384   46.335   30.961   46.335   30.961 0.000000 0.000000 
1 1 1   16   28    1 o  463.126   10.135  164.743   7.1843  170.256   10.256  159.432   10.067  469.982   14.257  454.751   14.463 15.23096 20.30836 
1 1 1   16   28    2 o   43.191   20.793  -6.0562   4.0606  -3.4381   5.3699  -9.5528   6.2056   58.511   26.760   52.712   25.458 5.798676 36.93540 
1 1 1   16   28    3 o  289.404   12.132   64.434   5.3740   64.648   7.3443   64.187   7.8845  288.748   16.689  287.405   18.014 1.342590 24.55628 
1 1 1   16   28    4 o   91.965   27.796   6.7168   4.2442   9.4492   5.9160   3.8192   6.0922  108.437   32.827   84.695   32.860 23.74151 46.44797 
1 1 1   16   28    5 o  162.958   18.383   20.823   4.5051   21.901   5.8609   19.266   7.0432  165.901   23.759  153.459   31.052 12.44177 39.09833 
1 1 1   16   28    6 o   82.012   26.253   5.1804   3.7273   2.3459   4.4552   11.793   6.8045   70.855   27.922  120.076   34.924 -49.22119 44.71404 
1 1 1   16   28    7 o  168.819   15.685   22.195   4.0068   24.401   4.8019   17.139   7.2700  176.613   18.015  143.927   33.610 32.68559 38.13353 
1 1 1   16   28    8 o  156.894   17.406   19.281   4.1095   18.550   4.8645   21.101   7.6801  152.971   21.359  160.256   32.423 -7.284256 38.82601 
1 1 1   16   28    9 o  373.679   9.7212  107.257   5.5602  103.452   6.6046  116.515   10.303  366.680   11.768  387.931   17.351 -21.25110 20.96495 
1 1 1   16   28   10 o  154.607   15.068   18.628   3.5204   18.878   3.9277   17.609   7.9381  155.316   16.789  145.266   35.906 10.04980 39.63745 
1 1 1   16   28   11 o  392.686   10.111  118.504   6.0771  120.430   7.3263  114.257   10.880  395.510   12.102  383.718   18.525 11.79263 22.12794 
1 1 1   16   28   12 o  239.701   13.900   44.472   5.0780   43.958   5.9884   45.787   9.5800  237.748   16.559  239.762   26.550 -2.013199 31.29095 
1 1 1   16   28   13 o  317.427   11.416   77.544   5.5464   76.554   6.5391   80.083   10.471  315.034   13.561  319.640   21.528 -4.605865 25.44290 
1 1 1   16   28   14 o  526.130   9.5418  212.701   7.6841  211.282   9.2317  215.902   13.865  523.894   11.512  527.716   17.165 -3.822021 20.66798 
1 1 1   16   28   15 o  325.371   11.669   81.525   5.8117   79.833   6.8689   85.787   10.903  321.551   13.956  330.616   21.664 -9.065247 25.77045 
1 1 1   16   28   16 o  251.275   14.191   48.933   5.4357   45.028   6.3120   60.140   10.693  240.274   17.278  274.970   25.706 -34.69585 30.97301 
1 1 1   16   28   17 o  426.443   12.443  140.234   8.1219  140.234   8.1219   0.0000   0.0000  426.443   12.443  ?   ?  0.000000 12.44306 
1 1 1   16   28   18 f   99.527   29.436   8.0644   4.7980   4.8664   5.4335   19.388   10.224   85.548   31.511  150.023   42.558 -64.47514 52.95374 
1 1 1   16   28   19 f  115.283   27.829   10.987   4.8547   11.437   5.5652   9.5528   9.9299  117.235   30.664  115.209   42.569 2.025703 52.46323 
1 1 1   16   28   20 o  358.797   11.647   99.246   6.3962   94.870   7.3793  112.468   12.826  350.291   13.763  377.700   22.285 -27.40942 26.19227 
1 1 1   16   28   21 o  425.626   11.131  139.598   7.2515  138.116   8.4079  143.903   14.328  422.837   12.991  427.403   21.976 -4.566498 25.52819 
1 1 1   16   28   22 o  173.596   21.223   23.978   5.5217   28.073   6.3214   10.795   11.342  187.620   22.459  121.435   45.370 66.18504 50.62468 
1 1 1   16   28   23 o  206.352   18.981   33.544   5.9280   31.074   6.7671   41.693   12.291  197.288   22.831  222.025   37.502 -24.73643 43.90510 
1 1 1   16   28   24 o  557.461   12.895  240.264   11.003  232.843   14.047  252.042   17.698  546.867   16.782  566.664   20.404 -19.79730 26.41920 
1 1 1   16   28   25 o  213.886   22.463   36.485   7.2442   39.933   8.8469   29.468   12.620  222.159   26.543  181.386   45.526 40.77367 52.69804 
1 1 1   16   28   26 o  111.268   31.742   10.389   5.6712   17.553   9.9172   6.9080   6.9132  141.458   42.430   97.698   35.610 43.76002 55.39328 
1 1 1   16   28   27 o  248.305   14.393   48.007   5.4466   42.054   7.3263   55.363   8.1439  230.088   21.035  264.562   20.265 -34.47470 29.20899 
1 1 1   16   28   28 o   92.956   30.317   6.9180   4.9555   1.7259   6.5040   14.103   7.6512   78.009   32.600  127.804   36.994 -49.79471 49.30799 
1 1 1   16   28   29 o  103.081   30.064   8.8887   5.0360   7.3945   6.8576   10.638   7.4196   98.946   35.552  112.923   37.110 -13.97783 51.39146 
1 1 1   16   28   30 o  322.287   12.656   80.475   6.2432   86.318   8.5979   73.957   9.0804  331.760   16.989  305.845   19.499 25.91516 25.86131 
1 1 1   16   28   31 o  272.443   14.787   57.962   6.1431   51.358   8.5751   64.925   8.8047  253.157   22.360  285.953   20.247 -32.79619 30.16479 
1 1 1   16   28   32 o  178.066   24.250   25.847   6.4374   20.881   8.0261   34.804   10.779  155.011   34.693  200.177   36.524 -45.16605 50.37515 
1 1 1   16   28   33 f  216.682   12.287   36.519   4.0582   36.851   4.3460   34.258   11.341  217.424   13.121  196.421   39.098 21.00255 41.24049 
1 1 1   16   28   34 o  213.072   12.403   35.355   4.0274   39.272   4.4806   18.877   9.1895  224.382   13.103  144.002   40.172 80.38023 42.25475 
1 1 1   16   28   35 o   85.652   24.274   6.1105   3.3279   7.0734   3.6016   0.4876   8.7035   91.793   24.971   83.046   36.254 8.747681 44.02131 
1 1 1   16   28   36 o  133.371   20.128   14.465   3.9811   14.714   4.1932   12.188   12.676  134.152   21.119  121.194   47.295 12.95776 51.79582 
1 1 1   16   28   37 o  100.250   26.241   8.5850   4.0735   9.0937   4.3951   5.4851   10.849  102.872   27.416  100.516   42.063 2.356155 50.20874 
1 1 1   16   28   38 o  157.602   16.816   19.859   3.9940   18.962   4.7345   22.073   7.4378  152.251   20.865  158.337   31.794 -6.086090 38.02942 
1 1 1   16   28   39 f  147.117   14.620   17.172   3.2485   18.403   4.8054   16.135   4.4083  149.372   21.649  139.887   21.258 9.485519 30.34077 
1 1 1   16   28   40 o  296.408   14.643   69.216   6.6435   0.0000   0.0000   69.216   6.6435  ?   ?   296.408   14.643 0.000000 14.64333 
1 1 1   16   28   41 o  103.508   21.977   9.0714   3.3742   13.134   4.9014   5.4121   4.6520  122.603   26.861   82.009   29.301 40.59423 39.75041 
1 1 1   16   28   42 o  108.441   22.567   10.047   3.6238   9.0707   5.2296   10.950   5.0261   99.930   30.980  110.002   29.319 -10.07170 42.65388 
1 1 1   16   28   43 o  166.104   20.442   22.961   5.0876   1.5814   8.7305   33.955   6.2605   81.046   35.812  202.304   20.501 -121.2580 41.26474 
1 1 1   16   28   44 o  168.691   15.141   22.906   3.8679   26.681   6.2063   20.508   4.9459  176.370   23.580  155.923   21.279 20.44687 31.76222 
1 1 1   16   28   45 o  110.582   28.668   11.327   4.8927   8.6631   5.3755   24.188   11.812   95.962   31.590  142.290   46.827 -46.32808 56.48615 
1 1 1   16   29    0 o  164.679   28.992   22.870   6.6313   22.870   6.6313   22.870   6.6313  164.679   28.992  164.679   28.992 0.000000 0.000000 
1 1 1   16   29    1 o  199.269   15.835   30.878   4.7901   32.206   6.6960   29.487   6.8552  202.087   22.003  192.796   23.731 9.290634 32.36215 
1 1 1   16   29    2 o  432.189   10.581  143.588   6.9995  139.103   9.6308  148.609   10.190  424.481   14.823  438.653   15.177 -14.17191 21.21493 
1 1 1   16   29    3 o  244.527   13.530   46.234   5.0444   47.924   6.7949   44.159   7.5290  248.003   18.023  237.260   20.947 10.74246 27.63383 
1 1 1   16   29    4 o  170.685   17.977   22.826   4.6260   23.849   6.1071   21.449   7.0857  173.091   23.672  162.273   29.619 10.81802 37.91631 
1 1 1   16   29    5 o  225.091   15.204   39.314   5.2075   37.025   7.0030   42.145   7.7885  216.951   21.366  231.335   22.271 -14.38385 30.86294 
1 1 1   16   29    6 o  381.019   9.9573  111.560   5.8071  105.580   7.0205  124.515   10.334  370.254   12.388  401.018   16.835 -30.76465 20.90191 
1 1 1   16   29    7 o  180.793   15.829   25.464   4.3362   29.010   5.2637   17.976   7.6494  192.570   18.069  146.866   34.598 45.70410 39.03182 
1 1 1   16   29    8 o  253.484   10.377   49.400   4.0261   50.417   4.5498   45.731   8.6442  255.932   11.614  240.478   23.797 15.45348 26.47978 
1 1 1   16   29    9 o  119.969   19.418   11.465   3.4438   12.718   3.8630   6.6145   7.6016  126.185   20.720  100.026   37.188 26.15926 42.57114 
1 1 1   16   29   10 o  380.458   8.5236  111.134   4.9636  103.933   5.5233  141.362   11.316  367.733   9.8129  426.956   17.316 -59.22260 19.90317 
1 1 1   16   29   11 o  223.357   14.410   38.696   4.9001   38.443   5.8426   39.293   8.9973  221.969   17.334  221.445   27.111 0.5236664 32.17857 
1 1 1   16   29   12 o  182.514   17.342   26.073   4.7866   27.305   5.6734   23.030   8.9162  186.084   20.246  165.633   36.182 20.45055 41.46066 
1 1 1   16   29   13 o  176.135   18.369   24.374   4.8793   26.335   5.7099   19.068   9.3945  182.508   20.812  149.505   40.188 33.00247 45.25679 
1 1 1   16   29   14 o  496.844   9.8632  189.827   7.5008  196.762   9.1605  175.714   13.066  505.307   11.844  475.401   17.957 29.90607 21.51098 
1 1 1   16   29   15 o   92.271   31.370   6.4533   5.2955   6.4533   5.2955   0.0000   0.0000   92.271   31.370  ?   ?  0.000000 31.37021 
1 1 1   16   29   16 o  446.975   12.296  154.103   8.4123  154.103   8.4123   0.0000   0.0000  446.975   12.296  ?   ?  0.000000 12.29591 
1 1 1   16   29   17 o  296.154   12.680   67.699   5.7478   68.112   6.7246   66.578   11.074  296.598   14.812  289.073   25.282 7.524719 29.30203 
1 1 1   16   29   18 o   68.172   28.195   1.2943   4.7938  -1.0314   5.3845   10.183   10.527   64.335   28.289  118.256   43.803 -53.92041 52.14364 
1 1 1   16   29   19 o   53.333   24.739  -3.8594   4.8248  -7.2876   5.4376   8.8318   10.462   50.876   24.380  113.938   43.353 -63.06136 49.73777 
1 1 1   16   29   20 o  259.438   17.653   52.662   6.9682   54.860   8.7359   48.818   11.554  263.310   21.874  243.948   31.691 19.36169 38.50677 
1 1 1   16   29   21 o  684.575   12.258  361.863   12.844  343.711   16.642  388.604   20.199  664.893   16.353  705.278   18.711 -40.38495 24.85010 
1 1 1   16   29   22 o  251.283   19.302   49.697   7.3670   52.573   8.9610   43.698   12.940  257.027   23.021  226.422   38.731 30.60538 45.05614 
1 1 1   16   29   23 o  155.210   24.583   19.548   5.6455   19.430   6.2675   20.056   12.998  153.636   27.670  150.305   49.105 3.330353 56.36384 
1 1 1   16   29   24 o   75.785   30.612   2.4661   5.4890  -1.5658   6.0666   20.668   12.890   66.715   29.647  151.821   48.845 -85.10613 57.13825 
1 1 1   16   29   25 o  125.159   37.149   13.420   7.6318   8.6991   9.5331   21.844   12.735  110.185   41.511  155.214   48.382 -45.02909 63.74967 
1 1 1   16   29   26 o  111.825   31.839   10.545   5.7116   10.041   6.3736   12.602   12.870  109.679   34.234  127.446   48.181 -17.76733 59.10427 
1 1 1   16   29   27 o  121.198   27.718   12.296   5.0302   21.614   6.8478   1.3768   7.4133  161.225   28.806   81.110   34.399 80.11517 44.86787 
1 1 1   16   29   28 f  163.546   21.739   21.528   5.3072   30.536   7.3320   11.615   7.6918  193.703   25.337  117.013   37.741 76.68926 45.45707 
1 1 1   16   29   29 o   65.418   28.231   0.0291   5.1545   4.3931   6.9874  -5.1809   7.6347   88.186   34.899   67.280   31.177 20.90595 46.79678 
1 1 1   16   29   30 o   73.106   29.639   2.3159   5.1663   2.7698   7.2048   1.8355   7.4121   83.738   34.594   81.936   34.553 1.801498 48.89439 
1 1 1   16   29   31 o  249.305   17.603   49.041   6.6741   49.062   8.4708   49.006   10.838  246.961   22.662  242.661   29.806 4.299957 37.44284 
1 1 1   16   29   32 o   94.794   32.404   7.2136   5.6505   15.278   8.1634  -0.2035   7.8291  130.863   38.308   78.168   34.247 52.69577 51.38462 
1 1 1   16   29   33 o   86.569   32.369   5.2843   5.7752   14.264   8.4018  -2.7590   7.9516  126.200   39.291   72.918   33.042 53.28145 51.33763 
1 1 1   16   29   34 o  210.485   13.689   34.684   4.3861   37.189   4.6182   11.623   14.012  217.903   13.919  122.225   49.071 95.67818 51.00652 
1 1 1   16   29   35 o   88.215   26.279   6.5307   3.8137   5.2138   4.0375   17.430   11.616   80.976   27.393  135.229   46.454 -54.25314 53.92929 
1 1 1   16   29   36 o   58.306   24.157   1.0796   3.5277  -0.6610   3.9897   7.3161   7.5522   55.005   24.262   97.586   36.905 -42.58025 44.16549 
1 1 1   16   29   37 o  132.826   20.119   14.439   3.9624   17.635   4.7030   6.6208   7.3559  146.346   21.649   94.292   36.239 52.05380 42.21253 
1 1 1   16   29   38 o  119.122   22.353   11.871   3.9261   9.5126   4.6027   18.168   7.5221  104.363   28.162  140.777   35.046 -36.41354 44.95862 
1 1 1   16   29   39 o  178.503   16.253   25.467   4.3921   35.223   5.4954   8.2145   7.3077  209.587   17.285   98.827   36.518 110.7605 40.40200 
1 1 1   16   29   40 o  110.134   20.985   10.177   3.4084   12.591   4.8148   7.7524   4.8256  119.829   26.909   93.798   29.856 26.03103 40.19314 
1 1 1   16   29   41 o  124.355   30.106   14.079   5.6691   16.280   8.5552   12.356   7.5695  127.169   39.657  112.886   37.502 14.28304 54.58043 
1 1 1   16   29   42 o   65.483   27.330   1.8000   4.5632  -8.5598   11.869   3.5969   4.9431   75.336   36.079   73.863   29.314 1.473076 46.48695 
1 1 1   16   29   43 o   70.333   25.696   3.8561   3.6027   5.1654   5.5348   2.8936   4.7457   81.256   31.378   70.001   28.397 11.25505 42.32038 
1 1 1   16   30    0 o  284.969   18.374   63.378   7.9379   63.378   7.9379   63.378   7.9379  284.969   18.374  284.969   18.374 0.000000 0.000000 
1 1 1   16   30    1 o  104.956   27.613   9.0289   4.4958   3.2959   6.1845   15.454   6.5471   82.824   32.815  136.476   31.912 -53.65252 45.77355 
1 1 1   16   30    2 o  369.149   11.468  104.902   6.4798  108.610   8.8923  100.704   9.4619  374.712   15.504  360.388   17.153 14.32349 23.12143 
1 1 1   16   30    3 o  116.614   26.820   11.149   4.6875   9.9951   6.2520   12.630   7.0837  110.864   33.788  123.384   35.561 -12.52087 49.05319 
1 1 1   16   30    4 o  318.391   12.584   78.138   6.1328   76.996   8.3968   79.443   8.9785  314.545   17.510  319.229   18.454 -4.684174 25.43908 
1 1 1   16   30    5 o  290.051   12.884   64.874   5.7198   63.519   7.5919   66.653   8.6984  285.600   17.451  291.945   19.579 -6.345154 26.22725 
1 1 1   16   30    6 o  324.112   10.913   80.838   5.4141   83.559   6.6955   75.697   9.2025  329.086   13.292  311.224   19.415 17.86255 23.52928 
1 1 1   16   30    7 o  284.130   11.660   62.178   5.0709   61.827   6.1867   62.898   8.8515  282.511   14.354  283.181   20.562 -0.6698608 25.07648 
1 1 1   16   30    8 o  154.920   18.324   18.908   4.2610   16.204   4.9983   26.098   8.1510  141.813   23.875  178.396   30.974 -36.58273 39.10798 
1 1 1   16   30    9 o  123.691   19.607   12.203   3.5882   12.015   4.0339   12.913   7.8535  122.022   22.424  124.668   37.841 -2.646431 43.98613 
1 1 1   16   30   10 o  396.208   8.7061  120.590   5.2798  121.250   5.9945  118.304   11.150  397.082   9.8629  389.819   18.687 7.262695 21.12977 
1 1 1   16   30   11 o  238.948   14.276   44.298   5.1974   43.814   6.3133   45.317   9.1552  236.818   17.542  238.238   25.503 -1.420532 30.95326 
1 1 1   16   30   12 o  372.838   11.015  107.048   6.2861  107.719   7.6856  105.692   10.926  373.438   13.446  367.567   19.490 5.871155 23.67780 
1 1 1   16   30   13 o  128.530   28.379   13.647   5.4337   13.647   5.4337   0.0000   0.0000  128.530   28.379  ?   ?  0.000000 28.37857 
1 1 1   16   30   14 o  330.304   14.194   84.393   7.1760   84.393   7.1760   0.0000   0.0000  330.304   14.194  ?   ?  0.000000 14.19386 
1 1 1   16   30   15 o  278.025   15.828   60.146   6.7077   61.241   8.7086   58.549   10.517  279.003   20.537  270.707   25.691 8.296539 32.89035 
1 1 1   16   30   16 o  219.055   18.993   37.719   6.3050   39.670   8.1255   34.766   9.9956  222.909   24.204  204.945   32.983 17.96324 40.91090 
1 1 1   16   30   17 o  286.226   15.893   63.785   6.9356   63.745   8.8541   63.848   11.157  284.557   20.465  282.361   26.111 2.195587 33.17575 
1 1 1   16   30   18 o  204.915   21.285   33.309   6.5785   32.112   8.2182   35.444   10.976  198.761   27.772  205.059   36.298 -6.298630 45.70385 
1 1 1   16   30   19 o  287.838   14.176   64.172   6.2458   63.958   7.1910   64.827   12.603  286.311   16.478  282.420   29.593 3.891022 33.87202 
1 1 1   16   30   20 o  303.852   13.733   71.478   6.3870   63.941   7.3197   95.528   13.076  286.114   16.788  346.000   24.856 -59.88641 29.99397 
1 1 1   16   30   21 o  255.932   15.583   51.079   6.0755   46.694   7.0104   64.309   12.177  243.566   18.953  281.422   28.670 -37.85545 34.36852 
1 1 1   16   30   22 o  242.990   15.934   46.124   5.8936   46.622   6.7649   44.554   12.006  243.529   18.282  230.149   35.199 13.38014 39.66379 
1 1 1   16   30   23 o  109.245   36.849   9.6510   7.3059   5.3637   8.9771   18.061   12.573   98.644   39.392  143.296   48.339 -44.65160 62.35751 
1 1 1   16   30   24 o   99.456   37.046   6.9895   7.5504   5.6131   9.4872   9.3674   12.470  100.775   40.406  118.363   46.691 -17.58760 61.74730 
1 1 1   16   30   25 o   84.576   31.765   4.7245   5.5737   3.4259   6.2097   10.108   12.643   82.155   32.777  120.233   47.145 -38.07870 57.41960 
1 1 1   16   30   26 f   98.631   32.707   7.8497   5.7588   5.5945   6.3673   17.986   13.499   90.571   33.964  142.261   50.009 -51.69019 60.45208 
1 1 1   16   30   27 o  105.834   29.822   9.4383   5.0380   2.2192   6.7047   18.801   7.6353   80.153   33.263  147.511   34.442 -67.35804 47.88189 
1 1 1   16   30   28 o  228.921   16.456   41.174   5.7276   47.998   8.1279   34.443   8.0726  244.893   21.915  205.130   26.318 39.76271 34.24752 
1 1 1   16   30   29 o  229.051   16.750   41.292   5.8319   36.357   8.0066   46.870   8.5116  211.156   25.275  241.083   23.359 -29.92656 34.41610 
1 1 1   16   30   30 o   68.102   32.163  -8.0413   8.7939   0.0000   0.0000  -8.0413   8.7939  ?   ?    68.102   32.163 0.000000 32.16315 
1 1 1   16   30   31 o  170.024   23.036   23.558   5.8407   32.900   8.2430   14.138   8.2770  198.847   27.847  125.950   38.963 72.89708 47.89083 
1 1 1   16   30   32 o   93.651   35.368   6.3138   6.9306   8.3771   8.0563   0.4394   13.594  103.543   38.326   99.554   44.303 3.989304 58.58034 
1 1 1   16   30   33 o   63.171   28.481  -1.9807   5.8225  -9.3888   8.4172   4.8165   8.0627   63.737   30.487   91.647   37.072 -27.91010 47.99777 
1 1 1   16   30   34 o  153.132   25.984   19.698   5.8726   22.167   9.1094   17.943   7.6821  155.162   38.532  140.968   35.596 14.19339 52.45742 
1 1 1   16   30   35 o   96.613   25.051   7.9499   3.7356   9.8640   4.2917   1.9664   7.5879  107.232   26.339   81.189   34.628 26.04333 43.50705 
1 1 1   16   30   36 o  104.217   24.296   9.2384   3.8041   11.763   4.4026   1.8004   7.5571  117.489   25.235   80.313   34.414 37.17664 42.67446 
1 1 1   16   30   37 o  175.188   15.270   24.378   4.0538   25.145   4.7761   22.400   7.6664  176.765   17.899  158.162   32.746 18.60251 37.31866 
1 1 1   16   30   38 o  185.822   19.120   28.056   5.3606   28.056   5.3606   0.0000   0.0000  185.822   19.120  ?   ?  0.000000 19.11996 
1 1 1   16   30   39 o   75.101   27.082   4.3919   3.9830   5.2892   4.7054   2.1239   7.4807   81.282   29.416   79.286   34.113 1.996330 45.04506 
1 1 1   16   30   40 o  104.391   35.000   10.226   6.5910  -4.4602   12.887   15.429   7.6701   84.055   39.459  125.229   37.259 -41.17351 54.27029 
1 1 1   16   30   41 o  103.804   27.896   9.7606   4.5272   13.901   12.299   9.1118   4.8690  115.149   46.064   99.667   29.693 15.48116 54.80524 
1 1 1   16   30   42 o   86.304   27.045   6.6414   3.9734   3.9465   4.6673   13.737   7.5736   73.951   28.742  116.382   37.441 -42.42997 47.20090 
1 1 1   16   31    0 o  496.749   15.366  190.490   11.658  190.490   11.658  190.490   11.658  496.749   15.366  496.749   15.366 0.000000 0.000000 
1 1 1   16   31    1 o  334.809   12.389   86.443   6.3492   86.276   8.7963   86.624   9.1739  332.856   17.325  333.286   18.051 -0.4293823 25.01958 
1 1 1   16   31    2 o  370.947   11.790  106.036   6.6939  100.986   9.2371  111.621   9.7142  360.753   16.728  379.272   16.734 -18.51889 23.66123 
1 1 1   16   31    3 o  241.105   15.195   45.173   5.5789   47.961   7.6280   41.966   8.1806  247.010   20.357  229.898   23.582 17.11189 31.15275 
1 1 1   16   31    4 o  364.989   12.056  102.696   6.7355   96.751   9.1468  109.739   9.9554  353.028   16.927  375.857   17.305 -22.82941 24.20721 
1 1 1   16   31    5 f  192.190   18.563   29.012   5.3928   30.983   7.3680   26.738   7.9146  196.689   25.042  180.914   29.606 15.77522 38.77608 
1 1 1   16   31    6 o  334.696   13.000   86.469   6.6599   93.231   9.2099   79.057   9.6420  345.937   17.450  317.620   19.934 28.31763 26.49268 
1 1 1   16   31    7 o  354.053   12.242   96.674   6.6344   91.010   8.8102  104.092   10.083  342.369   16.812  365.763   18.010 -23.39459 24.63753 
1 1 1   16   31    8 o  321.376   12.963   79.733   6.3764   96.092   8.7289   61.015   9.3370  351.953   16.203  278.036   22.123 73.91757 27.42215 
1 1 1   16   31    9 o  315.020   13.444   76.669   6.4822   86.370   8.5297   63.406   9.9730  333.082   16.785  282.985   23.230 50.09668 28.65895 
1 1 1   16   31   10 o  313.805   13.100   76.050   6.2920   76.050   6.2920   0.0000   0.0000  313.805   13.100  ?   ?  0.000000 13.09968 
1 1 1   16   31   11 o  320.017   12.570   79.043   6.1571   79.043   6.1571   0.0000   0.0000  320.017   12.570  ?   ?  0.000000 12.56989 
1 1 1   16   31   12 o  596.201   11.748  274.088   10.721  271.336   14.200  277.736   16.349  591.471   15.685  597.217   17.885 -5.746155 23.78883 
1 1 1   16   31   13 o  153.938   21.905   18.960   5.0157   15.930   5.9489   26.409   9.3280  138.736   28.950  176.922   35.677 -38.18634 45.94542 
1 1 1   16   31   14 o  231.657   15.188   41.782   5.3555   34.571   6.1514   64.366   10.886  209.462   19.407  283.860   25.322 -74.39729 31.90356 
1 1 1   16   31   15 o  109.853   28.938   10.033   4.9335   12.481   5.6479   2.1496   10.135  122.153   30.343   95.065   40.264 27.08795 50.41716 
1 1 1   16   31   16 o  414.455   11.213  132.444   7.1132  129.112   8.3133  141.550   13.743  408.594   13.293  424.451   21.154 -15.85693 24.98394 
1 1 1   16   31   17 o  254.404   15.055   50.382   5.8363   51.441   6.8213   47.491   11.275  256.324   17.491  240.357   31.397 15.96707 35.94029 
1 1 1   16   31   18 o  282.815   13.852   61.946   5.9963   63.221   7.0013   58.437   11.616  284.678   16.134  268.209   28.743 16.46841 32.96198 
1 1 1   16   31   19 o  128.815   27.255   13.752   5.2062   14.230   5.9621   12.216   10.683  130.134   30.469  123.745   44.383 6.389503 53.83514 
1 1 1   16   31   20 o  112.117   30.443   10.551   5.3588   8.5254   6.1245   17.167   11.069  102.761   33.713  140.106   45.283 -37.34443 56.45432 
1 1 1   16   31   21 o  282.673   14.722   62.209   6.3477   58.828   7.2863   72.855   12.929  273.913   17.470  299.244   28.575 -25.33102 33.49199 
1 1 1   16   31   22 o  140.388   35.096   16.971   7.5211   25.138   9.8895   5.7665   11.583  169.611   38.919  107.303   44.044 62.30817 58.77548 
1 1 1   16   31   23 o  210.055   19.074   34.915   6.0658   42.217   6.9570   11.764   12.387  230.815   19.886  124.118   47.185 106.6968 51.20473 
1 1 1   16   31   24 o  190.087   21.332   28.906   6.0994   32.678   6.9880   16.837   12.499  201.534   23.069  138.428   48.151 63.10637 53.39206 
1 1 1   16   31   25 o  299.999   15.434   70.313   7.0630   69.736   8.1661   72.027   14.072  297.670   18.008  294.288   31.743 3.382507 36.49533 
1 1 1   16   31   26 o  332.962   14.533   86.270   7.4066   82.255   8.5411   98.445   14.873  323.579   17.308  346.882   28.257 -23.30310 33.13638 
1 1 1   16   31   27 o  159.572   27.368   21.159   6.4438   22.567   7.3544   16.508   13.369  163.438   30.521  136.745   49.570 26.69354 58.21262 
1 1 1   16   31   28 o  277.217   14.250   59.996   6.0261   56.900   8.3818   63.308   8.6699  267.069   20.665  282.022   20.219 -14.95255 28.91096 
1 1 1   16   31   29 o  173.171   29.996   25.353   7.6628   25.353   7.6628   0.0000   0.0000  173.171   29.996  ?   ?  0.000000 29.99634 
1 1 1   16   31   30 o  156.314   30.981   20.958   7.1506   10.664   8.2063   53.420   14.573  112.165   39.016  244.019   40.433 -131.8535 56.18795 
1 1 1   16   31   31 o  275.449   14.854   59.525   6.2395   66.704   9.2101   53.435   8.4826  288.176   21.025  257.359   21.737 30.81754 30.24179 
1 1 1   16   31   32 o  378.786   12.318  111.602   7.1415  121.369   10.804  104.023   9.5172  391.431   18.032  362.980   17.130 28.45056 24.87173 
1 1 1   16   31   33 o  234.041   17.343   43.580   6.1685   51.505   9.5339   37.873   8.0899  249.392   25.327  213.633   25.227 35.75903 35.74733 
1 1 1   16   31   34 f   80.246   31.832   3.8825   5.8260  -3.2494   8.6836   9.7210   7.8568   74.175   33.962  106.339   38.070 -32.16417 51.01764 
1 1 1   16   31   35 o   95.159   33.455   7.5695   6.0413   6.0376   9.2919   8.6912   7.9512   96.872   39.569  102.309   38.035 -5.437347 54.88476 
1 1 1   16   31   36 o  158.788   16.656   20.217   3.9879   24.301   4.6301   8.4838   7.8484  173.760   17.654  100.781   37.724 72.97960 41.65092 
1 1 1   16   31   37 o   78.388   27.335   4.9569   4.0294   7.7912   4.7007  -2.8945   7.8237   94.151   29.402   69.886   32.086 24.26514 43.52002 
1 1 1   16   31   38 o  222.871   13.775   39.321   4.6760   40.441   5.7731   37.186   7.9730  224.145   16.952  208.628   25.498 15.51736 30.61951 
1 1 1   16   31   39 o  105.714   35.312   10.599   6.7085   11.125   12.797   10.400   7.8778  110.081   45.841  104.841   38.044 5.240631 59.57119 
1 1 1   16   31   40 o  164.025   17.799   22.014   4.3970   27.903   5.3710   10.047   7.6564  183.796   19.384  102.645   37.466 81.15131 42.18348 
1 1 1   16   31   41 o  100.666   26.352   9.1261   4.1080   8.5691   4.9095   10.426   7.5018   96.251   30.046  103.328   37.178 -7.076958 47.80141 
1 1 1   16   32    0 o  387.688   17.255  116.610   10.193  116.610   10.193  116.610   10.193  387.688   17.255  387.688   17.255 0.000000 0.000000 
1 1 1   16   32    1 o  779.958   11.168  468.646   13.333  467.568   18.819  469.732   18.892  776.488   15.834  778.268   15.859 -1.779297 22.41065 
1 1 1   16   32    2 f  362.010   12.443  101.121   6.8949  100.798   9.6508  101.457   9.8540  359.994   17.515  361.063   17.830 -1.069183 24.99360 
1 1 1   16   32    3 o  365.795   12.455  103.250   6.9737  104.374   9.6506  102.022   10.089  366.418   17.207  361.463   18.294 4.955078 25.11501 
1 1 1   16   32    4 o  217.968   17.322   37.165   5.7316   31.491   7.8266   43.726   8.4168  197.596   26.549  234.411   23.788 -36.81485 35.64754 
1 1 1   16   32    5 o  347.077   13.018   93.033   6.9157  100.610   9.9999   86.088   9.5744  358.927   18.262  331.692   18.937 27.23499 26.30823 
1 1 1   16   32    6 o  122.902   25.463   12.373   4.6326   11.948   5.6835   13.214   7.9963  119.666   30.837  125.491   38.204 -5.824585 49.09647 
1 1 1   16   32    7 o  249.487   14.201   48.315   5.4004   46.392   6.4140   52.997   10.010  243.624   17.313  257.356   25.756 -13.73250 31.03426 
1 1 1   16   32    8 o  210.149   18.561   34.697   5.9091   34.697   5.9091   0.0000   0.0000  210.149   18.561  ?   ?  0.000000 18.56140 
1 1 1   16   32    9 o  347.361   13.570   93.303   7.2151   93.303   7.2151   0.0000   0.0000  347.361   13.570  ?   ?  0.000000 13.57034 
1 1 1   16   32   10 o  173.421   19.140   23.765   4.9960   20.949   5.9071   30.842   9.3638  160.975   24.768  192.630   32.942 -31.65491 41.21448 
1 1 1   16   32   11 o  454.126   10.513  158.844   7.3074  155.550   8.7572  166.397   13.260  448.720   12.750  461.589   18.768 -12.86945 22.68936 
1 1 1   16   32   12 o  338.149   12.010   88.253   6.2160   79.060   7.1529  116.610   12.563  319.402   14.631  384.629   21.424 -65.22623 25.94338 
1 1 1   16   32   13 o  248.309   14.811   47.970   5.6037   48.064   6.6397   47.736   10.447  247.722   17.626  242.402   28.715 5.320175 33.69363 
1 1 1   16   32   14 o  362.937   12.215  101.728   6.7855  107.732   8.1617   88.290   12.211  372.870   14.301  333.008   24.119 39.86133 28.04009 
1 1 1   16   32   15 o  111.778   29.817   10.445   5.1954   13.152   5.9850   2.1703   10.465  124.964   31.345   96.001   40.800 28.96359 51.45023 
1 1 1   16   32   16 f  313.606   13.388   76.129   6.4264   75.771   7.5163   77.100   12.391  311.798   15.801  309.616   26.399 2.181824 30.76618 
1 1 1   16   32   17 o  508.958   10.679  199.720   8.3189  199.346   9.9981  200.561   14.997  507.636   12.868  505.770   19.372 1.865173 23.25643 
1 1 1   16   32   18 o  316.604   13.200   77.607   6.3968   74.660   7.4838   85.598   12.324  309.363   15.858  326.952   24.812 -17.58856 29.44663 
1 1 1   16   32   19 o  117.427   30.241   11.624   5.4684   8.8597   6.2594   20.536   11.238  104.293   34.076  151.296   45.120 -47.00300 56.54204 
1 1 1   16   32   20 o  241.301   22.961   46.586   8.3782   43.820   11.646   49.552   12.061  228.022   34.443  243.428   33.240 -15.40538 47.86669 
1 1 1   16   32   21 o  108.252   32.231   9.8471   5.7382   10.560   6.6774   7.8333   11.221  112.069   35.050  111.232   44.159 0.8368988 56.37859 
1 1 1   16   32   22 o   71.366   30.172   0.9652   5.6746  -2.5531   6.5417   11.661   11.406   66.781   30.142  121.919   45.509 -55.13800 54.58553 
1 1 1   16   32   23 o  314.476   14.611   76.929   7.0328   84.324   8.3469   58.832   13.058  328.047   16.678  264.932   32.910 63.11536 36.89448 
1 1 1   16   32   24 o   67.902   29.715  -0.5466   5.8786   4.5603   6.7656 -16.2820   11.876   87.906   34.482   72.075   34.908 15.83118 49.06770 
1 1 1   16   32   25 o  266.235   17.838   55.897   7.2270   58.319   8.3280   48.507   14.544  270.838   20.235  232.900   42.359 37.93756 46.94384 
1 1 1   16   32   26 o   86.030   33.492   4.5457   6.3455   8.6972   7.1997  -9.9010   13.431  103.980   36.524   85.005   40.024 18.97458 54.18397 
1 1 1   16   32   27 o  177.085   28.908   26.307   7.5651   26.307   7.5651   0.0000   0.0000  177.085   28.908  ?   ?  0.000000 28.90768 
1 1 1   16   32   28 o  126.984   36.440   14.331   7.4527   14.331   7.4527   0.0000   0.0000  126.984   36.440  ?   ?  0.000000 36.43987 
1 1 1   16   32   29 o  107.299   31.599   9.9426   5.5397   17.981   7.8515   1.9741   7.8171  141.740   36.093   83.039   35.276 58.70097 50.46914 
1 1 1   16   32   30 o  177.952   22.407   25.852   5.9679   28.546   8.4480   23.168   8.4317  181.989   31.466  161.368   35.134 20.62155 47.16442 
1 1 1   16   32   31 o  169.201   24.384   23.747   6.1327   28.588   8.8020   19.179   8.5494  180.557   33.068  144.239   38.141 36.31792 50.47970 
1 1 1   16   32   32 o   69.825   29.785   1.0185   5.6146   5.1050   8.2417  -2.5203   7.6695   92.129   37.406   71.130   32.317 20.99857 49.43288 
1 1 1   16   32   33 o   95.482   32.954   7.6633   5.8488   1.7664   8.8190   12.293   7.8146   84.961   36.796  115.986   38.083 -31.02493 52.95525 
1 1 1   16   32   34 o  133.566   30.368   15.788   6.0680   14.633   9.2898   16.647   8.0139  123.677   41.552  133.010   37.659 -9.333244 56.07848 
1 1 1   16   32   35 o   54.283   25.886  -6.3428   5.9716  -4.7887   9.2099  -7.4701   7.8438   72.743   33.889   62.470   29.756 10.27316 45.09843 
1 1 1   16   32   36 o  198.246   15.956   31.444   4.8006   36.809   5.8973   20.907   8.2652  213.197   18.248  148.023   36.669 65.17471 40.95877 
1 1 1   16   32   37 o  184.937   24.883   29.227   6.8648   31.209   12.682   28.406   8.1644  168.798   47.228  177.245   31.235 -8.446854 56.62273 
1 1 1   16   32   38 o   93.702   33.393   7.8438   6.0384   9.0328   9.1309   6.9196   8.0501  100.962   39.914   93.145   37.265 7.816971 54.60574 
1 1 1   16   32   39 o  191.994   15.045   29.575   4.3860   36.542   5.2812   14.088   7.8740  212.660   16.350  117.817   38.205 94.84347 41.55621 
1 1 1   16   33    0 o  182.428   33.380   28.545   8.3984   28.545   8.3984   28.545   8.3984  182.428   33.380  182.428   33.380 0.000000 0.000000 
1 1 1   16   33    1 o  290.415   14.480   65.322   6.4368   56.667   9.1362   73.853   9.0701  267.385   22.533  306.776   19.416 -39.39056 29.74474 
1 1 1   16   33    2 o  304.071   14.036   71.560   6.5325   67.434   9.0382   76.074   9.4525  292.745   20.296  311.151   19.953 -18.40558 28.46119 
1 1 1   16   33    3 o  208.725   18.893   34.286   5.9706   31.209   8.1536   37.844   8.7671  195.869   27.993  216.395   27.061 -20.52519 38.93438 
1 1 1   16   33    4 o  497.761   16.382  192.561   12.481  192.561   12.481   0.0000   0.0000  497.761   16.382  ?   ?  0.000000 16.38212 
1 1 1   16   33    6 o  207.922   19.927   34.141   6.2641   34.141   6.2641   0.0000   0.0000  207.922   19.927  ?   ?  0.000000 19.92702 
1 1 1   16   33    7 o  184.407   18.317   26.785   5.1018   27.106   6.2805   26.164   8.7477  184.130   22.769  176.671   33.576 7.458984 40.56872 
1 1 1   16   33    8 o  426.307   13.490  140.600   8.8022  136.750   12.952  143.903   11.999  417.618   20.263  429.369   18.257 -11.75140 27.27447 
1 1 1   16   33    9 o   89.530   33.877   5.1347   6.3663   13.412   9.3940  -1.8955   8.6576  126.636   41.763   79.649   35.405 46.98691 54.75104 
1 1 1   16   33   10 o  341.801   11.740   90.167   6.1421   85.216   7.2879  102.304   11.411  331.595   14.359  360.316   20.778 -28.72113 25.25698 
1 1 1   16   33   11 o  246.051   12.149   46.759   4.5755   44.034   5.0986   58.032   10.370  238.007   14.058  268.914   25.498 -30.90613 29.11699 
1 1 1   16   33   12 o  500.805   10.562  193.301   8.0962  189.005   9.6956  203.196   14.715  494.392   12.813  509.564   18.867 -15.17212 22.80626 
1 1 1   16   33   13 f  459.683   10.854  162.943   7.6373  163.584   9.2772  161.597   13.453  459.764   13.183  454.071   19.356 5.693359 23.41895 
1 1 1   16   33   14 o  338.814   12.752   88.791   6.6131   85.977   7.9612   95.057   11.878  332.516   15.642  346.043   22.548 -13.52747 27.44281 
1 1 1   16   33   15 o  394.317   11.828  120.113   7.1391  114.610   8.4757  133.550   13.245  384.315   14.409  411.134   21.119 -26.81982 25.56562 
1 1 1   16   33   16 o  252.978   16.182   50.050   6.2333   51.523   7.4154   46.503   11.507  255.631   19.090  236.259   32.697 19.37178 37.86184 
1 1 1   16   33   17 f  360.636   12.912  100.700   7.1274  106.810   8.5223   86.483   13.000  370.659   15.022  327.496   26.153 43.16220 30.15976 
1 1 1   16   33   18 o   94.619   35.925   5.9688   7.1745  -0.5204   10.012   12.819   10.286   87.747   38.579  124.276   43.656 -36.52912 58.25950 
1 1 1   16   33   19 o   68.864   31.421  -3.6581   7.3480 -12.9786   10.031   7.1349   10.794   67.926   32.696  108.220   43.202 -40.29417 54.17976 
1 1 1   16   33   20 o  162.551   24.808   21.569   5.9768   23.175   7.0243   17.355   11.376  167.053   28.494  139.480   45.957 27.57254 54.07339 
1 1 1   16   33   21 o  212.152   19.673   35.751   6.3156   34.303   7.3817   39.707   12.200  206.034   23.848  213.399   38.778 -7.364883 45.52443 
1 1 1   16   33   22 o  162.180   26.384   21.697   6.3243   21.198   7.3589   23.105   12.369  157.978   31.538  157.480   47.420 0.4982605 56.94955 
1 1 1   16   33   23 o  174.577   24.428   24.876   6.3488   22.704   7.3814   31.049   12.446  163.886   30.550  183.612   44.703 -19.72592 54.14479 
1 1 1   16   33   24 o  203.528   21.124   33.233   6.4847   30.403   7.4184   42.399   13.352  192.425   25.840  217.308   41.657 -24.88348 49.02052 
1 1 1   16   33   25 o   80.998   33.151   2.9033   6.5387  -0.3603   7.3760   14.880   14.130   75.680   33.197  131.810   50.327 -56.13048 60.29019 
1 1 1   16   33   26 o  130.032   36.025   15.025   7.4171   15.025   7.4171   0.0000   0.0000  130.032   36.025  ?   ?  0.000000 36.02518 
1 1 1   16   33   27 o   66.571   30.028  -2.1516   6.4804  -2.5919   7.3988  -0.7012   13.430   70.370   31.882   96.991   43.534 -26.62113 53.95944 
1 1 1   16   33   28 o  175.607   28.773   26.138   7.4659   26.663   8.9431   24.931   13.562  173.660   34.856  157.547   50.040 16.11357 60.98363 
1 1 1   16   33   29 o  161.509   30.483   22.537   7.2593   20.651   8.5885   27.256   13.584  150.307   37.464  163.687   49.786 -13.38007 62.30749 
1 1 1   16   33   30 o  117.293   32.064   12.192   5.9212   16.749   8.7967   8.4159   8.0067  133.695   39.930  102.236   38.136 31.45964 55.21526 
1 1 1   16   33   31 o   48.930   23.800  -8.8666   5.6783 -13.8879   8.3644  -4.5746   7.7332   57.423   28.136   67.373   31.276 -9.949944 42.06886 
1 1 1   16   33   32 o   91.394   33.709   6.6045   6.2209   6.3204   9.1075   6.8529   8.5174   97.064   39.352   97.268   38.519 -0.2044449 55.06635 
1 1 1   16   33   33 f  102.357   33.647   9.3360   6.0994   12.542   9.1366   6.7586   8.1922  115.615   41.090   95.559   37.797 20.05603 55.82993 
1 1 1   16   33   34 o   77.701   34.369   0.4324   8.0608   0.0000   0.0000   0.4324   8.0608  ?   ?    77.701   34.369 0.000000 34.36858 
1 1 1   16   33   35 o   64.169   30.363  -6.1641   7.9050   0.0000   0.0000  -6.1641   7.9050  ?   ?    64.169   30.363 0.000000 30.36343 
1 1 1   16   33   36 o   99.746   32.700   9.1517   5.7624   5.8365   8.7710   11.669   7.6433   91.881   38.081  109.780   37.684 -17.89938 53.57438 
1 1 1   16   33   37 o  163.557   16.759   21.711   4.1362   27.017   4.8886   8.3409   7.7600  181.984   17.777   97.006   37.235 84.97736 41.26109 
1 1 1   16   34    2 o  371.939   19.078  108.516   10.825  108.516   10.825   0.0000   0.0000  371.939   19.078  ?   ?  0.000000 19.07800 
1 1 1   16   34    3 o  341.417   13.539   90.223   7.0751   84.685   9.7527   96.375   10.280  328.264   19.498  350.373   19.242 -22.10922 27.39355 
1 1 1   16   34    4 o  303.025   14.435   71.186   6.6954   65.815   9.1840   77.279   9.7818  288.647   20.929  313.068   20.527 -24.42090 29.31530 
1 1 1   16   34    5 o  180.328   18.816   25.693   5.1169   23.982   6.4221   28.668   8.4675  172.069   25.125  186.058   30.811 -13.98885 39.75624 
1 1 1   16   34    6 o  117.434   32.073   11.613   5.9278   11.962   9.0474   11.350   7.8467  120.766   41.004  117.082   38.148 3.683716 56.00553 
1 1 1   16   34    7 o  230.717   19.918   42.050   6.9650   44.432   10.304   40.046   9.4515  233.027   29.552  221.552   28.534 11.47458 41.07946 
1 1 1   16   34    8 o  375.951   11.170  109.038   6.4276  107.139   7.7233  113.315   11.593  371.961   13.566  379.433   20.032 -7.472015 24.19349 
1 1 1   16   34    9 o  330.228   11.841   84.222   5.9850   79.666   7.1331   95.057   11.001  320.435   14.543  346.991   20.809 -26.55582 25.38746 
1 1 1   16   34   10 o  234.427   14.921   42.843   5.3263   43.677   6.3791   40.922   9.6784  235.806   17.805  223.576   28.963 12.22978 33.99804 
1 1 1   16   34   11 o  203.161   16.932   32.405   5.2173   34.102   6.1843   28.216   9.7170  207.541   19.704  181.615   36.225 25.92532 41.23742 
1 1 1   16   34   12 o  410.682   11.604  130.264   7.2945  132.922   8.7985  124.421   13.046  414.038   13.884  396.422   21.581 17.61603 25.66120 
1 1 1   16   34   13 o  263.436   15.242   54.139   6.1198   48.033   7.2754   68.912   11.317  246.610   19.432  292.571   25.526 -45.96091 32.08073 
1 1 1   16   34   14 o  277.451   14.993   60.013   6.3435   57.631   7.6340   65.326   11.402  270.563   18.546  284.146   26.523 -13.58365 32.36382 
1 1 1   16   34   15 o  235.735   17.457   43.682   6.2542   48.838   7.5010   31.924   11.328  248.374   19.898  190.772   40.070 57.60164 44.73804 
1 1 1   16   34   16 o  376.199   16.837  110.566   9.6951  114.539   14.106  107.010   13.347  377.920   24.519  365.603   23.984 12.31723 34.29843 
1 1 1   16   34   17 o  188.192   28.765   29.308   8.0227   28.348   11.465   30.230   11.230  177.642   42.696  184.697   40.810 -7.055542 59.06304 
1 1 1   16   34   18 o   77.186   31.526   2.4294   5.8983  -4.1280   6.9019   20.188   11.358   65.372   30.059  148.873   45.574 -83.50114 54.59432 
1 1 1   16   34   19 o  221.365   19.217   38.860   6.4466   37.917   7.7080   41.053   11.760  216.748   23.616  218.356   36.471 -1.608444 43.44959 
1 1 1   16   34   20 o  200.475   21.285   32.212   6.4316   31.611   7.6528   33.656   11.868  196.412   26.102  193.941   41.248 2.471024 48.81267 
1 1 1   16   34   21 o  308.896   15.295   74.470   7.2314   76.356   8.5800   69.843   13.436  311.099   18.097  289.461   30.799 21.63791 35.72239 
1 1 1   16   34   22 o  150.685   28.219   19.073   6.2693   19.198   7.2424   18.701   12.522  149.149   32.632  142.022   48.240 7.127197 58.23996 
1 1 1   16   34   23 o  239.090   18.612   45.381   6.7577   47.408   7.8542   39.604   13.260  243.059   21.327  207.985   43.070 35.07408 48.06081 
1 1 1   16   34   24 o  125.854   36.484   14.088   7.4366   14.088   7.4366   0.0000   0.0000  125.854   36.484  ?   ?  0.000000 36.48351 
1 1 1   16   34   25 o  388.327   14.107  117.714   8.3848  123.773   9.8395  101.645   16.024  396.962   16.194  347.685   30.416 49.27716 34.45798 
1 1 1   16   34   26 o  280.678   18.003   62.588   7.6936   59.175   9.1362   70.907   14.265  270.279   22.283  286.976   33.082 -16.69739 39.88693 
1 1 1   16   34   27 o  267.896   18.494   57.241   7.5372   48.650   8.7034   83.010   15.073  243.785   23.621  310.963   32.132 -67.17828 39.87987 
1 1 1   16   34   28 o  131.870   35.061   15.729   7.1989   14.538   8.5089   18.729   13.503  125.328   39.619  137.562   49.825 -12.23419 63.65681 
1 1 1   16   34   29 o  136.282   34.135   16.757   7.1052   14.405   8.4959   22.230   12.959  124.364   39.618  147.304   49.076 -22.94044 63.07122 
1 1 1   16   34   30 o  184.293   27.101   28.843   7.4166   31.524   9.0649   23.416   12.899  188.939   32.518  149.837   48.914 39.10234 58.73725 
1 1 1   16   34   31 o  124.385   33.967   14.200   6.6491   5.8719   10.731   19.391   8.4713   98.976   41.649  142.883   38.054 -43.90721 56.41579 
1 1 1   16   34   32 o  115.785   34.591   12.465   6.6008  -0.3717   11.023   19.640   8.2419   86.369   39.042  143.538   37.206 -57.16940 53.93106 
1 1 1   16   34   33 o  100.183   35.749   8.9897   6.9227   18.437   13.202   5.4066   8.1301  130.085   48.881   90.163   36.941 39.92279 61.27016 
1 1 1   16   34   34 o  102.982   32.840   9.8005   5.8366   12.385   8.6752   7.6632   7.8891  112.454   40.031   95.915   37.343 16.53817 54.74494 
1 1 1   16   34   35 o  220.916   18.994   39.980   6.3602   40.427   9.2363   39.576   8.7710  213.303   29.045  212.376   27.637 0.9274750 40.09262 
1 1 1   16   34   36 o   97.952   32.370   8.9030   5.6424   14.020   8.4074   4.7097   7.6111  117.056   39.529   85.274   35.418 31.78250 53.07526 
1 1 1   16   35    0 o   43.580   30.479  -7.0794   7.5405  -7.0794   7.5405  -7.0794   7.5405   43.580   30.479   43.580   30.479 0.000000 0.000000 
1 1 1   16   35    1 o  171.785   23.242   23.768   5.9544   16.197   8.5045   31.049   8.3396  136.591   38.837  194.330   28.918 -57.73921 48.42112 
1 1 1   16   35    2 o  280.745   15.600   61.479   6.6773   54.135   9.0445   70.276   9.8994  260.540   22.913  297.584   21.887 -37.04358 31.68669 
1 1 1   16   35    3 o  259.708   24.412   54.088   9.5904   0.0000   0.0000   54.088   9.5904  ?   ?   259.708   24.412 0.000000 24.41228 
1 1 1   16   35    4 o  411.494   18.616  132.609   11.725   0.0000   0.0000  132.609   11.725  ?   ?   411.494   18.616 0.000000 18.61613 
1 1 1   16   35    5 o  190.967   23.959   29.387   6.8490   41.232   10.686   21.129   8.9224  222.572   32.312  155.974   37.774 66.59836 49.70885 
1 1 1   16   35    6 o  270.160   17.687   57.275   7.2733   56.611   10.863   57.815   9.7920  264.182   27.256  268.654   24.068 -4.471252 36.36159 
1 1 1   16   35    7 o  138.155   30.950   16.104   6.3824   19.520   9.8028   13.590   8.4089  148.567   41.507  125.908   39.325 22.65902 57.17754 
1 1 1   16   35    8 o   83.814   33.621   3.4296   6.5714  -7.4286   9.4114   13.760   9.1796   72.765   34.019  126.849   41.258 -54.08373 53.47404 
1 1 1   16   35    9 o  151.289   31.253   19.290   6.9976   5.7110   9.9835   32.404   9.8110  102.506   41.326  195.828   33.963 -93.32199 53.49151 
1 1 1   16   35   10 o  366.324   15.692  104.497   8.7988   98.728   12.752  109.739   12.156  351.428   23.848  372.088   21.435 -20.66010 32.06514 
1 1 1   16   35   11 o  290.414   18.077   66.302   7.9957   76.140   11.721   57.740   10.935  307.622   25.113  266.512   27.186 41.10980 37.00995 
1 1 1   16   35   12 o  134.098   34.152   15.473   7.0288   6.0799   9.5719   26.465   10.355  102.039   40.699  173.273   39.870 -71.23428 56.97419 
1 1 1   16   35   13 o   80.495   33.550   2.0508   6.8632  -3.8390   9.2564   9.2422   10.228   77.883   35.431  112.719   42.871 -34.83624 55.61740 
1 1 1   16   35   14 o  204.217   24.861   33.822   7.6106   41.129   10.617   26.098   10.915  221.515   32.261  170.573   42.070 50.94165 53.01525 
1 1 1   16   35   15 o  269.017   16.122   56.691   6.6081   63.110   8.0475   43.406   11.578  282.786   18.698  226.046   34.561 56.73967 39.29503 
1 1 1   16   35   16 o   93.212   32.849   6.6662   5.8277   9.4805   6.8681  -0.5698   11.013  107.105   35.728   90.923   40.197 16.18224 53.77995 
1 1 1   16   35   17 o  122.009   31.578   12.766   5.9429   10.688   6.9560   18.381   11.435  112.189   35.860  141.963   46.042 -29.77354 58.35901 
1 1 1   16   35   18 o  290.543   15.825   66.150   7.0111   75.597   8.4324   44.997   12.619  309.676   17.866  227.349   37.574 82.32753 41.60559 
1 1 1   16   35   19 f  110.501   32.874   10.465   5.9711   9.7015   6.8685   12.828   12.083  107.557   35.722  124.582   46.773 -17.02490 58.85431 
1 1 1   16   35   20 o  266.577   17.114   56.037   6.9462   55.117   8.2459   58.286   12.890  262.607   20.682  262.027   32.862 0.5800781 38.82881 
1 1 1   16   35   21 o  134.477   30.614   15.562   6.1601   12.959   7.1654   22.936   12.060  121.229   35.999  154.958   46.860 -33.72890 59.09168 
1 1 1   16   35   22 o   84.565   34.390   3.5963   6.9798   3.5963   6.9798   0.0000   0.0000   84.565   34.390  ?   ?  0.000000 34.38972 
1 1 1   16   35   23 o   81.278   34.301   2.1198   7.3130   2.1198   7.3130   0.0000   0.0000   81.278   34.301  ?   ?  0.000000 34.30108 
1 1 1   16   35   24 o  125.866   33.421   14.051   6.5466   14.906   7.6123   11.623   12.830  128.317   36.830  119.736   47.319 8.581200 59.96278 
1 1 1   16   35   25 o  108.515   35.325   10.310   6.7290   15.822   7.8797  -4.5392   12.933  131.559   37.375   88.557   40.874 43.00150 55.38625 
1 1 1   16   35   26 o  143.549   32.168   18.190   6.8928   15.904   8.0713   24.348   13.248  131.272   37.995  154.339   49.505 -23.06738 62.40503 
1 1 1   16   35   27 o   88.600   34.680   5.3256   6.8321   15.274   8.1461 -18.2679   12.545  128.098   38.463   70.791   34.637 57.30717 51.76009 
1 1 1   16   35   28 o  155.384   35.017   21.979   8.1288   20.583   10.560   24.009   12.735  144.109   43.910  151.908   48.516 -7.799698 65.43642 
1 1 1   16   35   29 o  128.093   37.703   15.538   7.8884   22.296   10.565   7.0220   11.859  149.027   43.566  103.892   43.754 45.13496 61.74469 
1 1 1   16   35   30 o  338.803   15.420   90.919   7.9965  101.156   10.168   74.323   12.946  354.025   18.832  292.813   29.278 61.21121 34.81176 
1 1 1   16   35   31 o   95.292   35.351   7.7080   6.8616   10.376   8.8912   3.7788   10.789  106.721   40.112   92.949   40.476 13.77281 56.98552 
1 1 1   16   35   32 o  169.877   29.158   25.604   7.3085   18.202   14.325   28.209   8.4976  127.797   50.161  175.341   32.870 -47.54454 59.97166 
1 1 1   16   35   33 o  131.233   30.355   15.748   5.9760   17.785   8.8778   14.061   8.0809  131.763   40.284  118.641   38.716 13.12175 55.87265 
1 1 1   16   35   34 o  219.696   18.923   39.577   6.3012   45.351   9.2696   34.616   8.5914  227.678   27.134  196.548   29.466 31.13037 40.05611 
1 1 1   16   36    0 o  204.739   32.884   35.519   9.5079   35.519   9.5079   35.519   9.5079  204.739   32.884  204.739   32.884 0.000000 0.000000 
1 1 1   16   36    1 o  351.349   21.065   97.786   11.276   0.0000   0.0000   97.786   11.276  ?   ?   351.349   21.065 0.000000 21.06514 
1 1 1   16   36    2 o  242.834   28.021   48.178   10.224   0.0000   0.0000   48.178   10.224  ?   ?   242.834   28.021 0.000000 28.02140 
1 1 1   16   36    3 o  343.732   15.250   91.934   8.0232   86.191   11.045   98.351   11.674  329.230   22.045  351.929   21.780 -22.69876 30.98912 
1 1 1   16   36    4 o  154.468   28.300   19.819   6.4444   22.795   8.9172   16.564   9.3240  162.107   36.782  137.152   41.142 24.95412 55.18720 
1 1 1   16   36    5 o  185.415   19.353   27.292   5.4116   30.404   6.6471   21.176   9.3191  194.524   22.755  155.055   39.234 39.46851 45.35558 
1 1 1   16   36    6 o  227.109   16.591   40.468   5.7273   42.065   7.0024   37.242   9.9546  230.283   20.067  211.115   31.792 19.16830 37.59533 
1 1 1   16   36    7 o  282.268   14.671   62.103   6.3166   59.689   7.7474   66.888   10.909  275.248   18.497  288.147   24.982 -12.89960 31.08437 
1 1 1   16   36    8 o  458.747   10.994  162.513   7.7194  160.273   9.4320  167.056   13.434  454.518   13.558  461.013   19.039 -6.494568 23.37257 
1 1 1   16   36    9 o  188.555   19.653   28.278   5.5887   30.569   6.7359   23.218   10.012  194.792   23.038  161.475   40.561 33.31651 46.64719 
1 1 1   16   36   10 o  130.076   27.927   14.181   5.3940   19.500   6.4029   1.1783   10.011  152.895   28.405   91.001   39.308 61.89455 48.49682 
1 1 1   16   36   11 o  183.584   20.183   26.903   5.5777   24.273   6.6147   33.373   10.376  172.008   25.930  196.960   35.733 -24.95184 44.14941 
1 1 1   16   36   12 o  174.215   21.313   24.385   5.5647   20.728   6.4874   34.569   10.826  157.812   27.877  199.744   36.765 -41.93175 46.13823 
1 1 1   16   36   13 o  319.868   18.474   80.728   9.0063   82.540   12.406   78.709   13.096  319.111   25.615  309.986   27.899 9.125244 37.87493 
1 1 1   16   36   14 o   88.831   32.369   5.7543   5.7116   6.4425   6.6455   3.8089   11.173   94.177   34.819  100.260   42.360 -6.083305 54.83355 
1 1 1   16   36   15 o   92.494   32.860   6.5576   5.8428   6.9694   6.9818   5.5952   10.674   96.902   35.715  102.796   42.247 -5.893250 55.32063 
1 1 1   16   36   16 o  122.749   31.724   13.005   6.0034   9.6995   6.9563   22.654   11.884  107.560   35.958  155.111   46.430 -47.55125 58.72568 
1 1 1   16   36   17 o  102.179   33.391   8.7335   6.0102   3.7626   7.0935   21.383   11.316   85.862   34.758  150.949   45.334 -65.08665 57.12529 
1 1 1   16   36   18 o   79.999   32.216   3.2495   6.0595   3.2532   7.0976   3.2395   11.637   84.147   34.501   99.425   42.657 -15.27858 54.86299 
1 1 1   16   36   19 o   97.971   33.794   7.8261   6.1505   7.1117   7.1480   9.8633   12.071   97.104   36.070  115.359   45.801 -18.25472 58.29877 
1 1 1   16   36   20 o  159.287   31.989   22.002   7.5284   22.002   7.5284   0.0000   0.0000  159.287   31.989  ?   ?  0.000000 31.98904 
1 1 1   16   36   21 f  321.198   18.302   81.976   8.9608   81.976   8.9608   0.0000   0.0000  321.198   18.302  ?   ?  0.000000 18.30228 
1 1 1   16   36   22 f  118.542   33.689   12.472   6.4007   9.4871   7.3696   21.637   12.914  105.780   36.963  147.473   48.983 -41.69302 61.36479 
1 1 1   16   36   23 o   76.915   32.116   2.2192   6.3051  -1.9166   7.2676   14.804   12.678   70.686   31.849  127.058   47.870 -56.37186 57.49755 
1 1 1   16   36   24 o   87.929   36.002   4.1919   7.7153  -1.9011   9.6356   15.077   12.879   80.771   36.507  127.288   48.180 -46.51643 60.44881 
1 1 1   16   36   25 o  110.337   37.949   10.841   7.7529   16.442   9.7649   1.2884   12.752  130.875   42.552   96.225   42.859 34.64934 60.39495 
1 1 1   16   36   26 o  122.017   37.154   13.857   7.5621   16.499   9.8635   10.089   11.778  130.120   42.789  111.660   44.933 18.45989 62.04715 
1 1 1   16   36   27 o  174.596   26.575   26.015   6.8779   24.706   8.4105   28.658   11.951  164.488   34.507  167.475   45.456 -2.987473 57.06979 
1 1 1   16   36   28 o   52.959   25.538  -7.8950   6.1856  -7.4877   7.7161  -8.6276   10.347   61.685   29.418   71.558   34.110 -9.872921 45.04324 
1 1 1   16   36   29 o   97.852   34.597   8.4651   6.4692   14.994   8.1494  -2.6597   10.638  123.846   38.719   80.785   37.210 43.06136 53.70029 
1 1 1   16   36   30 o   94.870   37.615   7.1251   8.1314   5.8992   13.130   7.8879   10.357  101.209   44.346  100.722   41.530 0.4868622 60.75626 
1 1 1   16   36   31 o  125.138   44.446   16.696   10.689   0.0000   0.0000   16.696   10.689  ?   ?   125.138   44.446 0.000000 44.44629 
1 1 1   16   37    1 o  268.463   24.724   58.211   10.045   58.211   10.045   0.0000   0.0000  268.463   24.724  ?   ?  0.000000 24.72424 
1 1 1   16   37    2 o  274.040   17.815   59.134   7.4320   63.171   9.8716   53.853   11.292  280.598   23.192  255.392   29.424 25.20570 37.46520 
1 1 1   16   37    3 o  380.999   14.287  112.882   8.3320  112.374   11.666  113.410   11.904  376.616   20.312  378.139   20.646 -1.523712 28.96235 
1 1 1   16   37    4 o  203.527   18.110   32.761   5.5828   37.734   6.9658   23.830   9.3352  217.281   21.216  164.607   37.843 52.67348 43.38411 
1 1 1   16   37    5 o  137.462   26.799   15.734   5.4360   17.113   6.5775   12.762   9.6553  141.751   31.164  122.541   42.338 19.20927 52.57096 
1 1 1   16   37    6 o  256.509   15.368   51.486   6.0061   59.306   7.6089   38.559   9.7830  274.166   18.236  214.839   30.616 59.32654 35.63565 
1 1 1   16   37    7 o  219.365   17.575   37.976   5.8517   45.963   7.2174   22.654   9.9967  240.529   19.779  158.660   40.903 81.86894 45.43438 
1 1 1   16   37    8 o  324.515   13.680   81.841   6.7949   78.821   8.1909   88.507   12.168  316.763   16.955  331.422   24.153 -14.65961 29.51015 
1 1 1   16   37    9 o  160.309   23.489   20.945   5.5927   14.364   6.6381   37.044   10.382  128.727   33.402  208.395   33.700 -79.66769 47.44866 
1 1 1   16   37   10 o  337.295   13.008   88.328   6.7157   82.809   7.9241  102.398   12.653  325.441   15.908  356.950   23.286 -31.50974 28.20059 
1 1 1   16   37   11 o  172.506   23.247   24.208   5.9818   28.786   7.2208   14.193   10.680  187.087   25.911  127.299   44.496 59.78769 51.49104 
1 1 1   16   37   12 o   74.861   30.442   2.4693   5.4691   3.5754   6.3558  -0.6861   10.735   82.520   33.078   88.976   39.493 -6.455498 51.51552 
1 1 1   16   37   13 o   93.850   36.749   5.6543   7.6736   1.0193   10.550   10.861   11.182   91.551   39.942  117.302   44.774 -25.75094 60.00094 
1 1 1   16   37   14 o  185.335   21.915   27.793   6.0965   27.288   7.1629   29.119   11.613  181.394   26.588  177.195   43.207 4.199173 50.73212 
1 1 1   16   37   15 o  257.305   17.110   52.308   6.7002   50.492   7.9122   56.912   12.597  250.923   20.788  258.384   32.576 -7.460266 38.64409 
1 1 1   16   37   16 o  172.441   24.188   24.459   6.2087   26.719   7.3886   19.030   11.453  178.375   27.983  141.595   46.085 36.77980 53.91553 
1 1 1   16   37   17 f   99.675   33.364   8.3209   5.9892   9.2505   6.9293   5.5754   11.908  104.746   35.884  104.363   43.893 0.3830185 56.69381 
1 1 1   16   37   18 o  178.319   29.065   26.986   7.6598   26.986   7.6598   0.0000   0.0000  178.319   29.065  ?   ?  0.000000 29.06523 
1 1 1   16   37   19 o  204.893   25.256   34.742   7.7530   34.742   7.7530   0.0000   0.0000  204.893   25.256  ?   ?  0.000000 25.25623 
1 1 1   16   37   20 o  143.919   35.080   18.622   7.6573   18.663   9.8891   18.560   12.101  140.182   42.443  138.069   47.414 2.112579 63.63603 
1 1 1   16   37   21 o  111.019   37.345   10.906   7.5039   3.9303   9.6921   21.345   11.856   93.460   39.468  146.579   46.813 -53.11965 61.23016 
1 1 1   16   37   22 o   62.325   29.434  -6.4505   7.3636  -8.6605   9.3328  -2.8056   11.985   68.447   32.562   87.346   39.959 -18.89913 51.54632 
1 1 1   16   37   23 o   75.187   31.841   1.7959   6.3369  -0.0560   7.5700   6.1326   11.584   75.661   33.394  102.363   43.184 -26.70157 54.58942 
1 1 1   16   37   24 o  113.860   34.378   11.834   6.4946   6.0467   7.8684   24.207   11.504   92.896   36.948  153.968   45.590 -61.07193 58.68232 
1 1 1   16   37   25 o   79.196   32.729   3.1648   6.4520   4.3468   8.0295   1.0108   10.839   87.844   36.424   88.682   39.506 -0.8378906 53.73431 
1 1 1   16   37   26 o  140.792   30.901   17.823   6.4764   13.317   8.2848   24.903   10.385  117.630   39.241  157.439   42.225 -39.80962 57.64359 
1 1 1   16   37   27 o  114.184   33.483   12.135   6.2316   8.4957   7.9052   18.108   10.128   99.435   37.720  132.386   43.349 -32.95108 57.46278 
1 1 1   16   37   28 o  119.652   38.918   14.138   8.1680   24.141   13.954   8.9241   10.074  143.708   50.811  102.972   41.514 40.73645 65.61385 
1 1 1   16   37   29 o   86.639   36.682   4.1410   8.4070   6.6229   13.539   2.5835   10.725  102.452   44.958   89.275   39.558 13.17651 59.88343 
1 1 1   16   38    0 o  343.292   21.646   93.081   11.270   93.081   11.270   93.081   11.270  343.292   21.646  343.292   21.646 0.000000 0.000000 
1 1 1   16   38    1 o  274.662   17.018   59.409   7.1194   63.698   10.104   55.180   10.033  280.794   23.732  260.156   25.524 20.63724 34.85210 
1 1 1   16   38    2 f   94.086   33.886   6.7438   6.2334   6.1429   8.0800   7.6272   9.7966   96.826   37.766  105.731   41.488 -8.905266 56.10269 
1 1 1   16   38    3 o  293.979   21.958   69.288   9.8092   69.288   9.8092   0.0000   0.0000  293.979   21.958  ?   ?  0.000000 21.95809 
1 1 1   16   38    4 o  383.220   14.796  114.581   8.6787  114.581   8.6787   0.0000   0.0000  383.220   14.796  ?   ?  0.000000 14.79577 
1 1 1   16   38    5 o  106.802   31.645   9.7398   5.5414   8.3918   6.6636   12.762   9.9777  101.650   35.169  121.793   42.976 -20.14264 55.53247 
1 1 1   16   38    6 o  110.761   31.296   10.537   5.5403   3.5546   6.6235   26.804   10.110   83.440   33.653  172.849   39.124 -89.40965 51.60674 
1 1 1   16   38    7 f   90.498   32.037   6.3243   5.5490   4.6829   6.6371   10.136   10.114   87.250   34.174  113.407   42.751 -26.15649 54.73135 
1 1 1   16   38    8 o  116.096   31.305   11.646   5.6899   9.6426   6.6835   16.922   10.846  106.743   35.228  135.638   44.881 -28.89552 57.05555 
1 1 1   16   38    9 o  228.377   18.088   41.386   6.2711   37.728   7.3690   50.992   11.942  215.833   22.643  244.505   32.730 -28.67201 39.79890 
1 1 1   16   38   10 o  131.307   29.683   14.797   5.8256   19.495   6.8028   1.8757   11.281  150.782   30.523   95.296   41.444 55.48582 51.47089 
1 1 1   16   38   11 o  187.806   21.554   28.545   6.0836   23.466   6.9836   44.526   12.388  166.803   28.369  224.370   37.388 -57.56703 46.93256 
1 1 1   16   38   12 o  180.093   22.221   26.380   5.9954   22.186   6.9411   38.700   11.898  161.606   29.133  207.564   38.877 -45.95796 48.58138 
1 1 1   16   38   13 o  169.594   24.311   23.720   6.1302   25.228   7.1056   19.331   12.123  173.209   27.738  141.816   47.468 31.39330 54.97807 
1 1 1   16   38   14 o  168.470   44.630   27.162   11.692   0.0000   0.0000   27.162   11.692  ?   ?   168.470   44.630 0.000000 44.62998 
1 1 1   16   38   17 o  118.096   37.592   12.590   7.6504   7.1905   9.9932   20.235   11.891  102.792   41.380  143.346   46.974 -40.55450 62.60062 
1 1 1   16   38   18 o  133.301   31.584   15.683   6.3454   14.457   7.5891   18.531   11.568  125.655   36.980  137.510   46.367 -11.85546 59.30764 
1 1 1   16   38   19 o   98.154   34.079   8.1329   6.2594   10.999   7.5171   1.6527   11.304  110.938   37.378   92.871   40.907 18.06689 55.41207 
1 1 1   16   38   20 o  105.328   33.826   9.8467   6.1839   5.8685   7.4031   19.030   11.248   91.593   36.025  137.851   45.711 -46.25806 58.20023 
1 1 1   16   38   21 o   85.086   32.929   5.1044   6.1056   6.8278   7.6033   1.9755   10.245   94.859   36.736   89.417   39.176 5.441948 53.70593 
1 1 1   16   38   22 o  140.365   31.092   17.619   6.5041   31.169   8.3250  -3.6093   10.420  188.927   29.774   79.411   36.666 109.5161 47.23230 
1 1 1   16   38   23 o  118.512   34.183   13.027   6.5432   3.4584   8.2093   29.694   10.834   85.739   36.272  173.820   41.328 -88.08023 54.98781 
1 1 1   16   38   24 o  118.233   33.488   12.978   6.3356   17.157   8.3588   7.3363   9.7128  132.478   38.759   99.162   40.474 33.31617 56.03938 
1 1 1   16   38   25 o   76.041   31.845   2.6498   6.2254   5.0854   7.9771  -1.1444   9.9566   88.762   36.506   80.851   36.768 7.911903 51.81250 
1 1 1   16   38   26 o  192.810   22.731   31.195   6.5794   30.255   8.6334   32.498   10.162  182.378   32.099  184.143   37.331 -1.765350 49.23391 
1 1 1   16   38   27 o  175.125   31.936   28.017   8.2450   26.390   13.569   28.969   10.381  149.873   50.219  169.706   40.524 -19.83354 64.53031 
1 1 1   16   39    0 o  153.399   44.032   23.228   8.9642   23.228   8.9642   23.228   8.9642  153.399   44.032  153.399   44.032 0.000000 0.000000 
1 1 1   16   39    1 o  137.955   31.062   16.473   6.4010   19.981   8.7586   12.452   9.3777  148.438   38.296  119.289   41.696 29.14877 56.61362 
1 1 1   16   39    2 o  281.522   17.225   62.652   7.3865   64.761   10.136   60.262   10.787  282.321   23.674  270.396   26.399 11.92548 35.45961 
1 1 1   16   39    3 f  112.659   33.615   11.077   6.2365   17.778   8.7518   4.1637   8.8893  139.513   39.304   92.707   38.373 46.80534 54.92967 
1 1 1   16   39    4 o  105.596   34.700   9.5146   6.4871  -2.9317   8.2515   29.656   10.497   73.761   33.516  181.024   39.032 -107.2629 51.44731 
1 1 1   16   39    5 o   86.008   36.230   2.6512   8.1342   2.6512   8.1342   0.0000   0.0000   86.008   36.230  ?   ?  0.000000 36.22991 
1 1 1   16   39    6 o   86.462   36.898   2.1383   8.6236   2.1383   8.6236   0.0000   0.0000   86.462   36.898  ?   ?  0.000000 36.89786 
1 1 1   16   39    7 o  146.892   38.362   19.670   8.7190   19.670   8.7190   0.0000   0.0000  146.892   38.362  ?   ?  0.000000 38.36204 
1 1 1   16   39    8 o   88.550   34.483   5.1445   6.7277   12.056   8.5755  -5.9189   10.850  116.911   39.920   79.554   36.969 37.35680 54.40830 
1 1 1   16   39    9 f  101.100   34.427   8.5720   6.3779   0.5253   7.7451   25.524   11.242   78.810   34.307  163.621   43.952 -84.81145 55.75641 
1 1 1   16   39   10 o  125.808   34.476   14.118   6.8359   9.9669   8.6832   20.884   11.086  109.341   39.901  147.274   45.015 -37.93244 60.15332 
1 1 1   16   39   11 o  104.532   32.493   9.4655   5.7485   12.049   6.7098   2.3369   11.146  116.396   34.898   94.844   41.221 21.55222 54.00952 
1 1 1   16   39   12 o  234.135   17.716   43.633   6.3021   42.555   7.2211   47.077   12.909  229.574   20.775  228.478   38.266 1.095673 43.54188 
1 1 1   16   39   13 o  178.409   25.334   26.527   6.7239   26.527   6.7239   0.0000   0.0000  178.409   25.334  ?   ?  0.000000 25.33447 
1 1 1   16   39   14 o  306.747   26.752   78.474   12.435   78.474   12.435   0.0000   0.0000  306.747   26.752  ?   ?  0.000000 26.75159 
1 1 1   16   39   15 o  193.385   27.728   31.729   7.9726   38.183   10.906   24.320   11.685  206.130   35.868  155.991   45.879 50.13875 58.23584 
1 1 1   16   39   16 o  232.150   18.845   43.335   6.6386   43.980   8.0601   41.976   11.706  231.155   23.090  214.828   36.930 16.32716 43.55394 
1 1 1   16   39   17 o  285.301   19.585   65.683   8.5008   50.361   11.504   84.111   12.617  239.507   32.197  316.710   26.263 -77.20262 41.54969 
1 1 1   16   39   18 o  194.385   27.846   32.395   8.0484   27.256   11.606   37.157   11.171  164.088   44.904  199.882   37.900 -35.79434 58.76032 
1 1 1   16   39   19 o  102.975   37.702   9.2375   7.7616   23.077   11.720  -1.5727   10.359  148.630   46.428   82.544   37.524 66.08611 59.69594 
1 1 1   16   39   20 o   98.860   34.253   8.6086   6.3221   15.564   8.0699  -2.4442   10.172  127.108   38.309   80.094   36.704 47.01375 53.05444 
1 1 1   16   39   21 f  111.726   34.278   11.591   6.4214   9.0803   8.3625   15.200   10.024  102.314   38.800  123.099   43.105 -20.78420 57.99522 
1 1 1   16   39   22 o  224.159   20.150   41.177   6.8396   46.088   8.8308   33.816   10.813  233.098   25.149  187.070   39.025 46.02827 46.42632 
1 1 1   16   39   23 o  217.899   20.506   39.091   6.7588   50.179   8.9402   24.301   10.326  243.754   24.285  153.720   42.474 90.03424 48.92656 
1 1 1   16   39   24 o   84.676   33.107   5.3265   6.2210   10.669   7.9602  -3.0569   9.9716  106.372   38.295   77.243   35.736 29.12926 52.37887 
1 1 1   16   40    0 o   97.803   49.538   12.263   9.2370   12.263   9.2370   12.263   9.2370   97.803   49.538   97.803   49.538 0.000000 0.000000 
1 1 1   16   40    1 o  272.677   17.515   59.036   7.2715   65.683   10.174   52.093   10.397  283.571   23.656  249.462   27.696 34.10921 36.42331 
1 1 1   16   40    2 o  110.428   33.252   10.725   6.0819   22.945   8.4082  -2.6842   8.8080  160.143   35.257   76.265   34.644 83.87834 49.42910 
1 1 1   16   40    3 o  299.113   16.399   70.700   7.4794   63.331   10.134   79.519   11.085  278.065   24.046  312.332   23.357 -34.26657 33.52247 
1 1 1   16   40    4 o   99.737   34.268   8.3552   6.3213   6.1448   8.0199   11.981   10.272   95.090   37.465  117.208   43.298 -22.11794 57.25695 
1 1 1   16   40    5 o  160.144   24.115   21.273   5.7277   19.478   6.7230   26.023   10.938  149.881   30.346  165.064   42.901 -15.18259 52.54861 
1 1 1   16   40    6 o  111.106   32.035   10.873   5.7476   9.1701   6.9170   14.673   10.331  103.681   35.834  125.596   43.771 -21.91544 56.56792 
1 1 1   16   40    7 o   79.688   31.398   3.8697   5.6328   10.024   6.7172 -10.7104   10.339  106.981   35.317   70.311   33.673 36.66978 48.79733 
1 1 1   16   40    8 o  245.788   20.246   48.745   7.5491   48.745   7.5491   0.0000   0.0000  245.788   20.246  ?   ?  0.000000 20.24626 
1 1 1   16   40    9 o  144.535   32.312   18.536   6.9689   18.536   6.9689   0.0000   0.0000  144.535   32.312  ?   ?  0.000000 32.31246 
1 1 1   16   40   10 o  112.537   34.467   11.388   6.4955   11.388   6.4955   0.0000   0.0000  112.537   34.467  ?   ?  0.000000 34.46667 
1 1 1   16   40   11 o   87.455   34.193   5.2406   6.6354   5.2406   6.6354   0.0000   0.0000   87.455   34.193  ?   ?  0.000000 34.19261 
1 1 1   16   40   12 f  302.812   14.838   72.181   6.8773   69.197   8.1069   79.839   12.989  294.021   18.102  306.911   27.955 -12.89032 33.30446 
1 1 1   16   40   13 o   64.559   28.806  -1.0193   5.7882   1.5439   6.7831  -7.8860   11.102   76.119   32.610   76.098   36.000 0.2060699E-01 48.57418 
1 1 1   16   40   14 o  275.758   21.019   62.010   8.8048   60.799   12.640   63.152   12.272  262.782   32.093  269.784   30.238 -7.002594 44.09433 
1 1 1   16   40   15 o   98.696   37.020   8.0987   7.5653   17.920   10.618  -2.0291   10.782  133.063   44.424   83.225   38.007 49.83817 58.46423 
1 1 1   16   40   16 o   95.896   36.408   7.4658   7.3687   14.230   10.221   0.1456   10.633  120.650   43.398   86.280   38.730 34.37003 58.16727 
1 1 1   16   40   17 f  235.290   19.069   44.911   6.8084   48.883   8.3741   37.166   11.694  242.647   22.815  196.003   40.324 46.64316 46.33093 
1 1 1   16   40   18 o   63.192   28.639  -1.7592   5.9759   2.4355   7.3112 -10.2022   10.373   79.695   33.991   69.443   33.381 10.25274 47.64122 
1 1 1   16   40   19 o   52.937   25.468  -7.3447   6.0682  -9.3175   7.5153  -3.6489   10.286   57.843   27.956   77.910   36.133 -20.06722 45.68482 
1 1 1   16   40   20 f  122.651   37.131   14.595   7.5690   15.322   10.988   13.939   10.441  121.914   44.825  117.863   43.631 4.051193 62.55375 
1 1 1   16   41    0 o  334.994   22.629   89.834   11.481   89.834   11.481   89.834   11.481  334.994   22.629  334.994   22.629 0.000000 0.000000 
1 1 1   16   41    1 o  133.078   33.028   15.984   6.6958   20.470   9.1315   10.767   9.8477  146.448   39.729  111.263   42.126 35.18531 57.90481 
1 1 1   16   41    2 f  103.829   34.376   9.5278   6.3622   14.052   8.4387   3.5698   9.6845  122.161   39.545   91.551   39.086 30.60989 55.60143 
1 1 1   16   41    3 o  152.133   26.170   19.688   5.8742   19.054   7.0721   21.101   10.549  145.830   32.513  145.663   43.776 0.1667786 54.52913 
1 1 1   16   41    4 o   60.507   28.323  -4.8588   6.5589 -10.5880   8.3838   4.1797   10.530   61.145   29.546   95.152   40.694 -34.00689 50.28863 
1 1 1   16   41    5 o  161.154   38.659   24.517   9.4134   24.517   9.4134   0.0000   0.0000  161.154   38.659  ?   ?  0.000000 38.65861 
1 1 1   16   41    6 o   98.670   39.880   6.8676   9.3220   6.8676   9.3220   0.0000   0.0000   98.670   39.880  ?   ?  0.000000 39.87964 
1 1 1   16   41    7 o  293.837   18.624   69.422   8.3331   69.422   8.3331   0.0000   0.0000  293.837   18.624  ?   ?  0.000000 18.62438 
1 1 1   16   41    8 o  156.378   26.186   20.869   6.0462   24.598   7.2222   12.132   11.055  168.109   29.123  115.452   44.412 52.65622 53.10896 
1 1 1   16   41    9 f   88.581   32.758   6.2111   5.8825   1.7855   6.9753   17.110   10.946   77.302   33.092  130.257   45.076 -52.95463 55.91832 
1 1 1   16   41   10 o  101.872   33.314   9.2698   5.9819   13.428   6.7983  -4.9900   12.590  120.265   34.888   84.527   39.460 35.73822 52.67182 
1 1 1   16   41   11 o   76.086   32.591   1.7178   6.7730   1.7178   6.7730   0.0000   0.0000   76.086   32.591  ?   ?  0.000000 32.59055 
1 1 1   16   41   12 o   56.304   27.087  -8.1728   6.8618  -8.1728   6.8618   0.0000   0.0000   56.304   27.087  ?   ?  0.000000 27.08666 
1 1 1   16   41   13 o  127.418   31.932   14.816   6.2153   13.102   7.2901   19.378   11.892  117.567   36.599  135.045   46.968 -17.47805 59.54397 
1 1 1   16   41   14 o  229.139   18.255   42.464   6.3495   39.891   7.4022   49.627   12.353  219.148   22.382  231.409   36.049 -12.26097 42.43220 
1 1 1   16   41   15 o   55.790   27.126 -10.2921   7.3550 -11.3221   10.509  -9.3034   10.297   68.545   33.111   70.121   33.588 -1.576286 47.16484 
1 1 1   16   41   16 o   94.611   36.435   7.3187   7.4465   8.1034   10.476   6.5175   10.586  101.893   41.863   98.258   41.358 3.634453 58.84673 
1 1 1   16   42    2 o   97.206   39.636   6.7161   9.3028   6.7161   9.3028   0.0000   0.0000   97.206   39.636  ?   ?  0.000000 39.63570 
1 1 1   16   42    3 o   73.022   32.257   0.0737   7.0786   0.0737   7.0786   0.0000   0.0000   73.022   32.257  ?   ?  0.000000 32.25727 
1 1 1   16   42    4 o  152.635   27.302   20.203   6.1444   16.026   7.3525   29.872   11.188  130.346   35.770  172.943   42.555 -42.59683 55.59121 
1 1 1   16   42    5 o   55.035   26.049  -5.3535   5.8260 -13.0349   6.9230   13.289   10.785   50.417   24.877  117.326   44.163 -66.90871 50.68775 
1 1 1   16   42    6 o  212.186   23.668   37.693   7.5558   28.734   10.058   49.298   11.447  172.773   38.963  234.355   32.811 -61.58223 50.93817 
1 1 1   16   42    7 o  261.345   20.229   55.783   8.0291   57.326   10.866   53.928   11.916  257.813   27.985  245.366   32.531 12.44781 42.91200 
1 1 1   16   42    8 o   69.369   29.886   1.0125   5.7569   1.8180   6.8665  -0.8935   10.562   76.381   32.769   83.663   37.978 -7.281487 50.16081 
1 1 1   16   42    9 o  102.828   33.531   9.6295   6.0617   8.2264   7.2642   12.847   11.000   97.846   36.359  115.515   44.334 -17.66886 57.33644 
1 1 1   17    0    1 o  592.354   10.743  268.889   9.7335  268.889   9.7335  268.889   9.7335  592.354   10.743  592.354   10.743 0.000000 0.000000 
1 1 1   17    0    2 o  1258.65   17.086  1214.09   32.904  1214.09   32.904  1214.09   32.904  1258.65   17.086  1258.65   17.086 0.000000 0.000000 
1 1 1   17    0    3 f  884.133   13.346  598.953   18.052  598.953   18.052  598.953   18.052  884.133   13.346  884.133   13.346 0.000000 0.000000 
1 1 1   17    0    4 o  878.338   13.409  591.142   18.018  591.142   18.018  591.142   18.018  878.338   13.409  878.338   13.409 0.000000 0.000000 
1 1 1   17    0    5 f  858.886   13.323  565.260   17.506  565.260   17.506  565.260   17.506  858.886   13.323  858.886   13.323 0.000000 0.000000 
1 1 1   17    0    6 o  477.045   7.2458  174.311   5.2880  174.311   5.2880  174.311   5.2880  477.045   7.2458  477.045   7.2458 0.000000 0.000000 
1 1 1   17    0    7 o  960.431   9.9338  706.382   14.600  706.382   14.600  706.382   14.600  960.431   9.9338  960.431   9.9338 0.000000 0.000000 
1 1 1   17    0    8 o  1008.81   10.289  779.354   15.884  779.354   15.884  779.354   15.884  1008.81   10.289  1008.81   10.289 0.000000 0.000000 
1 1 1   17    0    9 f  1113.93   11.080  950.276   18.888  950.276   18.888  950.276   18.888  1113.93   11.080  1113.93   11.080 0.000000 0.000000 
1 1 1   17    0   10 o  958.251   10.030  703.201   14.707  703.201   14.707  703.201   14.707  958.251   10.030  958.251   10.030 0.000000 0.000000 
1 1 1   17    0   11 o  413.346   7.7676  130.922   4.9105  130.922   4.9105  130.922   4.9105  413.346   7.7676  413.346   7.7676 0.000000 0.000000 
1 1 1   17    0   12 o  535.104   8.3869  219.350   6.8655  219.350   6.8655  219.350   6.8655  535.104   8.3869  535.104   8.3869 0.000000 0.000000 
1 1 1   17    0   13 o  1209.54   8.4205  1120.08   15.588  1120.08   15.588  1120.08   15.588  1209.54   8.4205  1209.54   8.4205 0.000000 0.000000 
1 1 1   17    0   14 o  460.466   6.4024  162.386   4.5105  162.386   4.5105  162.386   4.5105  460.466   6.4024  460.466   6.4024 0.000000 0.000000 
1 1 1   17    0   15 o  481.196   6.7009  177.341   4.9333  177.341   4.9333  177.341   4.9333  481.196   6.7009  481.196   6.7009 0.000000 0.000000 
1 1 1   17    0   16 o  294.674   7.7700   66.608   3.4990   66.608   3.4990   66.608   3.4990  294.674   7.7700  294.674   7.7700 0.000000 0.000000 
1 1 1   17    0   17 o   35.453   21.775   0.7573   2.2825   0.7573   2.2825   0.7573   2.2825   35.453   21.775   35.453   21.775 0.000000 0.000000 
1 1 1   17    0   18 o  422.662   6.3940  136.835   4.1344  136.835   4.1344  136.835   4.1344  422.662   6.3940  422.662   6.3940 0.000000 0.000000 
1 1 1   17    0   19 o  274.524   7.6687   57.826   3.2167   57.826   3.2167   57.826   3.2167  274.524   7.6687  274.524   7.6687 0.000000 0.000000 
1 1 1   17    0   20 o  171.265   14.961   22.980   3.8532   22.980   3.8532   22.980   3.8532  171.265   14.961  171.265   14.961 0.000000 0.000000 
1 1 1   17    0   21 o  508.616   6.6218  198.122   5.1531  198.122   5.1531  198.122   5.1531  508.616   6.6218  508.616   6.6218 0.000000 0.000000 
1 1 1   17    0   22 o  433.393   6.9385  143.894   4.6001  143.894   4.6001  143.894   4.6001  433.393   6.9385  433.393   6.9385 0.000000 0.000000 
1 1 1   17    0   23 o  628.383   6.8587  302.380   6.5951  302.380   6.5951  302.380   6.5951  628.383   6.8587  628.383   6.8587 0.000000 0.000000 
1 1 1   17    0   24 o  296.864   8.9913   67.663   4.0771   67.663   4.0771   67.663   4.0771  296.864   8.9913  296.864   8.9913 0.000000 0.000000 
1 1 1   17    0   25 o   59.965   30.202   4.0641   3.4224   4.0641   3.4224   4.0641   3.4224   59.965   30.202   59.965   30.202 0.000000 0.000000 
1 1 1   17    0   26 o  337.002   8.6767   87.135   4.4689   87.135   4.4689   87.135   4.4689  337.002   8.6767  337.002   8.6767 0.000000 0.000000 
1 1 1   17    0   27 o  421.670   11.303  136.503   7.2836  136.503   7.2836  136.503   7.2836  421.670   11.303  421.670   11.303 0.000000 0.000000 
1 1 1   17    0   28 o  201.733   12.869   31.567   3.9366   31.567   3.9366   31.567   3.9366  201.733   12.869  201.733   12.869 0.000000 0.000000 
1 1 1   17    0   29 o  560.590   7.4963  240.766   6.4296  240.766   6.4296  240.766   6.4296  560.590   7.4963  560.590   7.4963 0.000000 0.000000 
1 1 1   17    0   30 o  446.172   7.9183  152.595   5.4037  152.595   5.4037  152.595   5.4037  446.172   7.9183  446.172   7.9183 0.000000 0.000000 
1 1 1   17    0   31 o  352.161   8.8876   95.181   4.7838   95.181   4.7838   95.181   4.7838  352.161   8.8876  352.161   8.8876 0.000000 0.000000 
1 1 1   17    0   32 o  198.466   16.220   30.844   4.8515   30.844   4.8515   30.844   4.8515  198.466   16.220  198.466   16.220 0.000000 0.000000 
1 1 1   17    0   33 o  297.524   10.924   68.134   4.9595   68.134   4.9595   68.134   4.9595  297.524   10.924  297.524   10.924 0.000000 0.000000 
1 1 1   17    0   34 o   98.907   30.856   9.4650   4.0957   9.4650   4.0957   9.4650   4.0957   98.907   30.856   98.907   30.856 0.000000 0.000000 
1 1 1   17    0   35 o  207.750   12.592   33.481   3.9703   33.481   3.9703   33.481   3.9703  207.750   12.592  207.750   12.592 0.000000 0.000000 
1 1 1   17    0   36 o   66.618   31.408   5.0537   3.6136   5.0537   3.6136   5.0537   3.6136   66.618   31.408   66.618   31.408 0.000000 0.000000 
1 1 1   17    0   37 o  292.258   10.231   65.748   4.5638   65.748   4.5638   65.748   4.5638  292.258   10.231  292.258   10.231 0.000000 0.000000 
1 1 1   17    0   38 o  109.379   26.336   10.707   3.8233   10.707   3.8233   10.707   3.8233  109.379   26.336  109.379   26.336 0.000000 0.000000 
1 1 1   17    0   39 o  457.707   9.8369  160.929   6.8843  160.929   6.8843  160.929   6.8843  457.707   9.8369  457.707   9.8369 0.000000 0.000000 
1 1 1   17    0   40 o  276.011   12.196   58.874   5.1295   58.874   5.1295   58.874   5.1295  276.011   12.196  276.011   12.196 0.000000 0.000000 
1 1 1   17    0   41 o   51.796   29.966   2.6502   3.8591   2.6502   3.8591   2.6502   3.8591   51.796   29.966   51.796   29.966 0.000000 0.000000 
1 1 1   17    0   42 o  235.109   12.671   42.886   4.5295   42.886   4.5295   42.886   4.5295  235.109   12.671  235.109   12.671 0.000000 0.000000 
1 1 1   17    0   43 o   69.395   33.334   5.6008   4.0898   5.6008   4.0898   5.6008   4.0898   69.395   33.334   69.395   33.334 0.000000 0.000000 
1 1 1   17    0   44 o   45.249   30.223  -1.6357   5.7428  -1.6357   5.7428  -1.6357   5.7428   45.249   30.223   45.249   30.223 0.000000 0.000000 
1 1 1   17    0   45 o  104.564   32.473   10.730   4.5526   10.730   4.5526   10.730   4.5526  104.564   32.473  104.564   32.473 0.000000 0.000000 
1 1 1   17    0   46 o  173.152   21.227   24.356   5.3995   24.356   5.3995   24.356   5.3995  173.152   21.227  173.152   21.227 0.000000 0.000000 
1 1 1   17    0   47 o   49.435   31.434   0.8829   5.2047   0.8829   5.2047   0.8829   5.2047   49.435   31.434   49.435   31.434 0.000000 0.000000 
1 1 1   17    0   48 o  162.575   23.475   21.922   5.4875   21.922   5.4875   21.922   5.4875  162.575   23.475  162.575   23.475 0.000000 0.000000 
1 1 1   17    0   49 f   56.279   32.826   3.2316   4.6895   3.2316   4.6895   3.2316   4.6895   56.279   32.826   56.279   32.826 0.000000 0.000000 
1 1 1   17    0   50 o  232.618   17.686   42.806   6.2134   42.806   6.2134   42.806   6.2134  232.618   17.686  232.618   17.686 0.000000 0.000000 
1 1 1   17    0   51 o   53.906   32.685   2.5102   4.9967   2.5102   4.9967   2.5102   4.9967   53.906   32.685   53.906   32.685 0.000000 0.000000 
1 1 1   17    0   52 o  100.045   38.789   11.137   5.6501   11.137   5.6501   11.137   5.6501  100.045   38.789  100.045   38.789 0.000000 0.000000 
1 1 1   17    0   53 o   48.469   30.826   1.0461   5.0086   1.0461   5.0086   1.0461   5.0086   48.469   30.826   48.469   30.826 0.000000 0.000000 
1 1 1   17    0   54 o   47.362   30.285   0.8641   4.9161   0.8641   4.9161   0.8641   4.9161   47.362   30.285   47.362   30.285 0.000000 0.000000 
1 1 1   17    0   55 o  135.631   34.995   17.697   6.2789   17.697   6.2789   17.697   6.2789  135.631   34.995  135.631   34.995 0.000000 0.000000 
1 1 1   17    0   56 o   50.160   32.095   1.2088   5.5319   1.2088   5.5319   1.2088   5.5319   50.160   32.095   50.160   32.095 0.000000 0.000000 
1 1 1   17    0   57 o   81.175   38.787   8.4942   5.5298   8.4942   5.5298   8.4942   5.5298   81.175   38.787   81.175   38.787 0.000000 0.000000 
1 1 1   17    0   58 o   79.623   35.941   7.9083   4.7045   7.9083   4.7045   7.9083   4.7045   79.623   35.941   79.623   35.941 0.000000 0.000000 
1 1 1   17    0   59 o   70.050   35.454   6.4704   4.7295   6.4704   4.7295   6.4704   4.7295   70.050   35.454   70.050   35.454 0.000000 0.000000 
1 1 1   17    1    1 o  774.595   12.058  459.568   14.296   0.0000   0.0000  459.568   14.296  ?   ?   774.595   12.058 0.000000 12.05775 
1 1 1   17    1    2 o  750.662   6.9144  431.368   7.9445  418.910   13.513  437.949   9.8212  739.543   11.938  756.315   8.4838 -16.77136 14.64516 
1 1 1   17    1    3 o  354.380   7.2002   96.141   3.9056  102.304   5.6453   90.483   5.4089  365.510   10.091  343.741   10.280 21.76868 14.40507 
1 1 1   17    1    4 o  996.601   10.278  760.584   15.679  776.174   22.574  746.057   21.792  1006.45   14.654  986.744   14.429 19.70050 20.56531 
1 1 1   17    1    5 o  834.175   13.051  533.072   16.663  533.072   16.663   0.0000   0.0000  834.175   13.051  ?   ?  0.000000 13.05077 
1 1 1   17    1    6 o  1138.07   7.9049  991.613   13.770  984.532   19.395  998.810   19.554  1133.80   11.176  1141.99   11.187 -8.191162 15.81266 
1 1 1   17    1    7 o  1190.49   8.1852  1085.09   14.915  1083.36   21.117  1086.82   21.070  1189.30   11.600  1191.20   11.556 -1.904297 16.37391 
1 1 1   17    1    8 o  486.478   7.5209  181.183   5.6002  181.183   5.6002   0.0000   0.0000  486.478   7.5209  ?   ?  0.000000 7.520908 
1 1 1   17    1    9 o  785.647   6.2781  472.499   7.5497  476.631   10.818  468.576   10.541  788.974   8.9579  782.286   8.8034 6.687927 12.55968 
1 1 1   17    1   10 o  876.018   6.0242  587.444   8.0776  591.953   12.873  584.516   10.374  879.219   9.5654  873.766   7.7570 5.453735 12.31530 
1 1 1   17    1   11 o  657.157   5.3085  330.565   5.3396  324.815   8.3820  334.493   6.9270  651.325   8.4078  661.009   6.8465 -9.684143 10.84273 
1 1 1   17    1   12 f  562.505   5.1754  242.198   4.4559  248.657   7.2000  238.188   5.6727  569.877   8.2544  557.797   6.6443 12.08051 10.59629 
1 1 1   17    1   13 o   64.937   16.744   3.3555   1.6750   3.6621   3.0887   3.2278   1.9936   71.386   23.960   64.380   18.956 7.006104 30.55127 
1 1 1   17    1   14 o  211.818   6.8862   34.349   2.2326   26.546   3.9350   38.054   2.7113  185.589   13.954  222.936   7.9455 -37.34700 16.05784 
1 1 1   17    1   15 o  982.723   5.5708  739.268   8.3795  746.514   12.844  733.897   11.057  987.377   8.4983  979.062   7.3783 8.315125 11.25438 
1 1 1   17    1   16 o  591.956   4.2901  268.213   3.8871  267.013   5.4626  269.444   5.5324  590.589   6.0429  593.271   6.0924 -2.681641 8.581061 
1 1 1   17    1   17 o  378.754   4.4966  109.805   2.6068  105.381   3.6456  114.434   3.7290  371.014   6.4197  386.624   6.3013 -15.60989 8.995503 
1 1 1   17    1   18 o  445.235   4.4631  151.737   3.0415  147.523   4.2640  156.101   4.3397  438.973   6.3462  451.556   6.2788 -12.58295 8.927363 
1 1 1   17    1   19 o  1569.82   7.9474  1887.04   19.096  1855.30   28.718  1912.20   25.568  1556.01   12.058  1579.92   10.573 -23.91296 16.03678 
1 1 1   17    1   20 o  671.922   5.4075  345.616   5.5614  342.770   7.9000  348.412   7.8304  669.057   7.7143  674.547   7.5841 -5.490173 10.81798 
1 1 1   17    1   21 o  696.199   5.0990  371.035   5.4336  377.559   7.3340  363.098   8.0901  702.223   6.8233  688.603   7.6757 13.62006 10.27003 
1 1 1   17    1   22 o  620.692   4.7642  294.912   4.5262  304.975   6.5617  285.777   6.2516  631.118   6.7926  610.935   6.6854 20.18268 9.530683 
1 1 1   17    1   23 o  563.405   4.8799  242.993   4.2083  246.389   6.0636  239.837   5.8452  567.253   6.9837  559.666   6.8234 7.586975 9.763728 
1 1 1   17    1   24 o  869.426   5.2874  578.690   7.0363  571.313   9.8906  586.250   10.012  863.726   7.4813  874.945   7.4762 -11.21918 10.57651 
1 1 1   17    1   25 o  827.746   5.2461  524.548   6.6466  523.439   9.4258  525.644   9.3739  826.725   7.4488  828.469   7.3922 -1.743896 10.49429 
1 1 1   17    1   26 o  429.150   5.8386  141.014   3.8352  148.002   5.1909  132.615   5.6911  439.577   7.7150  416.040   8.9370 23.53677 11.80639 
1 1 1   17    1   27 o  643.534   6.3863  317.143   6.2906  319.100   8.1710  314.296   9.8569  645.379   8.2716  640.342   10.057 5.037170 13.02143 
1 1 1   17    1   28 o  205.065   9.2595   32.230   2.9064   24.569   4.5019   37.705   3.8057  177.972   16.722  221.437   11.265 -43.46429 20.16316 
1 1 1   17    1   29 o  150.511   11.376   17.478   2.6015   20.757   3.7319   14.379   3.6284  163.649   15.068  135.498   17.936 28.15134 23.42509 
1 1 1   17    1   30 o  435.959   5.6588  145.554   3.7761  150.263   5.5311  141.443   5.1677  442.793   8.1610  429.623   7.8585 13.16995 11.32952 
1 1 1   17    1   31 o  106.326   16.577   8.9112   2.6099   12.300   3.7951   5.8702   3.5949  124.554   20.628   86.248   25.471 38.30643 32.77678 
1 1 1   17    1   32 o  210.373   9.6496   33.952   3.1072   40.643   5.2824   30.412   3.8422  229.278   15.137  198.528   12.711 30.75018 19.76620 
1 1 1   17    1   33 o   91.941   21.278   6.8107   2.9352   7.0274   3.9841   6.5535   4.3407   93.658   26.566   91.467   28.202 2.190407 38.74420 
1 1 1   17    1   34 o  361.400   6.6913  100.098   3.7014   98.355   5.0274  102.160   5.4698  358.020   9.1741  364.813   9.7957 -6.793152 13.42085 
1 1 1   17    1   35 o   67.827   21.961   3.4766   2.6024   3.8419   3.8056   3.1557   3.5667   74.819   26.526   70.068   25.572 4.750542 36.84558 
1 1 1   17    1   36 o  318.297   6.7973   77.670   3.3116   83.239   4.9033   72.999   4.4905  329.214   9.7306  308.323   9.5152 20.89059 13.60968 
1 1 1   17    1   37 o  383.338   6.2734  112.642   3.6809  113.992   5.2746  111.361   5.1393  385.309   8.9435  380.854   8.8161 4.455078 12.55825 
1 1 1   17    1   38 o  345.102   6.6237   91.324   3.4988   95.700   5.0889   87.400   4.8183  352.923   9.4205  337.283   9.3331 15.63931 13.26098 
1 1 1   17    1   39 o   97.589   23.125   7.7681   3.4014   4.3846   4.4022   12.780   5.3578   79.568   28.496  124.406   28.719 -44.83756 40.45723 
1 1 1   17    1   40 o  253.011   8.9727   49.202   3.4748   51.923   4.9826   46.626   4.8485  259.381   12.550  245.394   12.954 13.98665 18.03658 
1 1 1   17    1   41 o  158.924   12.637   19.630   3.0487   18.900   4.3639   20.326   4.2609  154.476   18.847  160.604   17.622 -6.128494 25.80247 
1 1 1   17    1   42 o  122.035   15.746   11.760   2.8725   13.895   4.1911   9.8685   3.9448  131.223   21.620  109.521   24.179 21.70181 32.43489 
1 1 1   17    1   43 o  332.029   7.5391   84.701   3.8315   82.721   5.4340   86.658   5.4032  327.445   10.842  335.224   10.530 -7.778534 15.11419 
1 1 1   17    1   44 o  146.723   19.550   17.204   4.2813   17.456   6.2004   16.973   5.9189  144.436   29.053  142.740   28.091 1.696411 40.41260 
1 1 1   17    1   45 o  121.522   19.235   11.886   3.4587   14.745   5.0571   9.3727   4.7408  133.447   25.691  105.517   28.626 27.93078 38.46411 
1 1 1   17    1   46 o  228.164   11.111   40.250   3.8803   46.486   5.2183   32.537   5.8034  244.087   14.026  202.388   18.955 41.69872 23.57991 
1 1 1   17    1   47 o   60.424   24.577   1.4049   3.5657   0.0546   4.7112   3.2157   5.4556   62.567   26.996   77.549   30.791 -14.98206 40.94898 
1 1 1   17    1   48 o  264.381   10.084   54.010   4.0806   56.936   6.1021   51.643   5.4883  269.563   14.847  257.024   14.003 12.53876 20.40868 
1 1 1   17    1   49 f  233.829   11.080   42.365   3.9657   44.884   5.9251   40.321   5.3375  238.458   16.332  226.303   15.502 12.15514 22.51803 
1 1 1   17    1   50 o  159.774   16.073   20.265   3.8775   24.593   5.1585   14.644   5.8790  174.706   19.631  129.844   30.158 44.86179 35.98430 
1 1 1   17    1   51 o  236.140   12.206   43.532   4.3968   37.566   5.5556   53.532   7.1926  217.378   16.828  258.876   18.269 -41.49750 24.83875 
1 1 1   17    1   52 o   69.260   26.229   3.1957   3.8183   2.2731   5.6794   3.9567   5.1580   73.772   30.614   77.822   30.224 -4.050659 43.02039 
1 1 1   17    1   53 o  239.319   10.726   44.550   3.9288   35.932   5.4784   53.675   5.6375  211.749   17.047  260.775   14.177 -49.02591 22.17202 
1 1 1   17    1   54 o  158.078   17.116   20.200   4.0753   16.435   6.1935   23.075   5.4119  134.813   30.702  166.482   21.758 -31.66849 37.63021 
1 1 1   17    1   55 o   67.950   28.218   2.0563   4.8297  -3.0650   7.8906   5.1244   6.1074   69.067   31.896   83.525   32.763 -14.45822 45.72448 
1 1 1   17    1   56 o  135.067   17.523   14.983   3.5374   20.535   5.0563   9.6613   4.9505  155.749   21.808  102.126   29.814 53.62225 36.93835 
1 1 1   17    1   57 o   86.886   27.257   6.8678   4.0348   2.7028   5.1346   13.591   6.5239   70.096   29.101  116.513   34.286 -46.41715 44.97059 
1 1 1   17    1   58 o   77.705   24.824   5.3910   3.3339   8.7100   4.6660   1.9295   4.7651   95.493   29.207   65.306   27.631 30.18645 40.20610 
1 1 1   17    1   59 f   92.270   24.001   7.7665   3.4217   6.8346   4.8059   8.7246   4.8730   85.014   29.841   94.409   29.997 -9.395386 42.31218 
1 1 1   17    2    0 o  992.216   14.169  754.339   21.508  754.339   21.508  754.339   21.508  992.216   14.169  992.216   14.169 0.000000 0.000000 
1 1 1   17    2    1 o  117.428   14.618   10.729   2.5706   0.0000   0.0000   10.729   2.5706  ?   ?   117.428   14.618 0.000000 14.61834 
1 1 1   17    2    2 o  1105.16   15.210  935.982   25.729   0.0000   0.0000  935.982   25.729  ?   ?   1105.16   15.210 0.000000 15.20979 
1 1 1   17    2    3 o  859.540   9.0982  565.691   11.970  566.672   17.291  564.789   16.587  860.062   13.135  858.665   12.620 1.396790 18.21527 
1 1 1   17    2    4 o  696.875   6.6771  371.759   7.1221  365.170   12.391  375.010   8.7036  690.484   11.724  699.872   8.1248 -9.387268 14.26407 
1 1 1   17    2    5 o  1189.35   9.4250  1083.15   17.158  1093.63   30.315  1078.21   20.812  1194.44   16.582  1186.49   11.460 7.946777 20.15639 
1 1 1   17    2    6 o  949.857   6.9602  690.687   10.119  696.402   14.559  685.346   14.075  953.633   9.9744  946.047   9.7197 7.586060 13.92699 
1 1 1   17    2    7 o  352.146   5.0492   94.919   2.7216   99.032   4.1401   91.789   3.6116  359.661   7.5204  346.269   6.8141 13.39215 10.14838 
1 1 1   17    2    8 o  690.508   5.8602  364.979   6.1937  368.350   8.9588  361.893   8.5725  693.611   8.4384  687.515   8.1462 6.096191 11.72896 
1 1 1   17    2    9 o  429.265   4.7203  141.043   3.1015  145.636   5.1087  138.362   3.9030  436.148   7.6525  425.148   5.9978 11.00079 9.722910 
1 1 1   17    2   10 o  486.818   4.8772  181.401   3.6342  186.581   5.9171  178.263   4.6050  493.661   7.8309  482.566   6.2346 11.09531 10.00964 
1 1 1   17    2   11 f  1309.98   7.9951  1313.86   16.031  1342.30   26.006  1296.44   20.359  1323.64   12.836  1301.09   10.223 22.55359 16.40969 
1 1 1   17    2   12 o  888.320   6.1767  604.075   8.3983  626.117   13.758  590.984   10.603  904.196   9.9409  878.570   7.8847 25.62616 12.68815 
1 1 1   17    2   13 o  572.497   5.0928  250.880   4.4628  251.939   5.7337  249.251   7.1081  573.672   6.5298  570.556   8.1392 3.115662 10.43483 
1 1 1   17    2   14 o  447.047   4.6364  152.972   3.1725  158.332   5.4399  150.210   3.9055  454.746   7.8154  442.973   5.7601 11.77356 9.708699 
1 1 1   17    2   15 o  807.042   5.9518  498.594   7.3522  516.979   17.042  494.389   8.1496  821.332   13.556  803.607   6.6256 17.72546 15.08860 
1 1 1   17    2   16 o  382.501   4.5906  111.989   2.6877  111.262   4.0676  112.552   3.5807  381.217   6.9710  383.438   6.1010 -2.220459 9.263730 
1 1 1   17    2   17 o  895.893   5.8603  614.430   8.0361  590.177   13.741  627.036   9.9069  877.786   10.227  904.976   7.1521 -27.18958 12.48013 
1 1 1   17    2   18 o  1111.10   6.1241  945.108   10.415  954.883   16.112  938.092   13.651  1116.59   9.4272  1106.84   8.0574 9.749878 12.40136 
1 1 1   17    2   19 o  616.104   5.1886  290.569   4.8930  294.964   8.5827  288.453   5.9557  620.596   9.0353  613.820   6.3390 6.776367 11.03720 
1 1 1   17    2   20 o  839.886   5.3529  540.002   6.8814  530.173   9.0321  553.601   10.624  832.125   7.0913  850.248   8.1637 -18.12262 10.81355 
1 1 1   17    2   21 o  365.149   5.3945  102.071   3.0151  104.272   4.1402   99.586   4.3994  369.021   7.3300  360.617   7.9704 8.404022 10.82848 
1 1 1   17    2   22 o  539.683   5.0864  222.962   4.2016  218.936   5.6210  228.061   6.3251  534.730   6.8677  545.731   7.5721 -11.00098 10.22264 
1 1 1   17    2   23 o  478.139   4.9373  175.010   3.6134  174.797   5.2902  175.197   4.9472  477.775   7.2340  478.339   6.7570 -0.5642700 9.898890 
1 1 1   17    2   24 o  521.207   4.9827  207.963   3.9751  211.990   5.8076  204.414   5.4524  526.145   7.2114  516.672   6.8945 9.473511 9.976904 
1 1 1   17    2   25 o  454.805   5.7086  158.370   3.9740  160.446   5.3705  155.857   5.9080  457.701   7.6659  451.066   8.5571 6.634613 11.48872 
1 1 1   17    2   26 o  552.669   5.9365  233.876   5.0219  233.079   6.2541  235.321   8.4257  551.652   7.4068  554.127   9.9341 -2.475647 12.39140 
1 1 1   17    2   27 o  522.027   5.5480  208.658   4.4330  210.436   6.9149  207.417   5.7760  524.070   8.6205  520.385   7.2516 3.684814 11.26490 
1 1 1   17    2   28 o  743.823   5.6320  423.660   6.4121  419.207   10.061  426.707   8.3209  739.600   8.8876  746.354   7.2837 -6.754272 11.49094 
1 1 1   17    2   29 o  373.695   6.3546  106.958   3.6347  111.616   5.7951  103.937   4.6668  381.534   9.9234  368.280   8.2789 13.25357 12.92338 
1 1 1   17    2   30 o  430.070   5.5886  141.647   3.6789  143.967   5.3677  139.592   5.0520  433.420   8.0911  426.809   7.7332 6.611115 11.19236 
1 1 1   17    2   31 o  165.186   10.498   21.021   2.6405   20.945   3.9052   21.085   3.5840  164.212   15.730  164.972   14.336 -0.7596130 21.28232 
1 1 1   17    2   32 o  899.966   6.4415  620.527   8.8732  650.771   16.194  607.551   10.607  920.552   11.493  890.285   7.7840 30.26660 13.88090 
1 1 1   17    2   33 o  208.376   9.6953   33.320   3.0923   34.066   4.2378   32.470   4.5223  210.041   13.250  204.854   14.517 5.187653 19.65414 
1 1 1   17    2   34 o  162.532   11.462   20.400   2.8331   17.782   3.7731   23.785   4.2897  150.887   16.613  174.837   16.214 -23.95053 23.21369 
1 1 1   17    2   35 o  269.026   7.5031   55.497   3.0896   53.861   4.4815   56.978   4.2652  264.734   11.060  272.368   10.231 -7.633728 15.06622 
1 1 1   17    2   36 o  282.686   7.4076   61.283   3.2052   67.338   4.7460   56.206   4.3459  296.018   10.475  270.442   10.499 25.57639 14.83043 
1 1 1   17    2   37 o  193.027   9.4765   28.620   2.7998   32.573   4.1588   25.343   3.7865  205.137   13.317  180.756   13.790 24.38109 19.17047 
1 1 1   17    2   38 o   64.981   22.376   3.0255   2.6959   5.3746   3.8829   0.8392   3.7459   83.307   26.809   60.029   24.883 23.27720 36.57765 
1 1 1   17    2   39 o  404.887   7.8831  125.843   4.8854  126.784   6.5677  124.679   7.3099  405.905   10.571  402.235   11.873 3.669830 15.89702 
1 1 1   17    2   40 o  118.872   15.847   11.145   2.8115   10.926   4.1562   11.330   3.8175  115.643   24.255  118.411   21.868 -2.768517 32.65788 
1 1 1   17    2   41 o  160.688   12.557   20.062   3.0638   19.765   4.7104   20.280   4.0337  157.701   19.961  160.661   16.644 -2.960831 25.99025 
1 1 1   17    2   42 o  301.062   7.6734   69.630   3.5360   70.022   5.1456   69.279   4.8673  301.274   11.158  299.786   10.607 1.487244 15.39565 
1 1 1   17    2   43 o  171.638   12.074   22.882   3.1519   22.672   4.6733   23.056   4.2690  169.248   18.333  171.223   16.493 -1.974976 24.65981 
1 1 1   17    2   44 o  240.020   12.135   44.673   4.4438   35.976   6.6581   51.660   5.9675  212.595   20.724  257.214   15.225 -44.61937 25.71592 
1 1 1   17    2   45 o  140.481   17.392   15.678   3.6598   13.349   5.0614   18.230   5.2981  126.375   26.986  149.391   23.981 -23.01560 36.10232 
1 1 1   17    2   46 o   88.320   25.216   6.4574   3.5775   7.6127   4.9095   5.1494   5.2239   95.936   30.062   84.762   30.946 11.17443 43.14357 
1 1 1   17    2   47 o   42.778   20.077  -3.2230   3.3329   3.0049   4.8419  -8.8314   4.5948   73.999   29.125   42.137   20.688 31.86280 35.72479 
1 1 1   17    2   48 f   70.788   24.946   3.6866   3.3607   1.3162   4.8201   5.9290   4.6882   67.298   28.089   86.530   29.516 -19.23160 40.74528 
1 1 1   17    2   49 o  153.948   15.078   18.721   3.5073   17.974   5.0133   19.437   4.9085  147.914   22.882  154.595   21.310 -6.681396 31.26832 
1 1 1   17    2   50 o  196.392   14.090   30.297   4.2074   35.840   5.8813   24.485   6.0217  211.887   18.314  172.539   23.405 39.34743 29.71913 
1 1 1   17    2   51 o  182.557   15.058   26.350   4.1701   25.053   6.2722   27.378   5.5827  173.685   24.255  183.835   20.172 -10.15012 31.54674 
1 1 1   17    2   52 o  161.040   15.897   20.673   3.8674   16.932   5.7540   23.755   5.2230  140.005   27.831  170.638   20.402 -30.63300 34.50813 
1 1 1   17    2   53 f   60.152   24.837   1.3701   3.7111   5.3509   5.5617  -1.8248   4.9826   84.167   31.708   57.643   26.135 26.52456 41.09009 
1 1 1   17    2   54 o  108.843   23.637   10.174   3.8251   13.060   5.6604   7.7475   5.1892  119.843   30.716   93.718   31.046 26.12423 43.67323 
1 1 1   17    2   55 o  111.141   27.066   10.998   4.5614   12.327   6.4135   9.6366   6.4888  113.948   34.109  101.892   34.725 12.05508 48.67479 
1 1 1   17    2   56 o  132.598   18.882   14.605   3.7241   13.372   5.5100   15.642   5.0529  119.980   30.064  133.120   25.730 -13.14011 39.57125 
1 1 1   17    2   57 o   92.899   24.877   7.7680   3.6080   5.7927   5.3715   9.3919   4.8703   82.489   31.141   99.679   29.697 -17.19022 43.03111 
1 1 1   17    2   58 o   86.913   26.381   6.9634   3.8170   8.0606   4.7388   4.9366   6.4410   91.918   29.621   80.415   32.906 11.50369 44.27448 
1 1 1   17    3    0 o  1187.40   16.176  1080.45   29.388  1080.45   29.388  1080.45   29.388  1187.40   16.176  1187.40   16.176 0.000000 0.000000 
1 1 1   17    3    1 f  240.768   7.3935   44.379   2.7247   46.211   4.0407   42.851   3.6897  245.645   10.747  236.554   10.190 9.090820 14.81015 
1 1 1   17    3    2 o  580.832   10.238  258.348   9.1017   0.0000   0.0000  258.348   9.1017  ?   ?   580.832   10.238 0.000000 10.23767 
1 1 1   17    3    3 o  520.118   7.1960  207.097   5.7288  213.361   8.8263  202.537   7.5306  527.820   10.925  514.300   9.5663 13.52014 14.52137 
1 1 1   17    3    4 o  858.142   9.0814  563.857   11.928  593.495   18.223  541.637   15.779  880.147   13.527  840.896   12.259 39.25037 18.25530 
1 1 1   17    3    5 o  764.086   6.9963  446.942   8.1824  490.720   15.886  431.134   9.5461  800.351   12.968  750.407   8.3111 49.94366 15.40246 
1 1 1   17    3    6 o  571.092   6.0911  249.660   5.3244   0.0000   0.0000  249.660   5.3244  ?   ?   571.092   6.0911 0.000000 6.091064 
1 1 1   17    3    7 o  884.526   9.6027  599.108   13.001   0.0000   0.0000  599.108   13.001  ?   ?   884.526   9.6027 0.000000 9.602657 
1 1 1   17    3    8 o  363.718   6.4086  101.270   3.5678   98.289   4.2905  107.951   6.4234  358.303   7.8233  375.427   11.178 -17.12372 13.64382 
1 1 1   17    3    9 o  733.111   6.2406  411.421   7.0028  408.507   9.8183  414.438   9.9907  730.422   8.7820  735.702   8.8721 -5.279907 12.48348 
1 1 1   17    3   10 o  608.511   5.1107  283.433   4.7602  282.943   7.6921  283.737   6.0599  607.902   8.2669  608.806   6.5031 -0.9042969 10.51815 
1 1 1   17    3   11 o  692.925   5.4245  367.534   5.7533  364.068   9.1988  369.762   7.3735  689.543   8.7156  694.979   6.9316 -5.435974 11.13594 
1 1 1   17    3   12 o  498.279   4.8165  190.044   3.6735  187.885   4.7239  193.346   5.8427  495.414   6.2296  502.530   7.5960 -7.116516 9.823821 
1 1 1   17    3   13 o  684.927   4.9470  359.090   5.1862  359.864   7.2798  358.292   7.3903  685.607   6.9370  684.104   7.0579 1.503601 9.896250 
1 1 1   17    3   14 o  275.872   5.1413   58.256   2.1709   69.362   3.1272   47.924   3.0162  301.000   6.7876  250.184   7.8764 50.81627 10.39754 
1 1 1   17    3   15 o  298.266   5.2766   68.098   2.4089   58.521   4.4771   72.001   2.8579  276.410   10.582  306.682   6.0882 -30.27213 12.20856 
1 1 1   17    3   16 o  128.911   10.529   12.814   2.0594   12.960   6.3816   12.797   2.1758  127.204   32.620  128.765   11.150 -1.561241 34.47314 
1 1 1   17    3   17 o  478.092   4.5800  174.959   3.3516  171.171   5.1617  177.721   4.4070  472.831   7.1321  481.821   5.9757 -8.990814 9.304550 
1 1 1   17    3   18 o  149.566   8.5810   17.187   1.9562   12.422   3.1534   20.168   2.4942  126.154   16.745  161.951   10.112 -35.79667 19.56137 
1 1 1   17    3   19 o  356.712   5.7096   97.410   3.1174   99.164   4.5748   95.888   4.2594  359.853   8.3057  353.870   7.8638 5.982941 11.43788 
1 1 1   17    3   20 o  180.881   7.4175   25.052   2.0536   27.088   3.0876   23.438   2.7501  187.722   10.791  174.608   10.336 13.11343 14.94267 
1 1 1   17    3   21 o  604.277   4.9926  279.523   4.6178  285.347   6.3757  273.097   6.6972  610.475   6.8232  597.206   7.3265 13.26849 10.01173 
1 1 1   17    3   22 o  804.911   5.4080  495.982   6.6627  489.733   8.7956  504.396   10.206  799.732   7.1854  811.549   8.2162 -11.81714 10.91492 
1 1 1   17    3   23 o  749.684   4.9859  430.245   5.7213  427.858   8.1953  432.514   7.9908  747.493   7.1629  751.562   6.9463 -4.068726 9.977919 
1 1 1   17    3   24 o  198.113   8.9023   30.066   2.6995   28.090   3.7014   32.311   3.9457  190.978   12.735  204.889   12.643 -13.91177 17.94557 
1 1 1   17    3   25 o  769.794   5.5161  453.691   6.4994  452.833   8.6933  454.780   9.7868  768.945   7.3862  770.525   8.2982 -1.579590 11.10925 
1 1 1   17    3   26 f  500.463   5.5004  191.766   4.2135  188.969   5.7726  194.954   6.1641  496.703   7.5929  504.486   7.9827 -7.783112 11.01706 
1 1 1   17    3   27 o  753.803   5.5379  435.077   6.3896  442.628   10.016  429.895   8.2973  760.055   8.6094  749.172   7.2358 10.88306 11.24625 
1 1 1   17    3   28 o  562.959   5.4971  242.675   4.7368  237.395   7.3701  246.390   6.1829  556.583   8.6511  567.149   7.1223 -10.56696 11.20578 
1 1 1   17    3   29 o  298.919   7.0449   68.449   3.2233   70.226   5.1916   67.334   4.1118  302.549   11.211  296.381   9.0637 6.168152 14.41641 
1 1 1   17    3   30 o  592.774   5.2463  269.077   4.7601  267.939   6.9206  270.099   6.5576  591.321   7.6462  593.741   7.2157 -2.419983 10.51337 
1 1 1   17    3   31 o  196.528   10.522   29.721   3.1536   30.609   6.4233   29.439   3.6200  197.759   21.570  195.410   12.163 2.349503 24.76317 
1 1 1   17    3   32 o  636.713   6.0284  310.559   5.8751  318.877   10.864  307.121   6.9846  644.462   11.013  633.049   7.2083 11.41370 13.16227 
1 1 1   17    3   33 o  417.159   6.2025  133.330   3.9604  131.877   5.4224  134.992   5.7981  414.671   8.5432  419.488   9.0302 -4.817078 12.43103 
1 1 1   17    3   34 o  116.211   14.760   10.571   2.5662   9.7707   3.7710   11.261   3.5021  110.066   23.119  119.000   19.932 -8.933571 30.52526 
1 1 1   17    3   35 o  314.112   7.2174   75.647   3.4701   75.623   4.8605   75.672   4.9557  313.790   10.120  313.869   10.315 -0.7958984E-01 14.45057 
1 1 1   17    3   36 o  309.048   6.7488   73.222   3.1924   80.809   4.8562   67.448   4.2365  324.356   9.7816  296.378   9.3389 27.97787 13.52382 
1 1 1   17    3   37 o  572.423   5.5480  251.089   4.8609  251.502   7.1325  250.731   6.6424  572.473   8.1399  571.697   7.5909 0.7757568 11.13010 
1 1 1   17    3   38 o   54.432   22.053   1.0195   2.8581   2.8634   3.6409  -1.9410   4.6135   68.667   25.696   56.848   25.516 11.81856 36.21259 
1 1 1   17    3   39 o  256.295   8.3578   50.446   3.2787   51.803   5.2237   49.564   4.2116  258.717   13.236  253.745   10.844 4.971512 17.11043 
1 1 1   17    3   40 o  171.212   11.190   22.681   2.9163   24.546   4.4386   21.265   3.8685  177.031   16.573  164.918   15.507 12.11389 22.69703 
1 1 1   17    3   41 o  255.406   8.6881   50.148   3.3965   50.849   5.3664   49.679   4.3870  255.969   13.747  253.819   11.292 2.150131 17.79035 
1 1 1   17    3   42 f  152.108   12.627   18.009   2.9133   20.972   4.3978   15.693   3.8890  162.926   17.932  140.504   18.536 22.42155 25.79016 
1 1 1   17    3   43 o  143.975   17.917   16.448   3.8630   21.408   6.4555   13.681   4.8215  161.322   27.105  128.864   25.347 32.45807 37.11013 
1 1 1   17    3   44 o  322.756   9.7415   80.280   4.8125   74.733   6.0342   89.975   7.9774  310.657   12.690  339.957   15.331 -29.30011 19.90175 
1 1 1   17    3   45 o  315.764   7.9314   76.685   3.8334   77.421   5.5548   76.016   5.2968  316.425   11.469  313.661   11.033 2.763794 15.91414 
1 1 1   17    3   46 o  153.027   14.529   18.393   3.3622   18.362   4.8272   18.422   4.6857  150.654   21.547  151.176   20.801 -0.5220184 29.94916 
1 1 1   17    3   47 o  179.036   14.020   25.106   3.8114   26.672   5.1572   23.221   5.6580  182.995   18.674  169.173   22.401 13.82129 29.16375 
1 1 1   17    3   48 o   88.685   24.068   6.5669   3.3505   14.224   4.8583  -0.3780   4.6268  130.529   25.230   60.507   26.423 70.02200 36.53389 
1 1 1   17    3   49 o   93.605   23.574   7.3480   3.3756   7.1399   4.8649   7.5412   4.6877   92.697   30.027   94.629   29.330 -1.931473 41.97470 
1 1 1   17    3   50 o   94.924   26.436   7.6571   3.9832   5.8421   5.0608   10.612   6.4572   86.445   30.596  109.926   34.481 -23.48100 46.09855 
1 1 1   17    3   51 o  106.152   25.973   9.6495   4.1855   16.588   6.8687   5.5510   5.2788  136.156   33.247   85.279   31.112 50.87695 45.53364 
1 1 1   17    3   52 o   64.208   25.512   2.2004   3.7481   8.0865   5.6126  -2.5372   5.0353   96.824   32.298   56.465   25.857 40.35843 41.37339 
1 1 1   17    3   53 o  127.487   19.844   13.397   3.7464   11.523   5.7015   14.821   4.9699  112.762   31.708  131.321   25.645 -18.55957 40.78087 
1 1 1   17    3   54 o  181.259   13.862   26.046   3.8167   19.271   5.3589   33.020   5.4372  150.561   24.064  202.065   17.760 -51.50383 29.90823 
1 1 1   17    3   55 o   55.888   24.654  -0.3501   4.1206   3.5726   6.0697  -3.7037   5.6121   77.939   31.924   56.488   26.362 21.45109 41.40232 
1 1 1   17    3   56 o  157.122   15.413   19.932   3.6590   22.205   5.4445   18.060   4.9412  161.317   22.676  145.037   23.028 16.28050 32.31818 
1 1 1   17    3   57 o  132.245   17.368   14.469   3.4306   15.199   4.8458   13.735   4.8574  130.590   25.155  122.977   26.581 7.613823 36.59672 
1 1 1   17    3   58 o   88.595   25.264   7.1861   3.5935   4.0460   4.6652   11.767   5.6348   72.875   28.619  108.824   31.819 -35.94880 42.79561 
1 1 1   17    4    0 o  280.412   10.525   60.451   4.5028   60.451   4.5028   60.451   4.5028  280.412   10.525  280.412   10.525 0.000000 0.000000 
1 1 1   17    4    1 o  901.844   9.3774  622.767   12.944  622.576   18.429  622.953   18.186  901.467   13.356  901.752   13.176 -0.2851563 18.76132 
1 1 1   17    4    2 o  1128.23   10.986  974.862   18.972  999.511   27.807  953.394   25.951  1141.96   15.909  1115.38   15.201 26.58362 22.00321 
1 1 1   17    4    3 o  1286.93   12.172  1268.61   23.977   0.0000   0.0000  1268.61   23.977  ?   ?   1286.93   12.172 0.000000 12.17229 
1 1 1   17    4    4 o  496.131   10.984  188.514   8.3412  188.514   8.3412   0.0000   0.0000  496.131   10.984  ?   ?  0.000000 10.98410 
1 1 1   17    4    5 o  651.245   8.1613  324.716   8.1353  333.829   12.007  316.982   11.061  660.173   11.883  643.328   11.233 16.84442 16.35173 
1 1 1   17    4    6 o  529.945   6.3287  214.985   5.1335  216.278   6.4251  212.702   8.5366  531.501   7.8978  527.009   10.583 4.492371 13.20489 
1 1 1   17    4    7 o  863.378   7.7415  570.693   10.231  588.732   12.954  540.790   16.678  876.828   9.6520  840.174   12.969 36.65356 16.16651 
1 1 1   17    4    8 o  579.592   6.6765  257.162   5.9230  267.649   7.4085  238.584   9.8605  591.251   8.1863  558.109   11.543 33.14209 14.15103 
1 1 1   17    4    9 o  384.711   8.1250  113.316   4.7844   0.0000   0.0000  113.316   4.7844  ?   ?   384.711   8.1250 0.000000 8.124950 
1 1 1   17    4   10 o  820.751   6.6739  515.691   8.3842  536.492   12.236  497.282   11.511  837.011   9.5508  805.855   9.3325 31.15631 13.35339 
1 1 1   17    4   11 o  419.103   6.7612  134.467   4.3372  132.466   5.3176  138.445   7.4965  415.939   8.3525  425.132   11.520 -9.192322 14.22959 
1 1 1   17    4   12 o  671.068   5.2931  344.712   5.4369  377.579   9.1506  326.778   6.7594  702.223   8.5134  653.338   6.7592 48.88507 10.87039 
1 1 1   17    4   13 f  578.552   5.0593  256.215   4.4803  256.200   7.0026  256.226   5.8295  578.458   7.9090  578.528   6.5832 -0.6909180E-01 10.29033 
1 1 1   17    4   14 f  628.440   4.8116  302.303   4.6283  300.194   7.9238  303.395   5.7022  626.140   8.2678  629.547   5.9175 -3.407593 10.16732 
1 1 1   17    4   15 o  210.215   5.7072   33.828   1.8364   31.386   3.0234   35.255   2.3116  202.438   9.7573  214.591   7.0378 -12.15312 12.03056 
1 1 1   17    4   16 o   91.491   11.503   6.5138   1.5752   8.4956   2.5725   5.3251   1.9924  103.943   16.738   81.870   16.470 22.07262 23.48178 
1 1 1   17    4   17 o  184.762   7.5021   26.138   2.1216   25.104   4.4855   26.436   2.4080  180.167   16.447  185.801   8.4672 -5.634491 18.49836 
1 1 1   17    4   18 o  690.355   4.8719  364.816   5.1481  362.615   7.9680  366.393   6.7449  688.171   7.5646  691.796   6.3698 -3.625183 9.889231 
1 1 1   17    4   19 o  561.943   4.8155  241.721   4.1419  245.160   6.6036  239.490   5.3180  565.837   7.6246  559.305   6.2120 6.532043 9.834807 
1 1 1   17    4   20 o  186.033   8.8079   26.505   2.5080   30.472   4.0485   24.036   3.1949  198.924   13.374  176.702   11.882 22.22121 17.88980 
1 1 1   17    4   21 o  697.508   5.4852  372.450   5.8561  378.112   8.6735  367.707   7.9389  702.668   8.0644  692.963   7.4848 9.704834 11.00256 
1 1 1   17    4   22 o  311.492   6.0358   74.285   2.8778   81.305   5.0618   70.932   3.4981  325.765   10.152  304.349   7.5091 21.41647 12.62700 
1 1 1   17    4   23 o  352.200   7.3002   94.990   3.9354  101.296   5.3668   87.655   5.7881  363.621   9.6427  338.193   11.182 25.42865 14.76513 
1 1 1   17    4   24 o  414.481   5.6604  131.528   3.5910  130.934   4.9699  132.177   5.1945  413.469   7.8531  415.414   8.1694 -1.945160 11.33178 
1 1 1   17    4   25 o  400.853   5.7622  123.027   3.5354  122.525   5.0075  123.526   4.9922  399.945   8.1800  401.578   8.1218 -1.633148 11.52723 
1 1 1   17    4   26 o  505.677   5.1304  195.773   3.9709  212.389   6.1160  183.664   5.2211  526.579   7.5881  489.709   6.9655 36.87027 10.30039 
1 1 1   17    4   27 o  383.607   5.6971  112.679   3.3451  116.862   5.0813  109.480   4.4439  390.536   8.5006  378.041   7.6799 12.49509 11.45601 
1 1 1   17    4   28 o  233.661   8.0562   41.833   2.8813   45.890   4.7577   39.483   3.6208  244.182   12.774  226.913   10.425 17.26906 16.48788 
1 1 1   17    4   29 o  328.574   6.6187   82.696   3.3287   85.279   5.4724   81.180   4.1937  333.428   10.723  325.459   8.4185 7.968414 13.63264 
1 1 1   17    4   30 o  516.818   5.5296  204.554   4.3742  210.875   7.0052  200.515   5.6002  524.478   8.7261  511.573   7.1519 12.90445 11.28251 
1 1 1   17    4   31 o  372.564   6.7932  106.349   3.8739  113.902   7.7958  103.872   4.4640  384.963   13.230  368.126   7.9225 16.83710 15.42099 
1 1 1   17    4   32 o  760.059   5.3932  442.460   6.2743  450.145   9.2723  435.969   8.5215  766.287   7.9054  754.205   7.3817 12.08203 10.81596 
1 1 1   17    4   33 o  637.044   5.7328  310.886   5.5899  317.278   7.6959  303.747   8.1328  643.292   7.8159  629.330   8.4429 13.96167 11.50531 
1 1 1   17    4   34 o  291.367   7.0708   65.076   3.1534   62.708   4.8092   66.862   4.1766  285.690   10.998  295.170   9.2443 -9.479706 14.36703 
1 1 1   17    4   35 o  329.734   7.1928   83.360   3.6302   81.018   5.0902   85.784   5.1788  324.766   10.240  334.196   10.124 -9.429718 14.39973 
1 1 1   17    4   36 o  251.949   7.6993   48.692   2.9692   46.036   4.5432   50.671   3.9228  244.570   12.136  256.821   9.9793 -12.25076 15.71243 
1 1 1   17    4   37 o  234.533   8.1599   42.215   2.9293   43.563   4.4766   41.205   3.8737  237.505   12.357  231.455   10.934 6.049347 16.50000 
1 1 1   17    4   38 o   82.344   22.081   5.4875   2.8402   2.4787   3.6293   10.242   4.5623   66.660   25.493  111.679   26.989 -45.01977 37.12584 
1 1 1   17    4   39 o  200.642   9.8339   30.960   3.0201   33.120   4.9222   29.655   3.8246  206.175   15.716  195.626   12.844 10.54901 20.29692 
1 1 1   17    4   40 o  248.175   8.2168   47.312   3.1212   47.657   4.7435   47.048   4.1450  248.164   12.528  247.125   10.958 1.038376 16.64459 
1 1 1   17    4   41 o  255.707   8.6992   50.270   3.4048   50.141   5.4535   50.352   4.3586  254.069   14.079  255.544   11.143 -1.475204 17.95490 
1 1 1   17    4   42 o  107.199   19.218   9.2617   3.0375   9.6703   4.1729   8.8012   4.4299  108.049   25.621  102.892   27.570 5.156502 37.63702 
1 1 1   17    4   43 o  207.516   12.735   33.451   4.0254   28.264   6.8365   36.204   4.9803  186.917   24.484  215.254   15.214 -28.33716 28.82594 
1 1 1   17    4   44 o  295.240   9.1237   67.122   4.1230   64.704   5.7297   69.719   5.9376  288.972   12.954  299.970   12.932 -10.99774 18.30410 
1 1 1   17    4   45 f   66.375   23.536   3.1284   2.9961   3.0661   4.3011   3.1871   4.1760   72.036   27.704   72.018   27.393 0.1828766E-01 38.96014 
1 1 1   17    4   46 o   83.753   23.542   5.7846   3.1436   2.9768   4.5412   8.3682   4.3561   72.626   28.317   99.766   27.596 -27.13956 39.53992 
1 1 1   17    4   47 o  253.576   10.567   49.705   4.1013   49.425   5.6256   50.023   5.9918  251.292   14.690  252.465   15.582 -1.173111 21.41441 
1 1 1   17    4   48 o   93.183   23.252   7.2524   3.3057   9.6463   4.6974   4.9037   4.6528  106.309   28.349   81.385   29.280 24.92405 40.75489 
1 1 1   17    4   49 o   77.247   25.037   4.7922   3.3819   1.5185   5.0235   7.5058   4.5736   68.889   28.707   94.337   28.927 -25.44738 40.75368 
1 1 1   17    4   50 f  355.720   9.2760   97.758   5.0506   94.787   6.4205  102.581   8.1801  349.165   12.013  361.791   14.772 -12.62674 19.04008 
1 1 1   17    4   51 o  260.477   10.812   52.653   4.3107   56.661   7.0653   50.277   5.4407  266.791   17.397  252.941   14.109 13.84967 22.39894 
1 1 1   17    4   52 o  116.749   20.860   11.304   3.5909   18.007   5.4892   6.2899   4.7477  145.620   25.560   87.113   29.703 58.50711 39.18638 
1 1 1   17    4   53 o  107.668   23.606   9.9040   3.7831   8.3855   5.7856   11.038   5.0001   97.557   32.792  111.378   29.033 -13.82073 43.79765 
1 1 1   17    4   54 o   89.395   27.907   6.9890   4.2353   17.069   8.1409   3.2481   4.9593  132.025   38.143   73.247   29.269 58.77803 48.07881 
1 1 1   17    4   55 o  167.989   15.947   22.729   4.0512   24.879   5.4471   20.067   6.0606  172.780   21.031  150.924   27.237 21.85619 34.41166 
1 1 1   17    4   56 o  109.181   21.228   10.198   3.4197   10.006   4.9297   10.375   4.7479  103.729   29.595  106.137   28.586 -2.408333 41.14685 
1 1 1   17    4   57 o  195.322   12.543   30.338   3.7301   28.682   4.9464   32.522   5.6795  186.613   17.522  197.591   19.014 -10.97821 25.85653 
1 1 1   17    4   58 o  133.549   20.646   15.324   4.0842   12.651   5.8199   17.917   5.7330  112.488   32.178  138.687   27.972 -26.19945 42.63655 
1 1 1   17    5    0 o  853.391   12.856  558.013   16.784  558.013   16.784  558.013   16.784  853.391   12.856  853.391   12.856 0.000000 0.000000 
1 1 1   17    5    1 o  296.167   5.7764   67.143   2.6186   71.867   5.2326   65.564   3.0245  306.326   11.160  292.655   6.7520 13.67120 13.04355 
1 1 1   17    5    2 o  836.054   7.2882  535.114   9.3266  592.083   18.156  514.692   10.871  879.094   13.493  819.891   8.6621 59.20239 16.03415 
1 1 1   17    5    3 o  1610.35   14.787  1987.25   36.447   0.0000   0.0000  1987.25   36.447  ?   ?   1610.35   14.787 0.000000 14.78680 
1 1 1   17    5    4 o  1051.86   10.616  847.323   17.091  892.689   25.705  811.373   22.882  1079.22   15.561  1028.99   14.528 50.23059 21.28885 
1 1 1   17    5    5 o  513.140   7.7216  201.590   6.0648  204.231   9.0437  199.432   8.1756  516.378   11.442  510.307   10.467 6.070770 15.50738 
1 1 1   17    5    6 o  223.028   9.3005   38.088   3.1749   36.188   5.3461   39.124   3.9462  216.667   16.238  225.718   11.460 -9.051117 19.87484 
1 1 1   17    5    7 o  459.192   8.0257  161.438   5.6409  154.632   8.3883  167.056   7.6215  449.290   12.198  467.042   10.661 -17.75116 16.20028 
1 1 1   17    5    8 o  538.236   8.3324  221.809   6.8645  250.913   10.723  201.596   8.9358  572.312   12.240  513.028   11.379 59.28442 16.71281 
1 1 1   17    5    9 o  634.218   8.9142  307.994   8.6534  324.606   12.688  293.547   11.832  650.920   12.735  619.010   12.488 31.91022 17.83636 
1 1 1   17    5   10 o  583.804   8.5918  260.969   7.6776  268.795   11.454  254.583   10.346  592.323   12.633  576.495   11.725 15.82825 17.23580 
1 1 1   17    5   11 o  1120.56   8.0889  961.399   13.874  976.318   19.932  947.379   19.323  1128.96   11.535  1112.11   11.351 16.84192 16.18359 
1 1 1   17    5   12 f  279.337   6.9879   59.737   2.9878   62.779   4.4189   57.176   4.0552  286.306   10.084  273.239   9.6961 13.06671 13.98904 
1 1 1   17    5   13 o  932.026   5.7597  664.969   8.2167  659.441   11.534  670.666   11.709  928.034   8.1197  935.896   8.1734 -7.862244 11.52106 
1 1 1   17    5   14 o  272.307   4.5659   56.758   1.9031   57.564   2.9697   56.197   2.4790  274.203   7.0758  270.942   5.9776 3.260956 9.262712 
1 1 1   17    5   15 o  634.170   4.8182  307.844   4.6770  305.754   7.8857  308.978   5.8089  631.908   8.1530  635.307   5.9737 -3.398254 10.10724 
1 1 1   17    5   16 o  982.337   6.0113  738.733   9.0385  743.682   15.531  736.198   11.114  985.344   10.298  980.576   7.4052 4.767578 12.68403 
1 1 1   17    5   17 o  416.657   5.1170  132.890   3.2633  128.332   6.4143  134.482   3.7906  409.314   10.238  419.129   5.9086 -9.814728 11.82078 
1 1 1   17    5   18 o  457.179   4.7342  159.992   3.3128  157.645   5.3496  161.452   4.2192  453.740   7.7027  459.233   6.0024 -5.492950 9.765282 
1 1 1   17    5   19 o  280.902   5.7135   60.406   2.4566   61.389   4.2839   59.924   2.9986  283.093   9.8864  279.759   7.0026 3.334625 12.11519 
1 1 1   17    5   20 o  367.308   5.2625  103.280   2.9586  105.333   5.0753  102.223   3.6413  370.848   8.9413  365.398   6.5106 5.449005 11.06050 
1 1 1   17    5   21 o  982.152   6.2694  738.533   9.4249  741.514   13.607  735.783   13.067  983.921   9.0348  980.140   8.7102 3.780945 12.54974 
1 1 1   17    5   22 o  478.536   5.6862  175.316   4.1649  174.709   6.2495  175.800   5.5864  477.603   8.5489  479.131   7.6174 -1.527679 11.45024 
1 1 1   17    5   23 o  634.021   5.7571  307.760   5.5869  308.388   8.1608  307.207   7.6647  634.529   8.4026  633.343   7.9065 1.186279 11.53764 
1 1 1   17    5   24 o  419.039   5.6533  134.438   3.6260  126.703   6.1613  138.536   4.4849  406.638   9.8991  425.337   6.8889 -18.69882 12.06022 
1 1 1   17    5   25 o  168.426   11.189   21.843   2.8682   13.363   5.1082   25.747   3.4662  129.179   26.717  182.802   12.462 -53.62334 29.48018 
1 1 1   17    5   26 o  647.868   5.0546  321.351   5.0124  322.294   7.4570  320.574   6.7700  648.666   7.5106  646.980   6.8364 1.685486 10.15600 
1 1 1   17    5   27 o  435.139   5.3926  144.980   3.5917  152.144   5.6429  140.100   4.6568  445.614   8.2732  427.677   7.1138 17.93732 10.91110 
1 1 1   17    5   28 o  381.318   5.9646  111.353   3.4813  110.103   5.6729  112.107   4.4092  378.961   9.7800  382.533   7.5304 -3.571625 12.34324 
1 1 1   17    5   29 o  745.871   5.5348  426.030   6.3188  427.522   9.9688  425.029   8.1696  746.826   8.7208  744.835   7.1659 1.991333 11.28723 
1 1 1   17    5   30 o  126.902   14.021   12.529   2.6779   12.908   4.7475   12.352   3.2430  126.777   25.351  125.447   17.354 1.329376 30.72235 
1 1 1   17    5   31 o  440.605   6.0541  148.709   4.0829  146.064   7.1138  150.008   4.9858  436.250   10.654  442.428   7.3625 -6.178680 12.95008 
1 1 1   17    5   32 o  429.121   5.5835  141.050   3.6674  146.748   5.6275  136.843   4.8351  437.466   8.4043  422.530   7.4761 14.93579 11.24833 
1 1 1   17    5   33 o  379.929   6.3444  110.605   3.6895  107.152   5.1730  114.180   5.2636  373.717   9.0434  385.792   8.9137 -12.07425 12.69790 
1 1 1   17    5   34 o  248.105   7.6891   47.202   2.9200   47.177   4.4354   47.220   3.8793  247.725   11.697  247.969   10.221 -0.2439728 15.53360 
1 1 1   17    5   35 o  143.722   12.897   16.028   2.8071   14.237   3.9042   17.945   4.0387  134.121   19.596  151.266   17.783 -17.14540 26.46226 
1 1 1   17    5   36 o   83.394   19.679   5.6163   2.4714   5.2939   3.7578   5.8620   3.2808   82.686   26.349   85.376   24.069 -2.690247 35.68723 
1 1 1   17    5   37 o  107.685   16.931   9.1926   2.6985   9.2865   3.8721   9.1041   3.7628  106.781   24.244  105.780   23.814 1.000664 33.98369 
1 1 1   17    5   38 o  185.084   10.660   26.442   3.0070   25.533   4.1776   27.419   4.3317  181.059   15.215  187.672   15.210 -6.613693 21.51437 
1 1 1   17    5   39 o  337.338   6.9584   87.307   3.5929   91.203   5.9929   85.121   4.4891  344.070   11.379  332.839   8.8116 11.23090 14.39219 
1 1 1   17    5   40 o  241.194   8.6747   44.709   3.2025   47.192   4.8430   42.780   4.2691  246.855   12.862  235.206   11.897 11.64870 17.52059 
1 1 1   17    5   41 o  295.885   8.2290   67.281   3.7268   76.107   5.2863   58.559   5.2549  314.185   10.993  275.302   12.471 38.88214 16.62382 
1 1 1   17    5   42 o  190.411   11.098   28.067   3.2204   30.949   5.1071   26.165   4.1493  198.522   16.970  182.966   14.947 15.55600 22.61410 
1 1 1   17    5   43 o  204.193   12.096   32.348   3.7636   35.430   8.2103   31.528   4.2347  208.752   26.278  201.158   13.838 7.593857 29.69879 
1 1 1   17    5   44 o  104.691   21.368   8.9645   3.3082   12.153   4.4582   5.0572   4.9351  121.245   24.858   83.736   30.152 37.50895 39.07745 
1 1 1   17    5   45 o  195.195   11.371   29.557   3.3826   31.606   5.1623   28.016   4.4778  200.248   17.003  188.887   15.628 11.36122 23.09441 
1 1 1   17    5   46 o  334.699   7.9491   86.196   4.0723   83.721   6.1047   88.180   5.4663  328.687   12.134  337.834   10.571 -9.146515 16.09306 
1 1 1   17    5   47 o  349.724   9.2986   94.341   4.9775   89.120   6.3367  102.753   8.0433  338.950   12.214  362.968   14.478 -24.01807 18.94145 
1 1 1   17    5   48 o  123.473   18.468   12.291   3.3831   14.482   5.0153   10.461   4.5827  131.422   25.853  110.916   27.201 20.50575 37.52681 
1 1 1   17    5   49 o   84.059   26.408   5.8190   3.7859   6.9030   4.8851   4.1889   5.9907   91.459   30.115   82.658   32.440 8.801239 44.26325 
1 1 1   17    5   50 o  119.877   21.066   11.829   3.7242   14.694   5.6107   9.5724   4.9794  130.491   28.857  105.083   29.661 25.40810 41.38264 
1 1 1   17    5   51 o  144.364   17.555   16.758   3.7993   21.957   5.6899   12.575   5.1038  162.673   23.536  120.396   28.192 42.27676 36.72491 
1 1 1   17    5   52 o   62.209   24.494   2.1496   3.4258   2.0508   4.9488   2.2404   4.7471   69.505   28.689   69.254   28.284 0.2513046 40.28702 
1 1 1   17    5   53 o   41.210   19.842  -5.0411   3.7010  -1.8502   6.0118  -6.9883   4.6964   63.314   28.707   45.036   21.846 18.27776 36.07353 
1 1 1   17    5   54 o   68.068   26.738   2.8757   4.0734   0.1284   7.5031   4.0238   4.8505   74.343   33.007   75.933   29.360 -1.590302 44.17540 
1 1 1   17    5   55 o  115.745   23.512   11.565   4.0233   8.9792   5.3417   14.955   6.1163   98.871   31.406  126.785   31.623 -27.91470 44.56853 
1 1 1   17    5   56 o   71.513   25.964   4.0749   3.6699   7.1915   5.6640   1.8196   4.8181   89.503   32.292   66.213   27.887 23.28963 42.66696 
1 1 1   17    5   57 o  150.757   16.359   18.625   3.7144   15.264   5.5335   21.381   5.0111  127.733   28.969  158.269   21.220 -30.53561 35.90934 
1 1 1   17    5   58 o   90.169   24.547   7.4139   3.4789   3.4650   4.5098   13.217   5.4670   69.899   27.918  116.488   30.355 -46.58887 41.24126 
1 1 1   17    6    1 o  734.959   8.1399  413.562   9.1570   0.0000   0.0000  413.562   9.1570  ?   ?   734.959   8.1399 0.000000 8.139931 
1 1 1   17    6    2 o  1124.12   8.9367  967.563   15.377  991.981   27.721  956.711   18.480  1137.62   15.920  1117.68   10.802 19.94202 19.23908 
1 1 1   17    6    3 o  1298.68   17.435  1293.15   34.658   0.0000   0.0000  1293.15   34.658  ?   ?   1298.68   17.435 0.000000 17.43531 
1 1 1   17    6    4 o  360.221   7.7835   99.344   4.2915   97.222   6.6073  100.892   5.6442  356.258   12.117  362.970   10.159 -6.711761 15.81230 
1 1 1   17    6    5 o  590.666   8.0826  267.116   7.3074  269.454   10.773  265.124   9.9450  593.104   11.867  588.355   11.043 4.749268 16.21041 
1 1 1   17    6    6 o  455.719   8.0008  159.005   5.5808  153.032   8.2498  164.044   7.5779  446.963   12.059  462.810   10.697 -15.84686 16.11974 
1 1 1   17    6    7 o  1003.32   8.5692  770.773   13.160  764.153   16.049  784.362   22.993  998.887   10.497  1011.65   14.849 -12.76257 18.18412 
1 1 1   17    6    8 f  660.082   7.1057  333.564   7.1791  353.059   9.2075  303.336   11.466  679.034   8.8589  629.274   11.904 49.76068 14.83852 
1 1 1   17    6    9 o  603.843   8.6438  279.194   7.9891  279.194   7.9891   0.0000   0.0000  603.843   8.6438  ?   ?  0.000000 8.643826 
1 1 1   17    6   10 o  138.630   13.092   14.856   2.7451   9.4731   3.3461   25.938   4.8010  109.298   20.760  183.096   17.338 -73.79727 27.04777 
1 1 1   17    6   11 o  819.627   6.8322  514.299   8.5712  502.453   11.938  526.901   12.314  810.002   9.6291  829.471   9.6987 -19.46881 13.66691 
1 1 1   17    6   12 o  868.868   7.0555  577.967   9.3832  611.019   13.975  550.836   12.662  893.189   10.222  848.090   9.7539 45.09955 14.12901 
1 1 1   17    6   13 o  529.226   5.2562  214.393   4.2578  226.667   5.5199  196.363   6.6902  544.131   6.6277  506.395   8.6314 37.73611 10.88244 
1 1 1   17    6   14 o  1247.07   7.8134  1190.76   14.914  1222.47   19.662  1147.79   22.887  1263.36   10.168  1223.94   12.217 39.41760 15.89446 
1 1 1   17    6   15 o  581.665   4.7305  258.978   4.2116  263.366   7.2318  256.727   5.1809  586.472   8.0562  579.104   5.8449 7.368408 9.953133 
1 1 1   17    6   16 o   76.537   13.687   4.6260   1.5446   9.2696   2.9340   2.8456   1.8167  108.423   18.333   60.618   18.156 47.80545 25.80150 
1 1 1   17    6   17 o  359.141   4.8164   98.732   2.6476   99.146   4.4279   98.501   3.3032  359.830   8.0395  358.702   6.0163 1.127869 10.04134 
1 1 1   17    6   18 o  206.746   6.9918   32.727   2.2126   31.023   5.2228   33.099   2.4426  200.339   17.199  207.910   7.6754 -7.570450 18.83375 
1 1 1   17    6   19 o  878.466   5.4410  590.758   7.3160  585.857   11.318  594.277   9.5886  874.642   8.4540  880.991   7.1107 -6.349182 11.04684 
1 1 1   17    6   20 o  440.581   5.4449  148.600   3.6718  148.291   5.5762  148.836   4.8789  440.039   8.2789  440.882   7.2299 -0.8428650 10.99143 
1 1 1   17    6   21 o  258.095   7.7308   51.012   3.0540   51.182   4.8147   50.897   3.9505  258.407   12.173  257.750   10.014 0.6567993 15.76233 
1 1 1   17    6   22 o  822.405   5.4526  517.791   6.8637  521.085   10.868  515.604   8.8527  824.815   8.6082  820.576   7.0484 4.238342 11.12567 
1 1 1   17    6   23 o  135.501   13.831   14.229   2.8283   9.4638   4.7184   16.902   3.5334  108.674   28.143  147.539   15.898 -38.86510 32.32265 
1 1 1   17    6   24 o  395.772   6.2181  119.935   3.7668  121.308   6.1272  119.101   4.7759  397.869   10.061  394.332   7.9127 3.537628 12.80006 
1 1 1   17    6   25 o  339.217   6.2539   88.112   3.2471   86.288   5.9282   88.894   3.8811  335.462   11.545  340.679   7.4428 -5.216766 13.73656 
1 1 1   17    6   26 o  527.692   5.4480  213.208   4.4003  223.943   7.7408  208.083   5.3485  540.568   9.3555  521.249   6.7038 19.31909 11.50942 
1 1 1   17    6   27 o  466.614   5.6553  166.724   4.0391  179.696   7.3700  161.155   4.8288  484.144   9.9455  458.694   6.8778 25.44995 12.09200 
1 1 1   17    6   28 o  386.917   6.7970  114.673   4.0254  114.633   10.073  114.681   4.3912  385.942   17.052  386.897   7.4152 -0.9551697 18.59479 
1 1 1   17    6   29 o  431.299   5.6876  142.461   3.7547  142.816   6.1096  142.246   4.7597  431.592   9.2485  430.883   7.2168 0.7088013 11.73106 
1 1 1   17    6   30 o  315.786   7.3600   76.415   3.5575   92.743   8.4209   72.868   3.9249  347.092   15.850  308.316   8.3169 38.77670 17.89995 
1 1 1   17    6   31 o  175.902   9.7082   23.809   2.6037   23.507   4.2002   23.998   3.3182  173.973   15.951  176.302   12.375 -2.328949 20.18802 
1 1 1   17    6   32 o  545.606   5.3037  228.005   4.4293  236.937   6.7480  221.244   5.8710  555.916   7.9304  537.282   7.1390 18.63452 10.67041 
1 1 1   17    6   33 o  111.740   16.016   9.8230   2.6610   7.2539   3.8207   12.243   3.7082   94.813   25.689  124.157   20.208 -29.34429 32.68435 
1 1 1   17    6   34 o  260.421   7.2618   51.995   2.8946   56.519   4.5431   48.904   3.7555  271.206   10.944  252.384   9.7217 18.82199 14.63857 
1 1 1   17    6   35 o  163.555   11.369   20.668   2.8285   19.823   3.9192   21.586   4.0862  159.357   16.297  166.366   16.255 -7.008698 23.01747 
1 1 1   17    6   36 o   91.148   19.444   6.6934   2.6300   8.9698   3.7763   4.5491   3.6651  105.032   24.013   78.063   26.100 26.96871 35.46588 
1 1 1   17    6   37 o   65.640   22.131   3.1611   2.6353   4.8384   3.6165   1.2623   3.8481   79.512   25.898   62.485   25.487 17.02722 36.33554 
1 1 1   17    6   38 o  450.726   5.8146  155.728   4.0115  152.717   6.0475  158.094   5.3606  445.872   8.8613  453.858   7.7165 -7.986145 11.75021 
1 1 1   17    6   39 o  436.451   6.9055  146.149   4.6131  144.162   6.7119  147.928   6.3510  432.852   10.131  438.619   9.4598 -5.767334 13.86069 
1 1 1   17    6   40 o  376.321   7.0141  108.687   4.0402  105.286   5.5600  112.491   5.8809  369.889   9.8205  382.285   10.050 -12.39661 14.05184 
1 1 1   17    6   41 o   42.342   19.052  -1.1972   2.5898   0.4419   3.8610  -2.5380   3.4919   58.922   24.898   46.227   21.302 12.69519 32.76728 
1 1 1   17    6   42 o   97.223   23.553   7.7900   3.4679   0.1751   11.421   8.5634   3.6398   94.854   41.466  101.924   23.768 -7.069954 47.79452 
1 1 1   17    6   43 o   77.835   22.372   4.9202   2.8071   5.5339   4.2834   4.4582   3.7164   84.374   28.216   76.926   26.280 7.448692 38.55856 
1 1 1   17    6   44 o  152.041   14.756   18.145   3.3908   17.369   4.7760   18.933   4.8148  146.541   21.970  153.435   21.057 -6.894073 30.43128 
1 1 1   17    6   45 o  173.576   12.003   23.433   3.1693   21.787   4.7855   24.720   4.2299  165.242   19.283  177.297   15.751 -12.05518 24.89851 
1 1 1   17    6   46 o  111.646   18.842   10.075   3.1052   11.762   4.7029   8.7717   4.1346  118.297   26.617  102.155   26.289 16.14198 37.41091 
1 1 1   17    6   47 o  387.533   7.9246  115.603   4.7006  118.542   6.4531  112.280   6.8609  391.475   10.770  380.599   11.777 10.87564 15.95894 
1 1 1   17    6   48 o  265.977   9.6772   54.640   3.9397   51.917   6.1878   56.497   5.1091  256.863   15.815  269.677   12.377 -12.81342 20.08298 
1 1 1   17    6   49 o  244.926   11.898   46.592   4.4603   46.645   6.0075   46.526   6.6584  243.040   16.243  241.825   18.120 1.215256 24.33444 
1 1 1   17    6   50 o  139.081   17.083   15.496   3.5602   15.055   5.2970   15.860   4.8082  132.931   26.956  138.084   23.597 -5.153076 35.82482 
1 1 1   17    6   51 o   79.980   25.265   5.2945   3.4608   7.3431   5.1366   3.5914   4.6834   93.156   30.890   74.706   28.860 18.45003 42.27368 
1 1 1   17    6   52 o  108.909   21.148   9.9036   3.3983   7.0741   4.8770   12.574   4.7378   91.048   30.095  120.643   26.391 -29.59473 40.02740 
1 1 1   17    6   53 o  148.535   17.262   17.846   3.8514   25.536   6.3850   13.447   4.8289  173.573   24.733  124.412   26.186 49.16070 36.01974 
1 1 1   17    6   54 o   62.164   25.687   1.6022   3.9735   4.7493   7.3241   0.2896   4.7301   85.851   35.106   61.687   26.832 24.16427 44.18533 
1 1 1   17    6   55 o   65.545   26.991   2.0571   4.3675   1.0323   6.9290   2.7326   5.6258   73.455   32.200   73.271   30.444 0.1839447 44.31275 
1 1 1   17    6   56 o   54.472   23.147   0.7488   3.3678   6.3258   4.6500  -5.4040   4.8841   84.501   29.371   48.244   23.115 36.25717 37.37582 
1 1 1   17    6   57 o   53.602   22.867   0.7098   3.3101   3.8286   4.5231  -2.8868   4.8572   71.986   28.207   52.714   24.576 19.27185 37.41098 
1 1 1   17    6   58 o   49.576   22.277  -0.7339   3.5271  -0.7395   4.4713  -0.7247   5.7388   55.381   24.965   61.824   28.037 -6.442444 37.54129 
1 1 1   17    7    0 f  952.498   9.6386  694.748   14.049  694.748   14.049  694.748   14.049  952.498   9.6386  952.498   9.6386 0.000000 0.000000 
1 1 1   17    7    1 o  863.880   6.3705  571.291   8.4236  560.751   11.724  582.539   12.111  855.769   8.9504  872.230   9.0717 -16.46082 12.74380 
1 1 1   17    7    2 o  491.873   6.9565  185.216   5.2373  185.216   5.2373   0.0000   0.0000  491.873   6.9565  ?   ?  0.000000 6.956462 
1 1 1   17    7    3 o  1178.89   16.216  1065.39   29.261   0.0000   0.0000  1065.39   29.261  ?   ?   1178.89   16.216 0.000000 16.21629 
1 1 1   17    7    4 o  436.431   7.7135  145.826   5.1527  140.986   7.5626  150.021   7.0396  429.027   11.516  442.595   10.391 -13.56839 15.51156 
1 1 1   17    7    5 o  836.234   9.2929  535.472   11.895  544.931   17.281  526.955   16.397  843.336   13.387  829.343   12.917 13.99365 18.60288 
1 1 1   17    7    6 f  479.036   8.0728  175.695   5.9192  178.444   8.8332  173.456   7.9746  482.646   11.957  475.888   10.948 6.757782 16.21189 
1 1 1   17    7    7 o   84.737   18.047   5.7173   2.2690   7.3198   2.8752   3.0719   3.6941   95.871   20.230   70.891   26.002 24.97970 32.94419 
1 1 1   17    7    8 o  1011.77   10.682  784.036   16.543  784.036   16.543   0.0000   0.0000  1011.77   10.682  ?   ?  0.000000 10.68223 
1 1 1   17    7    9 o  584.600   8.6723  261.687   7.7600  261.687   7.7600   0.0000   0.0000  584.600   8.6723  ?   ?  0.000000 8.672310 
1 1 1   17    7   10 o  645.052   7.2873  318.560   7.1950  319.343   8.8936  317.076   12.241  645.781   8.9975  643.317   12.431 2.463196 15.34580 
1 1 1   17    7   11 o  585.568   7.2410  262.517   6.4900  256.436   7.9139  275.007   11.341  578.688   8.9346  599.117   12.367 -20.42871 15.25719 
1 1 1   17    7   12 o  546.898   7.3419  228.996   6.1459  232.479   7.6548  222.678   10.309  550.984   9.0767  539.097   12.494 11.88629 15.44287 
1 1 1   17    7   13 o  799.906   5.9956  489.821   7.3408  480.235   9.1981  506.638   12.183  791.974   7.5879  813.336   9.7860 -21.36163 12.38307 
1 1 1   17    7   14 o  978.745   6.6893  733.386   10.021  736.619   12.860  728.386   15.991  980.790   8.5663  975.134   10.713 5.656067 13.71708 
1 1 1   17    7   15 o  792.526   6.7049  480.869   8.1335  504.095   11.607  458.461   11.401  811.299   9.3469  773.690   9.6271 37.60962 13.41813 
1 1 1   17    7   16 o  485.767   5.6877  180.641   4.2290  170.008   5.2912  199.444   7.0366  471.212   7.3362  510.318   9.0085 -39.10657 11.61777 
1 1 1   17    7   17 o  217.790   7.4190   36.318   2.4732   35.885   3.6825   36.675   3.3380  216.130   11.170  218.813   9.9664 -2.682709 14.96981 
1 1 1   17    7   18 o  727.392   6.0093  405.062   6.6905  425.217   11.571  394.940   8.2002  745.040   10.147  718.182   7.4597 26.85852 12.59392 
1 1 1   17    7   19 o  756.232   5.5797  437.804   6.4586  457.977   9.7310  421.921   8.6346  773.322   8.2210  742.292   7.5997 31.03033 11.19559 
1 1 1   17    7   20 o  997.078   5.8595  761.114   8.9426  785.700   14.277  745.243   11.471  1012.79   9.2100  986.511   7.5971 26.28418 11.93901 
1 1 1   17    7   21 o  305.918   7.4524   71.665   3.4896   67.544   6.1907   73.585   4.2247  296.783   13.628  309.948   8.9051 -13.16562 16.27942 
1 1 1   17    7   22 o  607.899   5.1214  282.900   4.7653  281.554   7.7725  283.711   6.0319  606.298   8.3754  608.715   6.4740 -2.416992 10.58578 
1 1 1   17    7   23 o   65.231   24.006   2.5914   3.1525   2.7058   4.6109   2.4910   4.3199   73.929   28.614   71.387   27.678 2.542488 39.81010 
1 1 1   17    7   24 o  449.747   6.8874  154.901   4.7412  157.152   6.5201  152.375   6.9069  452.877   9.4059  445.898   10.120 6.978241 13.81610 
1 1 1   17    7   25 o  181.689   9.2032   25.361   2.5511   27.958   5.1739   24.526   2.9323  189.830   18.023  178.538   10.781 11.29153 21.00108 
1 1 1   17    7   26 o  221.242   8.0554   37.501   2.7279   35.990   5.4377   38.009   3.1534  215.738   16.594  222.698   9.2511 -6.960129 18.99887 
1 1 1   17    7   27 f  682.427   6.1942  356.661   6.4701  370.722   15.361  353.628   7.1339  694.674   14.446  679.465   6.8594 15.20850 15.99220 
1 1 1   17    7   28 o  259.898   7.7595   51.757   3.0868   56.050   6.8964   50.682   3.4519  269.345   16.812  257.140   8.7703 12.20468 18.96220 
1 1 1   17    7   29 o  535.719   5.6102  219.794   4.6003  214.579   7.7965  222.579   5.6979  528.967   9.6295  539.005   6.9064 -10.03821 11.85014 
1 1 1   17    7   30 f  390.705   6.7028  116.953   4.0084  116.095   8.8500  117.175   4.4960  388.435   14.885  391.021   7.5121 -2.585205 16.67329 
1 1 1   17    7   31 o  487.755   5.8369  182.238   4.3577  175.961   7.5969  185.316   5.3199  478.811   10.366  491.752   7.0679 -12.94125 12.54613 
1 1 1   17    7   32 o   47.954   20.434  -0.0036   2.6376  -5.9463   5.5377   1.7401   2.9997   54.459   25.659   59.364   23.051 -4.905632 34.49273 
1 1 1   17    7   33 o   90.797   18.947   6.6145   2.5481   9.3304   3.8031   4.4022   3.4325  107.416   23.761   76.650   25.243 30.76534 34.66749 
1 1 1   17    7   34 o   99.103   16.863   7.7962   2.4663   13.743   3.9105   3.8685   3.1781  131.657   20.037   72.461   24.304 59.19622 31.49894 
1 1 1   17    7   35 o   68.963   22.934   3.5310   2.8306   3.9305   3.6272   2.9089   4.5265   74.480   25.937   73.611   28.390 0.8690186 38.45464 
1 1 1   17    7   36 o  133.728   13.623   13.930   2.7495   14.545   3.8170   13.268   3.9639  135.617   18.902  128.982   20.785 6.634308 28.09423 
1 1 1   17    7   37 o  614.536   5.8982  289.477   5.5480  290.140   7.7023  288.761   7.9981  614.796   8.1851  613.255   8.5207 1.540405 11.81516 
1 1 1   17    7   38 o  144.828   13.616   16.338   2.9829   20.129   4.1651   12.346   4.2740  160.119   17.268  123.446   23.478 36.67309 29.14404 
1 1 1   17    7   39 o   66.322   23.049   3.1414   2.8638   1.3839   3.9363   5.1177   4.1741   63.352   25.802   82.410   27.852 -19.05716 37.96656 
1 1 1   17    7   40 o  149.447   12.015   17.346   2.7251   15.286   4.1040   18.971   3.6446  138.399   19.950  155.610   15.508 -17.21184 25.26834 
1 1 1   17    7   41 o  187.570   10.238   27.185   2.9281   33.636   4.5820   22.732   3.8069  207.767   14.499  170.559   14.727 37.20786 20.66644 
1 1 1   17    7   42 o  178.007   13.677   24.698   3.6979   13.016   11.336   26.090   3.9118  126.624   45.684  182.880   14.083 -56.25663 47.80573 
1 1 1   17    7   43 o  178.847   11.002   24.784   2.9973   26.259   4.5360   23.641   3.9932  182.780   16.387  173.691   15.173 9.089539 22.33283 
1 1 1   17    7   44 o  160.641   13.162   20.142   3.2079   16.673   4.3811   24.151   4.7099  143.999   20.452  174.657   17.870 -30.65857 27.15886 
1 1 1   17    7   45 o  111.709   17.923   10.026   2.9609   11.126   4.3433   9.0716   4.0471  115.553   25.261  104.141   25.576 11.41192 35.94789 
1 1 1   17    7   46 o  186.107   11.761   26.931   3.3329   28.439   5.0431   25.761   4.4410  189.473   17.590  180.722   16.227 8.751587 23.93191 
1 1 1   17    7   47 o  148.902   16.285   17.579   3.6510   17.668   5.0299   17.480   5.3078  146.788   23.155  145.330   24.748 1.457458 33.89104 
1 1 1   17    7   48 o  221.681   11.019   38.065   3.7390   39.705   5.2908   36.428   5.2848  224.608   15.484  214.820   16.192 9.788437 22.40358 
1 1 1   17    7   49 o   73.289   25.536   4.0743   3.5160   8.0774   4.7560  -0.7503   5.2213   97.363   29.424   62.802   27.725 34.56078 40.42862 
1 1 1   17    7   50 o  165.217   14.474   21.546   3.6234   35.159   5.6613   12.100   4.7158  209.870   17.791  118.966   26.569 90.90456 31.97547 
1 1 1   17    7   51 o  260.114   9.8977   52.419   3.9407   49.033   5.8356   55.257   5.3428  249.004   15.387  265.835   13.131 -16.83073 20.22780 
1 1 1   17    7   52 o  102.177   24.585   8.9667   3.7983   13.205   6.5250   6.7945   4.6713  119.892   33.994   89.322   29.450 30.56982 44.97649 
1 1 1   17    7   53 o  108.359   25.187   10.191   4.0981   0.1517   8.5420   13.192   4.6707   78.750   35.076  123.455   25.559 -44.70473 43.40066 
1 1 1   17    7   54 o  124.167   22.737   13.112   4.1619   15.321   7.3746   12.079   5.0416  125.840   36.288  115.955   28.587 9.885628 46.19591 
1 1 1   17    7   55 o  139.968   18.618   16.178   3.8897   7.8536   5.2291   26.490   5.8199   93.016   31.175  177.322   21.909 -84.30661 38.10373 
1 1 1   17    7   56 o  176.822   14.030   25.062   3.7661   28.685   5.4612   21.777   5.2004  185.467   19.531  159.781   21.836 25.68610 29.29600 
1 1 1   17    7   57 o  102.753   21.435   9.2045   3.2622   13.574   4.5367   4.5259   4.6942  122.934   24.962   75.274   28.944 47.65980 38.22147 
1 1 1   17    7   58 o  130.409   18.228   14.320   3.5391   14.930   4.5000   13.330   5.7299  129.471   23.576  115.707   31.505 13.76355 39.34943 
1 1 1   17    8    0 o  502.103   6.9934  193.084   5.3723  193.084   5.3723  193.084   5.3723  502.103   6.9934  502.103   6.9934 0.000000 0.000000 
1 1 1   17    8    1 o  661.502   5.4848  334.955   5.5534  338.485   7.9435  331.579   7.7669  664.913   7.8051  658.098   7.7106 6.814758 10.97148 
1 1 1   17    8    2 o  1280.69   8.5628  1255.83   16.785  1259.00   23.802  1252.70   23.674  1281.99   12.130  1278.79   12.095 3.209717 17.12975 
1 1 1   17    8    3 o  565.113   7.2674  244.489   6.2861  233.407   8.2159  260.136   9.7627  552.082   9.7226  582.789   10.944 -30.70654 14.63929 
1 1 1   17    8    4 o  196.221   6.2398   29.474   1.8741   28.515   2.1024   33.185   4.1351  192.994   7.1170  207.708   13.073 -14.71375 14.88509 
1 1 1   17    8    5 o  718.283   8.6846  395.047   9.5481  391.804   13.494  398.298   13.512  715.147   12.328  721.055   12.243 -5.907349 17.37403 
1 1 1   17    8    6 o  795.784   9.2297  484.931   11.242  475.097   15.715  495.238   16.089  787.450   13.039  803.965   13.074 -16.51544 18.46473 
1 1 1   17    8    7 o  645.425   7.0988  318.920   7.0129  313.027   8.5535  331.006   12.249  639.378   8.7401  657.321   12.175 -17.94354 14.98717 
1 1 1   17    8    8 o  787.311   9.4410  474.682   11.377  474.682   11.377   0.0000   0.0000  787.311   9.4410  ?   ?  0.000000 9.441010 
1 1 1   17    8    9 o  866.852   8.0961  575.350   10.742  580.226   13.300  566.201   18.218  870.412   9.9831  859.547   13.847 10.86536 17.07065 
1 1 1   17    8   10 o  418.557   7.3625  134.128   4.7168  134.434   5.8327  133.550   8.0185  418.990   9.0948  417.498   12.548 1.492554 15.49725 
1 1 1   17    8   11 o  671.907   7.5049  345.653   7.7183  338.965   9.3661  359.805   13.625  665.305   9.1975  685.236   12.990 -19.93158 15.91660 
1 1 1   17    8   12 o  597.497   7.4644  273.335   6.8266  273.546   8.4371  272.936   11.617  597.660   9.2229  596.818   12.717 0.8417969 15.70906 
1 1 1   17    8   13 o  778.095   6.6867  463.509   7.9636  470.294   9.2194  443.568   15.805  783.725   7.6855  760.756   13.573 22.96954 15.59826 
1 1 1   17    8   14 o  882.066   6.4234  595.646   8.6724  609.835   11.247  574.841   13.620  892.414   8.2340  866.298   10.271 26.11584 13.16433 
1 1 1   17    8   15 o  681.206   6.3934  355.260   6.6662  357.773   9.1319  352.392   9.7538  683.509   8.7286  678.315   9.3945 5.194336 12.82362 
1 1 1   17    8   16 o  306.722   6.7034   72.028   3.1471   69.222   4.0150   76.498   5.0680  300.648   8.7248  316.007   10.478 -15.35944 13.63478 
1 1 1   17    8   17 o   99.570   17.305   7.8272   2.5417   8.9845   3.3863   6.3341   3.8465  106.223   21.564   89.904   26.289 16.31833 34.00231 
1 1 1   17    8   18 o  662.222   6.1588  335.741   6.2427  337.187   10.258  334.890   7.8674  663.445   10.101  661.312   7.7724 2.132446 12.74542 
1 1 1   17    8   19 f  730.326   5.7049  408.333   6.3773  407.158   9.0027  409.516   9.0352  729.157   8.0664  731.264   8.0722 -2.107666 11.41173 
1 1 1   17    8   20 o  865.455   6.0800  573.452   8.0541  576.735   11.450  570.238   11.331  867.757   8.6208  862.859   8.5795 4.898499 12.16246 
1 1 1   17    8   21 o  907.255   6.0598  630.199   8.4150  629.024   12.274  631.240   11.559  906.198   8.8491  907.840   8.3187 -1.641602 12.14521 
1 1 1   17    8   22 o  264.844   7.0075   53.713   2.8407   55.584   4.9667   52.803   3.4630  269.263   12.051  262.552   8.6173 6.710907 14.81505 
1 1 1   17    8   23 o  547.029   6.5643  229.142   5.4963  236.637   7.4315  220.092   8.1662  555.783   8.7358  535.922   9.9551 19.86121 13.24457 
1 1 1   17    8   24 o  377.088   5.7483  108.875   3.3178  115.032   5.9505  106.098   3.9968  387.414   10.035  372.204   7.0155 15.21030 12.24390 
1 1 1   17    8   25 o  522.699   5.6207  209.199   4.4968  229.515   9.0627  202.563   5.1794  547.125   10.822  514.295   6.5796 32.83002 12.66503 
1 1 1   17    8   26 o  412.895   5.9744  130.554   3.7757  135.275   7.9389  129.174   4.2923  419.869   12.353  410.668   6.8285 9.200439 14.11477 
1 1 1   17    8   27 o  449.492   5.8758  154.729   4.0426  162.316   8.2885  152.361   4.6307  459.923   11.774  445.991   6.7834 13.93250 13.58827 
1 1 1   17    8   28 o  549.486   5.5095  231.223   4.6338  229.110   8.0012  232.288   5.6841  546.619   9.5631  550.663   6.7438 -4.044312 11.70180 
1 1 1   17    8   29 o  209.162   8.7534   33.541   2.8024   30.286   5.6245   34.616   3.2322  197.243   18.860  212.433   9.9403 -15.19006 21.31923 
1 1 1   17    8   30 o  421.947   6.4774  136.401   4.1834  139.722   9.3995  135.581   4.6716  426.157   14.410  420.620   7.2561 5.537628 16.13382 
1 1 1   17    8   31 o  210.666   9.0265   34.042   2.9106   22.654   5.6962   38.066   3.3860  169.435   22.522  222.715   9.9327 -53.28043 24.61512 
1 1 1   17    8   32 o  303.702   7.1546   70.699   3.3259   75.235   6.4342   69.045   3.8852  312.678   13.444  300.035   8.4599 12.64297 15.88429 
1 1 1   17    8   33 o  239.505   8.9142   44.016   3.2679   39.599   6.0346   45.848   3.8871  225.652   17.611  244.326   10.394 -18.67334 20.45000 
1 1 1   17    8   34 o  250.482   8.7696   48.149   3.3622   50.419   6.1471   47.180   4.0162  255.049   15.824  247.793   10.589 7.255920 19.04035 
1 1 1   17    8   35 o  296.391   7.5192   67.380   3.4112   81.797   6.6161   62.159   3.9812  325.807   13.267  284.528   9.1414 41.27881 16.11146 
1 1 1   17    8   36 o  367.029   7.4065  103.337   4.1609  103.953   5.2785  102.326   6.7620  367.863   9.3746  364.518   12.119 3.345490 15.32205 
1 1 1   17    8   37 o  314.886   7.3746   76.075   3.5543   82.591   5.0638   69.746   4.9902  327.736   10.094  301.067   10.829 26.66876 14.80419 
1 1 1   17    8   38 o  185.926   9.5684   26.648   2.7138   23.461   4.2018   28.929   3.5546  173.251   16.026  193.341   12.072 -20.09067 20.06434 
1 1 1   17    8   39 o   71.614   21.657   4.0639   2.5759   8.0956   4.1713   1.5789   3.2749   99.208   26.826   59.949   23.839 39.25906 35.88754 
1 1 1   17    8   40 o  280.864   7.6045   60.583   3.2692   61.198   5.1099   60.157   4.2536  281.584   11.856  279.530   9.9417 2.053772 15.47256 
1 1 1   17    8   41 o  134.111   13.756   14.075   2.7837   12.568   4.5306   14.989   3.5282  123.690   24.794  137.640   17.117 -13.95032 30.12854 
1 1 1   17    8   42 o  247.671   9.9975   47.270   3.7900   49.267   9.6395   46.905   4.1219  246.891   25.894  246.548   10.923 0.3429871 28.10325 
1 1 1   17    8   43 o   77.076   22.035   4.8305   2.7299   2.5088   4.1638   6.5808   3.6154   69.027   27.059   89.365   25.292 -20.33858 37.03861 
1 1 1   17    8   44 o  240.971   9.4709   44.752   3.4932   50.505   5.0286   39.387   4.8562  254.908   12.931  224.663   14.195 30.24529 19.20144 
1 1 1   17    8   45 o  303.677   8.0400   70.959   3.7371   65.024   5.6674   75.525   4.9710  289.511   12.789  312.735   10.385 -23.22409 16.47458 
1 1 1   17    8   46 o  108.770   19.725   9.6273   3.1630   9.3296   4.7503   9.8645   4.2395  104.840   28.744  108.318   25.918 -3.478394 38.70322 
1 1 1   17    8   47 o  128.385   18.848   13.286   3.5936   15.425   4.5835   9.8732   5.7893  137.121   22.628  107.198   32.479 29.92253 39.58369 
1 1 1   17    8   48 o   40.296   19.313  -4.5425   3.4155  -5.7077   4.3046  -2.5622   5.6118   45.030   21.608   60.604   27.577 -15.57471 35.03429 
1 1 1   17    8   49 o   72.500   24.300   4.1178   3.1769  -0.3106   4.5999   8.1567   4.3930   60.280   26.334   97.718   27.958 -37.43838 38.40736 
1 1 1   17    8   50 o  252.476   12.145   49.631   4.6936   66.081   10.673   45.687   5.2261  282.849   24.906  241.085   14.225 41.76433 28.68205 
1 1 1   17    8   51 o  266.034   10.834   54.985   4.4117   48.608   7.9353   57.838   5.3076  244.098   21.457  272.070   12.745 -27.97224 24.95665 
1 1 1   17    8   52 o  190.265   12.170   28.397   3.5257   26.737   5.1722   29.839   4.8187  181.521   18.892  193.141   16.457 -11.62053 25.05493 
1 1 1   17    8   53 o  102.322   26.886   9.2318   4.2658   10.268   11.044   9.0501   4.6247  108.463   43.558  100.759   28.636 7.703896 52.12800 
1 1 1   17    8   54 o   52.216   22.454   0.2680   3.2375   2.2884   4.5441  -1.8146   4.6136   67.527   27.637   54.865   24.980 12.66193 37.25344 
1 1 1   17    8   55 o  210.275   12.858   35.031   4.1184   41.717   5.7928   28.198   5.8563  226.876   16.801  183.238   21.277 43.63779 27.11011 
1 1 1   17    8   56 o  106.410   21.582   9.8009   3.3949   10.945   4.7839   8.6402   4.8185  108.392   28.468   95.896   29.738 12.49615 41.16812 
1 1 1   17    8   57 o  100.915   22.045   8.9614   3.3099   12.177   4.6865   5.7609   4.6753  114.555   27.144   80.645   29.301 33.91029 39.94172 
1 1 1   17    9    0 o  592.234   7.5037  268.607   6.7995  268.607   6.7995  268.607   6.7995  592.234   7.5037  592.234   7.5037 0.000000 0.000000 
1 1 1   17    9    1 o  321.945   4.8997   79.336   2.4145   77.101   3.4114   81.580   3.4178  317.350   7.0229  326.440   6.8404 -9.089783 9.803674 
1 1 1   17    9    2 o  241.286   5.8676   44.566   2.1670   50.597   3.9320   41.935   2.5970  257.037   9.9942  234.042   7.2497 22.99530 12.34669 
1 1 1   17    9    3 o  1052.68   10.493  848.696   16.907  840.361   23.303  857.960   24.567  1047.14   14.539  1057.98   15.170 -10.84143 21.01252 
1 1 1   17    9    4 o  624.511   6.4639  298.568   6.1788  291.120   7.2760  317.829   11.701  616.635   7.7089  644.123   11.868 -27.48810 14.15195 
1 1 1   17    9    5 o  197.563   11.554   30.001   3.4787   27.435   4.8202   32.790   5.0254  188.397   16.895  206.187   16.050 -17.78964 23.30356 
1 1 1   17    9    6 o  436.900   6.0768  146.122   4.0637  144.642   4.7149  150.397   8.0140  434.661   7.0868  443.086   11.817 -8.424744 13.77876 
1 1 1   17    9    7 o  941.690   8.3780  679.003   12.076  679.741   14.812  677.540   20.854  942.083   10.272  940.209   14.491 1.874268 17.76244 
1 1 1   17    9    8 o  834.658   9.7323  533.524   12.433  533.524   12.433   0.0000   0.0000  834.658   9.7323  ?   ?  0.000000 9.732250 
1 1 1   17    9    9 o  882.211   8.2026  595.936   11.076  590.498   13.462  607.330   19.487  878.069   10.017  890.154   14.302 -12.08521 17.46109 
1 1 1   17    9   10 o  1227.36   8.6313  1153.53   16.215  1173.66   19.032  1100.21   30.972  1237.90   10.044  1197.71   16.894 40.19165 19.65470 
1 1 1   17    9   11 o  714.162   7.7002  390.509   8.4172  403.177   10.514  367.899   14.047  725.567   9.4671  692.869   13.245 32.69867 16.28079 
1 1 1   17    9   12 o  796.906   6.6763  486.191   8.1435  494.153   9.3984  462.203   16.313  803.360   7.6432  776.555   13.724 26.80511 15.70906 
1 1 1   17    9   13 o  401.278   6.2551  123.273   3.8419  123.632   4.2809  121.786   8.7091  401.847   6.9600  398.582   14.275 3.265015 15.88166 
1 1 1   17    9   14 o  785.247   6.8024  472.087   8.1759  481.409   9.4492  444.321   16.308  792.914   7.7857  761.324   13.995 31.59009 16.01473 
1 1 1   17    9   15 o  676.451   7.3622  350.364   7.6228  366.453   9.2755  316.888   13.379  691.741   8.7604  642.958   13.595 48.78345 16.17304 
1 1 1   17    9   16 o  1221.58   7.1656  1142.59   13.398  1162.63   19.181  1123.49   18.723  1231.96   10.172  1211.05   10.101 20.90967 14.33488 
1 1 1   17    9   17 o  203.206   9.3631   31.628   2.9122   34.790   5.2904   30.253   3.4883  212.309   16.407  198.363   11.539 13.94557 20.05838 
1 1 1   17    9   18 o  343.391   6.1353   90.277   3.2247   86.626   4.5948   93.822   4.5269  336.304   8.9261  350.009   8.4499 -13.70441 12.29131 
1 1 1   17    9   19 o  844.062   5.9515  545.442   7.6891  553.453   10.977  537.725   10.773  850.080   8.4367  837.917   8.4000 12.16296 11.90538 
1 1 1   17    9   20 o  601.417   6.0530  276.928   5.5721  282.843   7.4048  269.206   8.4606  607.717   7.9605  592.808   9.3243 14.90881 12.26021 
1 1 1   17    9   21 o  424.648   6.1184  138.067   3.9768  146.589   5.8174  130.591   5.4488  437.460   8.6880  412.901   8.6216 24.55875 12.23979 
1 1 1   17    9   22 o  288.506   8.2408   63.757   3.6391   67.158   4.9372   59.710   5.3849  296.007   10.897  279.038   12.608 16.96875 16.66447 
1 1 1   17    9   23 o  341.402   6.7401   89.258   3.5221   94.953   5.4221   85.100   4.6326  351.990   10.064  333.270   9.0815 18.71988 13.55568 
1 1 1   17    9   24 o  282.014   6.8153   60.910   2.9419   57.919   6.2314   61.767   3.3372  274.236   14.901  283.966   7.6780 -9.729950 16.76320 
1 1 1   17    9   25 o  235.067   7.3417   42.327   2.6416   40.532   5.2365   42.939   3.0593  229.215   15.008  236.728   8.4432 -7.513351 17.22027 
1 1 1   17    9   26 o  429.015   5.5556  140.939   3.6481  133.515   6.3761  144.552   4.4482  417.299   9.9825  434.424   6.6896 -17.12509 12.01667 
1 1 1   17    9   27 o   92.059   17.320   6.7363   2.3510   9.2446   5.5069   6.1772   2.5998  107.770   31.440   87.776   19.820 19.99404 37.16546 
1 1 1   17    9   28 o   62.315   20.881   2.8191   2.3460   2.4442   4.8713   2.9323   2.6769   73.961   29.181   64.633   22.295 9.327438 36.72270 
1 1 1   17    9   29 o  232.012   7.9188   41.259   2.8122   37.837   5.4388   42.508   3.2854  221.068   16.186  235.439   9.1169 -14.37071 18.57687 
1 1 1   17    9   30 o  335.209   6.9363   86.105   3.5589   85.324   8.4284   86.274   3.9261  332.689   16.551  335.493   7.6455 -2.803497 18.23189 
1 1 1   17    9   31 o  310.515   6.8571   73.892   3.2590   71.419   6.1185   74.872   3.8508  304.721   13.118  312.486   8.0510 -7.764587 15.39176 
1 1 1   17    9   32 o  225.698   8.9177   39.083   3.0807   37.473   5.6869   39.751   3.6651  219.630   17.050  227.509   10.525 -7.879242 20.03720 
1 1 1   17    9   33 o  173.322   11.427   23.192   3.0144   21.864   5.6495   23.721   3.5641  166.080   22.828  175.013   13.407 -8.932159 26.47348 
1 1 1   17    9   34 o  219.152   8.7179   36.860   2.9243   30.993   5.8848   38.784   3.3699  198.903   19.583  224.715   9.7974 -25.81255 21.89748 
1 1 1   17    9   35 o  272.421   8.9879   56.982   3.7477   67.300   6.3914   51.576   4.6266  295.350   14.138  258.884   11.676 36.46564 18.33591 
1 1 1   17    9   36 o  308.220   9.5877   72.999   4.5232   79.085   6.5351   67.402   6.2669  320.210   13.334  295.521   13.855 24.68890 19.22850 
1 1 1   17    9   37 o  378.564   6.7021  109.914   3.8834  101.444   7.2303  113.348   4.6039  362.603   13.027  384.282   7.8272 -21.67923 15.19785 
1 1 1   17    9   38 o  318.507   7.4896   77.867   3.6513   93.439   7.2126   72.501   4.2339  347.747   13.551  307.137   9.0061 40.61023 16.27049 
1 1 1   17    9   39 o  139.256   14.949   15.196   3.1366   10.415   7.2607   16.293   3.4778  113.043   36.689  144.001   16.052 -30.95842 40.04681 
1 1 1   17    9   40 o   73.986   21.697   4.3956   2.6167   9.5450   4.3097   1.3889   3.2931  107.321   26.414   59.049   23.760 48.27174 35.52818 
1 1 1   17    9   41 o  452.433   6.6818  157.123   4.6272  159.243   8.5647  156.249   5.4987  453.856   12.329  450.891   7.9675 2.965515 14.67929 
1 1 1   17    9   42 o  416.721   6.6633  133.318   4.2501  144.479   7.3627  127.740   5.2049  432.613   11.119  407.550   8.3437 25.06302 13.90155 
1 1 1   17    9   43 o  223.807   9.0144   38.569   3.0880   34.401   4.8295   41.451   4.0163  209.691   15.149  231.611   11.329 -21.91953 18.91691 
1 1 1   17    9   44 o   89.182   23.027   6.5775   3.1650   8.0033   4.9754   5.6083   4.1021   98.172   30.182   84.099   27.591 14.07280 40.89238 
1 1 1   17    9   45 o  307.775   8.1493   72.905   3.8390   68.888   6.2394   75.352   4.8701  297.654   13.695  312.405   10.185 -14.75159 17.06685 
1 1 1   17    9   46 f   83.205   22.461   5.7294   2.9273   2.5131   4.3071   8.4903   3.9906   69.347   27.413  100.461   25.813 -31.11420 37.65398 
1 1 1   17    9   47 o   71.758   28.355   2.7801   4.6062  -0.0070   7.4345   4.5165   5.8682   76.528   33.455   83.757   32.319 -7.229149 46.51614 
1 1 1   17    9   48 f  184.284   15.645   26.821   4.3712   22.706   7.9657   28.594   5.2287  160.960   33.425  189.278   18.275 -28.31776 38.09518 
1 1 1   17    9   49 o  105.986   23.970   9.4634   3.7975   9.4347   7.9414   9.4719   4.3239  106.131   38.245  105.192   26.784 0.9387970 46.69117 
1 1 1   17    9   50 o  117.112   19.495   11.226   3.3717   15.777   5.3598   8.2457   4.3374  135.988   26.703   97.817   27.709 38.17032 38.48150 
1 1 1   17    9   51 o  172.497   13.024   23.406   3.4134   24.136   4.8829   22.709   4.7734  172.731   18.771  167.402   18.964 5.328369 26.68298 
1 1 1   17    9   52 o  128.718   17.576   13.462   3.3722   9.3042   4.8306   17.414   4.7098  102.281   29.334  144.515   21.985 -42.23444 36.65791 
1 1 1   17    9   53 o   80.980   27.114   5.5129   3.9555   6.4882   8.4448   5.2388   4.4769   93.911   37.957   80.486   28.746 13.42413 47.61338 
1 1 1   17    9   54 o  216.333   12.034   36.827   3.9691   32.052   6.3240   39.931   5.0982  196.055   21.423  223.634   14.980 -27.57843 26.14083 
1 1 1   17    9   55 o  164.883   14.256   21.787   3.5624   20.607   4.7183   23.352   5.4329  156.939   20.104  165.905   21.932 -8.966125 29.75215 
1 1 1   17    9   56 o  109.659   19.875   10.243   3.2131   9.6654   4.3382   10.945   4.7823  102.310   27.224  108.158   28.491 -5.847649 39.40684 
1 1 1   17    9   57 o  133.041   17.129   14.703   3.4070   10.737   4.6839   19.159   4.9648  106.433   28.273  148.123   22.615 -41.69041 36.20491 
1 1 1   17   10    0 o  775.155   8.6529  460.143   10.264  460.143   10.264  460.143   10.264  775.155   8.6529  775.155   8.6529 0.000000 0.000000 
1 1 1   17   10    1 o  957.302   6.9489  701.590   10.182  705.109   14.481  698.149   14.320  959.536   9.8595  954.792   9.7984 4.743774 13.90035 
1 1 1   17   10    2 o  121.836   9.8227   11.442   1.8162   6.6323   3.7576   12.908   2.0747   91.641   25.732  129.389   10.568 -37.74847 27.81721 
1 1 1   17   10    3 o  626.465   6.5584  300.445   6.2888  300.874   7.5561  299.477   11.344  626.870   7.8750  625.241   11.854 1.629944 14.23117 
1 1 1   17   10    4 o  636.938   6.6510  310.578   6.4842  306.016   7.6733  321.970   12.126  632.202   7.9297  648.273   12.221 -16.07190 14.56804 
1 1 1   17   10    5 o  363.466   6.4690  101.134   3.5989  100.928   4.1672  101.739   7.1391  363.077   7.4985  364.393   12.800 -1.315735 14.83453 
1 1 1   17   10    6 o  324.372   6.6894   80.550   3.3213   77.729   3.7640   90.474   7.0585  318.623   7.7179  343.603   13.421 -24.98044 15.48188 
1 1 1   17   10    7 o  350.534   9.0227   94.094   4.8410   94.094   4.8410   0.0000   0.0000  350.534   9.0227  ?   ?  0.000000 9.022729 
1 1 1   17   10    8 o  1464.76   13.975  1644.40   31.332  1644.40   31.332   0.0000   0.0000  1464.76   13.975  ?   ?  0.000000 13.97521 
1 1 1   17   10    9 o  578.317   7.3647  256.066   6.5192  273.990   8.2348  225.972   10.670  598.154   8.9944  543.043   12.837 55.11121 15.67462 
1 1 1   17   10   10 o  874.134   6.9221  585.004   9.2615  586.993   10.607  578.625   18.998  875.568   7.9149  868.825   14.286 6.743896 16.33204 
1 1 1   17   10   11 o  333.099   6.1451   84.941   3.1331   83.615   3.4078   92.187   7.9643  330.478   6.7370  346.754   15.006 -16.27600 16.44863 
1 1 1   17   10   12 o  997.594   7.5561  761.995   11.538  766.981   13.268  746.527   23.367  1000.78   8.6616  986.675   15.472 14.10382 17.73188 
1 1 1   17   10   13 o  569.226   6.1935  248.057   5.3962  251.268   6.1063  236.607   11.530  572.874   6.9639  555.590   13.558 17.28412 15.24176 
1 1 1   17   10   14 o  503.476   6.9561  194.081   5.3606  196.881   6.1740  185.502   10.805  507.063   7.9549  491.883   14.351 15.17926 16.40863 
1 1 1   17   10   15 o  276.452   8.1034   58.525   3.4289   57.101   3.7913   64.921   8.0366  273.049   9.0716  290.254   18.181 -17.20499 20.31865 
1 1 1   17   10   16 o  288.221   6.8782   63.604   3.0344   61.468   3.7086   67.930   5.2779  283.306   8.5524  297.739   11.581 -14.43356 14.39675 
1 1 1   17   10   17 o  1068.12   8.2791  873.729   13.536  876.080   19.318  871.462   18.971  1069.19   11.804  1066.39   11.622 2.799805 16.56585 
1 1 1   17   10   18 o  415.844   5.6784  132.387   3.6143  130.952   5.0115  133.942   5.2176  413.520   7.9178  418.205   8.1510 -4.685669 11.36353 
1 1 1   17   10   19 o  549.462   5.5641  231.133   4.6795  239.123   6.6580  223.333   6.5784  558.787   7.7845  540.016   7.9588 18.77161 11.13285 
1 1 1   17   10   20 o  218.659   9.9828   36.633   3.3411   37.254   3.9840   35.162   6.1337  220.133   11.868  213.062   19.008 7.071091 22.40851 
1 1 1   17   10   21 o  352.994   7.2789   95.425   3.9328   93.127   5.0682   98.903   6.2351  348.636   9.4976  359.200   11.341 -10.56366 14.79234 
1 1 1   17   10   22 o  870.487   7.4455  580.351   9.9203  594.869   14.392  567.211   13.693  880.957   10.673  860.267   10.399 20.69006 14.90158 
1 1 1   17   10   23 f  269.456   8.1013   55.621   3.3413   67.283   5.6627   49.392   4.1385  296.162   12.492  253.831   10.652 42.33138 16.41668 
1 1 1   17   10   24 o  352.067   6.6731   94.930   3.5960   98.600   5.4704   92.138   4.7719  358.647   9.9650  346.748   8.9910 11.89923 13.42163 
1 1 1   17   10   25 o  632.506   5.9024  306.365   5.7143  315.374   8.4095  298.637   7.7885  641.518   8.5643  624.302   8.1506 17.21594 11.82288 
1 1 1   17   10   26 o  278.503   7.8882   59.433   3.3626   61.453   5.1721   57.954   4.4255  282.975   11.941  274.886   10.518 8.088470 15.91317 
1 1 1   17   10   27 o  240.251   7.4457   44.227   2.7380   35.414   5.5819   47.019   3.1420  213.759   17.206  247.683   8.2879 -33.92448 19.09813 
1 1 1   17   10   28 o  422.541   5.6559  136.742   3.6580  138.874   6.3809  135.698   4.4644  425.504   9.7973  420.846   6.9305 4.657532 12.00084 
1 1 1   17   10   29 o  188.468   8.9887   27.240   2.5930   28.834   5.2707   26.731   2.9784  192.467   18.104  186.337   10.485 6.129807 20.92122 
1 1 1   17   10   30 o  157.455   11.277   19.138   2.6999   23.800   7.3178   18.403   2.9049  172.202   28.779  154.246   12.409 17.95642 31.34028 
1 1 1   17   10   31 o  376.240   6.6111  108.479   3.8072  120.742   6.5604  102.253   4.6750  396.496   10.810  365.136   8.3647 31.35965 13.66838 
1 1 1   17   10   32 o  160.918   12.355   20.032   3.0198   24.177   5.4287   18.175   3.6339  175.363   20.619  152.688   15.776 22.67505 25.96209 
1 1 1   17   10   33 o  260.668   7.7249   52.112   3.0821   53.785   5.8957   51.483   3.6155  263.692   14.665  258.981   9.1208 4.711365 17.27011 
1 1 1   17   10   34 o  101.525   20.569   8.2963   3.0869   11.355   5.3751   6.7910   3.7708  117.570   29.823   91.726   25.784 25.84376 39.42381 
1 1 1   17   10   35 o  136.790   19.389   14.821   3.9458   11.386   5.6240   18.150   5.5375  117.505   30.869  150.194   24.964 -32.68983 39.70023 
1 1 1   17   10   36 o  394.729   6.4894  119.474   3.9208  125.530   7.2501  116.971   4.6612  403.728   11.732  390.405   7.8003 13.32297 14.08880 
1 1 1   17   10   37 o  304.301   7.3428   71.058   3.4201   66.169   6.5144   72.919   4.0184  292.496   14.551  308.115   8.5206 -15.61862 16.86184 
1 1 1   17   10   38 o  386.296   6.7794  114.489   4.0085  115.439   7.5295  114.113   4.7353  386.684   12.722  385.469   8.0258 1.214874 15.04166 
1 1 1   17   10   39 o  411.762   7.2080  130.158   4.5429  130.256   11.000  130.137   4.9881  408.819   17.579  411.599   7.9176 -2.780457 19.27958 
1 1 1   17   10   40 o   49.059   20.921   0.0702   2.7688  -0.8686   6.0892   0.3149   3.1088   68.694   30.147   52.879   22.343 15.81450 37.52388 
1 1 1   17   10   41 o   92.029   20.999   6.9285   2.8927  -2.1115   6.1492   9.4973   3.2780   65.765   29.492  108.197   20.545 -42.43196 35.94279 
1 1 1   17   10   42 o  122.741   17.751   12.017   3.2380   32.346   10.315   9.7941   3.4104  194.366   35.997  109.688   21.079 84.67857 41.71459 
1 1 1   17   10   43 o  242.576   10.486   45.414   3.8933   47.005   10.823   45.177   4.1727  238.017   30.402  241.785   11.275 -3.767960 32.42519 
1 1 1   17   10   44 o   78.041   25.226   4.8231   3.4350   7.2402   7.5469   4.1915   3.8578   99.544   37.046   75.664   26.720 23.88012 45.67659 
1 1 1   17   10   45 o  159.854   12.456   19.934   3.0237   17.886   4.5354   21.573   4.0568  148.974   20.428  165.271   16.247 -16.29700 26.10093 
1 1 1   17   10   46 o  114.782   26.531   11.122   4.5679  -3.3225   7.3031   20.405   5.8544   68.623   31.316  157.104   25.198 -88.48188 40.19452 
1 1 1   17   10   47 o  117.776   28.855   11.899   5.1608   11.750   7.6669   12.023   6.9786  115.753   37.708  116.850   35.715 -1.096741 51.93699 
1 1 1   17   10   48 o  156.687   13.343   19.270   3.1695   16.034   4.8795   21.632   4.1687  139.060   23.779  164.944   16.744 -25.88327 29.08272 
1 1 1   17   10   49 o   75.351   24.158   4.5980   3.1552   9.1292   4.8572   1.2902   4.1500  102.685   29.404   62.983   26.156 39.70171 39.35388 
1 1 1   17   10   50 o  114.040   19.731   10.686   3.3195   6.5079   5.0350   13.898   4.4148   88.943   30.582  128.905   23.230 -39.96204 38.40444 
1 1 1   17   10   51 o  136.510   15.787   14.920   3.2378   22.250   4.7343   8.4795   4.4380  165.543   19.030   98.500   28.072 67.04277 33.91484 
1 1 1   17   10   52 o   71.768   26.312   3.8262   3.7821   10.333   7.0353   1.1813   4.4853  106.109   36.158   63.621   26.857 42.48721 45.04106 
1 1 1   17   10   53 o  198.357   12.196   30.948   3.6850   37.181   6.0309   27.235   4.6551  213.790   18.616  183.847   16.725 29.94298 25.02557 
1 1 1   17   10   54 o  129.477   19.616   13.962   3.7658   19.587   4.6672   3.4688   6.3746  153.264   20.402   78.250   32.450 75.01468 38.33106 
1 1 1   17   10   55 o   67.549   24.347   3.5947   3.2185   3.1518   4.4741   4.0696   4.6335   69.688   27.816   74.061   28.679 -4.373032 39.95240 
1 1 1   17   10   56 o  100.203   21.235   8.7261   3.1557   8.7230   4.3869   8.7294   4.5428   96.595   28.027   96.326   28.677 0.2689285 40.09881 
1 1 1   17   10   57 o  147.208   14.572   17.608   3.2403   20.671   4.5316   14.403   4.6351  156.321   19.353  126.332   24.855 29.98836 31.50117 
1 1 1   17   11    0 o  275.374   8.1532   58.201   3.4297   58.201   3.4297   58.201   3.4297  275.374   8.1532  275.374   8.1532 0.000000 0.000000 
1 1 1   17   11    1 o  498.694   6.2268  190.384   4.7530  187.102   8.3514  191.956   5.7805  494.228   11.040  500.716   7.5423 -6.488220 13.37029 
1 1 1   17   11    2 o  469.976   6.3583  169.090   4.5739  168.113   5.4000  171.573   8.6044  468.587   7.5290  473.240   11.879 -4.652679 14.06381 
1 1 1   17   11    3 o  483.594   6.3727  179.032   4.7171  174.233   5.4709  192.938   9.3124  477.040   7.4926  501.827   12.124 -24.78662 14.25217 
1 1 1   17   11    4 o  169.899   9.9767   22.184   2.5831   21.463   2.8671   25.289   5.9525  167.008   11.282  180.125   22.051 -13.11703 24.76939 
1 1 1   17   11    5 o  610.723   6.7288  285.546   6.2900  275.546   7.2483  316.041   12.658  599.896   7.8939  642.218   12.877 -42.32214 15.10367 
1 1 1   17   11    6 o  874.211   7.8436  585.160   10.495  574.671   12.345  612.506   19.934  866.258   9.3106  893.895   14.569 -27.63672 17.29028 
1 1 1   17   11    7 o  320.178   6.6617   78.482   3.2647   78.482   3.2647   0.0000   0.0000  320.178   6.6617  ?   ?  0.000000 6.661686 
1 1 1   17   11    8 o  567.615   5.9356  246.643   5.1569  246.915   5.7626  245.548   11.555  567.909   6.6294  566.039   13.337 1.870117 14.89397 
1 1 1   17   11    9 o  647.728   6.1567  321.186   6.1039  323.329   6.9120  313.594   13.009  649.858   6.9489  639.673   13.287 10.18530 14.99443 
1 1 1   17   11   10 o  554.988   5.1400  235.776   4.3663  237.656   4.7391  225.219   11.231  557.185   5.5569  542.073   13.536 15.11249 14.63265 
1 1 1   17   11   11 o  161.060   8.6230   19.922   2.1180   21.232   2.2197   6.5862   7.0816  166.277   8.7521  100.499   36.126 65.77782 37.17100 
1 1 1   17   11   12 o  666.476   6.3780  340.065   6.5063  333.301   7.2153  369.499   15.052  659.786   7.1446  694.242   14.165 -34.45685 15.86444 
1 1 1   17   11   13 o  742.191   6.7000  421.740   7.6113  421.584   8.6052  422.298   16.314  742.013   7.5767  742.150   14.362 -0.1372070 16.23790 
1 1 1   17   11   14 o  663.068   7.3459  336.644   7.4555  337.702   8.7052  333.735   14.442  664.049   8.5646  659.740   14.301 4.308716 16.66977 
1 1 1   17   11   15 f  215.902   8.9457   35.701   2.9563   34.258   3.1507   46.324   8.5484  211.479   9.7334  244.328   23.134 -32.84909 25.09801 
1 1 1   17   11   16 o  791.247   8.5541  479.489   10.360  491.443   12.734  456.086   17.817  800.911   10.387  771.104   15.096 29.80676 18.32423 
1 1 1   17   11   17 o  268.357   7.3203   55.145   3.0068   57.965   3.6979   49.641   5.1656  275.100   8.7819  254.102   13.328 20.99802 15.96097 
1 1 1   17   11   18 o  932.098   6.8058  665.248   9.7098  663.294   12.351  668.408   15.711  930.582   8.6712  933.929   10.990 -3.347473 13.99924 
1 1 1   17   11   19 o  643.254   6.8547  316.842   6.7490  324.328   9.3439  308.676   9.7588  650.654   9.3823  634.712   10.045 15.94153 13.74514 
1 1 1   17   11   20 o  538.813   7.6769  222.349   6.3313  226.019   7.8513  215.525   10.706  543.139   9.4441  530.101   13.195 13.03876 16.22661 
1 1 1   17   11   21 o  422.149   6.4674  136.464   4.1789  136.064   6.5510  136.738   5.4263  421.357   10.158  422.492   8.3911 -1.135162 13.17520 
1 1 1   17   11   22 o  515.811   5.7691  203.719   4.5548  211.458   6.6022  196.690   6.2920  525.386   8.2099  506.713   8.1125 18.67224 11.54189 
1 1 1   17   11   23 o  492.106   5.8838  185.437   4.4318  201.912   6.5670  171.658   6.0057  513.357   8.3575  473.341   8.2893 40.01584 11.77116 
1 1 1   17   11   24 o  440.249   6.7427  148.451   4.5436  142.377   5.8452  157.725   7.2225  431.024   8.8598  453.543   10.404 -22.51920 13.66529 
1 1 1   17   11   25 f  648.490   5.9372  322.062   5.8933  327.027   8.5466  317.561   8.1371  653.234   8.5478  643.740   8.2583 9.493347 11.88551 
1 1 1   17   11   26 o  561.558   6.3489  241.543   5.4571  248.456   8.6526  236.977   7.0321  569.192   9.9316  556.063   8.2621 13.12872 12.91891 
1 1 1   17   11   27 o  291.584   8.0114   65.163   3.5756   74.798   5.9533   59.727   4.4720  312.075   12.463  279.012   10.471 33.06262 16.27831 
1 1 1   17   11   28 o  369.283   6.7972  104.485   3.8420  102.874   5.7412  105.792   5.1703  366.157   10.244  371.416   9.0947 -5.258911 13.69854 
1 1 1   17   11   29 o  132.573   16.579   13.757   3.2906   12.047   7.0967   14.226   3.7140  122.097   35.711  134.486   18.535 -12.38894 40.23460 
1 1 1   17   11   30 o   92.881   22.913   6.9665   3.2373   4.8807   4.5555   9.0944   4.6012   83.212   29.062  105.902   27.970 -22.69018 40.33546 
1 1 1   17   11   31 o  379.577   6.5379  110.415   3.7984  119.599   6.3520  105.303   4.7392  394.621   10.516  370.526   8.3563 24.09509 13.43197 
1 1 1   17   11   32 o  235.674   9.9956   42.654   3.6057   41.652   5.4047   43.457   4.8403  231.861   15.315  237.191   13.387 -5.329605 20.34136 
1 1 1   17   11   33 o  206.309   10.218   32.701   3.2267   29.536   5.2838   34.584   4.0747  194.488   17.952  211.575   12.640 -17.08696 21.95561 
1 1 1   17   11   34 o  178.174   10.801   24.499   2.9318   28.384   5.4355   22.905   3.4816  190.312   18.910  171.874   13.339 18.43742 23.14128 
1 1 1   17   11   35 o  366.407   7.4687  102.998   4.1887  114.649   6.8300   95.975   5.3030  385.915   11.563  353.381   9.8042 32.53378 15.15972 
1 1 1   17   11   36 o  225.878   8.6031   39.185   2.9744   36.619   5.8765   40.069   3.4488  216.384   17.904  228.284   9.8701 -11.89943 20.44419 
1 1 1   17   11   37 o  103.980   18.051   8.6448   2.7688   6.0361   6.3163   9.2653   3.0805   93.322   34.035  107.410   19.454 -14.08707 39.20205 
1 1 1   17   11   38 o  103.907   19.496   8.6993   2.9868   11.924   7.9257   8.1654   3.2245  119.993   38.270  100.137   21.667 19.85629 43.97764 
1 1 1   17   11   39 o   77.750   22.036   4.8931   2.7425   10.111   5.8288   3.4096   3.1080  110.161   32.405   68.863   24.008 41.29787 40.32940 
1 1 1   17   11   40 o   69.962   22.471   3.8004   2.7288  -2.8661   6.3497   5.3105   3.0221   65.233   29.546   80.858   23.205 -15.62446 37.56946 
1 1 1   17   11   41 o  103.268   20.340   8.6664   3.1007   25.190   9.8451   6.8469   3.2670  169.942   38.713   91.168   23.319 78.77380 45.19375 
1 1 1   17   11   42 o  104.421   20.768   8.8898   3.2025   16.430   9.7887   7.9859   3.3890  136.346   42.403   98.386   22.929 37.96034 48.20554 
1 1 1   17   11   43 o  227.259   10.707   39.881   3.7244   40.285   7.2515   39.737   4.3407  224.546   21.356  226.125   12.591 -1.578583 24.79123 
1 1 1   17   11   44 o  201.184   11.548   31.421   3.5410   44.140   7.5718   27.860   4.0061  234.896   21.291  188.773   13.964 46.12320 25.46174 
1 1 1   17   11   45 o  173.683   18.123   23.993   4.7469   27.076   7.4607   21.897   6.1530  180.259   27.945  162.884   25.518 17.37453 37.84270 
1 1 1   17   11   46 o  158.109   18.280   19.972   4.3423   25.024   7.4131   17.333   5.3577  172.185   29.169  144.494   25.138 27.69125 38.50626 
1 1 1   17   11   47 o  231.195   15.991   42.144   5.6239   38.040   7.8678   46.432   8.0419  215.524   24.273  239.572   22.182 -24.04826 32.88183 
1 1 1   17   11   48 o   77.458   25.617   4.7925   3.5336   6.3340   7.6243   4.3708   3.9877   94.915   36.779   76.347   27.145 18.56816 45.71117 
1 1 1   17   11   49 o  120.424   20.700   11.932   3.6779   21.598   8.1666   9.4726   4.1193  154.681   35.275  105.286   25.770 49.39525 43.68555 
1 1 1   17   11   50 o  224.716   11.975   39.463   4.1041   39.296   8.8366   39.509   4.6342  215.205   27.452  224.193   13.569 -8.987656 30.62185 
1 1 1   17   11   51 o  136.623   16.453   15.019   3.3715   8.4678   4.9894   20.523   4.5737   97.983   30.241  158.687   19.223 -60.70380 35.83304 
1 1 1   17   11   52 o  196.900   12.915   30.555   3.8706   22.304   6.5551   34.971   4.7960  159.896   27.793  209.647   15.046 -49.75139 31.60386 
1 1 1   17   11   53 o  165.283   14.104   21.746   3.5341   18.071   5.6064   24.168   4.5525  143.877   26.432  172.588   17.474 -28.71111 31.68579 
1 1 1   17   11   54 o  156.356   14.716   19.628   3.4804   18.640   4.8549   20.672   4.9919  148.192   22.078  156.633   21.380 -8.440674 30.73314 
1 1 1   17   11   55 o  188.267   11.869   28.045   3.4028   22.962   4.7077   33.606   4.9243  166.193   18.840  203.564   15.931 -37.37123 24.67257 
1 1 1   17   11   56 o  137.029   15.568   15.352   3.2073   17.530   4.5300   13.162   4.5418  142.754   21.390  120.666   25.395 22.08794 33.20298 
1 1 1   17   12    0 f  395.791   11.965  120.280   7.2336  120.280   7.2336  120.280   7.2336  395.791   11.965  395.791   11.965 0.000000 0.000000 
1 1 1   17   12    1 o  1174.00   9.4284  1055.54   16.943  1059.51   20.722  1047.51   29.427  1176.02   11.512  1168.72   16.450 7.294312 20.07786 
1 1 1   17   12    2 o  609.984   6.6756  284.856   6.2327  278.961   7.3435  300.041   11.786  603.597   7.9485  625.777   12.305 -22.18054 14.64924 
1 1 1   17   12    3 o  275.896   7.6679   58.281   3.2381   58.476   3.6901   57.627   6.7522  276.339   8.7243  273.654   16.192 2.685699 18.39314 
1 1 1   17   12    4 o  370.506   6.7834  105.096   3.8469  102.902   4.3819  112.468   8.0338  366.598   7.8091  383.071   13.702 -16.47357 15.77082 
1 1 1   17   12    5 o  732.233   7.2218  410.502   8.0940  400.708   9.4424  437.639   15.717  723.386   8.5279  755.656   13.589 -32.26917 16.04296 
1 1 1   17   12    6 o  288.624   8.2907   63.789   3.6627   63.789   3.6627   0.0000   0.0000  288.624   8.2907  ?   ?  0.000000 8.290735 
1 1 1   17   12    7 o  159.687   9.4241   19.597   2.2933   20.632   2.4241   10.786   7.0751  163.842   9.7096  117.897   35.946 45.94486 37.23387 
1 1 1   17   12    8 o  597.284   6.1175  273.108   5.5927  271.664   6.2256  279.148   12.731  595.680   6.8280  603.473   13.783 -7.793396 15.38166 
1 1 1   17   12    9 o  572.260   6.1257  250.705   5.3656  252.019   5.9685  245.172   12.251  573.736   6.7965  565.523   14.153 8.212830 15.70056 
1 1 1   17   12   10 o  238.438   7.2958   43.530   2.6627   44.931   2.8219   32.159   8.0390  242.240   7.6108  202.681   26.552 39.55901 27.62085 
1 1 1   17   12   11 o  690.158   8.0015  364.739   8.4526  375.081   10.301  343.429   14.787  699.787   9.6175  669.269   14.435 30.51813 17.34537 
1 1 1   17   12   12 o  782.227   6.7697  468.474   8.1054  471.397   9.2009  458.344   17.127  784.618   7.6613  773.151   14.473 11.46637 16.37542 
1 1 1   17   12   13 o  568.601   7.0842  247.547   6.1655  242.867   6.9748  264.277   13.186  563.159   8.0916  587.048   14.675 -23.88898 16.75817 
1 1 1   17   12   14 o  591.750   9.8212  268.238   8.8956  265.971   12.043  270.960   13.197  589.011   13.358  594.417   14.504 -5.406067 19.71831 
1 1 1   17   12   15 o  718.050   8.2910  394.865   9.1124  395.612   10.983  393.216   16.322  718.617   9.9855  715.999   14.893 2.617920 17.93102 
1 1 1   17   12   16 o  507.494   7.6406  197.228   5.9351  202.218   6.8244  181.738   12.024  513.828   8.6772  486.640   16.142 27.18790 18.32638 
1 1 1   17   12   17 o  119.428   15.193   11.119   2.7144   9.2496   3.2744   15.226   4.8535  107.910   20.575  138.710   23.712 -30.80042 31.39450 
1 1 1   17   12   18 o  480.661   6.8216  176.911   5.0187  190.521   6.8357  160.995   7.3920  498.709   8.9551  458.357   10.536 40.35199 13.82770 
1 1 1   17   12   19 o  813.946   7.1529  507.353   8.9114  500.167   10.162  531.284   18.544  808.079   8.2157  832.083   14.560 -24.00446 16.71812 
1 1 1   17   12   20 o  414.344   6.6029  131.467   4.1876  129.351   5.2074  135.339   7.0450  410.927   8.2791  420.185   10.954 -9.258209 13.73074 
1 1 1   17   12   21 f  577.163   5.7163  255.061   5.0499  261.825   7.1911  248.480   7.0931  584.630   8.0361  569.528   8.1368 15.10138 11.43617 
1 1 1   17   12   22 o  277.229   7.2189   58.868   3.0632   59.978   4.4114   57.834   4.2568  279.711   10.304  274.673   10.125 5.038269 14.44595 
1 1 1   17   12   23 o  525.283   5.8055  211.291   4.6677  210.903   6.6632  211.665   6.5407  524.641   8.2976  525.600   8.1302 -0.9595947 11.61679 
1 1 1   17   12   24 o  317.603   6.9963   77.270   3.4011   73.899   4.8849   80.441   4.7382  310.432   10.281  323.926   9.5566 -13.49417 14.03635 
1 1 1   17   12   25 o  581.845   6.4572  259.314   5.7507  272.614   7.6392  241.920   8.7362  596.406   8.3683  561.638   10.162 34.76892 13.16446 
1 1 1   17   12   26 o  410.030   6.6602  128.796   4.1800  134.770   6.5560  124.704   5.4258  419.150   10.219  403.316   8.7892 15.83447 13.47868 
1 1 1   17   12   27 o  569.303   6.0133  248.261   5.2399  249.561   7.5480  247.051   7.2800  570.524   8.6435  567.680   8.3783 2.844604 12.03770 
1 1 1   17   12   28 o  211.172   10.304   34.224   3.3306   32.683   4.5059   36.080   4.9451  205.592   14.410  215.964   15.054 -10.37169 20.83899 
1 1 1   17   12   29 o  126.211   20.013   12.624   3.7371   20.951   6.8252   9.0582   4.4660  161.304   28.696  105.702   27.383 55.60254 39.66472 
1 1 1   17   12   30 o  237.230   8.8480   43.175   3.2128   38.890   4.9164   46.368   4.2444  224.250   14.400  245.660   11.288 -21.41029 18.29656 
1 1 1   17   12   31 o   77.816   22.806   4.8006   2.8918  -2.2309   4.3123   10.547   3.8982   54.043   24.425  114.412   23.057 -60.36916 33.58854 
1 1 1   17   12   32 o  497.867   6.9459  190.031   5.2931  195.111   7.3808  184.653   7.5950  504.082   9.5660  490.291   10.121 13.79141 13.92604 
1 1 1   17   12   33 f  158.411   15.524   19.567   3.7157   18.241   5.0107   21.186   5.5384  151.394   22.291  163.251   22.786 -11.85747 31.87571 
1 1 1   17   12   34 o  306.429   9.4309   72.134   4.4234   77.222   6.0448   66.268   6.4900  316.606   12.474  292.960   14.473 23.64633 19.10681 
1 1 1   17   12   35 o  265.478   8.8978   54.135   3.6156   59.567   5.8792   50.831   4.5852  277.765   13.828  256.915   11.660 20.84949 18.08809 
1 1 1   17   12   36 o  481.009   6.2316  177.416   4.5880  182.768   8.8179  175.429   5.3725  486.978   11.830  478.128   7.3411 8.849915 13.92271 
1 1 1   17   12   37 o   89.048   19.526   6.4262   2.5881   4.9340   5.4917   6.8522   2.9344   85.901   31.674   91.726   21.308 -5.824905 38.17358 
1 1 1   17   12   38 o  326.233   7.3520   81.712   3.6711   90.416   7.6023   79.065   4.1924  341.584   14.540  320.727   8.5399 20.85727 16.86277 
1 1 1   17   12   39 o  111.599   16.433   9.8914   2.7229   22.845   5.6990   6.0596   3.0996  168.680   22.645   86.039   23.065 82.64148 32.32354 
1 1 1   17   12   40 o  121.384   15.904   11.653   2.8838   5.9567   9.3192   12.256   3.0326  101.418   40.250  124.433   16.316 -23.01526 43.43144 
1 1 1   17   12   41 o  105.226   19.060   8.9414   2.9567  -8.5102   10.112   10.573   3.0919   74.307   34.905  114.884   18.189 -40.57787 39.36002 
1 1 1   17   12   42 o  193.894   10.727   29.110   3.1712   34.153   6.7035   27.655   3.5995  206.654   21.508  188.570   12.542 18.08426 24.89781 
1 1 1   17   12   43 o  116.479   24.920   11.272   4.3087   8.9459   7.1592   12.593   5.3951  105.270   36.452  121.876   29.285 -16.60561 46.75872 
1 1 1   17   12   44 o  195.486   16.322   30.105   4.8391   32.614   7.5864   28.384   6.2833  199.671   25.398  187.473   22.337 12.19830 33.82240 
1 1 1   17   12   45 o  171.229   17.445   23.279   4.5082   19.633   7.8051   25.104   5.5226  149.577   34.754  176.572   20.835 -26.99446 40.52074 
1 1 1   17   12   46 o  400.286   10.751  124.001   6.5869  117.434   9.0143  131.523   9.6485  387.403   15.202  409.879   15.379 -22.47592 21.62456 
1 1 1   17   12   47 o  270.882   11.980   56.987   4.9671   60.776   8.3305   54.898   6.1872  275.616   19.880  264.218   15.365 11.39813 25.12601 
1 1 1   17   12   48 o   85.658   25.530   6.1464   3.5989   10.001   8.2455   5.2393   4.0000  108.500   38.984   80.920   27.266 27.58083 47.57281 
1 1 1   17   12   49 o  315.148   9.4186   76.826   4.5433   93.496   10.258   72.758   5.0674  341.085   19.733  306.174   10.813 34.91019 22.50167 
1 1 1   17   12   50 o  100.937   24.173   8.7021   3.6854   10.409   7.3290   8.1243   4.2637  107.696   36.904   96.729   27.497 10.96625 46.02187 
1 1 1   17   12   51 o  209.314   12.056   34.353   3.8462   25.463   6.5274   39.081   4.7603  173.079   25.395  222.361   14.059 -49.28203 29.02645 
1 1 1   17   12   52 o   57.935   24.053   1.1944   3.5081   5.5938   6.1760  -0.9012   4.2625   85.953   33.159   55.351   24.707 30.60238 41.35147 
1 1 1   17   12   53 o  143.518   19.208   17.011   4.1137   3.9709   8.2318   21.351   4.7492   85.540   36.262  160.709   19.721 -75.16931 41.27732 
1 1 1   17   12   54 o   46.129   21.450  -2.5108   3.6626  -0.1620   5.6844  -4.1781   4.7892   64.422   28.660   50.088   23.680 14.33389 37.17690 
1 1 1   17   12   55 o   65.507   24.837   3.1498   3.4261  -1.2682   5.3473   6.2266   4.4624   59.378   26.980   83.348   28.783 -23.97049 39.45145 
1 1 1   17   12   56 o   45.705   21.296  -2.4144   3.6387  -7.0590   5.0987   2.4065   5.1945   46.340   22.543   68.597   28.927 -22.25709 36.67402 
1 1 1   17   13    0 o  495.272   7.9407  187.919   6.0162  187.919   6.0162  187.919   6.0162  495.272   7.9407  495.272   7.9407 0.000000 0.000000 
1 1 1   17   13    1 o  705.262   7.1136  380.817   7.6791  372.971   9.1222  399.898   14.226  697.896   8.5397  722.381   12.866 -24.48541 15.44213 
1 1 1   17   13    2 o  551.284   6.6652  232.673   5.6242  226.150   6.5901  250.160   10.791  543.461   7.9223  571.377   12.338 -27.91559 14.66265 
1 1 1   17   13    3 o  275.665   7.8478   58.186   3.3113   59.493   3.7894   53.966   6.8104  278.723   8.8822  264.705   16.897 14.01797 19.08946 
1 1 1   17   13    4 o  559.097   6.7967  239.320   5.8164  228.464   6.6404  275.101   12.056  546.232   7.9423  599.127   13.147 -52.89496 15.35941 
1 1 1   17   13    5 o  224.326   9.5882   38.541   3.2922   38.541   3.2922   0.0000   0.0000  224.326   9.5882  ?   ?  0.000000 9.588179 
1 1 1   17   13    6 o  368.996   7.0395  104.247   3.9759  106.139   4.5062   97.598   8.4473  372.309   7.9074  356.752   15.470 15.55746 17.37346 
1 1 1   17   13    7 o  293.832   6.8198   66.101   3.0672   66.194   3.3009   65.514   8.2994  294.029   7.3344  291.554   18.696 2.474579 20.08335 
1 1 1   17   13    8 o  1016.72   7.6633  791.516   11.926  788.602   13.571  801.397   24.990  1014.77   8.7371  1022.17   15.973 -7.408813 18.20602 
1 1 1   17   13    9 o  409.514   6.2519  128.389   3.9188  125.715   4.2488  143.621   10.141  405.214   6.8504  432.752   15.310 -27.53873 16.77258 
1 1 1   17   13   10 o  1065.62   7.9340  869.540   12.941  864.483   14.674  887.230   27.447  1062.43   9.0238  1075.36   16.675 -12.93103 18.96018 
1 1 1   17   13   11 o  1368.68   11.102  1435.29   23.258  1416.86   28.060  1475.74   41.572  1359.49   13.485  1386.15   19.594 -26.66113 23.78556 
1 1 1   17   13   12 o  498.666   10.084  190.494   7.6968  182.491   10.190  201.126   11.745  487.881   13.646  512.092   14.984 -24.21085 20.26607 
1 1 1   17   13   13 o  599.106   14.821  275.289   13.591   0.0000   0.0000  275.289   13.591  ?   ?   599.106   14.821 0.000000 14.82114 
1 1 1   17   13   14 o  495.801   15.749  188.608   11.952   0.0000   0.0000  188.608   11.952  ?   ?   495.801   15.749 0.000000 15.74880 
1 1 1   17   13   15 f  596.667   7.5111  272.626   6.8597  270.397   7.8405  279.901   14.165  594.166   8.6211  603.998   15.322 -9.831787 17.58063 
1 1 1   17   13   16 o  460.780   7.7027  162.599   5.4326  166.331   6.1323  148.985   11.711  466.000   8.5973  440.467   17.371 25.53235 19.38222 
1 1 1   17   13   17 o  483.460   6.7917  178.978   5.0258  177.231   5.4797  188.232   12.612  481.068   7.4418  495.118   16.642 -14.05005 18.23027 
1 1 1   17   13   18 o  518.424   6.1446  205.787   4.8758  205.339   6.0247  206.638   8.3007  517.793   7.6017  519.258   10.444 -1.465698 12.91742 
1 1 1   17   13   19 o  272.779   8.1365   56.997   3.3972   58.130   3.9171   53.561   6.8236  275.437   9.2912  263.485   17.010 11.95193 19.38257 
1 1 1   17   13   20 o  125.337   14.430   12.218   2.7178   14.586   3.2392   6.5852   4.9955  136.911   15.744   93.651   30.434 43.25993 34.26532 
1 1 1   17   13   21 o  198.255   9.9077   30.128   3.0066   33.921   3.6483   22.100   5.3077  210.004   11.393  168.046   21.100 41.95781 23.97954 
1 1 1   17   13   22 o  154.023   10.816   18.282   2.5338   17.943   3.5388   18.638   3.6295  152.033   15.420  154.967   15.510 -2.933456 21.87126 
1 1 1   17   13   23 o  536.127   5.8242  220.116   4.7794  222.093   6.7378  218.115   6.7805  538.362   8.1767  533.508   8.3034 4.854431 11.65348 
1 1 1   17   13   24 o  836.490   6.1641  535.918   7.8923  545.516   11.274  526.696   11.052  843.619   8.7313  828.942   8.7103 14.67700 12.33311 
1 1 1   17   13   25 o  568.117   5.8809  247.199   5.1139  253.293   7.3374  241.444   7.1313  574.854   8.3390  561.250   8.3013 13.60333 11.76652 
1 1 1   17   13   26 o  423.748   6.5723  137.564   4.2628  137.085   6.4819  137.929   5.6586  422.720   10.018  424.144   8.7161 -1.423676 13.27896 
1 1 1   17   13   27 o  360.468   7.3845   99.584   4.0744  100.122   5.2742   98.788   6.4162  361.269   9.5380  358.641   11.688 2.627136 15.08600 
1 1 1   17   13   28 o  588.453   6.9131  265.368   6.2266  289.195   11.048  254.277   7.5377  613.520   11.765  575.819   8.5523 37.70142 14.54519 
1 1 1   17   13   29 o  335.406   8.0803   86.267   4.1483   96.181   8.0779   82.715   4.8345  353.309   14.937  328.294   9.6209 25.01566 17.76749 
1 1 1   17   13   30 o  350.997   6.9425   94.435   3.7299   98.060   5.5828   91.512   5.0127  357.344   10.207  345.287   9.4847 12.05661 13.93351 
1 1 1   17   13   31 o  347.039   7.5291   92.357   3.9994  100.768   5.7665   84.560   5.5516  362.169   10.402  331.701   10.935 30.46906 15.09215 
1 1 1   17   13   32 o  247.319   10.400   47.005   3.9370   43.550   5.1781   51.739   6.0613  237.196   14.330  258.395   15.395 -21.19881 21.03215 
1 1 1   17   13   33 o  407.961   7.8511  127.698   4.9025  128.043   6.4165  127.214   7.5989  408.143   10.271  406.455   12.214 1.687988 15.95883 
1 1 1   17   13   34 o  143.018   13.662   15.924   2.9543   23.697   4.8020   11.191   3.7474  173.745   18.334  117.968   21.548 55.77779 28.29192 
1 1 1   17   13   35 o  237.270   9.8303   43.287   3.5701   39.532   6.0433   45.300   4.4247  224.909   17.698  242.457   11.923 -17.54764 21.33925 
1 1 1   17   13   36 o   83.077   22.979   5.5959   3.0204   2.1228   4.9095   7.7111   3.8313   71.972   28.993   96.979   25.480 -25.00641 38.59791 
1 1 1   17   13   37 f  280.658   8.7561   60.547   3.7615   64.923   5.9585   57.648   4.8500  289.768   13.434  273.408   11.589 16.36002 17.74244 
1 1 1   17   13   38 o  315.345   10.306   76.604   4.9745   66.521   15.842   77.707   5.2395  280.838   37.815  317.509   10.781 -36.67120 39.32209 
1 1 1   17   13   39 o  155.399   13.258   18.826   3.1234   34.686   9.5514   16.927   3.3051  204.406   31.543  146.930   14.902 57.47646 34.88649 
1 1 1   17   13   40 f  307.628   7.4889   72.706   3.5262   81.606   6.9253   69.591   4.0972  324.369   13.949  300.727   8.9010 23.64258 16.54666 
1 1 1   17   13   41 o  146.523   14.456   16.838   3.1998   24.707   9.9735   15.935   3.3784  167.374   39.557  142.166   15.792 25.20747 42.59263 
1 1 1   17   13   42 o  149.123   16.705   17.590   3.7474   16.751   6.2549   18.060   4.6804  140.807   29.943  149.765   20.995 -8.958069 36.57021 
1 1 1   17   13   43 o  154.965   20.898   19.344   4.8304   14.005   6.7578   24.922   6.9072  127.015   34.060  173.681   26.848 -46.66639 43.36970 
1 1 1   17   13   44 o  209.221   13.469   34.170   4.2904   23.852   7.2632   39.700   5.3172  168.398   29.239  224.873   15.544 -56.47409 33.11403 
1 1 1   17   13   45 o   67.741   26.583   2.4929   4.0225   5.5657   7.0863   1.0322   4.8859   91.657   35.474   66.719   28.090 24.93839 45.24902 
1 1 1   17   13   46 o  211.701   17.765   35.599   5.7031   33.041   7.9488   38.314   8.1874  199.441   26.709  215.814   25.264 -16.37299 36.76461 
1 1 1   17   13   47 o  321.680   10.506   80.123   5.1729   78.697   8.2681   81.040   6.6311  315.326   17.196  322.328   13.440 -7.001709 21.82520 
1 1 1   17   13   48 o   82.597   25.034   5.6872   3.4390  -2.6683   7.5311   7.8884   3.8655   70.275   31.966   96.198   25.745 -25.92298 41.04389 
1 1 1   17   13   49 o  207.615   12.932   33.805   4.0892   29.129   10.554   34.631   4.4356  175.560   40.150  209.756   13.894 -34.19621 42.48578 
1 1 1   17   13   50 o  126.864   18.653   13.142   3.5139   15.397   6.4576   12.193   4.1882  130.288   32.492  119.943   23.654 10.34432 40.18973 
1 1 1   17   13   51 o  269.138   10.393   56.343   4.2813   34.266   6.6204   72.211   5.6128  203.654   21.566  303.839   12.069 -100.1845 24.71375 
1 1 1   17   13   52 o  128.429   18.291   13.532   3.4941   15.592   6.3055   12.620   4.1975  130.047   31.915  121.457   23.428 8.590317 39.59080 
1 1 1   17   13   53 o  184.614   14.371   27.220   4.0290   15.345   8.2195   30.976   4.6223  122.640   38.957  196.344   15.507 -73.70370 41.93021 
1 1 1   17   13   54 o   52.752   23.778  -1.0497   4.0554  -9.8399   5.6709   8.1512   5.8018   46.330   22.794   93.449   32.789 -47.11925 39.93323 
1 1 1   17   13   55 o   85.892   26.221   6.7176   3.7630   4.0501   5.4604   9.1301   5.1930   75.559   30.528   97.374   30.969 -21.81455 43.48589 
1 1 1   17   13   56 o  128.579   19.430   14.056   3.7046   11.449   5.5457   16.157   4.9784  107.325   31.619  133.723   25.249 -26.39766 40.46299 
1 1 1   17   14    0 o  993.194   10.347  755.521   15.726  755.521   15.726  755.521   15.726  993.194   10.347  993.194   10.347 0.000000 0.000000 
1 1 1   17   14    1 o  732.854   7.3166  411.218   8.2072  400.394   9.7196  438.109   15.320  723.073   8.7820  756.046   13.239 -32.97351 15.88664 
1 1 1   17   14    2 o  585.196   6.8887  262.191   6.1703  257.365   7.2695  274.630   11.670  579.736   8.1923  598.624   12.736 -18.88770 15.14362 
1 1 1   17   14    3 o  306.186   7.7347   71.785   3.6249   71.165   4.0998   74.003   7.7591  304.839   8.7867  310.172   16.402 -5.332855 18.60689 
1 1 1   17   14    4 o  265.711   9.2508   54.073   3.7623   54.073   3.7623   0.0000   0.0000  265.711   9.2508  ?   ?  0.000000 9.250761 
1 1 1   17   14    5 o  646.335   7.1140  319.851   7.0379  319.868   8.2855  319.806   13.336  646.298   8.3756  645.919   13.489 0.3788452 15.87809 
1 1 1   17   14    6 f  842.622   7.8556  543.680   10.132  537.518   11.951  559.425   19.104  837.741   9.3201  854.162   14.612 -16.42194 17.33131 
1 1 1   17   14    7 o  522.164   6.9975  208.759   5.5927  210.550   6.4304  203.196   11.332  524.363   8.0119  514.794   14.382 9.568909 16.46267 
1 1 1   17   14    8 o  312.014   7.6979   74.546   3.6763   73.364   4.0528   80.036   8.7349  309.511   8.5547  322.435   17.767 -12.92319 19.71964 
1 1 1   17   14    9 o  402.976   7.3391  124.342   4.5268  127.300   5.0847  113.033   9.9405  407.718   8.1476  383.796   16.921 23.92181 18.78087 
1 1 1   17   14   10 o  286.870   7.2443   63.013   3.1809   60.498   3.3855   81.947   9.2905  281.075   7.8693  326.148   18.688 -45.07236 20.27739 
1 1 1   17   14   11 o  769.539   8.2736  453.518   9.7453  449.707   11.633  462.485   17.846  766.186   9.9195  776.508   15.015 -10.32251 17.99540 
1 1 1   17   14   12 o  288.073   12.904   63.618   5.6899   64.225   7.1701   62.587   9.3509  288.841   16.284  284.479   21.637 4.361450 27.08039 
1 1 1   17   14   13 o  467.421   8.5426  167.337   6.1118  171.477   7.2130  156.797   11.509  473.102   9.9607  451.973   16.636 21.12891 19.38993 
1 1 1   17   14   14 o  302.059   10.719   69.916   4.9556   69.747   5.6044   70.521   10.610  301.640   12.139  301.792   23.146 -0.1512451 26.13581 
1 1 1   17   14   15 o  829.053   7.1975  526.340   9.1334  524.391   10.241  533.919   20.195  827.451   8.0856  834.039   15.820 -6.587524 17.76616 
1 1 1   17   14   16 o  602.291   6.7221  277.775   6.1969  279.614   6.8845  269.924   14.226  604.243   7.4437  592.987   15.673 11.25537 17.35107 
1 1 1   17   14   17 o  275.033   7.9582   57.939   3.3502   58.180   3.5554   56.027   10.007  275.591   8.4285  268.403   24.633 7.188324 26.03484 
1 1 1   17   14   18 o  165.207   10.794   21.011   2.7144   20.446   2.9919   23.642   6.4546  162.836   12.090  173.255   25.068 -10.41878 27.83163 
1 1 1   17   14   19 f  538.639   6.2173  222.172   5.1259  229.784   6.3649  208.122   8.6468  547.711   7.5922  521.021   10.843 26.68994 13.23642 
1 1 1   17   14   20 f  433.178   6.4614  143.704   4.2841  143.464   5.2030  144.208   7.5495  432.747   7.8551  433.629   11.375 -0.8811951 13.82323 
1 1 1   17   14   21 o  592.648   6.3712  268.994   5.7795  272.679   7.2908  262.763   9.4809  596.572   7.9844  585.378   10.581 11.19403 13.25583 
1 1 1   17   14   22 o  340.345   7.1972   88.737   3.7493   88.793   4.5834   88.623   6.5185  340.370   8.7977  339.788   12.533 0.5811462 15.31288 
1 1 1   17   14   23 o  391.795   6.1633  117.569   3.6961  123.373   5.2523  111.876   5.2022  401.204   8.5529  382.029   8.8966 19.17542 12.34103 
1 1 1   17   14   24 o  103.715   15.514   8.4561   2.3871   7.2789   3.2445   9.8453   3.5246   95.108   22.618  111.010   21.520 -15.90206 31.22034 
1 1 1   17   14   25 o  527.865   6.9914  213.498   5.6488  218.473   7.6979  207.693   8.3150  533.726   9.4229  520.266   10.442 13.46069 14.06475 
1 1 1   17   14   26 o  396.891   6.9255  120.704   4.2072  124.119   5.3838  115.347   6.7428  402.319   8.7427  387.578   11.366 14.74133 14.33958 
1 1 1   17   14   27 o  112.984   15.219   10.007   2.5650   11.545   3.6769   8.5480   3.5799  120.465   20.687  102.918   23.271 17.54702 31.13659 
1 1 1   17   14   28 o  324.954   8.2285   80.978   4.0927   77.131   7.6289   82.533   4.8496  316.284   15.759  327.932   9.6617 -11.64786 18.48465 
1 1 1   17   14   29 o  315.603   7.1260   76.354   3.4424   75.602   5.0193   77.022   4.7300  313.750   10.452  316.754   9.7560 -3.004791 14.29757 
1 1 1   17   14   30 o  414.364   6.5975  131.602   4.1844  137.219   6.1665  126.807   5.6965  422.769   9.5294  406.462   9.1563 16.30716 13.21545 
1 1 1   17   14   31 o   85.369   21.470   5.8922   2.8027   2.8748   4.2163   8.2811   3.7516   71.882   27.481  100.923   24.526 -29.04189 36.83390 
1 1 1   17   14   32 o  189.181   12.341   27.674   3.5540   28.497   4.6104   26.469   5.5791  191.353   15.885  183.409   20.209 7.943817 25.70475 
1 1 1   17   14   33 o  118.912   16.043   11.134   2.8455   9.0541   4.9616   12.153   3.4734  105.242   29.574  123.692   18.950 -18.45023 35.12474 
1 1 1   17   14   34 o  246.454   9.2954   46.675   3.5065   53.996   6.0283   42.931   4.3108  263.810   14.991  235.748   11.986 28.06131 19.19358 
1 1 1   17   14   35 f  135.852   15.112   14.459   3.0892   8.4221   4.7918   18.753   4.0410  101.436   29.252  154.412   17.401 -52.97578 34.03620 
1 1 1   17   14   36 o  279.397   8.5786   59.986   3.6687   60.817   5.5495   59.341   4.8896  280.602   12.921  277.439   11.514 3.162567 17.30674 
1 1 1   17   14   37 o  175.445   15.079   24.047   4.0100   44.517   13.845   22.172   4.1896  227.241   41.326  168.075   16.498 59.16595 44.49741 
1 1 1   17   14   38 o   93.662   24.395   7.2235   3.5321   6.8067   9.2544   7.2946   3.8214  104.002   40.459   94.100   25.773 9.901939 47.97018 
1 1 1   17   14   39 o  118.803   17.860   11.262   3.1472   14.782   5.2342   9.2681   3.9388  133.766   26.501  105.877   24.749 27.88918 36.26070 
1 1 1   17   14   40 o  153.507   15.104   18.496   3.5028   23.679   5.9188   15.702   4.3456  171.269   23.173  139.657   20.977 31.61174 31.25735 
1 1 1   17   14   41 o  306.190   10.691   72.371   5.0104   84.035   11.229   69.472   5.5986  324.359   22.762  299.603   12.208 24.75558 25.82945 
1 1 1   17   14   42 o  227.626   14.240   40.450   4.9364   46.329   6.9558   34.484   7.0069  241.898   18.938  207.041   22.471 34.85701 29.38682 
1 1 1   17   14   43 o  218.887   12.779   37.299   4.2627   36.722   6.9811   37.641   5.3827  213.873   21.623  218.785   16.189 -4.912720 27.01122 
1 1 1   17   14   44 o  247.560   11.677   47.484   4.4247   44.075   7.1482   49.602   5.6338  234.959   20.069  251.724   14.686 -16.76462 24.86823 
1 1 1   17   14   45 o  426.210   10.015  140.366   6.5333  141.924   8.8651  138.514   9.6658  426.866   13.568  420.891   15.004 5.975159 20.22878 
1 1 1   17   14   46 o  206.918   14.150   33.582   4.4545   35.686   7.0498   32.185   5.7472  209.674   22.309  200.637   18.938 9.037521 29.26373 
1 1 1   17   14   47 o  106.029   21.786   9.3432   3.4174   6.8917   7.0142   10.106   3.9133   95.226   35.660  109.596   23.993 -14.37045 42.98021 
1 1 1   17   14   48 o  238.010   10.588   43.937   3.8573   48.566   8.0785   42.570   4.3901  244.215   21.842  233.421   12.331 10.79437 25.08281 
1 1 1   17   14   49 o  112.838   21.772   10.641   3.6242  -2.5482   7.8059   14.265   4.0919   71.178   32.441  131.400   21.056 -60.22143 38.67536 
1 1 1   17   14   50 o  117.007   19.940   11.334   3.4431   12.233   6.2780   10.947   4.1175  115.327   33.547  112.942   24.521 2.384811 41.55371 
1 1 1   17   14   51 o  128.303   18.555   13.500   3.5381   11.622   6.4505   14.308   4.2314  111.585   34.376  130.508   21.962 -18.92269 40.79263 
1 1 1   17   14   52 o  133.125   19.562   14.693   3.8671   12.391   6.2351   16.131   4.9299  114.535   33.465  136.854   24.431 -22.31904 41.43439 
1 1 1   17   14   53 o  108.630   27.603   10.729   4.5991  -0.6416   8.2355   15.882   5.5442   74.047   33.583  132.358   28.228 -58.31167 43.87046 
1 1 1   17   14   54 o  104.621   22.117   9.5326   3.4310   7.9364   5.5836   10.501   4.3490   92.053   32.174  107.278   26.614 -15.22421 41.75442 
1 1 1   17   14   55 o   77.406   25.001   5.3245   3.3744   5.2702   5.2535   5.3626   4.4027   79.457   30.602   78.485   28.447 0.9718246 41.78177 
1 1 1   17   15    1 o  374.539   7.2663  107.409   4.1656  107.017   4.9066  108.422   7.8833  373.819   8.5753  376.071   13.695 -2.252258 16.15839 
1 1 1   17   15    2 o  839.512   9.4550  539.815   12.149  539.815   12.149   0.0000   0.0000  839.512   9.4550  ?   ?  0.000000 9.454970 
1 1 1   17   15    3 o  1014.08   10.543  787.820   16.365  787.820   16.365   0.0000   0.0000  1014.08   10.543  ?   ?  0.000000 10.54290 
1 1 1   17   15    4 o  605.155   7.0468  280.396   6.5272  285.064   7.7963  269.454   11.936  610.116   8.3485  592.893   13.152 17.22229 15.57819 
1 1 1   17   15    5 o  607.545   7.1110  282.619   6.6127  277.438   7.6971  297.218   12.921  601.897   8.3548  622.653   13.558 -20.75586 15.92545 
1 1 1   17   15    6 o  919.420   8.2943  647.365   11.672  651.296   14.065  638.670   20.921  922.074   9.9657  912.555   14.978 9.518921 17.99021 
1 1 1   17   15    7 o  644.603   6.4586  318.126   6.3724  321.965   7.2235  304.653   13.532  648.446   7.2778  630.337   14.025 18.10895 15.80108 
1 1 1   17   15    8 o  876.439   7.1981  588.171   9.6563  589.159   10.995  584.836   20.193  877.110   8.1898  873.196   15.108 3.913391 17.18520 
1 1 1   17   15    9 f  810.465   6.9744  502.945   8.6519  501.766   9.7800  507.190   18.556  809.459   7.8936  813.169   14.909 -3.710022 16.86962 
1 1 1   17   15   10 o  901.313   7.3264  622.059   10.107  623.100   11.501  618.529   21.186  901.993   8.3300  897.899   15.415 4.094177 17.52184 
1 1 1   17   15   11 o  180.405   18.909   25.274   5.1439   24.103   6.4020   27.407   8.6404  175.234   24.542  185.763   31.515 -10.52921 39.94320 
1 1 1   17   15   12 o  1225.12   10.424  1150.06   19.548  1159.79   24.084  1131.27   33.465  1229.92   12.793  1213.62   18.015 16.29565 22.09549 
1 1 1   17   15   13 o  144.980   18.406   16.406   3.9924   17.461   4.4765   12.301   8.8263  149.379   20.088  126.713   40.382 22.66590 45.10266 
1 1 1   17   15   14 o  252.184   12.375   48.762   4.7767   50.504   5.4885   43.322   9.6991  256.199   14.050  235.296   27.447 20.90327 30.83351 
1 1 1   17   15   15 o  711.914   8.5094  388.238   9.2725  391.435   11.086  380.793   16.918  714.701   10.134  704.271   15.694 10.43005 18.68146 
1 1 1   17   15   16 o  461.368   6.8572  163.009   4.8424  165.831   5.2715  147.762   12.254  465.319   7.4013  438.407   18.262 26.91174 19.70459 
1 1 1   17   15   17 o  729.237   10.307  407.612   11.505  407.612   11.505   0.0000   0.0000  729.237   10.307  ?   ?  0.000000 10.30740 
1 1 1   17   15   18 o  507.525   6.9805  197.281   5.4226  197.158   5.8535  198.020   14.400  507.336   7.5380  507.313   18.544 0.2328491E-01 20.01790 
1 1 1   17   15   19 o  207.906   8.6740   33.122   2.7603   31.335   3.1579   38.909   5.6825  201.909   10.252  224.350   16.667 -22.44043 19.56751 
1 1 1   17   15   20 o  406.657   6.5335  126.657   4.0667  124.807   4.8850  130.834   7.3401  403.605   7.9074  412.968   11.612 -9.363098 14.04897 
1 1 1   17   15   21 o  297.526   7.3946   67.818   3.3675   69.168   4.0143   64.613   6.1867  300.409   8.7302  290.022   13.937 10.38794 16.44532 
1 1 1   17   15   22 o  497.909   7.1648  189.933   5.4604  189.722   5.9514  191.055   13.728  497.582   7.8142  497.970   18.011 -0.3883972 19.63282 
1 1 1   17   15   23 o  172.280   12.397   22.910   3.2473   24.967   3.4258   4.6973   10.193  179.872   12.521  104.750   41.924 75.12192 43.75397 
1 1 1   17   15   24 o  129.054   14.866   12.981   2.8828   12.663   3.3607   13.865   5.6082  126.946   17.784  130.839   28.785 -3.892464 33.83605 
1 1 1   17   15   25 o  305.616   7.1864   71.577   3.3617   70.130   4.8471   72.918   4.6663  302.284   10.476  308.282   9.8891 -5.997803 14.40632 
1 1 1   17   15   26 o  246.740   7.7842   46.672   2.9398   44.498   4.1002   48.972   4.2174  240.713   11.129  252.541   10.910 -11.82829 15.58463 
1 1 1   17   15   27 o  455.722   7.0982  159.182   4.9513  168.725   9.0142  155.059   5.9251  468.431   12.572  449.622   8.6095 18.80917 15.23757 
1 1 1   17   15   28 o  281.750   7.4369   60.860   3.2072   59.318   4.5965   62.324   4.4772  277.884   10.807  284.888   10.267 -7.004456 14.90644 
1 1 1   17   15   29 o  518.721   6.1058  206.188   4.8479  220.575   7.1486  193.939   6.5964  536.157   8.7108  502.764   8.5719 33.39301 12.22111 
1 1 1   17   15   30 o  289.009   8.0523   64.077   3.5620   69.830   4.9743   58.022   5.1032  301.419   10.782  274.597   12.142 26.82172 16.23776 
1 1 1   17   15   31 o  497.547   7.1563  189.842   5.4500  185.571   6.9047  196.902   8.8762  491.595   9.1763  505.907   11.463 -14.31192 14.68329 
1 1 1   17   15   32 o  264.354   8.4368   53.646   3.4138   56.759   5.5250   51.723   4.3417  271.304   13.305  259.305   10.939 11.99963 17.22433 
1 1 1   17   15   33 o  389.335   6.9395  116.267   4.1354  120.760   6.2932  112.852   5.4863  396.241   10.376  383.227   9.3530 13.01474 13.96946 
1 1 1   17   15   34 o  122.682   15.736   11.845   2.8869   15.477   4.4312   9.1662   3.8052  139.093   21.508  105.911   24.025 33.18185 32.24560 
1 1 1   17   15   35 o   81.851   24.202   5.3821   3.2439   6.7800   7.8454   5.0938   3.5627  100.603   37.706   80.644   25.652 19.95933 45.60402 
1 1 1   17   15   36 o   46.367   21.170  -2.0658   3.3425 -11.4990   8.4734  -0.3274   3.6375   62.600   30.111   54.517   23.621 8.082970 38.27069 
1 1 1   17   15   37 o  335.070   9.3265   86.392   4.7833   80.596   7.0276   91.395   6.5290  322.472   14.238  343.918   12.403 -21.44650 18.88247 
1 1 1   17   15   38 o  150.751   14.234   17.775   3.2455   17.164   5.2740   18.147   4.1173  145.106   24.626  151.343   18.135 -6.237061 30.58330 
1 1 1   17   15   39 o  150.055   15.161   17.677   3.4345   12.421   5.6320   20.789   4.3335  121.271   30.399  162.142   17.751 -40.87096 35.20269 
1 1 1   17   15   40 o  296.167   12.565   67.914   5.6961   72.168   11.100   66.394   6.6365  299.679   24.412  291.785   14.909 7.893524 28.60468 
1 1 1   17   15   41 o  113.867   23.448   10.690   3.9507   9.5366   6.0206   11.561   5.2355  106.610   33.271  116.852   29.320 -10.24197 44.34671 
1 1 1   17   15   42 o  203.655   13.315   32.339   4.1276   29.922   6.2206   34.240   5.5171  193.050   21.413  208.223   17.472 -15.17329 27.63661 
1 1 1   17   15   43 o  284.933   10.211   62.705   4.4532   60.886   6.9923   63.946   5.7760  278.285   16.489  286.877   13.154 -8.591309 21.09333 
1 1 1   17   15   44 o   59.334   26.372  -1.1665   4.8027  -0.0081   6.6327  -2.4434   6.9633   72.835   31.726   68.690   31.042 4.145119 44.38649 
1 1 1   17   15   45 o  105.369   24.925   9.3482   3.9571   6.5520   6.3330   11.139   5.0682   92.970   34.053  113.876   28.999 -20.90596 44.72779 
1 1 1   17   15   46 o  300.783   10.443   70.040   4.8079   74.026   7.6103   67.393   6.2025  306.323   16.290  293.793   13.793 12.52997 21.34483 
1 1 1   17   15   47 o  139.305   22.580   16.045   4.6498   8.1202   7.6197   20.747   5.8693  100.615   37.267  157.471   25.201 -56.85680 44.98806 
1 1 1   17   15   48 o   96.846   27.853   8.1087   4.3499   11.823   7.7640   6.4093   5.2515  113.960   37.986   88.793   31.193 25.16746 49.15210 
1 1 1   17   15   49 f  175.623   13.243   24.303   3.5338   25.153   6.5046   23.948   4.2091  172.416   25.409  173.170   16.062 -0.7546082 30.06068 
1 1 1   17   15   50 o  173.409   15.634   24.027   4.1051   23.749   6.5354   24.208   5.2758  166.141   26.597  171.546   20.498 -5.405243 33.57943 
1 1 1   17   15   51 o   98.539   25.847   8.5298   3.9468   12.577   6.3235   5.9471   5.0515  115.795   33.664   84.839   30.510 30.95609 45.43265 
1 1 1   17   15   52 o   52.277   23.098  -0.4205   3.6311   6.2358   8.2852  -2.0030   4.0397   91.325   37.340   50.374   23.102 40.95027 43.90879 
1 1 1   17   15   53 o   98.586   24.090   8.6106   3.6043  -3.7041   5.8418   16.180   4.5800   57.050   26.713  137.109   22.612 -80.05959 34.99838 
1 1 1   17   15   54 o   78.513   25.885   5.4511   3.6089   8.3925   5.6670   3.4443   4.6809   93.652   32.431   71.024   28.416 22.62757 43.11883 
1 1 1   17   15   55 f   60.069   23.971   2.2256   3.3220   6.7117   5.6435  -0.1530   4.1094   85.595   32.000   55.180   24.467 30.41494 40.28129 
1 1 1   17   16    1 o  670.385   8.7860  344.202   9.0154  344.202   9.0154   0.0000   0.0000  670.385   8.7860  ?   ?  0.000000 8.786032 
1 1 1   17   16    2 o  431.478   7.1727  142.553   4.7371  139.916   5.5289  149.833   9.1867  427.428   8.4509  442.073   13.577 -14.64523 15.99201 
1 1 1   17   16    3 o  681.850   7.3011  355.995   7.6198  359.367   9.1774  348.511   13.672  684.993   8.7531  674.241   13.248 10.75269 15.87821 
1 1 1   17   16    4 o  743.314   7.5436  423.086   8.5826  424.257   10.293  420.416   15.546  744.250   9.0360  740.483   13.716 3.767334 16.42490 
1 1 1   17   16    5 o  1117.30   9.3549  956.221   15.998  970.710   19.679  927.982   27.473  1125.49   11.424  1099.69   16.322 25.79846 19.92235 
1 1 1   17   16    6 o  569.072   7.2567  247.975   6.3208  253.878   7.4791  233.219   11.824  575.749   8.4868  551.477   14.008 24.27185 16.37849 
1 1 1   17   16    7 o  861.387   7.1619  568.157   9.4427  559.306   10.632  601.212   20.547  854.586   8.1281  885.269   15.164 -30.68292 17.20476 
1 1 1   17   16    8 o  651.363   6.5788  324.852   6.5590  328.635   7.4318  311.524   13.949  655.104   7.4117  637.313   14.300 17.79047 16.10643 
1 1 1   17   16    9 o  654.828   6.6185  328.324   6.6337  335.771   7.5644  303.524   13.804  662.170   7.4634  629.054   14.337 33.11554 16.16327 
1 1 1   17   16   10 o  162.678   12.544   20.410   3.0993   22.446   3.3874   9.9386   7.6803  170.596   13.072  115.242   37.751 55.35453 39.94965 
1 1 1   17   16   11 f  598.246   10.377  274.251   9.5018  278.677   13.055  269.266   13.856  602.727   14.151  592.346   15.282 10.38068 20.82785 
1 1 1   17   16   12 o  374.388   9.1710  107.382   5.2554  109.300   6.1099  101.927   10.304  377.653   10.570  363.707   18.571 13.94556 21.36797 
1 1 1   17   16   13 o  233.622   12.781   41.982   4.5529   41.570   5.2338   43.265   9.2311  232.267   14.799  235.339   26.064 -3.071732 29.97241 
1 1 1   17   16   14 o  181.538   16.124   25.508   4.4338   25.477   4.9684   25.628   9.8257  181.156   18.163  178.136   37.235 3.019806 41.42880 
1 1 1   17   16   15 o  932.478   9.1625  666.252   13.077  659.543   15.694  681.493   23.654  927.518   11.055  941.837   16.408 -14.31891 19.78461 
1 1 1   17   16   16 o  287.083   13.518   63.250   5.9401   63.250   5.9401   0.0000   0.0000  287.083   13.518  ?   ?  0.000000 13.51820 
1 1 1   17   16   17 o  321.977   12.539   79.542   6.1795   79.542   6.1795   0.0000   0.0000  321.977   12.539  ?   ?  0.000000 12.53886 
1 1 1   17   16   18 o  436.762   6.9817  146.115   4.6674  146.430   5.0025  143.997   12.971  437.206   7.4754  432.334   19.601 4.871796 20.97789 
1 1 1   17   16   19 o  230.209   8.2023   40.609   2.8902   42.979   3.3278   33.332   5.8309  236.795   9.1815  207.217   18.582 29.57799 20.72612 
1 1 1   17   16   20 o  333.727   7.7478   85.337   3.9577   85.078   4.2116   87.292   11.572  333.193   8.2582  335.283   22.683 -2.090088 24.13947 
1 1 1   17   16   21 o  315.187   8.0384   76.133   3.8780   75.070   4.0978   85.250   12.003  312.952   8.5546  330.937   23.855 -17.98581 25.34265 
1 1 1   17   16   22 o  414.379   6.6128  131.543   4.1942  125.233   5.0085  146.355   7.6740  404.220   8.0950  436.652   11.482 -32.43198 14.04863 
1 1 1   17   16   23 o  404.813   6.7777  125.555   4.1996  126.518   5.0650  123.437   7.5121  406.261   8.1452  400.877   12.243 5.384460 14.70485 
1 1 1   17   16   24 o  396.194   7.3828  120.302   4.4771  120.414   5.6590  120.116   7.3199  396.208   9.3314  395.413   12.094 0.7952576 15.27583 
1 1 1   17   16   25 o   65.850   22.261   3.1366   2.6666   5.5265   3.1369  -3.0893   5.0630   83.237   23.559   57.385   26.144 25.85240 35.19275 
1 1 1   17   16   26 o  197.930   11.239   30.191   3.3908   24.941   6.3292   32.305   4.0157  177.500   23.904  204.546   12.892 -27.04604 27.15890 
1 1 1   17   16   27 o  286.591   7.2754   62.965   3.1915   64.184   4.4980   61.729   4.5290  289.120   10.164  283.511   10.437 5.608215 14.56819 
1 1 1   17   16   28 o  497.736   6.1104  189.842   4.6552  203.859   6.8316  177.692   6.3606  515.451   8.6590  481.238   8.6351 34.21274 12.22876 
1 1 1   17   16   29 o  424.709   7.3513  138.320   4.7789  147.272   6.0097  122.924   7.8813  438.026   8.9636  399.555   12.887 38.47101 15.69774 
1 1 1   17   16   30 o  499.057   8.3794  191.137   6.4008  194.677   7.8458  184.091   11.068  503.326   10.184  488.341   14.808 14.98541 17.97155 
1 1 1   17   16   31 o  235.485   8.9505   42.583   3.2261   46.937   5.0577   39.597   4.1890  246.346   13.464  226.438   12.130 19.90765 18.12271 
1 1 1   17   16   32 o   68.280   21.990   3.5624   2.6119   1.9359   4.0646   4.7064   3.4089   66.655   26.542   78.106   25.118 -11.45137 36.54274 
1 1 1   17   16   33 o  271.847   8.0866   56.740   3.3648   59.965   5.0852   54.228   4.4878  278.942   11.910  265.392   11.048 13.55054 16.24522 
1 1 1   17   16   34 o  208.803   11.581   33.706   3.6869   42.483   8.1309   31.434   4.1366  231.230   23.290  201.251   13.507 29.97871 26.92378 
1 1 1   17   16   35 o  376.273   8.4110  108.795   4.8442  107.976   9.6369  109.072   5.6036  372.567   16.899  376.495   9.7239 -3.927765 19.49693 
1 1 1   17   16   36 o  331.834   8.1039   84.613   4.1161   80.145   6.6840   87.342   5.2241  321.784   13.571  336.761   10.135 -14.97614 16.93761 
1 1 1   17   16   37 o   66.026   23.238   3.0889   2.9154   2.9312   4.6737   3.1893   3.7300   73.639   28.723   70.321   26.069 3.318481 38.78883 
1 1 1   17   16   38 o  123.386   17.440   12.111   3.2019   10.433   4.9562   13.313   4.1948  111.575   28.818  128.099   22.199 -16.52333 36.37693 
1 1 1   17   16   39 o   48.095   21.792  -1.7638   3.4578  -3.3109   5.1837  -0.5236   4.6412   56.768   26.083   60.654   26.476 -3.886311 37.16645 
1 1 1   17   16   40 o   56.097   24.948  -1.2378   4.3043  -9.5605   9.4871   0.9194   4.8300   69.680   33.056   66.470   27.955 3.210617 43.29128 
1 1 1   17   16   41 f  169.699   14.144   22.543   3.6403   32.424   5.9511   16.635   4.6017  201.895   19.500  143.320   21.652 58.57503 29.13873 
1 1 1   17   16   42 o  280.017   10.455   60.572   4.4812   61.614   6.8059   59.775   5.9539  280.273   15.931  276.775   14.101 3.498810 21.27494 
1 1 1   17   16   43 o  184.324   16.830   26.876   4.6960   32.119   6.3132   20.382   7.0260  199.946   20.939  154.464   30.798 45.48221 37.24192 
1 1 1   17   16   44 o  203.757   16.088   32.753   4.9768   28.893   6.5123   38.173   7.7162  188.340   23.073  216.482   23.673 -28.14264 33.05696 
1 1 1   17   16   45 o  172.260   15.501   23.442   4.0434   20.209   6.4317   25.554   5.1993  154.405   28.256  178.413   19.349 -24.00810 34.24579 
1 1 1   17   16   46 o   76.817   27.455   4.4193   4.0846  -0.0653   6.5887   7.2187   5.2057   71.830   31.445   93.161   31.106 -21.33112 44.23106 
1 1 1   17   16   47 o  285.948   10.781   63.454   4.7186   66.600   7.1686   61.049   6.2680  290.025   16.213  278.441   14.760 11.58337 21.92535 
1 1 1   17   16   48 o  172.630   21.548   24.501   5.5698   23.662   7.4305   25.576   8.4148  164.093   30.713  168.549   33.794 -4.455338 45.66497 
1 1 1   17   16   49 o  230.048   18.862   42.822   6.5833   35.911   9.2897   49.794   9.3308  201.596   31.107  242.983   25.467 -41.38669 40.20191 
1 1 1   17   16   50 o  127.265   22.128   13.633   4.1540   18.592   6.1446   9.4592   5.6373  145.060   28.691  102.106   32.245 42.95435 43.16102 
1 1 1   17   16   51 o   70.780   27.182   3.4785   4.1369   1.2932   5.9637   5.5053   5.7434   70.504   30.396   84.020   32.085 -13.51616 44.19713 
1 1 1   17   16   52 o   88.650   29.859   7.0550   4.7971   18.268   8.8534   2.3949   5.7075  131.689   40.223   72.019   30.343 59.66977 50.38485 
1 1 1   17   16   53 o   43.086   20.991  -6.7651   4.4666  -2.0767   5.5517 -15.3691   7.5208   58.692   26.977   49.904   24.848 8.788002 36.67691 
1 1 1   17   16   54 o   59.889   25.208   1.4415   3.9331   8.4775   5.6331  -5.2517   5.4941   93.631   32.339   51.706   24.704 41.92498 40.69527 
1 1 1   17   17    0 o  1505.50   20.160  1739.26   46.437  1739.26   46.437  1739.26   46.437  1505.50   20.160  1505.50   20.160 0.000000 0.000000 
1 1 1   17   17    1 o  1015.88   10.818  790.797   16.822  784.362   23.439  797.632   24.155  1011.14   15.145  1019.60   15.478 -8.462708 21.65488 
1 1 1   17   17    2 o  662.520   9.0320  336.213   9.1591  355.382   13.160  318.206   12.755  680.862   12.628  644.240   12.935 36.62213 18.07700 
1 1 1   17   17    3 o  501.423   7.1998  192.526   5.5258  183.195   6.4201  219.196   10.854  489.065   8.5764  534.672   13.263 -45.60703 15.79414 
1 1 1   17   17    4 o  378.079   7.5232  109.464   4.3536  107.516   5.0609  115.010   8.5386  374.657   8.8252  387.221   14.406 -12.56381 16.89472 
1 1 1   17   17    5 o  339.507   7.9911   88.276   4.1526   88.456   4.8025   87.744   8.2667  339.812   9.2334  338.127   15.973 1.685120 18.44966 
1 1 1   17   17    6 o  120.421   17.286   11.361   3.0947   9.9553   3.4146   17.826   7.3230  112.031   20.674  148.853   33.007 -36.82134 38.94709 
1 1 1   17   17    7 o  266.053   8.0106   54.212   3.2621   52.736   3.5572   62.022   8.1805  262.383   8.8574  283.466   18.964 -21.08270 20.93027 
1 1 1   17   17    8 o  272.672   8.0207   56.944   3.3475   58.428   3.6635   49.439   8.2397  276.184   8.6662  252.573   21.519 23.61043 23.19810 
1 1 1   17   17    9 o  561.186   7.6400  241.191   6.5626  242.303   7.6881  238.207   12.598  562.404   8.9310  557.161   14.772 5.242737 17.26196 
1 1 1   17   17   10 o  522.245   6.6102  208.847   5.2840  210.441   5.9139  202.537   11.766  524.200   7.3707  513.712   14.963 10.48804 16.68031 
1 1 1   17   17   11 o  192.587   14.031   28.609   4.1077   32.866   4.7200   15.322   8.3391  206.378   15.046  138.065   38.179 68.31293 41.03700 
1 1 1   17   17   12 o  426.524   8.8008  139.376   5.7456  143.472   6.7974  129.127   10.753  432.663   10.264  409.933   17.137 22.72961 19.97557 
1 1 1   17   17   13 o  193.248   14.741   28.836   4.3275   29.687   4.9048   25.844   9.1936  195.880   16.513  179.285   34.757 16.59471 38.48000 
1 1 1   17   17   14 o  489.355   8.6977  183.480   6.5148  181.333   7.5955  189.455   12.672  486.379   10.203  496.496   16.674 -10.11765 19.54790 
1 1 1   17   17   15 o  173.093   17.080   23.258   4.4662   22.502   5.0292   26.080   9.7142  169.821   19.715  179.570   36.585 -9.749329 41.55895 
1 1 1   17   17   16 o  770.937   10.522  455.718   12.416  455.718   12.416   0.0000   0.0000  770.937   10.522  ?   ?  0.000000 10.52213 
1 1 1   17   17   17 o  577.561   8.7594  255.645   7.7436  250.934   9.0247  268.795   15.078  572.062   10.307  591.156   16.663 -19.09393 19.59321 
1 1 1   17   17   18 o  222.708   14.343   38.265   4.8632   38.643   5.5449   37.006   10.124  223.547   16.318  215.689   31.603 7.858368 35.56738 
1 1 1   17   17   19 o  260.495   8.5623   52.010   3.4139   53.317   3.5909   39.726   11.011  263.730   8.8956  223.048   33.269 40.68262 34.43819 
1 1 1   17   17   20 o  406.633   6.6044  126.665   4.1106  128.737   4.8929  121.694   7.5786  409.868   7.7992  398.091   12.438 11.77667 14.68067 
1 1 1   17   17   21 o  142.741   11.915   15.753   2.5795   16.940   2.9506   11.903   5.3126  147.901   13.172  121.160   29.028 26.74072 31.87646 
1 1 1   17   17   22 o  379.562   6.7558  110.382   3.9249  109.043   4.6505  113.696   7.3174  377.163   8.0556  384.698   12.427 -7.534973 14.80960 
1 1 1   17   17   23 o  193.995   10.126   28.959   2.9962   30.056   3.5509   26.246   5.5827  197.460   11.803  183.108   20.258 14.35124 23.44585 
1 1 1   17   17   24 o  280.206   8.0812   60.200   3.4660   59.867   4.0922   61.048   6.5192  279.323   9.5716  281.108   15.208 -1.784119 17.96934 
1 1 1   17   17   25 o  341.287   9.7054   89.395   5.0700   83.996   7.2574   94.541   7.0856  330.265   14.357  350.551   13.206 -20.28549 19.50641 
1 1 1   17   17   26 o   92.613   20.409   6.9066   2.8151   8.9651   3.3255   1.7016   5.2880  105.634   21.303   73.123   29.857 32.51083 36.67757 
1 1 1   17   17   27 o  342.618   6.5930   89.972   3.4575   91.902   4.8630   88.000   4.9168  346.030   9.1817  338.571   9.4877 7.459076 13.20304 
1 1 1   17   17   28 o  382.880   8.0609  112.461   4.7241  114.522   6.1742  109.551   7.3370  386.059   10.449  377.225   12.707 8.832977 16.45127 
1 1 1   17   17   29 f  374.302   8.6649  107.539   4.9643  110.707   5.9556  100.327   8.9859  379.552   10.252  360.187   16.299 19.36441 19.25501 
1 1 1   17   17   30 o  206.631   8.9066   32.786   2.8169   33.010   4.1978   32.602   3.7994  206.486   13.353  205.405   12.139 1.081360 18.04600 
1 1 1   17   17   31 o  359.883   6.8585   99.332   3.7780   99.000   5.5525   99.618   5.1553  358.832   10.109  360.071   9.3540 -1.239075 13.77310 
1 1 1   17   17   32 o  270.863   9.6785   56.406   4.0126   58.805   8.4858   55.715   4.5539  273.710   20.402  269.011   11.060 4.699341 23.20651 
1 1 1   17   17   33 o   76.426   24.187   4.5608   3.1706  -3.8085   7.3753   6.4582   3.5117   69.466   31.611   89.089   24.826 -19.62257 40.19471 
1 1 1   17   17   34 o  165.980   11.448   21.339   2.8905   17.554   4.2621   24.563   3.9334  148.761   19.164  177.501   14.607 -28.73943 24.09594 
1 1 1   17   17   35 o   66.188   22.083   3.2877   2.6238   5.7924   4.0741   1.5126   3.4297   85.643   27.451   60.548   24.288 25.09558 36.65337 
1 1 1   17   17   36 o  115.120   17.168   10.546   2.9326   13.503   4.7711   8.7507   3.7178  128.240   25.205  103.087   24.009 25.15250 34.81005 
1 1 1   17   17   37 o  279.621   8.7366   60.144   3.7392   58.698   5.6970   61.239   4.9561  275.262   13.522  281.630   11.497 -6.368469 17.74894 
1 1 1   17   17   38 o   50.550   22.085  -0.5017   3.2353   3.0551   4.8487  -3.3562   4.3438   74.785   29.232   50.753   23.518 24.03116 37.51767 
1 1 1   17   17   39 o  106.159   24.530   9.3463   3.9059 -11.6881   9.1636   14.016   4.3178   65.325   31.395  131.289   22.283 -65.96445 38.49891 
1 1 1   17   17   40 o  334.861   8.7553   86.338   4.4875   81.749   6.7216   90.029   6.0276  324.478   13.534  341.182   11.542 -16.70401 17.78711 
1 1 1   17   17   41 o   75.973   25.480   4.4618   3.4931   2.7474   5.2794   5.7966   4.6585   75.172   30.142   86.204   29.423 -11.03209 42.12133 
1 1 1   17   17   42 o  118.680   21.114   11.502   3.6949   15.810   5.9986   8.8686   4.6903  136.247   29.610  102.328   28.754 33.91855 41.27381 
1 1 1   17   17   43 o  273.242   12.597   57.993   5.2686   56.740   6.8436   59.818   8.2552  268.282   16.749  273.911   19.824 -5.628967 25.95271 
1 1 1   17   17   44 o   97.440   25.075   8.0025   3.7616   4.4809   5.9959   10.288   4.8304   83.947   32.591  109.569   28.524 -25.62228 43.31053 
1 1 1   17   17   45 f  204.087   13.899   32.679   4.3161   36.123   7.0744   30.637   5.4473  210.727   22.270  195.783   18.393 14.94429 28.88411 
1 1 1   17   17   46 o  182.414   18.145   26.667   4.9989   18.590   6.2308   41.259   8.3745  147.011   28.720  223.178   24.942 -76.16771 38.03861 
1 1 1   17   17   47 o  300.143   14.948   70.900   6.8673   50.247   10.137   88.420   9.3362  243.554   27.683  332.370   18.424 -88.81593 33.25367 
1 1 1   17   17   48 o  158.951   24.576   21.323   5.7863   0.0000   0.0000   21.323   5.7863  ?   ?   158.951   24.576 0.000000 24.57617 
1 1 1   17   17   49 o  143.878   19.561   17.000   4.1962   14.788   6.1183   18.966   5.7659  127.556   31.520  148.269   26.373 -20.71279 41.09781 
1 1 1   17   17   50 o   90.429   27.187   7.1892   4.0680   3.4112   5.9031   10.606   5.6140   77.175   31.533  107.318   31.864 -30.14314 44.82865 
1 1 1   17   17   51 o  183.490   15.760   27.117   4.3833   23.957   6.1699   30.337   6.2284  166.383   25.000  190.016   21.810 -23.63275 33.17645 
1 1 1   17   17   52 o  100.328   32.870   9.6520   5.8227   15.011   8.0816   3.8672   8.3965  119.711   38.693   83.916   36.124 35.79414 52.93466 
1 1 1   17   17   53 o   78.202   27.605   5.3105   4.1169   3.7566   5.7150   6.9868   5.9356   75.400   30.942   87.804   32.819 -12.40430 45.10509 
1 1 1   17   18    0 o  452.020   12.731  156.891   8.7925  156.891   8.7925  156.891   8.7925  452.020   12.731  452.020   12.731 0.000000 0.000000 
1 1 1   17   18    1 o  568.326   8.7848  247.417   7.6418  242.913   10.583  252.325   11.046  562.883   12.283  573.659   12.580 -10.77576 17.58262 
1 1 1   17   18    2 o  203.646   10.700   31.870   3.3237   34.225   3.8813   25.392   6.4360  210.946   12.071  179.987   23.957 30.95900 26.82607 
1 1 1   17   18    3 o  204.862   10.750   32.252   3.3590   31.895   3.9337   33.213   6.4542  203.556   12.689  206.779   20.669 -3.222977 24.25319 
1 1 1   17   18    4 o  108.432   25.598   9.4319   4.1803   11.294   5.2772   6.2954   6.8492  118.543   29.261   98.335   35.505 20.20824 46.00914 
1 1 1   17   18    5 o  455.759   9.5071  159.145   6.6321  144.562   8.6259  180.232   10.372  434.166   12.980  484.699   13.981 -50.53317 19.07740 
1 1 1   17   18    6 o  565.794   9.4140  245.268   8.1527  256.277   11.365  233.596   11.702  578.074   12.844  551.806   13.855 26.26770 18.89273 
1 1 1   17   18    7 o  163.314   14.997   20.643   3.7069   18.162   4.2832   28.047   7.3989  152.572   18.735  188.821   26.316 -36.24867 32.30329 
1 1 1   17   18    8 o  565.304   10.105  244.903   8.7433  224.466   11.867  269.171   12.931  540.831   14.335  592.251   14.265 -51.42053 20.22348 
1 1 1   17   18    9 o  136.659   18.045   14.603   3.6822   14.653   4.1718   14.428   7.8337  136.467   20.615  133.982   36.985 2.484695 42.34268 
1 1 1   17   18   10 o  559.780   8.2114  240.045   7.0356  236.115   8.3126  249.972   13.211  555.067   9.7841  570.580   15.127 -15.51355 18.01502 
1 1 1   17   18   11 o  346.047   9.5065   91.769   5.0353   93.288   5.8860   87.622   9.7235  348.819   11.024  336.943   18.930 11.87585 21.90639 
1 1 1   17   18   12 o  378.516   9.2656  109.797   5.3682  113.944   6.3242   99.104   10.154  385.512   10.718  358.417   18.573 27.09479 21.44360 
1 1 1   17   18   13 o  520.467   8.4600  207.556   6.7396  206.772   7.9286  209.596   12.795  519.366   9.9736  522.232   16.007 -2.866638 18.86010 
1 1 1   17   18   14 o  405.911   9.2724  126.282   5.7609  129.294   6.7196  117.927   11.191  410.624   10.691  391.373   18.682 19.25113 21.52490 
1 1 1   17   18   15 o  381.887   11.099  111.861   6.4876  111.861   6.4876   0.0000   0.0000  381.887   11.099  ?   ?  0.000000 11.09891 
1 1 1   17   18   16 o  219.303   13.930   37.091   4.6515   33.873   5.1966   50.060   10.433  209.219   16.358  252.528   27.433 -43.30928 31.94000 
1 1 1   17   18   17 o  954.320   9.4559  698.251   13.812  706.589   16.782  680.740   24.319  959.604   11.426  940.423   16.895 19.18127 20.39557 
1 1 1   17   18   18 o  238.470   13.804   43.844   5.0170   40.898   5.6632   54.587   10.815  229.965   16.192  263.664   27.188 -33.69879 31.64499 
1 1 1   17   18   19 o  608.570   9.0295  283.963   8.4109  279.023   9.8543  297.218   16.142  603.031   10.676  621.161   16.978 -18.12921 20.05569 
1 1 1   17   18   20 o  170.412   9.9516   22.354   2.5845   24.825   2.9574   14.367   5.3167  179.527   10.813  133.554   26.938 45.97327 29.02734 
1 1 1   17   18   21 o  142.436   11.532   15.681   2.4926   13.963   2.8341   21.547   5.2375  134.017   14.024  165.548   21.153 -31.53110 25.37959 
1 1 1   17   18   22 o  578.747   11.216  257.218   9.9355   0.0000   0.0000  257.218   9.9355  ?   ?   578.747   11.216 0.000000 11.21586 
1 1 1   17   18   23 o  377.123   7.5563  109.024   4.3618  108.752   5.4161  109.526   7.3577  376.482   9.3988  377.418   12.736 -0.9360046 15.82896 
1 1 1   17   18   24 o  421.451   8.6593  136.248   5.5860  128.809   7.6306  144.838   8.1996  409.325   12.179  434.021   12.343 -24.69543 17.34011 
1 1 1   17   18   25 o  485.798   6.6571  180.874   4.9501  175.835   5.9578  192.108   8.8952  478.813   8.1293  499.918   11.625 -21.10446 14.18525 
1 1 1   17   18   26 o  214.308   10.077   35.273   3.3054   37.270   4.0243   31.132   5.7950  219.806   12.007  199.529   19.212 20.27673 22.65567 
1 1 1   17   18   27 o  212.738   10.464   34.777   3.4074   40.760   4.2138   23.474   5.7920  229.853   12.019  172.145   22.522 57.70868 25.52833 
1 1 1   17   18   28 o  187.360   9.2023   26.955   2.6390   29.626   3.6871   24.151   3.7788  195.774   12.368  176.396   14.114 19.37794 18.76628 
1 1 1   17   18   29 o  561.024   6.1314  241.265   5.2652  257.436   7.6812  226.932   7.2313  579.063   8.6663  543.670   8.6899 35.39392 12.27265 
1 1 1   17   18   30 o  231.342   8.4852   41.093   3.0046   39.971   4.2612   42.202   4.2372  227.432   12.286  233.782   11.880 -6.350586 17.09083 
1 1 1   17   18   31 o  521.503   7.3863  208.693   5.8960  223.932   10.835  202.282   7.0275  538.664   13.141  513.113   8.9479 25.55109 15.89849 
1 1 1   17   18   32 o  271.595   7.9183   56.638   3.2917   58.888   4.8297   54.685   4.4983  276.454   11.414  266.464   11.029 9.989563 15.87188 
1 1 1   17   18   33 o   60.995   21.408   2.6069   2.4733   7.1561   3.6809  -1.1377   3.3396   93.442   25.172   49.332   21.956 44.11015 33.40147 
1 1 1   17   18   34 o  138.357   13.219   14.935   2.7654   17.158   3.9383   12.772   3.8839  147.320   17.828  126.003   20.868 21.31640 27.44686 
1 1 1   17   18   35 o  142.211   14.027   15.816   3.0135   16.226   4.7587   15.542   3.8938  141.719   22.704  139.825   18.659 1.894135 29.38799 
1 1 1   17   18   36 o  215.118   10.977   35.789   3.6024   31.797   4.8879   40.535   5.3299  201.536   15.976  227.873   15.371 -26.33672 22.16974 
1 1 1   17   18   37 o  299.150   9.2614   68.902   4.2407   71.155   5.8120   66.336   6.2013  303.251   12.521  292.446   13.854 10.80463 18.67389 
1 1 1   17   18   38 o  181.588   12.189   25.623   3.3681   28.606   5.1594   23.407   4.4462  190.311   17.923  172.252   17.089 18.05902 24.76456 
1 1 1   17   18   39 o  307.022   10.477   72.759   4.9234   86.643   11.225   69.451   5.4786  329.410   22.395  299.580   11.948 29.83017 25.38283 
1 1 1   17   18   40 o  129.890   18.371   13.508   3.5506   7.1308   5.4025   18.357   4.7108   94.307   31.687  150.891   20.963 -56.58365 37.99420 
1 1 1   17   18   41 o  236.989   11.484   43.479   4.1657   44.336   6.0040   42.682   5.7844  237.298   16.635  232.930   16.327 4.368256 23.30924 
1 1 1   17   18   42 o  106.455   27.074   9.5975   4.4217   10.586   5.5950   7.9529   7.2163  110.895   31.491  100.735   36.434 10.16020 48.15667 
1 1 1   17   18   43 o  212.602   12.543   35.239   4.0635   44.950   6.5913   29.285   5.1608  237.891   18.241  191.941   17.768 45.95073 25.46421 
1 1 1   17   18   44 o   74.430   28.664   3.4659   4.6090   1.9810   5.8437   5.9100   7.4970   74.408   30.981   93.365   36.389 -18.95679 47.79077 
1 1 1   17   18   45 o  142.775   22.722   16.837   4.7991   16.252   5.9243   17.954   8.1849  137.211   29.110  139.876   37.474 -2.665146 47.45217 
1 1 1   17   18   46 o   78.861   26.664   4.9923   3.8255   7.4654   5.7400   3.0159   5.1312   94.491   32.644   74.227   29.732 20.26433 44.15470 
1 1 1   17   18   47 o  166.886   17.424   22.395   4.3852   23.482   6.9016   21.658   5.6789  164.817   28.382  160.879   23.778 3.938187 37.02594 
1 1 1   17   18   48 o   84.990   26.972   6.1562   3.9406   6.6890   5.9192   5.7321   5.2809   90.343   32.948   85.003   31.102 5.339767 45.30873 
1 1 1   17   18   49 o   46.843   21.928  -3.2269   3.9319   2.6076   5.9423  -7.7709   5.2441   74.920   31.222   47.304   22.978 27.61565 38.76543 
1 1 1   17   18   50 o   55.946   24.613  -0.2352   4.0808   0.4856   5.8553  -0.9159   5.6904   67.635   29.625   63.151   28.342 4.483994 40.99879 
1 1 1   17   18   51 o   97.078   38.371   8.4477   8.4375   8.4477   8.4375   0.0000   0.0000   97.078   38.371  ?   ?  0.000000 38.37136 
1 1 1   17   18   52 o  201.943   15.733   33.054   4.8246   26.320   6.1651   43.695   7.7497  174.061   23.761  225.832   22.729 -51.77037 32.88112 
1 1 1   17   18   53 o   68.231   26.458   3.4031   3.9477   2.9863   5.5428   3.8322   5.6239   71.974   30.087   75.074   30.738 -3.100311 43.01252 
1 1 1   17   19    0 f  525.508   12.720  211.949   10.218  211.949   10.218  211.949   10.218  525.508   12.720  525.508   12.720 0.000000 0.000000 
1 1 1   17   19    1 o  681.547   9.2039  355.899   9.6015  351.523   13.371  360.558   13.796  676.972   12.904  685.588   13.147 -8.615723 18.42150 
1 1 1   17   19    2 o  513.848   7.3610  202.222   5.7895  197.264   6.9162  213.831   10.583  507.424   8.9049  527.973   13.096 -20.54950 15.83658 
1 1 1   17   19    3 o  930.956   8.5292  663.942   12.154  656.802   14.623  679.893   21.856  925.724   10.320  941.061   15.174 -15.33765 18.35061 
1 1 1   17   19    4 o  341.667   8.1558   89.422   4.2652   86.148   4.9934   98.257   8.2023  335.288   9.7299  357.757   14.979 -22.46924 17.86160 
1 1 1   17   19    5 o  737.665   7.7844  416.801   8.7893  417.077   10.568  416.180   15.830  737.769   9.3584  736.408   14.044 1.361450 16.87614 
1 1 1   17   19    6 o  443.558   9.2980  150.758   6.3126  152.279   8.1112  148.421   10.053  445.614   11.892  439.674   14.938 5.940155 19.09356 
1 1 1   17   19    7 o  546.126   7.7190  228.458   6.4525  228.948   7.6857  227.290   11.877  546.610   9.1862  544.150   14.260 2.460266 16.96230 
1 1 1   17   19    8 o  569.594   6.7133  248.467   5.8529  243.208   6.5117  270.583   13.354  563.483   7.5499  593.633   14.696 -30.14996 16.52235 
1 1 1   17   19    9 o  177.523   11.253   24.263   3.0418   24.022   3.2929   25.665   7.9414  176.537   12.263  179.553   29.951 -3.016510 32.36391 
1 1 1   17   19   10 o  555.994   6.7352  236.756   5.7318  238.214   6.4571  231.337   12.447  557.649   7.5650  548.816   14.818 8.833740 16.63723 
1 1 1   17   19   11 o  657.349   8.3375  331.087   8.3889  331.081   10.142  331.100   14.928  657.165   10.083  656.523   14.855 0.6411133 17.95345 
1 1 1   17   19   12 o  747.260   8.5270  427.897   9.7530  423.837   11.751  436.886   17.485  743.484   10.326  754.027   15.150 -10.54254 18.33416 
1 1 1   17   19   13 o  418.066   10.683  134.042   6.8359  134.042   6.8359   0.0000   0.0000  418.066   10.683  ?   ?  0.000000 10.68265 
1 1 1   17   19   14 o  482.849   10.333  178.796   7.6366  178.796   7.6366   0.0000   0.0000  482.849   10.333  ?   ?  0.000000 10.33276 
1 1 1   17   19   15 o  327.933   10.488   82.486   5.2642   83.194   6.0775   80.356   10.534  329.221   12.061  321.828   21.509 7.393311 24.65930 
1 1 1   17   19   16 o  473.167   9.0485  171.643   6.5533  171.806   7.6586  171.197   12.663  473.241   10.573  471.419   17.550 1.821594 20.48857 
1 1 1   17   19   17 o   60.898   25.925   0.0497   4.2385  -0.7312   4.7923   2.8545   9.0827   62.150   27.020   95.375   39.058 -33.22543 47.49320 
1 1 1   17   19   18 o  293.401   11.620   66.093   5.2183   64.249   5.9663   72.093   10.764  289.121   13.482  304.110   23.303 -14.98862 26.92161 
1 1 1   17   19   19 o  205.717   15.388   32.759   4.8102   29.725   5.4404   43.623   10.295  195.408   18.406  234.528   29.321 -39.12082 34.61956 
1 1 1   17   19   20 o  399.203   10.247  122.302   6.2612  121.801   7.2579  123.762   12.380  398.189   11.908  399.455   20.315 -1.266205 23.54801 
1 1 1   17   19   21 o  239.468   11.802   44.059   4.3258   46.093   6.1414   42.055   6.0940  243.928   16.547  232.827   17.222 11.10138 23.88304 
1 1 1   17   19   22 o  372.625   10.342  106.600   5.8987  122.257   10.615   99.606   7.0950  397.897   17.430  359.881   12.880 38.01575 21.67259 
1 1 1   17   19   23 o  299.260   11.712   68.833   5.3648   72.968   9.5411   66.922   6.4875  306.115   20.481  294.755   14.380 11.35953 25.02507 
1 1 1   17   19   24 o  249.758   9.1717   47.873   3.5062   47.438   4.2229   48.839   6.2910  248.460   11.104  250.962   16.469 -2.502701 19.86251 
1 1 1   17   19   25 o  330.625   7.6033   83.829   3.8477   79.661   4.5593   94.145   7.1724  322.143   9.2466  349.627   13.403 -27.48459 16.28286 
1 1 1   17   19   26 o  164.430   11.341   20.890   2.8369   20.499   3.2513   22.137   5.8072  162.607   13.177  166.849   23.381 -4.242661 26.83848 
1 1 1   17   19   27 o  140.443   13.589   15.345   2.8847   16.512   3.2153   10.532   6.5311  145.551   14.631  113.911   34.493 31.63988 37.46754 
1 1 1   17   19   28 o  307.138   8.5176   72.419   4.0042   69.698   4.5280   82.182   8.5771  301.160   9.8228  325.182   17.295 -24.02228 19.88947 
1 1 1   17   19   29 o  186.501   16.007   27.122   4.5253   31.647   6.7862   23.499   6.0725  199.855   22.580  171.529   23.768 28.32544 32.78376 
1 1 1   17   19   30 o  311.837   8.6798   74.695   4.1429   72.875   8.0631   75.347   4.8291  305.888   17.292  312.996   10.080 -7.108490 20.01569 
1 1 1   17   19   31 o  204.418   9.0677   32.118   2.8372   28.070   3.9316   36.516   4.0983  190.124   13.600  217.221   12.378 -27.09624 18.38926 
1 1 1   17   19   32 o  134.656   12.777   14.126   2.6020   12.121   3.8300   15.845   3.5458  122.700   21.157  141.862   16.646 -19.16197 26.92088 
1 1 1   17   19   33 o  201.364   9.4641   31.198   2.9170   32.990   4.1676   29.477   4.0840  206.122   13.280  194.677   13.795 11.44531 19.14883 
1 1 1   17   19   34 o  193.358   9.9167   28.864   2.9251   30.652   4.2617   27.271   4.0220  198.407   14.125  187.084   14.150 11.32263 19.99385 
1 1 1   17   19   35 o  219.854   10.866   37.278   3.6567   39.124   5.1509   35.403   5.1920  223.943   15.116  212.713   16.065 11.22952 22.05842 
1 1 1   17   19   36 o   72.149   22.742   4.0999   2.8052   6.1816   4.2026   2.4271   3.7673   87.787   27.853   66.657   25.846 21.13020 37.99797 
1 1 1   17   19   37 o  254.230   9.2622   49.773   3.6042   52.297   5.2620   47.543   4.9468  259.416   13.297  247.364   13.112 12.05231 18.67439 
1 1 1   17   19   38 o  210.214   13.464   34.426   4.3094   28.848   9.5976   35.834   4.8229  183.058   35.535  214.099   14.808 -31.04080 38.49673 
1 1 1   17   19   39 o   59.351   22.970   1.9229   2.9712   1.3950   4.4532   2.3464   3.9889   65.883   27.206   67.211   26.441 -1.327766 37.93786 
1 1 1   17   19   40 o  443.678   8.1151  151.506   5.5110  159.053   7.8295  144.094   7.7584  453.406   11.282  431.360   11.751 22.04578 16.28981 
1 1 1   17   19   41 o  310.659   10.978   74.667   5.2200   79.132   6.6263   67.363   8.4745  318.902   13.575  291.335   19.110 27.56708 23.44107 
1 1 1   17   19   42 o   91.421   28.438   6.9492   4.4024   9.2059   5.7047   3.6263   6.9224  103.915   32.380   84.549   34.298 19.36647 47.16761 
1 1 1   17   19   43 o   59.620   26.191  -0.5772   4.6060  -3.5087   5.7705   4.5696   7.6460   59.392   27.374   89.680   36.162 -30.28848 45.35505 
1 1 1   17   19   44 o   90.411   29.068   6.8236   4.5657   4.6220   5.5965   11.204   7.8946   82.693   31.650  112.805   38.303 -30.11174 49.68731 
1 1 1   17   19   45 o   91.285   25.572   7.0918   3.7157   12.162   5.6879   3.3171   4.9076  117.280   31.157   74.578   29.332 42.70148 42.79153 
1 1 1   17   19   46 o   78.579   26.772   4.9673   3.8568   2.8181   5.5545   6.9681   5.3593   75.017   30.612   91.334   31.543 -16.31721 43.95541 
1 1 1   17   19   47 o  137.962   20.421   15.694   4.1821   10.010   6.8484   19.074   5.2812  105.314   35.675  150.604   23.692 -45.28967 42.82593 
1 1 1   17   19   48 o  150.773   18.342   18.510   4.1458   12.683   6.3342   22.877   5.4834  116.915   33.607  165.674   22.180 -48.75917 40.26673 
1 1 1   17   19   49 o  164.411   16.885   21.872   4.1888   24.283   6.5031   20.162   5.4761  167.356   26.251  153.676   24.071 13.68001 35.61608 
1 1 1   17   19   50 o  141.739   21.418   16.978   4.5018   11.113   6.1090   23.947   6.6595  107.694   33.499  164.218   27.464 -56.52461 43.31844 
1 1 1   17   19   51 o   78.472   30.718   4.6987   5.3603   2.7229   8.2139   6.1643   7.0744   80.538   35.187   87.278   34.928 -6.739983 49.57958 
1 1 1   17   19   52 o   78.866   27.837   5.4321   4.1864   5.1932   5.8148   5.6892   6.0322   80.667   31.864   82.894   32.546 -2.227264 45.54706 
1 1 1   17   20    0 o  126.540   32.031   14.447   5.3648   14.447   5.3648   14.447   5.3648  126.540   32.031  126.540   32.031 0.000000 0.000000 
1 1 1   17   20    1 o  323.470   10.126   80.204   5.0135   81.777   6.9545   78.502   7.2341  326.396   13.920  319.732   14.782 6.664063 20.30458 
1 1 1   17   20    2 o  374.153   9.7063  107.294   5.5587  104.280   7.5466  110.868   8.2187  368.618   13.375  380.023   14.129 -11.40454 19.45602 
1 1 1   17   20    3 o  142.120   15.083   15.686   3.2309   15.190   3.8120   16.950   6.0881  139.339   18.317  145.485   28.359 -6.145355 33.76025 
1 1 1   17   20    4 o  395.307   9.7050  119.773   5.8722  126.209   7.8963  111.810   8.7834  405.571   12.720  381.539   15.040 24.03214 19.69784 
1 1 1   17   20    5 o  848.672   10.095  552.122   13.114  569.401   18.551  534.860   18.541  861.181   14.073  834.567   14.515 26.61377 20.21714 
1 1 1   17   20    6 o  584.457   7.5736  261.671   6.7753  256.427   7.9662  275.383   12.881  578.459   8.9973  598.884   14.052 -20.42529 16.68584 
1 1 1   17   20    7 o  480.066   6.8573  176.517   5.0388  177.733   5.7091  172.232   10.718  481.665   7.7438  473.518   14.787 8.146179 16.69217 
1 1 1   17   20    8 o  552.061   6.7585  233.431   5.7109  229.208   6.4099  249.689   12.577  546.984   7.6561  570.163   14.411 -23.17950 16.31881 
1 1 1   17   20    9 o  594.597   6.7455  270.794   6.1391  269.455   6.9315  275.665   13.223  593.058   7.6359  599.053   14.421 -5.995178 16.31752 
1 1 1   17   20   10 o  777.964   7.1633  463.628   8.5299  467.702   9.7668  450.533   17.512  781.263   8.1674  765.682   14.942 15.58008 17.02890 
1 1 1   17   20   11 o  405.374   9.0717  125.961   5.6287  126.052   6.6930  125.739   10.404  405.389   10.786  404.242   16.814 1.147003 19.97631 
1 1 1   17   20   12 o  218.256   15.223   36.800   5.0536   36.800   5.0536   0.0000   0.0000  218.256   15.223  ?   ?  0.000000 15.22282 
1 1 1   17   20   13 o  522.148   10.258  209.110   8.1980  209.110   8.1980   0.0000   0.0000  522.148   10.258  ?   ?  0.000000 10.25752 
1 1 1   17   20   14 o  636.753   8.5401  310.791   8.3234  301.270   9.7800  335.806   15.853  626.714   10.195  660.649   15.677 -33.93475 18.70052 
1 1 1   17   20   15 o  665.493   8.6377  339.517   8.7986  340.657   10.507  336.841   16.096  666.372   10.302  661.534   15.896 4.838562 18.94211 
1 1 1   17   20   16 o  429.766   9.3798  141.648   6.1701  143.748   7.2595  136.186   11.711  432.774   10.959  420.185   18.209 12.58902 21.25227 
1 1 1   17   20   17 o  543.147   9.0489  226.237   7.5229  223.354   8.8591  233.690   14.245  539.452   10.729  550.622   16.902 -11.17010 20.01953 
1 1 1   17   20   18 o  112.357   26.138   10.219   4.4105   11.173   5.0223   7.0022   9.2214  117.309   28.297  107.740   40.771 9.568665 49.62881 
1 1 1   17   20   19 o  344.521   11.119   91.150   5.8633   89.298   6.7775   96.657   11.690  340.792   12.993  352.429   21.777 -11.63770 25.35845 
1 1 1   17   20   20 o  265.665   16.734   54.664   6.7699   62.653   8.6663   42.154   10.844  283.779   20.081  229.391   31.735 54.38893 37.55483 
1 1 1   17   20   21 o  206.797   18.765   33.343   5.8749   0.0000   0.0000   33.343   5.8749  ?   ?   206.797   18.765 0.000000 18.76458 
1 1 1   17   20   22 o  291.136   11.983   65.169   5.3398   69.288   9.0579   62.974   6.6107  298.340   19.951  285.399   15.188 12.94113 25.07373 
1 1 1   17   20   23 o  589.704   6.6071  266.535   5.9637  266.528   7.2754  266.550   10.412  589.482   8.0633  588.821   11.552 0.6609497 14.08807 
1 1 1   17   20   24 o  138.872   12.207   14.952   2.5684   17.328   2.9537   7.5830   5.2014  149.452   13.043   98.207   30.969 51.24533 33.60310 
1 1 1   17   20   25 o  389.296   7.0840  116.208   4.2211  112.816   4.9810  124.849   7.9511  383.413   8.4875  402.616   12.902 -19.20319 15.44363 
1 1 1   17   20   26 o  259.553   8.4611   51.708   3.3614   50.918   3.8932   54.021   6.6627  257.427   9.8806  263.704   16.591 -6.277802 19.31061 
1 1 1   17   20   27 o  199.215   10.796   30.614   3.2797   31.517   3.6733   27.068   7.2825  201.963   11.936  183.517   26.710 18.44556 29.25505 
1 1 1   17   20   28 o   83.902   28.037   5.3249   4.2293   6.5546   6.3500   4.3446   5.6699   95.834   34.234   84.490   31.971 11.34442 46.84143 
1 1 1   17   20   29 o   98.476   18.526   7.7827   2.6899   7.8446   3.0814   7.5843   5.5143   98.371   21.098   98.197   31.979 0.1743011 38.31114 
1 1 1   17   20   30 o  265.276   8.9335   54.083   3.6273   53.140   4.2695   56.531   6.8774  262.726   10.617  269.296   16.768 -6.569885 19.84671 
1 1 1   17   20   31 o   62.936   20.586   2.9991   2.2843   6.1897   3.1277  -0.6482   3.3441   87.085   23.089   51.090   22.383 35.99543 32.15779 
1 1 1   17   20   32 o  271.895   7.8064   56.783   3.2488   60.673   4.6582   53.099   4.5333  280.581   10.846  262.410   11.287 18.17117 15.65366 
1 1 1   17   20   33 o   70.538   22.138   3.9019   2.6613   1.8483   3.4732   6.8221   4.1417   62.367   24.629   91.557   27.411 -29.19013 36.85015 
1 1 1   17   20   34 o  191.172   14.385   28.500   4.1784   0.0000   0.0000   28.500   4.1784  ?   ?   191.172   14.385 0.000000 14.38514 
1 1 1   17   20   35 o  231.627   9.2856   41.304   3.2921   38.271   4.7424   44.126   4.5736  221.689   14.049  238.499   12.573 -16.80974 18.85320 
1 1 1   17   20   36 o  182.478   11.384   25.819   3.1638   27.162   4.6374   24.649   4.3272  185.895   16.469  177.117   16.139 8.777618 23.05804 
1 1 1   17   20   37 o   84.145   25.713   5.7475   3.6175   0.6128   8.7443   6.8078   3.9735   84.770   36.676   90.883   26.761 -6.113266 45.40174 
1 1 1   17   20   38 o  239.183   9.8813   44.126   3.6175   43.869   5.1225   44.381   5.1095  237.111   14.179  238.533   14.057 -1.421783 19.96611 
1 1 1   17   20   39 o   50.907   22.055  -0.2251   3.1706  -6.9041   4.5482   6.0892   4.4223   44.870   21.701   87.179   28.650 -42.30898 35.94095 
1 1 1   17   20   40 o  117.737   24.364   11.530   4.2459   9.7732   5.3009   14.675   7.0917  106.999   30.740  129.252   34.989 -22.25321 46.57495 
1 1 1   17   20   41 f  411.600   9.9427  130.865   6.2640  133.875   8.1401  126.494   9.8087  415.042   12.813  401.758   15.951 13.28384 20.45982 
1 1 1   17   20   42 o  141.779   20.722   16.335   4.3641   21.356   5.3700   6.5687   7.4891  161.785   22.276   95.830   36.628 65.95510 42.86968 
1 1 1   17   20   43 o  118.329   20.161   11.454   3.5206   6.4725   5.2811   15.438   4.7233   89.887   31.297  136.434   23.464 -46.54764 39.11616 
1 1 1   17   20   44 o  256.766   10.837   51.150   4.2592   47.970   6.3380   53.767   5.7513  245.736   16.954  261.523   14.424 -15.78717 22.25950 
1 1 1   17   20   45 o   46.707   21.540  -2.3611   3.5801  -3.6872   5.2976  -1.2465   4.8570   55.558   25.823   58.734   26.284 -3.175919 36.84630 
1 1 1   17   20   46 o   55.520   24.229  -0.1737   3.8848   1.8003   6.4791  -1.2816   4.8541   75.363   32.068   58.380   26.190 16.98336 41.40342 
1 1 1   17   20   47 f   87.325   26.287   6.5766   3.8015   8.0225   5.7995   5.4874   5.0337   95.799   32.828   83.258   30.380 12.54156 44.72855 
1 1 1   17   20   48 o  188.820   14.353   28.344   4.1172   27.606   6.1775   28.934   5.5226  181.400   22.749  187.908   19.485 -6.508072 29.95279 
1 1 1   17   20   49 o  184.948   21.769   28.724   6.0445   28.724   6.0445   0.0000   0.0000  184.948   21.769  ?   ?  0.000000 21.76874 
1 1 1   17   20   50 o  126.688   24.714   14.123   4.6203   8.8382   8.5127   16.330   5.5010   97.976   38.600  134.351   27.672 -36.37544 47.49437 
1 1 1   17   20   51 o  152.318   19.792   19.522   4.5053   10.138   5.7934   33.880   7.1660  101.866   32.744  197.054   24.272 -95.18819 40.75859 
1 1 1   17   21    0 o  872.246   14.388  583.801   19.198  583.801   19.198  583.801   19.198  872.246   14.388  872.246   14.388 0.000000 0.000000 
1 1 1   17   21    1 o  631.963   9.1864  306.106   8.8860  310.394   12.575  301.830   12.558  635.910   12.920  627.052   13.084 8.858215 18.38798 
1 1 1   17   21    2 o  959.657   10.680  706.242   15.688  691.281   21.555  723.092   22.876  948.542   14.846  969.975   15.408 -21.43311 21.39688 
1 1 1   17   21    3 o  568.644   9.2287  247.848   8.0325  243.384   10.892  253.172   11.894  563.124   12.636  574.215   13.532 -11.09131 18.51494 
1 1 1   17   21    4 o  463.744   7.6816  164.764   5.4525  168.957   6.6013  155.762   9.6727  469.500   9.1859  450.334   14.033 19.16589 16.77200 
1 1 1   17   21    5 o  136.746   16.264   14.581   3.3374   11.742   3.8064   24.018   6.9398  121.638   21.216  174.037   26.921 -52.39932 34.27591 
1 1 1   17   21    6 o  682.553   7.7668  356.948   8.1143  358.380   9.7785  353.782   14.540  683.748   9.3435  678.655   13.998 5.093079 16.82965 
1 1 1   17   21    7 o  237.166   9.3376   43.119   3.3897   44.622   3.8219   37.580   7.3377  241.217   10.352  219.480   22.145 21.73636 24.44495 
1 1 1   17   21    8 o   67.515   23.082   3.2366   2.8671   4.1573   3.1601  -1.0494   6.8180   74.507   24.206   73.948   32.189 0.5587845 40.27501 
1 1 1   17   21    9 o  897.413   7.5431  617.058   10.361  622.666   11.985  600.459   20.618  901.312   8.6872  883.690   15.243 17.62219 17.54461 
1 1 1   17   21   10 o  390.826   7.2146  117.025   4.3158  118.922   4.8454  109.739   9.4943  393.930   8.0360  377.607   16.427 16.32321 18.28704 
1 1 1   17   21   11 o  348.390   11.481   93.155   6.1226   93.155   6.1226   0.0000   0.0000  348.390   11.481  ?   ?  0.000000 11.48146 
1 1 1   17   21   12 o  479.467   8.7268  176.238   6.4044  171.932   7.5317  187.479   12.170  473.406   10.394  493.511   16.111 -20.10550 19.17293 
1 1 1   17   21   13 o   91.207   27.045   6.5701   4.0462   7.9552   4.5891   1.7336   8.5755   99.801   28.582   90.085   37.521 9.716248 47.16711 
1 1 1   17   21   14 o  476.222   8.9424  173.900   6.5183  174.491   7.7108  172.420   12.202  476.847   10.564  473.023   16.852 3.824554 19.89001 
1 1 1   17   21   15 o  425.721   9.3968  139.015   6.1232  136.968   7.1027  144.939   12.083  422.403   10.986  433.365   18.216 -10.96252 21.27236 
1 1 1   17   21   16 o  387.362   12.328  115.297   7.3091  111.339   9.2739  121.786   11.875  380.145   15.938  396.912   19.547 -16.76706 25.22116 
1 1 1   17   21   17 o  253.077   16.267   49.575   6.2678   46.465   7.7419   55.491   10.678  244.063   20.926  265.425   26.643 -21.36267 33.87874 
1 1 1   17   21   18 o  386.390   12.468  114.772   7.3741  113.221   9.7038  116.892   11.344  383.119   16.548  388.781   19.064 -5.661865 25.24387 
1 1 1   17   21   19 o  502.599   9.5302  193.854   7.3316  186.102   8.6044  214.396   14.007  492.153   11.422  526.887   17.368 -34.73337 20.78732 
1 1 1   17   21   20 o  313.282   15.175   75.661   7.2765   79.509   9.6333   70.549   11.104  319.751   19.780  299.858   24.404 19.89249 31.41384 
1 1 1   17   21   21 o  237.498   14.473   43.628   5.2362   43.647   5.9725   43.566   10.886  237.165   16.557  232.925   31.330 4.239853 35.43542 
1 1 1   17   21   22 o  152.701   17.506   18.266   4.0177   18.675   5.6210   17.838   5.7448  152.705   24.907  148.846   26.171 3.859711 36.12877 
1 1 1   17   21   23 o  257.976   11.447   51.181   4.5199   50.583   6.2836   51.823   6.5065  255.354   16.160  258.395   16.538 -3.041031 23.12226 
1 1 1   17   21   24 o  410.821   6.9764  129.412   4.3869  132.900   5.2279  121.112   8.0651  416.167   8.2071  396.435   13.291 19.73294 15.62098 
1 1 1   17   21   25 o  598.630   8.2849  275.040   7.5913  287.819   10.703  262.106   10.768  611.590   11.434  583.455   12.058 28.13434 16.61701 
1 1 1   17   21   26 o  119.952   24.622   11.695   4.3692   4.8502   5.8831   20.113   6.5245   87.446   32.676  157.232   28.144 -69.78660 43.12510 
1 1 1   17   21   27 o  240.685   12.854   44.803   4.7181   40.012   6.6577   49.637   6.6873  225.859   19.448  252.301   17.423 -26.44179 26.11110 
1 1 1   17   21   28 o  262.414   8.8470   52.907   3.5535   52.411   4.1466   54.278   6.8950  260.990   10.380  263.843   17.167 -2.853729 20.06105 
1 1 1   17   21   29 o  105.724   17.150   8.9002   2.6802   7.6359   3.0317   13.424   5.7348   96.959   21.033  127.030   29.977 -30.07127 36.62010 
1 1 1   17   21   30 o  156.096   12.653   18.937   2.9972   21.901   3.4481   9.7753   6.0622  167.766   13.543  108.967   33.285 58.79936 35.93448 
1 1 1   17   21   31 o   66.606   23.373   3.1451   2.9480   4.5659   3.0436 -18.4185   11.857   76.016   23.645   70.729   34.401 5.287216 41.74350 
1 1 1   17   21   32 o  105.502   16.373   8.8539   2.5582   4.4136   3.4400   14.348   3.8266   76.038   25.282  134.136   19.184 -58.09855 31.73652 
1 1 1   17   21   33 o  155.006   11.905   18.664   2.8030   14.645   3.9490   22.745   3.9792  135.344   19.636  170.414   15.423 -35.07062 24.96823 
1 1 1   17   21   34 o   80.120   21.074   5.2446   2.6191   7.6345   3.6970   2.8366   3.7110   96.072   24.927   68.363   25.866 27.70877 35.92164 
1 1 1   17   21   35 o  254.085   8.7852   49.682   3.4167   46.800   4.8312   52.567   4.8326  245.495   12.902  260.710   12.110 -15.21439 17.69541 
1 1 1   17   21   36 o  272.193   10.700   57.193   4.4580   58.146   9.6309   56.934   5.0293  269.105   23.620  271.246   12.114 -2.140961 26.54555 
1 1 1   17   21   37 o   76.175   25.313   4.4997   3.4485   14.029   9.0166   2.8668   3.7323  126.747   40.860   68.377   25.923 58.36980 48.38963 
1 1 1   17   21   38 o   39.946   18.778  -2.9576   2.9350  -2.6094   4.3145  -3.2575   4.0042   52.212   23.919   48.232   22.429 3.980160 32.78932 
1 1 1   17   21   39 o  134.844   22.669   14.886   4.5128   20.503   5.3009   0.0956   8.6016  158.837   22.428   82.288   35.979 76.54858 42.39648 
1 1 1   17   21   40 o  307.640   11.505   73.325   5.4176   70.824   6.7341   77.913   9.1214  301.227   14.606  313.254   19.115 -12.02780 24.05640 
1 1 1   17   21   41 o  164.163   14.414   21.200   3.5853   23.482   5.2140   19.154   4.9380  170.638   20.365  153.393   21.632 17.24434 29.71035 
1 1 1   17   21   42 o  171.682   14.550   23.217   3.7875   19.939   5.4508   26.278   5.2666  155.408   23.662  180.844   19.326 -25.43600 30.55130 
1 1 1   17   21   43 o  104.847   22.333   9.1893   3.4743   1.1626   5.1345   15.969   4.7187   67.916   28.706  138.769   23.023 -70.85231 36.79807 
1 1 1   17   21   44 o  130.859   18.691   13.911   3.6375   13.817   5.3705   13.991   4.9441  126.021   28.509  127.973   26.125 -1.952278 38.66862 
1 1 1   17   21   45 o   48.605   22.173  -1.8649   3.6573  -0.8652   5.5898  -2.6133   4.8362   63.811   28.402   54.908   25.216 8.902935 37.98050 
1 1 1   17   21   46 o  146.907   18.215   17.535   4.0079   13.923   5.8003   20.834   5.5445  124.435   30.654  157.337   23.764 -32.90141 38.78621 
1 1 1   17   21   47 o  150.628   18.864   18.572   4.2537   14.833   5.9462   22.492   6.0876  127.802   30.767  162.021   25.381 -34.21916 39.88485 
1 1 1   17   21   48 o   47.915   22.295  -2.7894   3.9670  -8.5685   5.3765   4.1160   5.8771   46.687   22.808   78.986   31.756 -32.29892 39.09761 
1 1 1   17   21   49 o   76.141   26.830   4.8315   3.8874   5.2947   5.6045   4.4020   5.3965   81.852   31.584   77.886   30.718 3.965851 44.05893 
1 1 1   17   21   50 o   81.182   29.871   5.6273   4.8808   12.064   8.0673   1.9107   6.1300  107.792   38.578   71.467   30.815 36.32479 49.37432 
1 1 1   17   21   51 o   52.184   23.796  -1.4744   4.2068   0.7598   5.2738  -5.3832   6.9756   64.191   28.116   59.153   28.144 5.038273 39.78167 
1 1 1   17   22    0 o  341.515   14.372   89.918   7.4827   89.918   7.4827   89.918   7.4827  341.515   14.372  341.515   14.372 0.000000 0.000000 
1 1 1   17   22    1 o  505.389   9.1841  195.808   7.1045  192.467   9.7324  199.620   10.395  500.670   12.700  509.806   13.321 -9.135529 18.40484 
1 1 1   17   22    2 o  153.058   18.054   18.293   4.1482   18.381   5.6939   18.193   6.0556  152.023   25.363  150.831   27.232 1.192230 37.21413 
1 1 1   17   22    3 o  330.351   10.124   83.695   5.1192   80.921   6.8052   87.311   7.7695  324.548   13.699  336.985   15.063 -12.43695 20.36085 
1 1 1   17   22    4 o   91.666   22.281   6.7542   3.0956   5.8999   3.5691   9.3485   6.2197   86.461   25.336  109.250   33.771 -22.78931 42.21854 
1 1 1   17   22    5 o  141.463   15.301   15.568   3.2602   14.523   3.7982   18.494   6.3547  136.003   18.744  151.824   28.389 -15.82034 34.01863 
1 1 1   17   22    6 o  435.597   7.7220  145.399   5.1486  147.642   6.1490  140.139   9.4168  438.830   9.1545  426.971   14.409 11.85919 17.07124 
1 1 1   17   22    7 o  334.097   7.7125   85.535   3.9440   85.336   4.4960   86.201   8.2151  333.642   8.8040  334.674   16.037 -1.032379 18.29461 
1 1 1   17   22    8 o  305.574   8.9848   71.590   4.2024   71.948   4.9197   70.625   8.0823  306.237   10.496  302.243   17.546 3.993225 20.44572 
1 1 1   17   22    9 o  260.194   11.367   51.966   4.5270   51.966   4.5270   0.0000   0.0000  260.194   11.367  ?   ?  0.000000 11.36707 
1 1 1   17   22   10 o  305.999   10.468   71.846   4.9028   71.846   4.9028   0.0000   0.0000  305.999   10.468  ?   ?  0.000000 10.46771 
1 1 1   17   22   11 o  513.636   10.366  202.435   8.1496  198.961   10.936  206.773   12.221  508.655   14.047  518.293   15.405 -9.638092 20.84770 
1 1 1   17   22   12 o  562.412   10.398  242.733   8.9508  226.255   11.589  267.101   14.092  542.396   13.959  588.961   15.632 -46.56464 20.95749 
1 1 1   17   22   13 o  504.107   10.724  195.067   8.2748  179.573   10.496  220.514   13.451  483.130   14.194  534.904   16.429 -51.77405 21.71081 
1 1 1   17   22   14 o  106.341   30.119   9.1040   5.1250   11.397   6.2815   4.5373   8.8636  118.559   33.262   98.902   39.253 19.65716 51.45081 
1 1 1   17   22   15 o  294.236   11.522   66.503   5.1890   63.399   5.9136   76.893   10.819  287.094   13.457  313.940   22.668 -26.84595 26.36130 
1 1 1   17   22   16 o  144.847   20.536   16.564   4.4255   22.641   5.1122  -1.6075   8.8402  169.872   20.048   82.859   36.345 87.01330 41.50721 
1 1 1   17   22   17 o  292.399   11.774   65.707   5.2695   60.759   6.0795   80.657   10.566  280.552   14.204  321.680   21.585 -41.12793 25.83933 
1 1 1   17   22   18 o  254.606   17.593   50.329   6.8139   50.634   8.7643   49.863   10.834  254.170   22.769  250.470   28.783 3.700607 36.70034 
1 1 1   17   22   19 o  390.201   13.266  117.206   7.9230  111.621   10.553  124.421   11.995  379.830   18.151  400.668   19.559 -20.83728 26.68381 
1 1 1   17   22   20 o  314.273   11.823   75.956   5.6873   73.607   6.5799   82.897   11.309  309.086   13.908  325.411   22.851 -16.32446 26.75048 
1 1 1   17   22   21 o  328.557   11.498   83.016   5.7825   79.224   6.6185   95.245   11.886  320.676   13.484  348.916   22.374 -28.24023 26.12308 
1 1 1   17   22   22 o  133.599   24.652   14.393   4.8554   14.628   5.4927   13.553   10.386  133.977   27.699  130.743   43.935 3.234650 51.93756 
1 1 1   17   22   23 o  322.127   10.159   79.746   5.0090   84.930   6.9118   74.012   7.2694  331.882   13.606  309.504   15.345 22.37848 20.50845 
1 1 1   17   22   24 o   57.553   24.982  -0.4789   4.0834  -5.9263   5.6061   5.6775   5.9598   54.699   25.786   91.162   33.089 -36.46289 41.94986 
1 1 1   17   22   25 o  155.732   19.884   19.183   4.6314   18.752   5.9115   19.868   7.4528  152.167   26.334  154.830   32.484 -2.663177 41.81788 
1 1 1   17   22   26 o  105.176   16.657   8.7805   2.5922   8.7686   2.8773   8.8316   5.9731  104.673   18.642  104.914   33.198 -0.2413330 38.07377 
1 1 1   17   22   27 o  517.372   6.9369  205.359   5.4933  203.433   6.6291  209.580   9.8143  514.642   8.4155  521.292   12.300 -6.649902 14.90344 
1 1 1   17   22   28 o  273.496   9.4736   57.525   3.9659   59.098   4.1636   42.136   13.023  277.161   9.8145  222.757   39.648 54.40439 40.84496 
1 1 1   17   22   29 o  113.313   17.341   10.213   2.9120   9.7532   3.0022   17.534   11.972  110.423   18.411  142.878   47.148 -32.45502 50.61534 
1 1 1   17   22   30 o  147.052   13.216   16.853   2.9429   15.034   3.3085   23.744   6.4404  138.241   15.927  171.249   25.335 -33.00781 29.92596 
1 1 1   17   22   31 f  144.617   13.365   16.317   2.9249   16.579   3.2876   15.320   6.4067  145.433   14.983  134.866   31.590 10.56696 34.96321 
1 1 1   17   22   32 o  393.578   8.7423  119.143   5.2665  114.416   6.4430  128.660   9.1421  385.151   10.929  407.158   14.669 -22.00708 18.29319 
1 1 1   17   22   33 o  261.952   8.8893   52.800   3.5642   53.748   5.1989   51.959   4.8958  263.511   12.890  259.210   12.340 4.301483 17.84406 
1 1 1   17   22   34 o   87.420   19.751   6.2393   2.5805   1.4458   3.5247   11.776   3.7882   60.655   24.520  120.469   21.324 -59.81457 32.49516 
1 1 1   17   22   35 o   90.039   25.383   6.6947   3.6489  -9.5018   8.1846   10.713   4.0765   63.300   30.218  113.869   24.138 -50.56936 38.67556 
1 1 1   17   22   36 o  129.165   19.270   13.404   3.6932   12.472   8.3697   13.629   4.1155  120.542   39.405  129.555   21.508 -9.013191 44.89236 
1 1 1   17   22   37 o   76.412   26.380   4.4048   3.7482   5.4766   4.4419   1.7542   6.9853   84.061   28.730   79.745   33.582 4.315178 44.19471 
1 1 1   17   22   38 o  390.277   10.382  117.674   6.2020  128.895   7.3923   91.001   11.397  407.886   11.841  336.956   22.223 70.93030 25.18092 
1 1 1   17   22   39 o  264.844   9.5856   54.137   3.8858   62.209   5.6102   46.694   5.3873  282.918   12.955  244.250   14.475 38.66830 19.42560 
1 1 1   17   22   40 f  184.018   12.540   26.432   3.5109   20.662   4.8923   32.557   5.0413  159.927   20.455  202.997   16.364 -43.06989 26.19483 
1 1 1   17   22   41 o  188.122   12.558   27.649   3.5953   26.441   5.1991   28.757   4.9773  181.591   18.986  190.170   17.288 -8.579269 25.67783 
1 1 1   17   22   42 o  247.338   10.460   47.401   3.9599   47.154   5.8045   47.615   5.4159  244.412   15.597  246.143   14.438 -1.730591 21.25404 
1 1 1   17   22   43 o  207.166   12.130   33.548   3.8296   31.966   5.5250   35.010   5.3129  199.576   18.290  209.725   16.688 -10.14980 24.75942 
1 1 1   17   22   44 o  198.236   12.904   30.866   3.8940   40.058   5.9558   24.002   5.1463  223.623   17.541  171.612   19.965 52.01089 26.57604 
1 1 1   17   22   45 o   61.731   24.919   1.8381   3.6349   3.3742   5.8780   0.8869   4.6254   77.749   31.582   63.538   27.067 14.21154 41.59335 
1 1 1   17   22   46 o  227.825   17.785   41.882   6.1528   41.882   6.1528   0.0000   0.0000  227.825   17.785  ?   ?  0.000000 17.78501 
1 1 1   17   22   47 o   91.964   25.888   7.4601   3.7984   4.5446   5.4406   10.232   5.3054   79.435   30.988  105.398   30.891 -25.96215 43.75528 
1 1 1   17   22   48 o  129.031   20.135   13.977   3.8468   15.722   5.4238   12.211   5.4568  132.165   27.697  114.289   30.589 17.87554 41.26539 
1 1 1   17   22   49 o   66.418   27.364   2.3274   4.4917  -9.8448   7.9104   8.1197   5.4568   57.746   28.089   93.223   31.844 -35.47721 42.46209 
1 1 1   17   22   50 f   63.987   25.864   2.4203   3.9211   1.6770   5.1538   3.4420   6.0422   66.575   28.471   75.372   31.453 -8.796448 42.42466 
1 1 1   17   23    0 o  313.527   15.057   75.942   7.1876   75.942   7.1876   75.942   7.1876  313.527   15.057  313.527   15.057 0.000000 0.000000 
1 1 1   17   23    1 o  395.197   9.6481  119.782   5.8361  130.068   8.3638  110.021   8.1476  411.424   13.281  378.300   14.071 33.12442 19.34903 
1 1 1   17   23    2 o  210.740   13.501   34.269   4.3321   30.945   5.8290   38.371   6.4747  199.313   19.351  222.160   19.231 -22.84723 27.28108 
1 1 1   17   23    3 o  235.074   12.525   42.564   4.4903   44.790   6.0381   39.811   6.7163  240.605   16.495  226.247   19.588 14.35783 25.60789 
1 1 1   17   23    4 o  439.392   7.8315  147.968   5.2670  146.219   6.2648  152.185   9.7276  436.652   9.3736  444.867   14.286 -8.214722 17.08653 
1 1 1   17   23    5 o  441.037   7.8190  149.081   5.2783  145.678   6.2494  157.550   9.8591  435.837   9.3680  452.633   14.231 -16.79605 17.03718 
1 1 1   17   23    6 o  667.463   7.8481  341.460   8.0179  333.932   9.5436  359.523   14.783  659.843   9.4493  683.752   14.125 -23.90839 16.99435 
1 1 1   17   23    7 o  370.545   8.6458  105.274   4.9036  105.274   4.9036   0.0000   0.0000  370.545   8.6458  ?   ?  0.000000 8.645790 
1 1 1   17   23    8 o  229.222   10.796   40.330   3.7878   40.330   3.7878   0.0000   0.0000  229.222   10.796  ?   ?  0.000000 10.79583 
1 1 1   17   23    9 o  607.328   7.0695  282.647   6.5717  291.617   7.6043  256.183   13.062  616.771   8.0550  576.946   14.791 39.82495 16.84200 
1 1 1   17   23   10 o  298.408   8.4257   68.277   3.8485   65.542   4.2259   81.570   9.3157  292.299   9.4455  324.419   18.841 -32.11923 21.07649 
1 1 1   17   23   11 o  347.314   9.8384   92.560   5.2302   90.238   6.1767   98.445   9.8317  342.734   11.774  356.630   18.070 -13.89615 21.56755 
1 1 1   17   23   12 o  529.969   8.8527  215.422   7.1812  219.019   8.6799  207.620   12.784  534.119   10.617  518.977   16.094 15.14178 19.28053 
1 1 1   17   23   13 o  229.430   13.475   40.633   4.7114   42.046   5.5100   36.790   9.0863  233.077   15.534  215.071   28.288 18.00552 32.27234 
1 1 1   17   23   14 o   56.304   24.828  -1.1394   4.1748   0.4019   4.7403  -6.4686   8.8143   65.340   27.598   73.118   33.747 -7.778320 43.59464 
1 1 1   17   23   15 o  133.297   22.465   14.171   4.4205   14.777   5.0143   12.056   9.3646  135.596   25.084  124.773   41.720 10.82298 48.68029 
1 1 1   17   23   16 o  323.288   10.837   80.289   5.3625   77.048   6.1913   90.022   10.729  316.463   12.782  340.024   20.714 -23.56128 24.33981 
1 1 1   17   23   17 o  313.113   14.574   75.565   6.9845   73.232   9.2008   78.737   10.730  306.740   19.701  317.400   22.226 -10.65930 29.70055 
1 1 1   17   23   18 o  377.832   13.738  109.976   7.9449  103.245   10.311  119.810   12.464  364.655   18.535  392.165   20.839 -27.51056 27.88922 
1 1 1   17   23   19 o   93.675   29.348   6.8944   4.6793   11.642   5.3102  -9.5998   9.8981  119.180   29.312   73.363   34.485 45.81775 45.25991 
1 1 1   17   23   20 o  205.580   15.973   32.851   4.9866   30.342   5.6164   42.192   10.838  196.914   18.865  228.474   31.858 -31.56026 37.02506 
1 1 1   17   23   21 o  269.576   13.583   56.167   5.5864   55.815   6.3889   57.307   11.513  268.305   15.625  267.950   28.510 0.3557129 32.51102 
1 1 1   17   23   22 o  202.804   16.831   32.064   5.1774   32.225   5.8684   31.501   10.998  202.778   19.134  194.036   38.389 8.742828 42.89258 
1 1 1   17   23   23 o  500.401   8.5882  192.267   6.5780  192.507   9.0416  191.996   9.5877  499.983   11.815  499.121   12.550 0.8618469 17.23617 
1 1 1   17   23   24 o  225.437   14.531   39.438   4.9873   40.038   6.2650   38.399   8.2404  226.266   18.245  219.519   24.969 6.747284 30.92464 
1 1 1   17   23   25 o   95.547   27.835   7.4145   4.3191  -1.8974   5.9195   18.016   6.3161   65.466   29.177  148.103   28.900 -82.63663 41.06685 
1 1 1   17   23   26 o  193.632   19.643   29.557   5.7411   27.306   6.5391   37.129   11.993  184.820   23.658  209.452   38.837 -24.63155 45.47597 
1 1 1   17   23   27 o  244.829   9.7864   46.118   3.6674   45.571   3.8333   52.027   12.603  243.305   10.293  251.178   33.624 -7.873306 35.16439 
1 1 1   17   23   28 o  383.031   7.4806  112.646   4.3857  111.870   5.1568  114.675   8.3374  381.466   8.8319  384.859   14.153 -3.392670 16.68292 
1 1 1   17   23   29 o  245.801   9.2032   46.475   3.4625   45.884   3.9746   48.336   7.0520  244.024   10.641  248.044   18.712 -4.020172 21.52619 
1 1 1   17   23   30 o  561.541   7.2573  242.123   6.2377  240.660   7.5529  245.261   11.063  559.403   8.8211  563.199   12.833 -3.795959 15.57221 
1 1 1   17   23   31 o   46.511   20.424  -0.6024   2.7983   1.0165   3.1232  -7.1919   6.3012   56.078   22.927   56.436   26.821 -0.3573456 35.28476 
1 1 1   17   23   32 o  249.721   10.506   48.088   4.0157   47.958   4.6644   48.459   7.8937  249.049   12.236  247.072   21.075 1.977768 24.36938 
1 1 1   17   23   33 o   83.963   23.040   5.7819   3.0506   5.7005   3.3830   6.1362   7.0574   83.663   24.709   94.834   35.719 -11.17077 43.43263 
1 1 1   17   23   34 o  215.620   12.489   36.116   4.1040   40.848   8.9503   34.856   4.6181  223.785   26.654  211.307   14.364 12.47826 30.27809 
1 1 1   17   23   35 o  456.717   14.777  162.407   10.330   0.0000   0.0000  162.407   10.330  ?   ?   456.717   14.777 0.000000 14.77657 
1 1 1   17   23   36 o  187.175   14.104   27.404   4.0110   26.387   4.6981   30.137   7.7035  182.765   16.989  191.137   27.090 -8.371948 31.97604 
1 1 1   17   23   37 o  182.351   14.454   26.066   4.0012   24.551   4.4480   32.489   9.1595  176.243   16.687  195.798   31.642 -19.55461 35.77285 
1 1 1   17   23   38 o  177.104   12.673   24.477   3.4128   22.816   4.8605   26.093   4.7931  168.874   19.142  181.350   17.484 -12.47540 25.92491 
1 1 1   17   23   39 o  113.163   19.305   10.409   3.2239   11.384   4.4864   9.3666   4.6359  116.185   25.890  104.762   28.260 11.42337 38.32663 
1 1 1   17   23   40 o   53.255   22.163   0.7300   2.9887   4.7508   4.3247  -2.9459   4.1351   79.409   28.265   49.731   23.009 29.67837 36.44608 
1 1 1   17   23   41 o  114.050   20.320   10.686   3.4171   12.437   5.0832   9.2418   4.6156  120.098   28.144  103.506   28.315 16.59225 39.92252 
1 1 1   17   23   42 f  175.236   13.976   24.201   3.7174   25.392   5.2968   23.046   5.2185  176.979   19.898  168.126   20.717 8.852463 28.72525 
1 1 1   17   23   43 o  139.439   20.915   16.020   4.3262   19.876   5.2936   8.2672   7.5072  154.464   23.099   99.786   36.985 54.67808 43.60592 
1 1 1   17   23   44 o   41.812   19.844  -3.7510   3.4265  -2.8195   5.2744  -4.4312   4.5071   57.062   26.253   48.520   22.949 8.542038 34.86920 
1 1 1   17   23   45 o  156.345   17.213   19.753   4.0510   23.003   5.9943   17.021   5.4960  164.673   24.531  140.059   26.610 24.61372 36.19159 
1 1 1   17   23   46 o   76.291   28.250   4.4860   4.3778 -11.1832   9.2321   9.0315   4.9725   63.047   30.593   99.721   30.075 -36.67439 42.90018 
1 1 1   17   23   47 o  151.847   16.340   18.713   3.7379   22.951   5.4705   15.001   5.1193  164.565   22.292  129.871   26.647 34.69394 34.74133 
1 1 1   17   23   48 f   87.099   28.030   6.8464   4.2444   5.0146   7.9358   7.5803   5.0233   85.797   35.944   90.848   30.555 -5.051567 47.17622 
1 1 1   17   23   49 f  223.114   13.199   39.687   4.4876   26.839   5.6633   61.365   7.3565  177.729   21.239  273.417   17.673 -95.68788 27.63015 
1 1 1   17   24    0 o   43.391   28.984  -1.7515   5.2833  -1.7515   5.2833  -1.7515   5.2833   43.391   28.984   43.391   28.984 0.000000 0.000000 
1 1 1   17   24    1 o  231.635   12.785   41.361   4.5154   38.456   6.3568   44.319   6.4150  222.364   18.855  239.044   17.658 -16.68022 25.83187 
1 1 1   17   24    2 o  172.814   15.990   23.200   4.1817   19.670   5.6918   27.341   6.1641  157.335   24.427  186.597   22.006 -29.26131 32.87740 
1 1 1   17   24    3 o  641.401   9.6068  315.607   9.4315  300.135   12.708  334.582   14.073  624.794   13.288  659.522   13.941 -34.72729 19.25907 
1 1 1   17   24    4 o  659.149   9.6312  333.327   9.7170  333.547   13.313  333.076   14.215  658.659   13.205  657.979   14.114 0.6795044 19.32876 
1 1 1   17   24    5 o  513.858   9.4360  202.562   7.4216  202.562   7.4216   0.0000   0.0000  513.858   9.4360  ?   ?  0.000000 9.435981 
1 1 1   17   24    6 o  105.889   24.287   9.0579   3.8526   9.0579   3.8526   0.0000   0.0000  105.889   24.287  ?   ?  0.000000 24.28738 
1 1 1   17   24    7 o  194.059   11.212   29.016   3.3160   33.037   3.7406   14.259   7.1662  207.034   11.853  131.945   34.934 75.08919 36.89003 
1 1 1   17   24    8 o  386.782   7.5805  114.676   4.4878  111.390   5.0215  127.715   10.004  381.113   8.6081  407.042   16.057 -25.92902 18.21875 
1 1 1   17   24    9 o  157.050   13.246   19.104   3.1543   19.809   3.4856   15.915   7.4128  159.771   14.408  139.150   34.873 20.62103 37.73238 
1 1 1   17   24   10 o  427.507   7.4280  140.096   4.8605  140.060   5.4697  140.233   10.598  427.359   8.3619  426.417   16.237 0.9426575 18.26395 
1 1 1   17   24   11 o  208.853   13.976   33.726   4.4422   34.996   5.1919   30.258   8.5814  212.420   16.088  194.197   29.823 18.22339 33.88592 
1 1 1   17   24   12 f  308.340   10.734   73.021   5.0659   73.851   5.9609   70.860   9.6126  309.885   12.567  301.543   20.957 8.341522 24.43630 
1 1 1   17   24   13 o  451.108   9.2382  156.165   6.3788  155.413   7.5608  158.021   11.881  449.768   10.983  452.274   17.163 -2.505920 20.37616 
1 1 1   17   24   14 o  228.937   13.187   40.474   4.6015   40.137   5.4008   41.364   8.7896  227.576   15.599  228.705   25.545 -1.129501 29.93113 
1 1 1   17   24   15 o  333.870   10.702   85.644   5.4688   84.853   6.3275   87.980   10.873  332.096   12.448  335.823   21.262 -3.727020 24.63816 
1 1 1   17   24   16 o  551.152   11.649  233.599   9.8268  217.502   12.989  255.148   15.028  530.698   15.990  574.425   17.092 -43.72729 23.40534 
1 1 1   17   24   17 o  455.730   9.8066  159.514   6.8407  163.255   7.9928  149.268   13.226  460.771   11.333  438.497   19.706 22.27365 22.73211 
1 1 1   17   24   18 o  191.882   16.978   28.705   4.9351   24.457   5.5657   44.329   10.674  176.080   21.069  234.789   30.416 -58.70868 37.00091 
1 1 1   17   24   19 o  498.981   9.6980  191.270   7.4069  189.099   8.6441  197.267   14.367  495.787   11.391  504.199   18.617 -8.412567 21.82494 
1 1 1   17   24   20 o  179.850   18.667   25.375   5.0638   29.327   5.7024   10.635   11.012  193.269   19.545  122.086   44.877 71.18276 48.94831 
1 1 1   17   24   21 o  742.094   9.6358  423.194   10.945  417.275   12.826  439.051   20.993  736.291   11.381  751.902   18.241 -15.61096 21.50024 
1 1 1   17   24   22 o  469.711   10.688  169.744   7.6844  175.441   8.9946  154.350   14.786  477.116   12.317  444.245   21.744 32.87051 24.99039 
1 1 1   17   24   23 o   98.828   32.540   7.6337   5.7036   7.6337   5.7036   0.0000   0.0000   98.828   32.540  ?   ?  0.000000 32.53956 
1 1 1   17   24   24 o  391.785   11.698  118.301   7.0152  118.638   8.0810  117.268   14.133  391.896   13.472  385.038   24.102 6.858063 27.61127 
1 1 1   17   24   25 o  370.441   9.9281  105.582   5.6293  105.743   7.8790  105.415   8.0458  369.776   13.921  369.113   14.241 0.6625671 19.91459 
1 1 1   17   24   26 o  299.957   11.612   69.385   5.3312   65.540   7.3840   73.572   7.7053  289.895   16.712  307.288   16.442 -17.39294 23.44403 
1 1 1   17   24   27 o   81.593   28.419   4.8854   4.3547   8.5121   6.3692   1.7016   5.9675  103.491   34.401   75.790   31.411 27.70102 46.58387 
1 1 1   17   24   28 o  364.353   7.8495  101.979   4.3776  102.261   5.1103  101.202   8.4848  364.610   9.1568  361.059   15.353 3.550903 17.87630 
1 1 1   17   24   29 o  117.100   15.841   10.845   2.7664   11.224   3.0369   9.0014   6.7052  118.830   17.197  105.867   35.302 12.96323 39.26765 
1 1 1   17   24   30 o   66.153   22.360   3.2577   2.6902   2.4889   2.9338   7.3190   6.7430   62.510   23.131   98.826   35.281 -36.31579 42.18691 
1 1 1   17   24   31 o   39.515   18.624  -3.1141   2.9214  -3.1648   3.2718  -2.9149   6.4883   42.574   19.953   65.821   29.835 -23.24711 35.89193 
1 1 1   17   24   32 o  186.361   12.468   26.995   3.5360   30.516   4.0770   16.309   7.1036  197.926   13.539  137.795   33.910 60.13133 36.51319 
1 1 1   17   24   33 o  224.090   17.346   39.525   5.9035   42.976   8.9577   36.876   7.8492  229.969   25.899  213.524   24.458 16.44508 35.62218 
1 1 1   17   24   34 o  103.366   21.805   8.7790   3.3413   9.3213   3.7583   6.7344   7.2977  106.068   23.741   97.217   36.380 8.851898 43.44112 
1 1 1   17   24   35 o  179.837   13.875   25.291   3.7897   28.687   4.4279   15.989   7.3276  191.186   15.258  135.260   35.093 55.92563 38.26622 
1 1 1   17   24   36 o  267.779   9.2038   55.284   3.7724   63.148   5.1931   46.499   5.4891  285.491   11.884  243.749   14.782 41.74214 18.96713 
1 1 1   17   24   37 o   68.615   23.177   3.5883   2.8905   4.6910   4.0342   2.4251   4.1435   78.616   27.355   68.117   26.901 10.49888 38.36595 
1 1 1   17   24   38 f  203.275   11.317   32.115   3.5072   29.077   4.7864   35.637   5.1539  191.743   16.469  212.605   15.954 -20.86153 22.92919 
1 1 1   17   24   39 o   61.981   23.306   2.4403   3.0021  -3.3424   4.3858   7.5388   4.1182   50.603   23.512   94.347   27.092 -43.74446 35.87125 
1 1 1   17   24   40 o   83.776   23.245   5.8779   3.0856   4.4258   4.3853   7.3018   4.3424   77.758   28.359   92.757   28.134 -14.99918 39.94683 
1 1 1   17   24   41 o  125.449   18.171   12.751   3.3875   17.091   5.0625   9.2329   4.5585  142.978   23.982  103.171   28.104 39.80719 36.94552 
1 1 1   17   24   42 o  134.512   17.368   14.601   3.4923   16.250   5.2930   13.330   4.6474  137.959   26.020  125.073   25.148 12.88622 36.18623 
1 1 1   17   24   43 o  277.272   11.516   59.929   4.8872   69.065   7.2793   52.432   6.5945  294.644   16.203  256.174   16.913 38.46960 23.42196 
1 1 1   17   24   44 o  140.741   17.410   16.057   3.6705   16.948   5.6458   15.404   4.8308  139.303   27.455  134.382   24.384 4.921280 36.72003 
1 1 1   17   24   45 f   64.262   24.800   2.6727   3.4558   1.6810   4.9264   3.6335   4.8491   67.140   28.234   74.106   29.153 -6.966362 40.58411 
1 1 1   17   24   46 o   42.721   20.112  -3.0709   3.3887  -4.7860   4.7715  -1.3256   4.8134   48.961   23.289   57.050   25.793 -8.088898 34.75143 
1 1 1   17   24   47 o   89.569   30.071   7.2981   4.8654 -12.2766   7.8079   19.724   6.2208   54.631   26.852  147.215   28.638 -92.58379 39.25770 
1 1 1   17   24   48 o  195.513   17.477   31.393   5.1749   28.884   8.1845   33.065   6.6796  174.812   31.758  196.325   22.643 -21.51352 39.00341 
1 1 1   17   25    0 o   41.935   28.290  -2.3369   5.2659  -2.3369   5.2659  -2.3369   5.2659   41.935   28.290   41.935   28.290 0.000000 0.000000 
1 1 1   17   25    1 f  346.532   10.577   92.199   5.6102  103.433   7.9464   81.034   7.9217  366.572   14.163  324.209   15.963 42.36313 21.34023 
1 1 1   17   25    2 o  215.393   19.056   36.150   6.2177   36.150   6.2177   0.0000   0.0000  215.393   19.056  ?   ?  0.000000 19.05594 
1 1 1   17   25    3 o  166.164   23.341   21.863   5.7726   21.863   5.7726   0.0000   0.0000  166.164   23.341  ?   ?  0.000000 23.34061 
1 1 1   17   25    4 o  541.220   9.6563  224.788   7.9993  230.584   11.026  218.349   11.623  547.513   13.157  532.554   14.259 14.95850 19.40157 
1 1 1   17   25    5 o  135.382   21.467   14.553   4.2999   12.743   5.4289   17.600   7.0435  125.085   28.932  146.697   32.248 -21.61221 43.32393 
1 1 1   17   25    6 o  574.922   7.9246  253.441   6.9735  247.710   8.2757  267.477   12.951  568.147   9.5165  589.360   14.356 -21.21289 17.22414 
1 1 1   17   25    7 o  239.247   9.8995   43.937   3.6252   45.861   4.1362   37.562   7.5288  244.339   11.060  218.673   22.830 25.66612 25.36824 
1 1 1   17   25    8 o  145.485   14.531   16.464   3.1925   15.918   3.5570   18.729   7.2404  142.668   16.599  151.310   32.249 -8.641800 36.26965 
1 1 1   17   25    9 o  272.699   9.1301   57.063   3.8109   52.294   4.2141   78.474   8.9282  260.937   10.551  317.985   18.423 -57.04779 21.23017 
1 1 1   17   25   10 o   64.518   23.621   2.6320   3.0466   3.0979   3.3649   0.5134   7.1754   68.793   24.879   79.516   33.789 -10.72358 41.95995 
1 1 1   17   25   11 o   66.087   26.167   1.9245   3.9301   4.4145   4.6228  -4.5665   7.4639   81.060   29.183   69.115   31.586 11.94523 43.00391 
1 1 1   17   25   12 o  365.844   9.9670  102.781   5.5813  101.626   6.5961  105.692   10.472  363.526   11.854  368.979   18.603 -5.452484 22.05875 
1 1 1   17   25   13 o  468.211   9.2564  168.283   6.6336  165.975   7.8554  174.020   12.386  464.691   11.044  474.408   17.057 -9.716339 20.31996 
1 1 1   17   25   14 o  294.694   14.662   66.987   6.6134   77.024   9.1503   56.008   9.5695  314.595   19.093  266.813   23.678 47.78159 30.41695 
1 1 1   17   25   15 o  315.441   14.609   76.766   7.0536   76.422   9.3457   77.222   10.752  313.148   19.597  313.889   22.529 -0.7414551 29.85956 
1 1 1   17   25   16 o  320.972   11.348   79.243   5.5754   63.010   6.1397  155.574   13.313  285.832   14.033  447.562   19.434 -161.7296 23.97114 
1 1 1   17   25   17 o  369.925   10.598  105.209   6.0008  105.593   6.9559  104.092   11.865  370.312   12.272  364.832   21.341 5.479187 24.61797 
1 1 1   17   25   18 o  596.998   9.4705  273.806   8.6540  272.785   10.156  276.513   16.537  595.449   11.143  596.936   18.099 -1.486938 21.25409 
1 1 1   17   25   19 o  411.874   10.696  130.488   6.7430  122.360   7.7769  155.103   13.534  398.416   12.753  446.309   19.812 -47.89273 23.56166 
1 1 1   17   25   20 o  592.648   9.7254  269.982   8.8222  264.825   10.260  284.606   17.279  586.474   11.430  604.958   18.661 -18.48401 21.88301 
1 1 1   17   25   21 o  367.071   13.008  103.968   7.3088  103.968   7.3088   0.0000   0.0000  367.071   13.008  ?   ?  0.000000 13.00844 
1 1 1   17   25   22 o  206.738   20.052   33.673   6.2654   33.673   6.2654   0.0000   0.0000  206.738   20.052  ?   ?  0.000000 20.05179 
1 1 1   17   25   23 o  295.560   13.561   67.512   6.1351   68.836   6.9384   62.766   13.135  297.680   15.279  277.643   31.465 20.03717 34.97838 
1 1 1   17   25   24 f  439.679   11.006  148.948   7.4068  148.500   8.6223  150.209   14.469  438.484   12.847  437.365   21.613 1.119354 25.14302 
1 1 1   17   25   25 o  416.946   9.7294  133.772   6.2092  137.724   8.6845  129.639   8.8811  422.018   13.444  409.207   14.179 12.81079 19.53979 
1 1 1   17   25   26 o   51.918   23.858  -2.9427   4.3382   2.8770   6.0604  -9.0584   6.2126   80.146   32.238   53.039   25.581 27.10688 41.15444 
1 1 1   17   25   27 o   95.833   28.244   7.5269   4.4242   12.666   6.3039   2.5386   6.2106  122.438   32.924   79.585   32.411 42.85281 46.19963 
1 1 1   17   25   28 o  191.062   16.537   28.633   4.7886   27.500   6.6903   29.824   6.8570  184.677   24.255  192.624   23.761 -7.946564 33.95390 
1 1 1   17   25   29 o  350.763   8.0956   94.575   4.3464   93.796   5.0731   96.724   8.4278  349.029   9.4961  352.630   15.614 -3.601318 18.27519 
1 1 1   17   25   30 o  175.382   12.983   23.944   3.4606   25.343   3.9904   19.699   6.9501  180.066   14.604  153.131   30.721 26.93500 34.01521 
1 1 1   17   25   31 o  387.119   12.969  116.103   7.6844  109.927   12.586  119.774   9.7029  371.741   22.221  391.868   16.177 -20.12726 27.48579 
1 1 1   17   25   32 o  154.058   25.906   19.532   5.8920   26.588   10.511   16.299   7.1149  172.968   40.428  137.441   34.006 35.52710 52.82882 
1 1 1   17   25   33 o  280.072   9.9467   60.508   4.2640   62.754   4.9075   53.589   8.6135  284.909   11.254  258.840   21.948 26.06882 24.66463 
1 1 1   17   25   34 o  311.899   9.5933   75.024   4.5798   79.669   5.3922   62.998   8.6765  321.030   10.974  281.449   20.277 39.58118 23.05556 
1 1 1   17   25   35 o  142.814   17.375   16.237   3.7198   15.394   4.0844   20.338   9.0064  138.188   19.883  150.599   38.824 -12.41107 43.61934 
1 1 1   17   25   36 o  125.208   16.159   12.473   3.0245   10.010   4.1322   15.316   4.4389  109.208   25.229  136.987   21.908 -27.77847 33.41352 
1 1 1   17   25   37 o  143.489   15.441   16.297   3.3378   24.771   4.6895   7.5957   4.7520  176.453   17.598   95.115   29.538 81.33780 34.38304 
1 1 1   17   25   38 o  303.072   9.1550   70.913   4.2469   71.003   5.7864   70.808   6.2529  302.126   12.513  301.286   13.559 0.8393860 18.45028 
1 1 1   17   25   39 o  222.549   10.471   38.373   3.5669   40.563   5.0158   36.132   5.0733  227.115   14.504  213.844   15.608 13.27094 21.30647 
1 1 1   17   25   40 o  102.197   21.068   8.6937   3.1861   5.5760   4.4851   11.870   4.5268   83.405   28.853  117.887   25.803 -34.48267 38.70821 
1 1 1   17   25   41 o  287.185   13.716   64.672   6.0290   64.672   6.0290   0.0000   0.0000  287.185   13.716  ?   ?  0.000000 13.71554 
1 1 1   17   25   42 o  157.622   16.090   19.878   3.8275   19.060   5.4047   20.701   5.4212  150.302   24.324  157.384   23.200 -7.081787 33.61402 
1 1 1   17   25   43 o  154.574   16.009   19.168   3.7327   22.334   6.0585   17.231   4.7390  161.844   25.284  143.460   22.307 18.38373 33.71711 
1 1 1   17   25   44 o   61.022   24.486   1.9591   3.4871   5.9003   5.1436  -1.3927   4.7435   84.616   30.736   56.825   25.656 27.79115 40.03607 
1 1 1   17   25   45 o   61.291   24.640   2.0289   3.5379   4.0775   5.1840   0.2428   4.8404   76.448   30.121   61.666   26.975 14.78207 40.43463 
1 1 1   17   25   46 o  166.904   15.890   22.567   4.0103   28.366   6.2702   18.553   5.2168  182.123   23.006  146.088   24.176 36.03447 33.37316 
1 1 1   17   25   47 o  171.059   19.642   24.480   5.0495   23.039   8.3487   25.310   6.3408  150.967   36.526  169.567   25.197 -18.59966 44.37371 
1 1 1   17   26    1 o  196.070   22.061   30.239   6.5057   0.0000   0.0000   30.239   6.5057  ?   ?   196.070   22.061 0.000000 22.06109 
1 1 1   17   26    2 o  322.294   15.944   80.149   7.8653   0.0000   0.0000   80.149   7.8653  ?   ?   322.294   15.944 0.000000 15.94391 
1 1 1   17   26    3 o  428.463   14.494  141.456   9.5052   0.0000   0.0000  141.456   9.5052  ?   ?   428.463   14.494 0.000000 14.49360 
1 1 1   17   26    4 o  572.635   9.7266  251.733   8.5252  249.878   11.704  253.831   12.443  569.724   13.421  574.021   14.162 -4.297302 19.51152 
1 1 1   17   26    5 o  279.609   11.934   60.116   5.1073   58.681   6.8058   61.966   7.7273  275.237   16.227  282.487   17.965 -7.249237 24.20826 
1 1 1   17   26    6 o  648.959   8.1775  323.035   8.1228  320.602   9.7241  328.653   14.775  646.188   9.8316  652.917   14.785 -6.729370 17.75503 
1 1 1   17   26    7 o   93.409   22.081   7.0557   3.1072   3.2905   3.4559   22.936   7.0975   70.264   25.239  168.661   28.509 -98.39672 38.07587 
1 1 1   17   26    8 o  237.625   10.124   43.368   3.6822   43.064   4.1716   44.442   7.8347  236.667   11.516  238.088   21.739 -1.421082 24.60057 
1 1 1   17   26    9 o  799.345   7.6126  490.005   9.3140  490.523   10.686  488.367   19.003  799.508   8.7318  795.398   15.609 4.110413 17.88512 
1 1 1   17   26   10 o  131.290   16.741   13.534   3.2876   13.347   3.6405   14.362   7.6545  129.928   18.857  131.751   36.631 -1.823502 41.19978 
1 1 1   17   26   11 o  233.172   10.312   41.774   3.6805   40.863   4.0741   45.816   8.5824  230.208   11.600  241.124   23.555 -10.91608 26.25611 
1 1 1   17   26   12 o  611.365   9.0856  286.950   8.5020  288.370   10.428  284.136   14.683  612.395   11.125  606.428   15.819 5.967163 19.33891 
1 1 1   17   26   13 o  563.511   11.707  244.331   10.097  225.408   13.810  266.066   14.801  539.748   16.717  586.496   16.487 -46.74860 23.47923 
1 1 1   17   26   14 o  249.398   13.156   48.067   5.0043   41.614   5.7341   68.686   10.250  231.386   16.295  295.642   22.828 -64.25519 28.04662 
1 1 1   17   26   15 o  220.894   14.489   37.830   4.8718   32.920   5.5334   54.757   10.274  205.300   17.785  262.642   25.894 -57.34210 31.41319 
1 1 1   17   26   16 o  473.213   9.7044  172.081   7.0290  171.424   8.3061  173.738   13.193  471.919   11.499  473.049   18.220 -1.129822 21.54539 
1 1 1   17   26   17 o  255.251   13.778   50.433   5.3631   52.301   6.2509   45.223   10.440  259.489   15.814  236.899   29.426 22.58994 33.40561 
1 1 1   17   26   18 o  412.953   10.577  131.195   6.6856  131.671   7.6712  129.692   13.634  413.362   12.124  406.509   21.994 6.852905 25.11467 
1 1 1   17   26   19 o   91.477   29.703   6.5354   4.7587   6.3293   5.3672   7.2930   10.289   91.945   31.578  109.727   42.668 -17.78201 53.08190 
1 1 1   17   26   20 o  452.600   12.147  157.957   8.4150  157.957   8.4150   0.0000   0.0000  452.600   12.147  ?   ?  0.000000 12.14704 
1 1 1   17   26   21 o   84.926   30.447   5.0724   5.0270   6.1491   5.6132   0.7105   11.298   91.616   32.245   96.678   41.759 -5.061195 52.75890 
1 1 1   17   26   22 o  246.723   15.029   47.336   5.6485   48.582   6.4059   42.983   11.974  249.450   16.877  226.997   35.638 22.45352 39.43195 
1 1 1   17   26   23 o  343.097   12.523   90.896   6.5763   87.300   7.4072  104.280   14.291  335.759   14.413  361.393   26.009 -25.63339 29.73552 
1 1 1   17   26   24 o  133.418   26.774   14.648   5.2776   17.794   5.8689   1.3515   12.065  147.304   27.026  100.252   43.228 47.05229 50.98101 
1 1 1   17   26   25 o   53.259   24.239  -2.4204   4.3379  -1.7897   5.8582  -3.1862   6.4546   65.043   29.004   65.280   29.655 -0.2371826 41.48038 
1 1 1   17   26   26 o   85.949   28.579   5.7327   4.3957   6.4598   6.2514   5.0216   6.1822   94.239   33.935   88.303   33.391 5.935593 47.60841 
1 1 1   17   26   27 f  115.453   26.547   11.065   4.5933   12.641   6.5543   9.5448   6.4391  121.987   33.890  107.761   34.508 14.22598 48.36623 
1 1 1   17   26   28 o  163.360   20.138   21.276   4.9289   15.702   7.0742   26.535   6.8711  135.426   34.138  180.676   25.559 -45.24989 42.64579 
1 1 1   17   26   29 o   79.338   32.810   2.1823   6.4904   0.0000   0.0000   2.1823   6.4904  ?   ?    79.338   32.810 0.000000 32.80963 
1 1 1   17   26   30 o  145.788   27.390   17.641   5.8877   11.990   9.3752   21.320   7.5657  120.171   41.708  158.515   32.279 -38.34438 52.73982 
1 1 1   17   26   31 o  130.205   16.062   13.421   3.1332   13.652   3.4726   12.409   7.2670  130.853   17.800  120.034   36.393 10.81870 40.51252 
1 1 1   17   26   32 o  278.104   9.8899   59.659   4.2099   59.044   4.7976   61.719   8.7780  276.324   11.343  278.484   20.742 -2.160217 23.64103 
1 1 1   17   26   33 o  112.970   19.976   10.365   3.3278   10.763   3.7113   8.7297   7.5173  114.557   21.965  104.777   37.268 9.780472 43.25875 
1 1 1   17   26   34 o  302.013   10.264   70.454   4.7449   69.238   5.2570   75.801   11.021  299.047   11.485  306.449   23.680 -7.401184 26.31782 
1 1 1   17   26   35 o  107.348   22.574   9.5467   3.5914   7.7925   3.9018   19.275   9.1886   96.250   25.911  145.515   40.010 -49.26524 47.66745 
1 1 1   17   26   36 o  115.160   21.301   10.898   3.6163   13.307   4.0524   1.4750   8.0140  127.452   21.540   82.600   35.418 44.85223 41.45361 
1 1 1   17   26   37 o  152.872   13.738   18.379   3.1801   18.561   4.3577   18.173   4.6515  151.748   19.190  149.442   20.908 2.306015 28.37965 
1 1 1   17   26   38 o   64.774   23.338   2.9890   2.9571  -0.2341   3.9513   7.0927   4.4585   56.189   24.481   91.633   28.637 -35.44320 37.67511 
1 1 1   17   26   39 o  187.449   14.953   27.789   4.2545   41.155   5.2740   2.8813   7.1994  228.225   15.184   82.003   34.286 146.2213 37.49768 
1 1 1   17   26   40 f  170.127   19.466   23.499   4.9778   23.499   4.9778   0.0000   0.0000  170.127   19.466  ?   ?  0.000000 19.46617 
1 1 1   17   26   41 o  130.125   17.066   13.681   3.3171   9.5042   5.0048   16.953   4.4298  103.521   29.907  143.381   20.791 -39.86024 36.42395 
1 1 1   17   26   42 o  147.058   34.150   20.026   7.5396   0.0000   0.0000   20.026   7.5396  ?   ?   147.058   34.150 0.000000 34.15044 
1 1 1   17   26   43 o  116.203   20.824   11.347   3.5679   4.9017   5.0243   17.904   5.0674   79.956   30.134  144.942   23.658 -64.98634 38.31084 
1 1 1   17   26   44 o  109.987   22.627   10.415   3.6821   16.028   5.4821   5.8022   4.9699  133.855   27.672   83.245   30.216 50.61037 40.97218 
1 1 1   17   26   46 o  138.977   21.031   16.422   4.3339   7.4807   8.5312   19.533   5.0315   93.296   37.989  150.734   22.497 -57.43729 44.15089 
1 1 1   17   27    0 o  470.176   14.188  170.256   10.190  170.256   10.190  170.256   10.190  470.176   14.188  470.176   14.188 0.000000 0.000000 
1 1 1   17   27    1 o  148.809   20.011   17.485   4.4423   10.861   6.0975   24.978   6.4852  115.362   32.914  177.173   24.576 -61.81052 41.07742 
1 1 1   17   27    2 o  167.950   16.932   22.024   4.2933   14.080   5.8054   31.614   6.3781  131.110   29.626  200.590   21.089 -69.47952 36.36610 
1 1 1   17   27    3 o  470.330   10.088  169.920   7.2621  171.291   9.9747  168.373   10.594  471.464   13.822  467.192   14.814 4.271301 20.26115 
1 1 1   17   27    4 o  252.493   12.736   49.203   4.9062   47.114   6.5580   51.858   7.3938  246.138   17.521  257.974   18.856 -11.83592 25.73982 
1 1 1   17   27    5 o  132.564   33.122   14.522   6.7015   0.0000   0.0000   14.522   6.7015  ?   ?   132.564   33.122 0.000000 33.12220 
1 1 1   17   27    6 o  236.315   21.445   43.811   7.6723   0.0000   0.0000   43.811   7.6723  ?   ?   236.315   21.445 0.000000 21.44484 
1 1 1   17   27    7 o  151.038   18.127   17.920   4.1069   16.652   5.0039   20.536   7.1887  144.267   23.467  158.526   30.736 -14.25870 38.67062 
1 1 1   17   27    8 o   61.828   25.484   1.0002   3.8977   2.0094   4.7743  -1.0165   6.7490   71.206   28.624   72.915   31.875 -1.708664 42.84105 
1 1 1   17   27    9 o  424.888   9.3674  138.641   6.0921  135.737   7.3996  144.750   10.733  420.045   11.509  432.661   16.207 -12.61530 19.87761 
1 1 1   17   27   10 o  464.586   9.6034  165.801   6.8291  156.945   8.2530  185.032   12.162  451.551   11.941  489.101   16.245 -37.55066 20.16163 
1 1 1   17   27   11 o  441.865   12.062  150.325   8.1577  146.256   11.502  154.444   11.572  434.470   17.296  446.581   16.929 -12.11099 24.20196 
1 1 1   17   27   12 o  420.995   9.7355  136.190   6.2734  131.592   7.4696  147.197   11.557  413.437   11.804  435.782   17.327 -22.34561 20.96550 
1 1 1   17   27   13 f  529.075   9.1492  215.012   7.4092  210.769   8.8399  225.031   13.584  523.395   11.034  539.065   16.463 -15.66980 19.81917 
1 1 1   17   27   14 o  212.652   15.272   35.146   4.9377   32.094   5.6385   45.185   10.226  202.449   18.397  237.067   28.771 -34.61850 34.15029 
1 1 1   17   27   15 o  326.114   11.546   81.897   5.7635   80.768   6.7622   84.893   11.019  323.461   13.658  328.671   22.031 -5.209442 25.92143 
1 1 1   17   27   16 o  358.222   10.843   98.765   5.9450   96.851   6.9315  104.092   11.562  354.344   12.780  364.447   20.813 -10.10342 24.42397 
1 1 1   17   27   17 o  270.051   12.884   56.277   5.3256   53.940   6.0907   63.867   10.975  263.545   15.163  283.228   25.594 -19.68243 29.74812 
1 1 1   17   27   18 o  199.540   16.988   31.141   5.1390   32.219   5.8719   27.614   10.623  202.402   19.183  179.739   39.674 22.66351 44.06791 
1 1 1   17   27   19 o  171.951   22.226   23.579   5.7128   23.579   5.7128   0.0000   0.0000  171.951   22.226  ?   ?  0.000000 22.22599 
1 1 1   17   27   20 o   78.169   29.212   3.8738   4.7021   5.0547   5.2482  -0.9315   10.586   85.533   31.050   90.391   39.708 -4.857246 50.40607 
1 1 1   17   27   21 o   62.572   27.325  -0.6662   4.9479   1.0623   5.5964  -6.8554   10.590   71.839   30.145   79.744   36.870 -7.904602 47.62473 
1 1 1   17   27   22 o   83.025   30.240   4.7292   4.9840   3.8605   5.5845   8.1297   11.049   81.721   31.530  113.133   44.153 -31.41153 54.25470 
1 1 1   17   27   23 o  160.618   22.694   20.717   5.4240   18.472   6.0999   29.195   11.855  149.869   27.609  182.149   43.178 -32.27957 51.25020 
1 1 1   17   27   24 o  173.781   21.507   24.109   5.5987   27.786   6.2600   9.4116   12.516  186.428   22.385  119.449   46.886 66.97881 51.95567 
1 1 1   17   27   25 o  173.559   22.667   24.177   5.8779   32.363   6.5636  -8.9721   13.208  201.567   21.611   86.977   40.542 114.5905 45.94205 
1 1 1   17   27   26 o   77.709   29.903   3.5521   5.0128  -4.2898   8.0809   8.4573   6.3910   71.687   32.801  102.808   34.465 -31.12113 47.57915 
1 1 1   17   27   27 o  173.797   26.326   24.691   6.7839   0.0000   0.0000   24.691   6.7839  ?   ?   173.797   26.326 0.000000 26.32611 
1 1 1   17   27   28 o   74.109   30.547   1.9005   5.6009   1.1934   10.237   2.2026   6.6914   92.214   39.790   80.267   33.264 11.94742 51.86240 
1 1 1   17   27   29 o  159.135   21.245   20.354   5.0456   21.756   7.0801   18.908   7.1924  161.174   29.797  148.891   32.474 12.28406 44.07307 
1 1 1   17   27   30 o  109.255   30.063   10.106   5.1855   12.896   7.2124   7.1213   7.4607  122.070   36.086   99.096   36.842 22.97451 51.57085 
1 1 1   17   27   31 o  103.498   21.063   8.7759   3.2232   6.9164   3.5754   16.844   7.4476   91.245   24.904  138.982   35.023 -47.73646 42.97485 
1 1 1   17   27   32 o   74.914   23.840   4.4648   3.0771   1.9993   3.3739   16.655   7.5024   62.071   24.350  137.803   35.385 -75.73183 42.95403 
1 1 1   17   27   33 o  100.432   23.081   8.3828   3.4737   7.1483   3.7244   16.640   9.6321   92.477   25.491  135.426   42.054 -42.94902 49.17659 
1 1 1   17   27   34 o  244.405   11.506   46.288   4.3044   45.817   4.6920   48.790   10.816  242.521   12.684  241.093   29.955 1.428268 32.52977 
1 1 1   17   27   35 o  185.447   14.323   27.010   4.0341   28.222   4.5560   22.612   8.6802  189.035   15.894  159.064   36.435 29.97157 39.75095 
1 1 1   17   27   36 o  116.862   20.965   11.229   3.6122   15.326   4.0784  -3.6816   7.7805  137.356   19.985   69.776   32.022 67.58012 37.74630 
1 1 1   17   27   37 o  273.771   10.943   58.151   4.5854   67.039   5.6256   40.558   7.9149  293.329   12.530  222.163   23.639 71.16663 26.75434 
1 1 1   17   27   38 o  120.982   18.582   11.912   3.3309   17.376   4.5629   5.6790   4.8736  145.463   21.110   84.684   30.019 60.77940 36.69875 
1 1 1   17   27   39 o  128.530   21.033   13.659   3.9948   16.037   4.7939   8.2549   7.2264  138.318   23.483   99.386   36.380 38.93214 43.30077 
1 1 1   17   27   40 o   49.237   21.651  -0.4537   3.1546  -6.1018   4.6141   4.5034   4.3226   46.081   22.179   77.119   28.151 -31.03812 35.83836 
1 1 1   17   27   41 o   80.773   25.485   5.5317   3.5220   4.0383   5.5378   6.5461   4.5641   78.566   31.076   87.419   29.124 -8.853638 42.59005 
1 1 1   17   27   42 f  172.332   13.768   23.590   3.6014   24.927   5.1967   22.354   4.9955  173.863   19.885  164.311   20.294 9.552612 28.41278 
1 1 1   17   27   43 o   82.333   24.711   5.9093   3.3630   4.0070   4.8700   7.6434   4.6496   75.204   29.323   92.062   29.307 -16.85809 41.45764 
1 1 1   17   27   44 o  113.741   21.077   11.031   3.5344   11.732   5.2459   10.447   4.7828  112.086   29.989  106.446   28.700 5.639526 41.50988 
1 1 1   17   27   45 o   57.412   26.764  -3.2420   5.7590  -4.1543   10.870  -2.8860   6.7903   76.218   35.923   63.193   29.325 13.02441 46.37307 
1 1 1   17   28    0 o  120.047   38.101   14.155   6.1611   14.155   6.1611   14.155   6.1611  120.047   38.101  120.047   38.101 0.000000 0.000000 
1 1 1   17   28    1 o  168.165   17.647   22.144   4.4745   30.183   6.1787   13.280   6.4884  195.816   20.940  126.646   33.102 69.17010 39.16906 
1 1 1   17   28    2 o  109.846   25.881   9.8502   4.2800   8.3961   5.6479   11.812   6.5594  102.763   32.250  119.790   34.125 -17.02652 46.95302 
1 1 1   17   28    3 o  341.311   11.156   89.605   5.8279   89.627   7.9053   89.579   8.6254  340.626   15.163  340.232   16.563 0.3937988 22.45507 
1 1 1   17   28    4 o  225.173   14.685   39.309   5.0335   41.383   6.6502   36.526   7.7020  230.076   19.056  214.755   23.833 15.32053 30.51429 
1 1 1   17   28    5 o   83.924   27.485   5.3808   4.0713   6.9843   5.1801   2.7896   6.5848   94.960   30.998   83.057   33.535 11.90298 45.66733 
1 1 1   17   28    6 o   74.174   27.899   3.3059   4.3026   6.3218   5.6255  -0.9449   6.6787   92.953   32.305   72.584   31.720 20.36931 45.27478 
1 1 1   17   28    7 o  185.056   14.807   26.617   4.1591   25.128   4.9842   30.032   7.5474  179.000   18.456  193.716   26.120 -14.71590 31.98281 
1 1 1   17   28    8 o  142.506   18.272   16.012   3.8937   17.608   4.6143   12.066   7.2559  148.936   20.810  121.111   36.286 27.82533 41.82932 
1 1 1   17   28    9 o  414.324   9.3465  131.883   5.9273  124.859   7.0020  149.644   11.134  402.772   11.358  439.548   16.550 -36.77570 20.07203 
1 1 1   17   28   10 o  151.488   15.621   17.937   3.5700   18.413   3.9694   15.924   8.1660  153.165   17.231  137.601   37.670 15.56381 41.42411 
1 1 1   17   28   11 o  449.135   9.7437  155.057   6.6984  150.857   7.9792  165.079   12.327  442.567   11.779  461.206   17.462 -18.63937 21.06352 
1 1 1   17   28   12 o  128.020   23.830   13.263   4.4977   12.573   5.2303   15.219   8.8122  123.538   28.272  134.518   39.917 -10.97998 48.91497 
1 1 1   17   28   13 o  276.446   12.444   58.929   5.2657   52.392   6.1543   76.789   10.173  259.668   15.556  312.611   21.388 -52.94363 26.44703 
1 1 1   17   28   14 o  277.683   12.528   59.476   5.3246   61.292   6.2342   54.578   10.238  281.148   14.537  261.531   25.916 19.61688 29.71419 
1 1 1   17   28   15 o   63.951   26.854   0.6929   4.4459   1.4154   5.1601  -1.3892   8.7591   70.779   29.261   81.695   35.996 -10.91559 46.38887 
1 1 1   17   28   16 o  647.325   9.5469  322.239   9.4592  314.405   11.255  341.076   17.454  638.711   11.513  662.400   17.215 -23.68903 20.70987 
1 1 1   17   28   17 o  225.467   17.738   39.800   6.0721   39.800   6.0721   0.0000   0.0000  225.467   17.738  ?   ?  0.000000 17.73830 
1 1 1   17   28   18 o  312.413   14.051   75.516   6.7190   75.516   6.7190   0.0000   0.0000  312.413   14.051  ?   ?  0.000000 14.05092 
1 1 1   17   28   19 o  229.099   15.586   40.904   5.4331   42.775   6.2011   34.719   11.271  233.781   17.455  202.352   37.781 31.42863 41.61867 
1 1 1   17   28   20 o  356.088   11.994   97.857   6.5374   97.486   7.5172   99.010   13.243  354.922   13.837  352.681   24.688 2.241333 28.30113 
1 1 1   17   28   21 o  256.649   15.372   51.306   6.0108   50.964   6.8301   52.479   12.657  255.102   17.600  251.595   33.715 3.507324 38.03204 
1 1 1   17   28   22 o  179.268   21.500   25.631   5.7818   28.884   6.6068   14.993   11.949  189.834   23.222  134.153   47.056 55.68132 52.47438 
1 1 1   17   28   23 o  460.810   13.769  164.491   9.7117  161.032   12.362  170.067   15.697  454.118   17.784  464.180   22.094 -10.06137 28.36197 
1 1 1   17   28   24 f   92.065   35.032   5.4764   6.8314   4.9411   8.3107   6.5919   11.996   95.268   37.947  110.773   45.070 -15.50517 58.91745 
1 1 1   17   28   25 o  207.182   19.152   33.943   6.0049   32.787   6.6926   38.719   13.600  202.587   21.933  208.564   43.985 -5.977020 49.15042 
1 1 1   17   28   26 o  145.616   36.088   18.363   8.0028   13.374   9.8512   28.047   13.723  125.760   42.787  173.713   49.315 -47.95279 65.28944 
1 1 1   17   28   27 o  445.039   10.486  152.815   7.1433  147.129   9.7553  159.388   10.489  435.009   14.651  452.527   15.143 -17.51785 21.07046 
1 1 1   17   28   28 o  374.889   11.146  108.589   6.3956  102.198   8.7062  116.081   9.4260  361.998   15.713  385.686   15.967 -23.68808 22.40171 
1 1 1   17   28   29 o  240.659   15.391   45.336   5.6397   52.482   7.8603   37.755   8.0965  257.025   20.141  215.566   25.003 41.45839 32.10610 
1 1 1   17   28   30 o  330.227   12.440   84.532   6.2877   86.744   8.5140   81.878   9.3258  332.396   16.789  321.767   19.020 10.62918 25.36954 
1 1 1   17   28   31 o  174.149   21.478   24.450   5.6039   20.925   7.9657   27.905   7.8852  155.066   34.456  182.565   29.202 -27.49892 45.16578 
1 1 1   17   28   32 o  224.307   11.893   39.108   4.0686   40.051   4.4537   34.352   10.002  226.700   12.888  199.674   33.939 27.02629 36.30417 
1 1 1   17   28   33 o  227.462   12.081   40.262   4.1912   41.479   4.6163   34.550   9.9990  230.541   13.136  199.787   33.910 30.75400 36.36575 
1 1 1   17   28   34 o  152.933   15.532   18.515   3.5854   19.245   4.0325   15.763   7.8338  155.358   17.249  132.093   37.176 23.26511 40.98256 
1 1 1   17   28   35 o   70.032   25.245   3.5396   3.4604   6.0746   3.9445  -4.9280   7.2092   85.581   26.966   64.485   30.022 21.09624 40.35506 
1 1 1   17   28   36 o   75.665   26.755   4.3600   3.8689   3.4687   4.1695   9.8822   10.378   72.284   27.401  110.482   42.883 -38.19811 50.88918 
1 1 1   17   28   37 o  146.475   18.518   17.355   4.0590   19.826   4.8060   11.207   7.5807  155.710   20.676  111.534   37.535 44.17705 42.85326 
1 1 1   17   28   38 o  102.777   25.429   9.0896   3.9785   13.003   4.8441   0.9772   6.9741  122.799   26.546   75.460   32.701 47.33906 42.11923 
1 1 1   17   28   39 f   95.275   22.555   7.7141   3.2382   7.8697   4.7444   7.5784   4.4308   94.862   29.524   93.282   28.447 1.579880 40.99872 
1 1 1   17   28   40 o  118.686   19.859   11.691   3.4802   12.217   5.3187   11.297   4.6022  116.447   29.736  113.280   26.936 3.166473 40.12241 
1 1 1   17   28   41 o  150.918   16.187   18.389   3.6809   17.761   5.3917   18.938   5.0374  143.043   25.564  149.604   22.712 -6.561188 34.19613 
1 1 1   17   28   42 o   73.470   24.982   4.4786   3.3584   3.1051   4.8539   5.7400   4.6515   71.526   28.823   82.389   29.314 -10.86337 41.11069 
1 1 1   17   28   43 o  208.360   11.976   34.275   3.8034   31.919   5.6893   36.179   5.1143  196.446   19.165  211.659   15.902 -15.21350 24.90375 
1 1 1   17   29    0 o  600.065   14.529  277.359   13.327  277.359   13.327  277.359   13.327  600.065   14.529  600.065   14.529 0.000000 0.000000 
1 1 1   17   29    1 o  231.846   14.762   41.704   5.2113   42.249   7.0424   41.044   7.7477  232.059   20.023  227.973   22.497 4.086319 30.11669 
1 1 1   17   29    2 o  114.254   26.745   10.706   4.5946   10.390   6.4526   11.030   6.5440  112.869   34.309  115.876   34.401 -3.006943 48.58568 
1 1 1   17   29    3 o  311.238   12.068   74.626   5.7490   70.992   7.7448   79.086   8.5800  302.185   16.811  318.746   17.655 -16.56088 24.37837 
1 1 1   17   29    4 o  152.587   20.619   18.473   4.6924   14.099   6.0791   24.922   7.3807  130.426   30.922  175.226   28.498 -44.80026 42.05104 
1 1 1   17   29    5 o  565.930   10.298  246.314   8.9203  242.160   12.032  251.383   13.292  559.965   14.039  570.073   15.233 -10.10779 20.71522 
1 1 1   17   29    6 o   87.008   26.579   6.0263   3.8656   3.9271   4.6005   11.068   7.1297   78.250   28.963  116.423   36.186 -38.17330 46.34907 
1 1 1   17   29    7 o  275.663   11.751   58.538   4.9583   60.905   5.9575   53.204   8.9439  280.822   13.860  259.572   22.741 21.25040 26.63141 
1 1 1   17   29    8 o  460.818   8.0847  163.031   5.7025  161.797   6.4839  167.244   11.982  458.851   9.2320  464.292   16.860 -5.440857 19.22195 
1 1 1   17   29    9 o  238.111   13.721   43.934   4.9796   42.381   6.1145   46.992   8.5806  233.010   17.267  243.540   23.303 -10.53046 29.00322 
1 1 1   17   29   10 o  314.349   11.533   76.129   5.5493   78.327   6.7347   71.481   9.7938  318.396   13.819  301.484   21.362 16.91168 25.44209 
1 1 1   17   29   11 f  257.989   10.975   51.252   4.3340   50.184   4.8867   55.190   9.3820  255.052   12.517  263.892   23.472 -8.840347 26.60155 
1 1 1   17   29   12 o  117.299   25.638   11.284   4.4746   11.173   5.2626   11.576   8.5008  116.030   29.551  119.657   39.741 -3.626892 49.52411 
1 1 1   17   29   13 o  351.576   11.170   95.224   6.0109   90.212   7.0470  108.610   11.516  341.685   13.474  372.148   20.293 -30.46304 24.35940 
1 1 1   17   29   14 o  502.567   9.8743  194.319   7.5957  196.392   9.1842  189.832   13.512  504.645   11.890  493.787   17.878 10.85825 21.47080 
1 1 1   17   29   15 o  262.640   16.346   53.766   6.5387   53.766   6.5387   0.0000   0.0000  262.640   16.346  ?   ?  0.000000 16.34638 
1 1 1   17   29   16 o  161.157   24.485   20.959   5.8496   20.959   5.8496   0.0000   0.0000  161.157   24.485  ?   ?  0.000000 24.48463 
1 1 1   17   29   17 o  149.419   22.627   17.947   5.0130   18.290   5.6591   16.696   10.804  149.928   25.578  139.512   44.701 10.41664 51.50174 
1 1 1   17   29   18 o  279.573   16.375   60.966   6.9767   54.201   8.5691   74.267   12.016  261.718   21.584  304.478   26.032 -42.75931 33.81625 
1 1 1   17   29   19 o  101.480   33.468   8.2164   6.0330   10.165   7.2705   3.9096   10.810  111.748   36.736  101.383   42.169 10.36534 55.92580 
1 1 1   17   29   20 o  707.719   12.210  386.895   13.227  363.758   16.938  423.051   21.174  683.846   16.182  735.399   18.811 -51.55231 24.81375 
1 1 1   17   29   21 o   97.759   35.532   6.9276   6.8760   12.819   8.3643  -5.3514   12.076  123.232   39.316   87.842   40.157 35.39099 56.19899 
1 1 1   17   29   22 o  194.140   19.800   29.876   5.8012   30.041   6.4711   29.204   13.094  193.833   22.212  179.248   47.107 14.58485 52.08130 
1 1 1   17   29   23 o  239.807   16.671   45.052   6.0812   43.384   6.8743   51.058   13.041  234.372   19.335  245.914   35.690 -11.54213 40.59058 
1 1 1   17   29   24 o  221.753   17.916   38.720   6.0290   37.749   6.7762   42.409   13.208  217.981   20.552  220.440   40.643 -2.459076 45.54338 
1 1 1   17   29   25 o  122.971   37.759   13.008   7.7899   9.4398   9.6674   19.614   13.154  112.255   41.898  147.193   49.445 -34.93848 64.80949 
1 1 1   17   29   26 o  294.400   15.273   67.679   6.8587   66.639   7.8593   71.001   14.046  291.123   17.722  292.139   31.933 -1.015869 36.52061 
1 1 1   17   29   27 o  121.171   32.460   12.591   6.1415   14.651   6.9126   4.8705   13.381  130.109   34.244  109.271   46.272 20.83838 57.56543 
1 1 1   17   29   28 o  165.785   22.192   22.214   5.4901   27.879   7.4182   15.354   8.1636  183.783   27.192  131.913   38.221 51.86969 46.90673 
1 1 1   17   29   29 o  202.492   18.178   32.493   5.5741   37.533   7.7609   27.123   8.0108  215.153   23.974  179.541   30.224 35.61197 38.57803 
1 1 1   17   29   30 o  202.381   19.524   32.674   5.9728   33.935   8.2739   31.303   8.6311  202.461   27.404  192.799   30.242 9.661713 40.81132 
1 1 1   17   29   31 o  227.940   18.600   41.294   6.4329   54.451   8.5532   24.160   9.7609  260.297   21.665  163.352   39.477 96.94501 45.03128 
1 1 1   17   29   32 o  194.376   20.284   30.374   5.9459   41.151   8.7432   21.100   8.1100  223.293   26.072  154.383   35.113 68.90994 43.73428 
1 1 1   17   29   33 o  135.385   18.655   14.780   3.7630   15.406   3.9483   8.5721   12.431  138.064   19.203  111.986   45.758 26.07896 49.62397 
1 1 1   17   29   34 o   77.133   25.821   4.7360   3.5870   4.1426   3.7758   10.230   11.489   74.348   26.416  113.640   44.820 -39.29190 52.02523 
1 1 1   17   29   35 o  343.336   11.446   91.636   6.0152   91.636   6.0152   0.0000   0.0000  343.336   11.446  ?   ?  0.000000 11.44628 
1 1 1   17   29   36 o  218.721   12.866   37.501   4.2885   43.705   5.1553   23.563   7.7271  235.502   14.371  163.167   32.083 72.33572 35.15439 
1 1 1   17   29   37 f  121.887   22.113   12.417   3.9735   18.074   4.9040   1.6021   6.7800  147.449   22.437   76.239   32.631 71.20929 39.60002 
1 1 1   17   29   38 o  129.324   21.153   13.910   4.0424   14.100   4.8621   13.485   7.2750  127.935   25.721  119.633   36.444 8.301788 44.60697 
1 1 1   17   29   39 o  156.221   19.012   19.988   4.4524   27.819   5.6373   7.0018   7.2592  183.764   20.386   93.206   35.951 90.55745 41.32889 
1 1 1   17   29   40 o  191.124   12.573   28.836   3.6577   31.038   5.2393   26.742   5.1086  195.465   17.704  180.710   18.742 14.75562 25.78158 
1 1 1   17   29   41 o   55.561   23.176   1.0733   3.2787   5.2374   4.7265  -2.7890   4.5520   80.092   29.406   51.770   24.019 28.32168 37.96926 
1 1 1   17   29   42 o  235.880   16.025   44.935   5.7514   23.087   12.562   50.729   6.4692  137.862   48.255  249.861   17.017 -111.9989 51.16725 
1 1 1   17   30    0 o   33.127   23.875 -10.7198   6.0682 -10.7198   6.0682 -10.7198   6.0682   33.127   23.875   33.127   23.875 0.000000 0.000000 
1 1 1   17   30    1 o  114.103   27.794   10.743   4.8094   10.889   6.8033   10.597   6.7996  115.107   35.277  113.812   35.332 1.294189 49.92831 
1 1 1   17   30    2 o  197.926   17.166   30.643   5.1490   34.663   7.0025   25.910   7.5974  209.154   22.213  178.335   28.815 30.81895 36.38364 
1 1 1   17   30    3 o  419.551   10.851  135.514   6.9685  128.562   9.3536  144.186   10.447  407.554   14.994  431.332   15.823 -23.77856 21.79915 
1 1 1   17   30    4 o  443.664   10.953  151.562   7.4378  157.738   10.305  144.844   10.746  451.447   14.913  432.151   16.246 19.29565 22.05314 
1 1 1   17   30    5 o  291.216   13.069   65.471   5.8256   63.924   7.6116   67.660   9.0513  286.277   17.454  293.609   20.265 -7.332581 26.74517 
1 1 1   17   30    6 o  153.153   19.443   18.575   4.4551   17.640   5.4392   20.480   7.7658  147.625   24.962  156.488   33.437 -8.862549 41.72636 
1 1 1   17   30    7 o  246.691   17.709   47.566   6.6424   41.185   10.006   52.592   8.8814  225.171   29.763  257.773   22.743 -32.60229 37.45768 
1 1 1   17   30    8 o  175.766   22.954   24.671   6.0280   23.952   8.6965   25.336   8.3631  168.939   34.790  174.776   32.457 -5.837372 47.57915 
1 1 1   17   30    9 o   89.211   25.096   6.4742   3.5707   7.1313   3.9579   3.5999   8.2780   93.495   26.464   92.067   37.447 1.427490 45.85443 
1 1 1   17   30   10 o  248.502   11.089   47.574   4.2177   44.838   4.6794   59.425   9.7378  240.667   12.748  273.701   23.471 -33.03448 26.70994 
1 1 1   17   30   11 o  374.076   9.0610  107.573   5.1881  105.787   5.8319  114.351   11.359  370.720   10.278  382.133   19.484 -11.41354 22.02896 
1 1 1   17   30   12 o  467.440   12.120  168.584   8.6719  158.962   11.328  182.208   13.479  452.404   16.358  483.509   18.213 -31.10498 24.48076 
1 1 1   17   30   13 o  204.939   26.385   33.882   8.0843   33.882   8.0843   0.0000   0.0000  204.939   26.385  ?   ?  0.000000 26.38476 
1 1 1   17   30   14 o  296.430   19.579   69.015   8.8335   69.015   8.8335   0.0000   0.0000  296.430   19.579  ?   ?  0.000000 19.57905 
1 1 1   17   30   15 o  143.072   27.751   16.868   5.8580   19.896   7.2390   11.125   9.9708  154.249   31.720  119.653   42.882 34.59608 53.33895 
1 1 1   17   30   16 o  229.968   18.965   41.614   6.6160   41.929   8.1076   40.987   11.446  229.216   23.438  221.299   34.951 7.916962 42.08258 
1 1 1   17   30   17 o   55.297   25.255  -2.8104   4.7623  -3.8341   5.2933   1.5379   10.909   56.530   26.112   96.281   41.305 -39.75096 48.86637 
1 1 1   17   30   18 o  280.597   14.024   61.007   6.0231   55.022   6.8443   81.551   12.681  265.222   16.948  318.634   26.235 -53.41129 31.23339 
1 1 1   17   30   19 o  172.180   20.747   23.628   5.3576   21.620   6.0286   31.171   11.685  163.174   24.929  188.510   41.611 -25.33615 48.50727 
1 1 1   17   30   20 o  214.389   17.557   36.123   5.7108   37.871   6.5571   30.635   11.621  218.781   19.795  186.527   41.747 32.25432 46.20206 
1 1 1   17   30   21 o  195.076   19.479   30.153   5.7384   32.303   6.5823   23.341   11.714  201.165   21.722  160.727   45.539 40.43839 50.45441 
1 1 1   17   30   22 o  162.919   23.051   21.442   5.5878   19.112   6.2828   30.258   12.222  151.783   28.078  183.457   44.076 -31.67313 52.25896 
1 1 1   17   30   23 o  211.857   25.057   36.350   7.9680   31.585   10.223   43.726   12.719  191.802   36.147  225.073   38.290 -33.27072 52.65678 
1 1 1   17   30   24 o  275.933   19.687   60.251   8.2603   60.902   10.705   59.293   12.986  274.252   25.806  266.415   32.520 7.837219 41.51476 
1 1 1   17   30   25 o   89.121   32.300   5.7899   5.6761   8.0321   6.4601  -1.8023   11.887  100.479   34.636   91.974   41.142 8.504784 53.78041 
1 1 1   17   30   26 o  380.619   13.181  112.426   7.6789  112.786   8.9626  111.433   14.890  380.269   15.398  370.497   26.430 9.772614 30.58888 
1 1 1   17   30   27 o  143.437   29.503   17.397   6.2611   14.452   7.1079   27.595   13.227  128.674   35.112  170.603   48.408 -41.92909 59.80111 
1 1 1   17   30   28 o  297.143   16.289   69.333   7.3802   73.278   8.4806   57.025   14.981  304.512   18.280  254.094   39.829 50.41730 43.82357 
1 1 1   17   30   29 o  257.662   15.523   52.107   6.0936   49.256   8.0132   56.017   9.3833  247.768   21.338  263.039   23.555 -15.27148 31.78298 
1 1 1   17   30   30 o   88.072   33.071   5.4834   6.0406  -1.0876   7.8809   14.842   9.4052   76.053   33.794  128.055   41.767 -52.00218 53.72625 
1 1 1   17   30   31 o  106.408   35.551   9.6796   6.8000   4.5435   8.0628   22.334   12.656   90.926   36.967  150.949   48.382 -60.02291 60.88808 
1 1 1   17   30   32 o  131.960   34.520   15.582   7.0522   25.127   8.9011  -0.5117   11.558  167.554   35.794   90.684   40.567 76.87046 54.10048 
1 1 1   17   30   33 o  131.758   29.984   15.149   5.9109   32.172   9.3627   3.8666   7.6219  191.372   33.165   86.689   35.672 104.6836 48.70748 
1 1 1   17   30   34 o   48.128   21.818  -1.5936   3.4716  -1.2983   3.9768  -2.5394   7.1169   52.822   23.700   68.261   31.059 -15.43963 39.06891 
1 1 1   17   30   35 o   73.528   25.762   4.1750   3.5809   3.6886   4.0670   5.8523   7.5530   72.637   27.163   91.867   36.307 -19.22939 45.34311 
1 1 1   17   30   36 f  113.550   22.026   10.820   3.6901   8.4325   4.2620   17.970   7.3751   98.339   27.331  139.670   34.662 -41.33066 44.14095 
1 1 1   17   30   37 o   83.347   25.998   5.9281   3.6766   5.3782   4.3114   7.3939   7.0393   81.130   28.277   94.747   35.676 -13.61697 45.52280 
1 1 1   17   30   38 o   85.897   27.803   6.3886   4.1716   8.5448   5.0223   1.5911   7.4916   97.427   30.385   77.680   33.778 19.74643 45.43341 
1 1 1   17   30   39 o  148.988   18.814   18.275   4.1948   22.536   4.9547   7.4901   7.8826  164.900   20.042   94.790   37.208 70.10990 42.26286 
1 1 1   17   30   40 o  144.950   20.620   17.626   4.4459   14.162   5.4041   24.881   7.8203  124.566   28.902  163.159   32.456 -38.59225 43.45984 
1 1 1   17   30   41 f  155.478   27.838   21.729   6.3815   17.656   12.642   23.121   7.3924  122.458   47.386  156.973   31.856 -34.51553 57.09820 
1 1 1   17   31    0 o  138.172   40.122   18.334   7.3648   18.334   7.3648   18.334   7.3648  138.172   40.122  138.172   40.122 0.000000 0.000000 
1 1 1   17   31    1 o  443.031   11.211  151.227   7.6026  150.585   10.615  151.903   10.893  440.658   15.739  442.452   16.085 -1.794434 22.50403 
1 1 1   17   31    2 o  114.459   28.341   10.854   4.9389   8.8817   6.6103   13.346   7.4308  105.817   35.040  125.927   36.459 -20.10977 50.56736 
1 1 1   17   31    3 o  249.760   15.060   48.493   5.7303   50.766   7.8565   45.910   8.3763  253.960   20.383  240.499   23.036 13.45995 30.75944 
1 1 1   17   31    4 o  393.775   11.910  119.581   7.1787  107.198   9.5934  135.339   10.822  371.404   16.876  417.290   16.943 -45.88580 23.91324 
1 1 1   17   31    5 o  248.669   23.426   49.128   8.8112   0.0000   0.0000   49.128   8.8112  ?   ?   248.669   23.426 0.000000 23.42563 
1 1 1   17   31    6 o  339.208   19.921   90.267   10.298   0.0000   0.0000   90.267   10.298  ?   ?   339.208   19.921 0.000000 19.92080 
1 1 1   17   31    7 o  142.563   24.520   16.480   5.1577   15.040   6.6856   18.597   8.1061  133.710   32.893  147.872   36.124 -14.16183 48.85538 
1 1 1   17   31    8 o  231.715   16.524   41.923   5.8221   40.884   7.6429   43.359   8.9868  226.985   22.286  232.499   25.682 -5.514603 34.00310 
1 1 1   17   31    9 o  129.043   23.098   13.492   4.3947   16.836   5.0645   3.2978   8.8422  144.306   23.756   93.149   38.387 51.15652 45.14287 
1 1 1   17   31   10 o  115.021   22.502   10.754   3.8197   12.054   4.2171   4.8159   9.0131  121.672   23.495   97.919   39.341 23.75262 45.82228 
1 1 1   17   31   11 o   70.854   26.640   3.0847   3.9224   3.0847   3.9224   0.0000   0.0000   70.854   26.640  ?   ?  0.000000 26.64030 
1 1 1   17   31   12 o  146.630   19.905   17.127   4.3520   17.127   4.3520   0.0000   0.0000  146.630   19.905  ?   ?  0.000000 19.90526 
1 1 1   17   31   13 o  225.099   15.762   39.545   5.3965   37.685   6.1611   45.674   11.184  218.893   18.564  235.438   31.854 -16.54446 36.86820 
1 1 1   17   31   14 o  257.561   14.537   51.589   5.7074   45.325   6.5456   71.453   11.657  240.361   17.920  298.524   25.764 -58.16367 31.38320 
1 1 1   17   31   15 o  122.722   27.151   12.491   4.9650   12.637   5.7754   12.075   9.7193  122.575   30.816  122.023   42.460 0.5520096 52.46380 
1 1 1   17   31   16 o  257.067   14.565   51.425   5.7072   50.137   6.6224   55.142   11.252  252.992   17.204  260.259   28.724 -7.266205 33.48149 
1 1 1   17   31   17 o  435.454   11.090  146.298   7.3915  136.427   8.4897  177.220   15.026  419.798   13.212  474.552   20.687 -54.75403 24.54617 
1 1 1   17   31   18 o  466.678   10.839  168.000   7.7425  166.216   9.0683  172.797   14.872  463.481   12.783  468.408   20.743 -4.926422 24.36561 
1 1 1   17   31   19 f  218.994   17.267   37.681   5.7408   38.625   6.4942   34.305   12.280  221.000   19.394  197.123   41.986 23.87717 46.24852 
1 1 1   17   31   20 o  213.051   18.030   35.780   5.8245   35.428   6.7171   36.846   11.693  210.877   21.094  206.369   38.431 4.507767 43.83950 
1 1 1   17   31   21 o  108.608   30.991   9.9413   5.4053   13.668   6.2347  -1.3393   10.847  126.564   32.127   89.278   39.659 37.28652 51.03948 
1 1 1   17   31   22 o  202.492   26.608   33.520   8.0473   29.054   10.841   39.002   12.009  181.305   40.128  211.920   38.439 -30.61497 55.56762 
1 1 1   17   31   23 o  171.952   24.238   24.055   6.2023   24.673   7.1756   22.230   12.333  172.486   28.150  154.962   47.499 17.52438 55.21402 
1 1 1   17   31   24 o   52.949   25.315  -7.1760   5.7885   0.4138   6.6174 -31.9053   11.945   74.395   32.047   59.521   29.882 14.87391 43.81722 
1 1 1   17   31   25 o  340.781   14.187   90.365   7.3998   89.740   8.5998   92.149   14.524  338.575   16.594  334.809   28.615 3.766846 33.07883 
1 1 1   17   31   26 o  459.466   12.130  163.632   8.5310  162.148   9.9313  167.809   16.663  456.301   14.220  456.498   23.931 -0.1970520 27.83677 
1 1 1   17   31   27 o   92.365   34.018   6.2926   6.3324   2.0403   7.1278   22.221   13.795   80.848   33.978  151.788   50.636 -70.93993 60.97958 
1 1 1   17   31   28 o   89.571   34.312   5.4335   6.5811   6.5788   7.4946   1.5755   13.755   96.201   36.672  102.191   45.063 -5.989418 58.09903 
1 1 1   17   31   29 o  167.794   32.387   24.399   8.0167   24.399   8.0167   0.0000   0.0000  167.794   32.387  ?   ?  0.000000 32.38687 
1 1 1   17   31   30 f  102.863   32.115   9.1074   5.6088   5.3651   7.9373   12.840   7.9267   92.754   37.041  119.564   38.287 -26.81013 53.27174 
1 1 1   17   31   31 o  216.408   18.216   37.421   5.9779   36.052   9.0883   38.465   7.9363  205.486   29.762  215.894   24.447 -10.40717 38.51564 
1 1 1   17   31   32 o  168.865   35.737   25.777   8.9489   25.777   8.9489   0.0000   0.0000  168.865   35.737  ?   ?  0.000000 35.73733 
1 1 1   17   31   33 o   48.708   23.679  -8.6439   5.6000  -2.8747   8.5047 -13.0599   7.4407   73.899   33.751   53.587   26.313 20.31289 42.79622 
1 1 1   17   31   34 o  157.943   26.378   21.251   6.1519   32.186   9.4854   13.311   8.0823  189.366   33.973  119.193   38.711 70.17314 51.50440 
1 1 1   17   31   35 o  172.546   16.870   23.911   4.3984   35.634   5.3144  -1.5809   7.8365  211.081   16.582   72.774   32.905 138.3065 36.84730 
1 1 1   17   31   36 o  251.127   12.731   49.603   4.8775   60.549   6.0550   29.377   8.2310  276.523   14.355  181.521   30.721 95.00107 33.90946 
1 1 1   17   31   37 o  172.022   16.760   23.909   4.3570   23.777   5.1606   24.236   8.1305  169.522   20.292  160.988   34.058 8.534134 39.64505 
1 1 1   17   31   38 o   62.662   25.781   1.8047   3.9805   5.3038   4.6506  -7.7817   7.6976   80.462   29.226   60.248   28.907 20.21395 41.10645 
1 1 1   17   31   39 o  157.818   19.466   20.679   4.6025   26.629   5.7100   9.6430   7.7764  177.952   21.392  100.898   37.594 77.05458 43.25395 
1 1 1   17   32    0 o   51.655   34.640  -2.4894   7.6768  -2.4894   7.6768  -2.4894   7.6768   51.655   34.640   51.655   34.640 0.000000 0.000000 
1 1 1   17   32    1 o  244.990   16.164   46.822   6.0273   49.279   8.3935   44.206   8.6605  249.307   22.229  235.181   24.414 14.12590 33.01811 
1 1 1   17   32    2 o  148.449   25.960   17.973   5.6839   20.649   8.1385   15.426   7.9415  156.106   34.933  134.408   37.291 21.69769 51.09737 
1 1 1   17   32    3 o  340.019   18.884   90.577   9.7892   0.0000   0.0000   90.577   9.7892  ?   ?   340.019   18.884 0.000000 18.88363 
1 1 1   17   32    4 o  271.539   22.166   58.399   9.1325   0.0000   0.0000   58.399   9.1325  ?   ?   271.539   22.166 0.000000 22.16634 
1 1 1   17   32    5 o  156.891   23.112   19.801   5.3839   14.390   7.0487   27.378   8.3416  130.250   34.723  181.917   31.073 -51.66739 46.59661 
1 1 1   17   32    6 o   74.331   28.387   3.2478   4.4959   2.4134   5.3631   5.2206   8.2463   75.189   30.298   96.409   37.989 -21.22002 48.59130 
1 1 1   17   32    7 o  110.948   27.183   10.207   4.5799   13.143   5.5105   3.6479   8.2358  125.550   29.223   91.634   37.321 33.91566 47.40033 
1 1 1   17   32    8 o  204.177   18.947   32.855   5.8538   32.855   5.8538   0.0000   0.0000  204.177   18.947  ?   ?  0.000000 18.94689 
1 1 1   17   32    9 o  278.584   15.309   60.419   6.5028   60.419   6.5028   0.0000   0.0000  278.584   15.309  ?   ?  0.000000 15.30886 
1 1 1   17   32   10 o  313.642   10.287   75.779   4.9383   76.270   5.4794   73.655   11.397  314.426   11.385  303.631   24.739 10.79486 27.23328 
1 1 1   17   32   11 o  228.488   12.522   40.466   4.3626   40.559   4.8200   40.046   10.260  228.428   13.851  220.275   31.313 8.153214 34.23992 
1 1 1   17   32   12 o  223.288   13.036   38.698   4.4361   34.429   4.8876   58.653   10.567  209.998   15.311  270.035   25.882 -60.03691 30.07224 
1 1 1   17   32   13 o  362.478   11.814  101.468   6.5548   97.062   7.6454  113.692   12.735  353.840   14.116  378.900   22.054 -25.05966 26.18453 
1 1 1   17   32   14 o  510.217   10.533  200.690   8.2259  191.812   9.6248  224.749   15.844  498.010   12.627  535.329   19.336 -37.31888 23.09336 
1 1 1   17   32   15 o  260.648   15.270   52.985   6.0655   48.301   7.0126   66.898   12.086  247.678   18.634  287.082   27.854 -39.40334 33.51281 
1 1 1   17   32   16 o  286.329   13.804   63.572   6.0498   64.858   7.0291   59.895   11.882  288.149   16.000  270.623   29.145 17.52591 33.24779 
1 1 1   17   32   17 o  233.777   16.258   42.802   5.7812   40.395   6.7386   49.514   11.252  225.876   19.688  244.791   30.707 -18.91577 36.47619 
1 1 1   17   32   18 o  191.047   19.950   29.021   5.7478   25.165   6.6853   39.952   11.255  175.630   25.623  216.963   35.091 -41.33321 43.45015 
1 1 1   17   32   19 o  269.320   15.262   56.642   6.2656   55.840   7.2949   58.898   12.234  266.368   17.998  266.991   30.484 -0.6233521 35.40059 
1 1 1   17   32   20 o  214.192   25.541   37.290   8.2084   24.028   10.777   55.613   12.668  163.210   42.662  257.611   32.876 -94.40068 53.86009 
1 1 1   17   32   21 o  187.861   30.480   29.538   8.4640   23.990   11.385   36.395   12.656  161.900   44.544  201.643   42.352 -39.74290 61.46453 
1 1 1   17   32   22 o  227.806   19.034   41.132   6.5760   44.168   7.6325   32.385   12.954  235.052   21.451  187.446   45.589 47.60582 50.38388 
1 1 1   17   32   23 o  180.078   23.909   26.385   6.4272   35.989   7.5686   1.5491   12.171  210.729   23.887   98.620   42.967 112.1094 49.16005 
1 1 1   17   32   24 o  247.291   18.210   48.389   6.8443   53.906   7.9374   32.395   13.515  260.170   20.088  185.014   47.485 75.15628 51.55901 
1 1 1   17   32   25 o  106.996   34.046   9.7364   6.2757   10.312   7.0527   7.5490   13.754  110.062   36.181  114.217   47.541 -4.155144 59.74265 
1 1 1   17   32   26 o  224.343   20.333   40.317   6.9061   36.457   7.9487   52.206   13.949  210.804   25.130  242.552   38.887 -31.74837 46.29987 
1 1 1   17   32   27 o  120.436   36.941   12.905   7.4583   12.905   7.4583   0.0000   0.0000  120.436   36.941  ?   ?  0.000000 36.94069 
1 1 1   17   32   28 o   83.114   35.207   2.2088   7.7507   2.2088   7.7507   0.0000   0.0000   83.114   35.207  ?   ?  0.000000 35.20710 
1 1 1   17   32   29 o  183.558   25.632   28.083   7.0051   19.678   8.4128   47.086   12.650  146.634   37.373  229.153   37.353 -82.51984 52.83908 
1 1 1   17   32   30 o  120.200   30.689   12.711   5.6658   15.765   8.3269   10.078   7.7315  130.218   38.839  107.814   37.850 22.40392 54.23197 
1 1 1   17   32   31 o  161.262   25.355   21.854   6.0518   26.224   8.8760   18.058   8.2729  170.476   35.183  139.229   37.834 31.24779 51.66442 
1 1 1   17   32   32 o  296.439   15.250   69.442   6.8963   85.388   10.487   57.292   9.1540  324.108   21.257  264.022   22.878 60.08560 31.22915 
1 1 1   17   32   33 o  223.845   19.448   40.614   6.5970   30.751   9.5919   49.467   9.0875  183.216   35.485  243.147   24.763 -59.93045 43.27179 
1 1 1   17   32   34 o   79.970   32.057   4.0067   5.9698  -1.1979   9.0087   8.0816   7.9714   77.900   35.246   98.598   37.764 -20.69740 51.65698 
1 1 1   17   32   35 o  124.143   31.833   14.207   6.0775   7.5304   8.8948   20.053   8.3233   97.534   39.118  143.637   37.467 -46.10278 54.16632 
1 1 1   17   32   36 o  160.017   19.588   21.142   4.6975   30.428   5.8919   4.9439   7.7821  191.749   20.388   87.058   35.958 104.6905 41.33591 
1 1 1   17   32   37 o   73.161   26.219   4.2789   3.7274   2.2306   4.2381   11.275   7.8322   65.536   26.741  107.326   38.054 -41.79002 46.51021 
1 1 1   17   32   38 o   82.231   31.716   5.3366   5.6493   17.917   8.5378  -4.4603   7.5345  131.266   39.368   64.243   30.163 67.02370 49.59479 
1 1 1   17   33    1 f  362.768   18.306  103.057   10.132   0.0000   0.0000  103.057   10.132  ?   ?   362.768   18.306 0.000000 18.30570 
1 1 1   17   33    2 o  158.511   23.930   20.306   5.6251   14.983   7.7712   26.164   8.1526  132.236   36.960  177.454   31.152 -45.21837 48.33731 
1 1 1   17   33    3 o  364.115   12.529  102.460   6.9825  106.539   9.6009   97.881   10.174  369.798   16.962  353.239   18.885 16.55908 25.38380 
1 1 1   17   33    4 o  302.484   13.915   70.875   6.4423   64.611   8.5863   78.944   9.7449  286.458   19.703  316.543   20.218 -30.08411 28.23088 
1 1 1   17   33    5 f  215.979   24.850   37.515   8.0654   37.515   8.0654   0.0000   0.0000  215.979   24.850  ?   ?  0.000000 24.85038 
1 1 1   17   33    6 o  171.386   23.166   23.619   5.9213   23.619   5.9213   0.0000   0.0000  171.386   23.166  ?   ?  0.000000 23.16572 
1 1 1   17   33    7 o  392.639   13.545  119.374   8.1404  119.374   8.1404   0.0000   0.0000  392.639   13.545  ?   ?  0.000000 13.54512 
1 1 1   17   33    8 o  127.225   25.423   13.314   4.7777   20.596   5.7885  -2.2484   8.4622  159.344   24.519   77.772   34.756 81.57220 42.53477 
1 1 1   17   33    9 o  160.227   20.333   20.473   4.8745   17.556   5.7348   28.065   9.2528  146.113   26.623  182.132   34.453 -36.01901 43.54078 
1 1 1   17   33   10 o   63.358   27.103   0.2091   4.6731  -2.8801   5.4880   8.3556   8.9120   59.907   27.264  107.756   40.226 -47.84892 48.59510 
1 1 1   17   33   11 o  261.195   14.041   53.054   5.5927   54.672   6.5869   48.874   10.586  264.418   16.355  244.526   28.840 19.89180 33.15449 
1 1 1   17   33   12 o  273.123   12.282   57.682   5.1344   58.327   5.7562   55.171   11.358  274.299   13.710  259.722   29.069 14.57712 32.13951 
1 1 1   17   33   13 o  604.069   10.328  281.347   9.5497  278.580   11.606  287.148   16.803  599.986   12.638  605.614   18.127 -5.627808 22.09780 
1 1 1   17   33   14 o  321.924   13.417   80.331   6.6113   84.069   7.9799   72.149   11.806  328.500   15.871  298.922   26.064 29.57773 30.51562 
1 1 1   17   33   15 o  215.807   18.256   36.743   5.9738   35.105   7.0924   40.743   11.082  209.301   22.492  219.757   34.047 -10.45613 40.80552 
1 1 1   17   33   16 o  145.323   27.375   17.528   5.8658   17.239   6.9855   18.221   10.802  142.019   32.797  142.629   44.575 -0.6092682 55.34069 
1 1 1   17   33   17 o  114.879   29.871   11.171   5.3014   7.7751   6.1984   20.423   10.232   99.015   33.938  150.705   42.512 -51.68976 54.39706 
1 1 1   17   33   18 o  165.225   31.874   23.133   7.7687   16.150   10.266   32.489   11.883  134.950   43.610  190.659   41.867 -55.70854 60.45396 
1 1 1   17   33   19 o  304.777   19.012   73.385   8.8247   70.276   12.060   76.968   12.947  293.535   27.149  306.781   27.877 -13.24579 38.91305 
1 1 1   17   33   20 o   76.768   31.641   2.2140   6.0089   10.773   6.9582 -22.8890   11.917  112.547   35.854   65.950   32.560 46.59663 48.43190 
1 1 1   17   33   21 o  268.151   16.857   56.564   6.8837   52.814   8.0201   67.058   13.415  257.395   20.527  283.010   31.504 -25.61514 37.60155 
1 1 1   17   33   22 f  201.038   21.543   32.512   6.5258   30.164   7.5813   39.228   12.822  191.168   26.633  208.617   41.613 -17.44954 49.40577 
1 1 1   17   33   23 o  145.497   29.006   17.943   6.2329   14.798   7.2266   27.077   12.317  129.479   35.434  168.959   46.267 -39.48032 58.27688 
1 1 1   17   33   24 o   60.746   28.031  -3.8045   6.0765  -4.2976   7.0180  -2.3275   12.145   65.069   30.060   90.528   40.946 -25.45872 50.79538 
1 1 1   17   33   25 o  136.390   32.002   16.227   6.5657   11.075   7.5904   31.538   13.085  112.858   37.556  180.694   46.901 -67.83644 60.08491 
1 1 1   17   33   26 o  261.457   20.738   54.989   8.2312   54.989   8.2312   0.0000   0.0000  261.457   20.738  ?   ?  0.000000 20.73829 
1 1 1   17   33   27 o  207.684   21.969   35.102   6.8775   31.864   8.0671   43.717   13.159  194.330   27.923  217.541   41.023 -23.21103 49.62471 
1 1 1   17   33   28 o  206.720   22.650   34.980   7.0494   29.580   8.2734   49.288   13.467  185.389   30.196  232.217   39.290 -46.82875 49.55312 
1 1 1   17   33   29 o  323.772   16.625   83.104   8.2111  100.836   10.039   47.274   14.271  355.257   18.527  222.556   43.452 132.7004 47.23646 
1 1 1   17   33   30 o   94.028   35.341   6.9031   6.9016   5.0360   8.3029   11.077   12.415   91.494   37.392  115.259   46.219 -23.76432 59.45009 
1 1 1   17   33   31 o  115.198   40.395   12.369   8.8052   12.369   8.8052   0.0000   0.0000  115.198   40.395  ?   ?  0.000000 40.39522 
1 1 1   17   33   32 o  142.514   29.539   17.993   6.2319   11.809   9.1805   23.278   8.4868  112.397   41.026  157.753   35.949 -45.35664 54.54755 
1 1 1   17   33   33 o   81.828   33.100   4.2194   6.4278   0.6076   11.330   5.9335   7.8054   88.217   39.756   90.941   36.584 -2.723686 54.02745 
1 1 1   17   33   34 o  134.181   36.938   17.576   7.8262   0.0000   0.0000   17.576   7.8262  ?   ?   134.181   36.938 0.000000 36.93797 
1 1 1   17   33   35 o   62.644   28.898  -2.8086   6.4514   3.7326   12.389  -5.2424   7.5568   94.558   42.171   63.507   29.938 31.05161 51.71738 
1 1 1   17   33   36 o  142.222   26.701   17.917   5.5991   20.623   8.4218   15.773   7.4954  143.230   37.846  125.762   36.677 17.46751 52.70236 
1 1 1   17   34    0 o  200.736   29.443   33.552   8.4764   33.552   8.4764   33.552   8.4764  200.736   29.443  200.736   29.443 0.000000 0.000000 
1 1 1   17   34    1 o   93.970   36.172   5.5566   7.3368   5.5566   7.3368   0.0000   0.0000   93.970   36.172  ?   ?  0.000000 36.17198 
1 1 1   17   34    2 o  158.751   31.764   21.195   7.4489   21.195   7.4489   0.0000   0.0000  158.751   31.764  ?   ?  0.000000 31.76426 
1 1 1   17   34    3 o  255.020   21.351   51.623   8.2575   51.623   8.2575   0.0000   0.0000  255.020   21.351  ?   ?  0.000000 21.35094 
1 1 1   17   34    4 o  233.117   16.950   42.608   6.0067   53.241   8.2281   30.475   8.7892  259.180   20.919  191.426   31.062 67.75441 37.44922 
1 1 1   17   34    5 o   57.991   25.527  -0.8756   4.3948  -4.4261   5.3634   6.3792   7.6668   55.584   25.884   97.751   37.132 -42.16702 45.26296 
1 1 1   17   34    6 o  215.894   15.845   36.470   5.1996   36.941   6.3092   35.472   9.1800  216.175   19.270  207.363   29.777 8.811890 35.46868 
1 1 1   17   34    7 o   76.966   29.037   3.7381   4.6683   3.8612   5.6035   3.4588   8.4400   81.375   31.531   91.259   37.544 -9.884308 49.02758 
1 1 1   17   34    8 o  292.021   13.179   66.055   5.8907   61.837   7.0088   76.206   10.871  281.185   16.355  309.049   23.150 -27.86383 28.34492 
1 1 1   17   34    9 o  319.429   12.721   78.981   6.2195   73.592   7.3532   92.525   11.658  307.056   15.698  341.024   22.460 -33.96771 27.40256 
1 1 1   17   34   10 o  452.992   10.568  158.297   7.3274  155.856   8.6850  164.326   13.649  448.719   12.645  457.204   19.504 -8.484833 23.24441 
1 1 1   17   34   11 o  224.697   16.129   39.558   5.5104   34.635   6.2929   55.745   11.410  208.883   19.924  260.697   29.091 -51.81360 35.25936 
1 1 1   17   34   12 o  238.655   13.532   44.312   4.9228   38.532   5.3853   73.702   12.143  221.767   15.972  301.601   26.575 -79.83357 31.00513 
1 1 1   17   34   13 o  171.666   29.893   24.612   7.5691   20.818   10.455   28.790   10.972  152.058   43.001  180.196   40.738 -28.13799 59.23441 
1 1 1   17   34   14 o  431.287   15.185  144.855   10.024  135.527   14.257  153.974   14.097  412.267   22.681  441.284   20.870 -29.01645 30.82172 
1 1 1   17   34   15 o  142.018   27.597   16.816   5.7828   23.932   6.9106   0.1944   10.562  170.147   27.471   90.928   39.809 79.21837 48.36781 
1 1 1   17   34   16 o  466.321   14.939  169.383   10.663  172.326   15.275  166.585   14.892  466.080   21.412  458.392   21.225 7.688873 30.14896 
1 1 1   17   34   17 o   61.502   29.283  -8.4061   7.5817  -6.9533   10.335 -10.0986   11.156   77.078   35.906   76.141   36.040 0.9374008 50.87386 
1 1 1   17   34   18 f  440.108   12.296  150.131   8.2832  156.585   9.9869  135.903   14.828  448.338   14.553  411.206   23.658 37.13168 27.77584 
1 1 1   17   34   19 o  216.023   19.735   37.197   6.4535   34.258   7.5053   45.533   12.640  205.121   24.383  228.444   37.448 -23.32312 44.68644 
1 1 1   17   34   20 o  111.544   33.735   10.720   6.2501   5.4697   7.2109   26.578   12.532   91.908   35.725  167.143   47.013 -75.23486 59.04625 
1 1 1   17   34   21 o   97.846   33.769   7.7542   6.1416   11.055   7.1045  -2.0056   12.217  113.006   36.253   91.477   41.249 21.52893 54.91568 
1 1 1   17   34   22 o  297.970   15.791   69.785   7.1764   62.138   8.4435   89.683   13.620  278.965   19.905  329.698   27.233 -50.73279 33.73186 
1 1 1   17   34   23 o  221.334   20.108   39.317   6.7378   43.585   8.0151   29.035   12.440  231.566   22.914  173.562   46.063 58.00327 51.44746 
1 1 1   17   34   24 o   67.873   30.777  -2.4762   6.9128  -2.4762   6.9128   0.0000   0.0000   67.873   30.777  ?   ?  0.000000 30.77740 
1 1 1   17   34   25 o  336.887   17.895   90.183   9.1943   90.183   9.1943   0.0000   0.0000  336.887   17.895  ?   ?  0.000000 17.89474 
1 1 1   17   34   26 f  166.904   27.532   23.631   6.7884   26.185   7.8871   16.329   13.334  173.874   30.761  130.943   49.140 42.93083 57.97396 
1 1 1   17   34   27 o  156.051   29.704   21.100   6.8359   18.738   8.0709   27.096   12.858  142.698   36.734  162.934   48.188 -20.23610 60.59215 
1 1 1   17   34   28 o  149.630   31.230   19.769   6.9215   16.926   8.3075   26.221   12.515  134.071   38.473  159.679   47.614 -25.60757 61.21456 
1 1 1   17   34   29 o  295.810   17.183   69.860   7.7465   78.245   9.7067   55.152   12.855  310.399   20.547  247.505   34.903 62.89336 40.50171 
1 1 1   17   34   30 f   75.445   33.344   0.1935   7.5725  -1.8202   10.365   2.4988   11.090   81.867   37.340   91.979   40.516 -10.11152 55.09835 
1 1 1   17   34   31 o   74.130   32.742   0.3073   7.2906   3.4625   10.301  -2.8592   10.320   91.089   39.609   79.385   36.596 11.70422 53.92680 
1 1 1   17   34   32 o   65.107   28.875  -0.3373   5.7267  -5.4279   8.4548   3.9778   7.7842   67.650   31.823   84.809   35.568 -17.15897 47.72646 
1 1 1   17   34   33 o   63.447   29.072  -2.3053   6.3789   4.8564   12.005  -5.1226   7.5298   96.183   42.268   63.697   29.984 32.48638 51.82298 
1 1 1   17   34   34 o  101.654   32.726   9.6810   5.7854   11.103   8.5056   8.4571   7.8923  106.728   39.406   97.486   37.519 9.241676 54.41018 
1 1 1   17   35    0 o  363.122   19.948  103.245   11.011  103.245   11.011  103.245   11.011  363.122   19.948  363.122   19.948 0.000000 0.000000 
1 1 1   17   35    1 f  238.770   18.076   44.890   6.5573   51.905   9.2085   37.675   9.3398  254.258   23.944  213.766   29.317 40.49234 37.85216 
1 1 1   17   35    2 o  242.372   26.184   47.632   9.5596   0.0000   0.0000   47.632   9.5596  ?   ?   242.372   26.184 0.000000 26.18440 
1 1 1   17   35    5 o  100.640   41.286   4.8743   10.170   4.8743   10.170   0.0000   0.0000  100.640   41.286  ?   ?  0.000000 41.28563 
1 1 1   17   35    6 o  179.210   26.358   26.289   7.0142   14.541   9.9836   37.740   9.8569  129.666   43.068  212.837   31.182 -83.17097 53.17094 
1 1 1   17   35    7 o  323.966   16.604   82.165   8.2059   80.234   11.973   83.876   11.269  315.714   24.980  324.120   22.861 -8.405548 33.86213 
1 1 1   17   35    8 o   98.343   36.062   7.0927   7.1053   8.8770   10.155   5.3815   9.9449  111.426   42.637  101.098   41.074 10.32822 59.20293 
1 1 1   17   35    9 f  300.424   17.982   70.995   8.2306   62.041   11.676   79.839   11.604  275.455   28.086  315.256   24.234 -39.80130 37.09555 
1 1 1   17   35   10 o  450.530   14.900  157.992   10.275  145.315   14.653  170.256   14.412  426.998   22.499  464.384   20.276 -37.38647 30.28750 
1 1 1   17   35   11 o  346.795   17.139   94.157   9.0977   87.123   12.670  101.645   13.072  328.377   25.405  355.701   24.152 -27.32437 35.05355 
1 1 1   17   35   12 o  109.663   37.052   9.9472   7.3871   16.931   10.088   1.8738   10.846  137.458   43.097   95.270   41.034 42.18858 59.50694 
1 1 1   17   35   13 o  558.675   10.993  241.222   9.4007  234.206   11.217  257.783   17.232  549.224   13.343  571.401   19.703 -22.17737 23.79587 
1 1 1   17   35   14 f  223.924   24.719   40.733   8.3311   28.451   11.623   53.712   11.948  176.423   43.351  253.200   31.511 -76.77730 53.59341 
1 1 1   17   35   15 o  116.138   37.825   11.583   7.7147   14.663   10.672   8.2116   11.165  129.064   44.516  110.723   44.021 18.34048 62.60591 
1 1 1   17   35   16 o  132.395   37.356   15.553   7.8994   23.849   10.719   5.6940   11.686  161.056   42.766  105.563   43.870 55.49354 61.26546 
1 1 1   17   35   17 o  137.207   37.653   16.820   8.1468   9.5057   11.017   25.647   12.102  113.315   44.127  164.635   46.161 -51.32053 63.85919 
1 1 1   17   35   18 o  204.486   21.340   33.676   6.5809   31.728   7.7131   38.889   12.618  195.914   26.393  207.168   41.241 -11.25319 48.96316 
1 1 1   17   35   19 o  179.164   24.346   26.359   6.5035   24.302   7.5977   31.999   12.579  168.762   30.537  184.130   45.012 -15.36766 54.39299 
1 1 1   17   35   20 o  164.169   26.425   22.507   6.4149   16.505   7.5418   38.211   12.199  135.831   35.778  205.041   40.308 -69.20978 53.89597 
1 1 1   17   35   21 o  267.478   17.352   56.703   7.0656   62.802   8.4396   42.409   12.920  280.115   19.812  215.336   40.689 64.77953 45.25578 
1 1 1   17   35   22 o  134.721   36.722   16.489   7.7798   16.489   7.7798   0.0000   0.0000  134.721   36.722  ?   ?  0.000000 36.72183 
1 1 1   17   35   23 o   87.239   35.619   4.0908   7.5254   4.0908   7.5254   0.0000   0.0000   87.239   35.619  ?   ?  0.000000 35.61893 
1 1 1   17   35   24 o  119.565   34.308   12.846   6.6065   16.525   7.8265   3.7270   12.322  134.141   36.943  100.157   43.435 33.98434 57.02131 
1 1 1   17   35   25 o  215.259   21.536   37.768   7.0004   33.392   8.2763   48.771   13.123  198.203   28.065  230.928   38.481 -32.72510 47.62775 
1 1 1   17   35   26 o  157.664   29.259   21.580   6.8009   24.500   8.2183   15.237   12.114  165.247   33.636  125.811   46.912 39.43617 57.72421 
1 1 1   17   35   27 o  161.007   32.524   23.248   7.7395   17.703   10.312   30.399   11.711  133.111   43.750  174.590   43.876 -41.47830 61.96114 
1 1 1   17   35   28 o  122.136   37.269   14.195   7.6032   25.515   10.840   3.2338   10.667  158.737   43.380   92.293   40.217 66.44358 59.15453 
1 1 1   17   35   29 f  110.805   34.812   11.464   6.5788   13.541   8.6105   8.5504   10.197  117.805   40.002  102.989   41.680 14.81668 57.76993 
1 1 1   17   35   30 o  138.739   31.756   17.658   6.5979   25.417   8.6785   7.0314   10.157  163.966   35.600   98.310   40.881 65.65604 54.20887 
1 1 1   17   35   31 o   86.857   33.487   5.9432   6.2960   3.1749   8.0596   10.277   10.085   83.121   35.576  105.949   41.927 -22.82863 54.98692 
1 1 1   17   35   32 o   72.370   32.775  -0.9842   7.8106  -3.1755   12.507   0.4167   10.000   84.067   39.274   82.596   37.275 1.470390 54.14686 
1 1 1   17   36    0 o  112.502   50.111   15.040   9.1468   15.040   9.1468   15.040   9.1468  112.502   50.111  112.502   50.111 0.000000 0.000000 
1 1 1   17   36    1 o   84.329   33.060   4.1051   6.2157   10.569   8.6190  -2.8997   8.9723  113.804   39.963   78.174   35.290 35.63004 53.31436 
1 1 1   17   36    2 o  199.067   22.745   31.908   6.8058   28.225   9.4711   35.839   9.7864  180.947   35.464  206.448   32.006 -25.50085 47.77131 
1 1 1   17   36    3 o  302.887   15.979   71.804   7.3817   78.333   10.094   64.300   10.822  313.832   21.137  281.862   25.356 31.96957 33.01099 
1 1 1   17   36    4 o  114.121   33.231   11.126   6.1575   11.209   8.2343   11.021   9.2741  115.616   39.119  116.219   41.388 -0.6024399 56.94954 
1 1 1   17   36    5 o  213.818   17.617   36.076   5.7144   35.652   6.8948   37.006   10.213  210.949   21.661  209.132   32.999 1.817368 39.47331 
1 1 1   17   36    6 f  121.939   32.114   12.760   6.0770   12.760   6.0770   0.0000   0.0000  121.939   32.114  ?   ?  0.000000 32.11439 
1 1 1   17   36    7 o  157.568   27.341   20.623   6.3549   20.623   6.3549   0.0000   0.0000  157.568   27.341  ?   ?  0.000000 27.34084 
1 1 1   17   36    8 o  346.426   12.655   93.055   6.7102   97.017   7.9246   83.020   12.613  352.935   14.670  319.712   26.001 33.22250 29.85346 
1 1 1   17   36    9 o  140.660   25.021   16.332   5.1896   17.387   6.1370   13.684   9.7223  143.642   28.914  125.428   42.507 18.21394 51.40828 
1 1 1   17   36   10 o  177.526   20.842   25.306   5.5555   23.622   6.5161   29.788   10.631  169.300   25.975  183.146   39.111 -13.84566 46.95093 
1 1 1   17   36   11 o  194.950   18.772   30.220   5.5322   27.867   6.3664   37.477   11.179  185.450   22.916  207.552   36.523 -22.10223 43.11704 
1 1 1   17   36   12 f  164.091   22.117   21.827   5.4133   22.902   6.2208   18.475   10.987  166.851   25.139  141.521   45.050 25.33014 51.58913 
1 1 1   17   36   13 o   83.227   31.015   4.8091   5.2932   6.8505   6.1420  -1.0842   10.436   94.183   33.666   86.993   38.757 7.189812 51.33775 
1 1 1   17   36   14 o   66.322   29.230  -0.7695   5.7792   0.0829   6.7724  -3.0531   11.085   73.782   32.099   85.740   38.916 -11.95763 50.44586 
1 1 1   17   36   15 o   88.549   32.779   5.6940   5.8931   4.5149   6.8583   9.0210   11.521   87.255   34.561  112.474   44.717 -25.21981 56.51574 
1 1 1   17   36   16 o  112.960   32.594   11.106   5.9479   15.591   6.9638  -0.9920   11.437  132.884   34.075   90.206   40.353 42.67715 52.81557 
1 1 1   17   36   17 o  119.682   32.003   12.530   5.9761   16.911   7.0203   1.0005   11.389  138.486   33.487   93.477   41.121 45.00945 53.03129 
1 1 1   17   36   18 o  113.370   38.516   11.238   7.9829   11.284   10.762   11.181   11.903  116.351   44.041  117.593   45.847 -1.242699 63.57293 
1 1 1   17   36   19 o  300.044   20.280   72.243   9.2591   79.321   12.854   64.611   13.348  308.641   27.497  274.123   32.443 34.51868 42.52839 
1 1 1   17   36   20 f   80.997   37.773  -6.2964   11.489  -6.2964   11.489   0.0000   0.0000   80.997   37.773  ?   ?  0.000000 37.77338 
1 1 1   17   36   21 o  247.233   23.121   49.991   8.6479   49.991   8.6479   0.0000   0.0000  247.233   23.121  ?   ?  0.000000 23.12107 
1 1 1   17   36   22 o  111.816   34.710   11.177   6.5625   10.769   7.8299   12.141   12.031  110.364   38.126  118.534   46.126 -8.170265 59.84313 
1 1 1   17   36   23 o  186.479   28.043   29.665   7.7566   28.508   9.9645   31.444   12.356  175.357   38.205  178.089   45.241 -2.732941 59.21467 
1 1 1   17   36   24 o   67.369   30.928  -3.1697   7.2671  -8.2521   9.3347   4.6493   11.578   68.549   32.597   98.678   42.449 -30.12958 53.52085 
1 1 1   17   36   25 o  127.946   36.076   15.347   7.3699   13.054   9.7987   18.334   11.183  117.322   42.451  133.920   45.588 -16.59791 62.29250 
1 1 1   17   36   26 o   86.267   33.208   5.5475   6.1840   13.105   7.8169  -7.0945   10.110  117.233   38.069   72.645   34.363 44.58817 51.28434 
1 1 1   17   36   27 o  152.685   28.848   20.588   6.4948   34.132   8.2799  -1.0748   10.471  198.087   28.096   82.871   37.694 115.2165 47.01287 
1 1 1   17   36   28 o  139.990   30.549   17.759   6.3620   26.654   8.4749   6.2756   9.6299  169.592   33.834   95.407   39.751 74.18542 52.20065 
1 1 1   17   36   29 o   71.191   30.764   1.2700   6.1375  -0.2606   8.0301   3.4202   9.5177   75.096   33.688   87.856   38.137 -12.75964 50.88519 
1 1 1   17   36   30 o   89.474   35.945   6.0430   7.5239   4.8912   11.953   6.7989   9.6829   95.837   42.144   95.731   39.871 0.1065674 58.01569 
1 1 1   17   37    0 o  234.430   29.443   45.458   10.113   45.458   10.113   45.458   10.113  234.430   29.443  234.430   29.443 0.000000 0.000000 
1 1 1   17   37    1 o  193.506   23.391   30.380   6.7874   25.176   9.2972   36.319   9.9320  169.046   36.962  206.810   32.443 -37.76434 49.18079 
1 1 1   17   37    2 o  168.213   26.945   23.477   6.7034   22.880   9.2377   24.141   9.7426  160.278   38.197  164.111   39.304 -3.832458 54.80677 
1 1 1   17   37    3 o  141.801   30.657   17.179   6.4602   15.539   8.8934   19.011   9.3998  131.748   40.326  144.858   40.706 -13.10999 57.29944 
1 1 1   17   37    4 o  103.816   34.508   8.9615   6.4091   8.2596   8.6492   9.8163   9.5443  105.078   39.550  111.827   41.652 -6.748589 57.43726 
1 1 1   17   37    5 o  224.193   17.020   39.663   5.7969   35.513   7.1387   47.698   9.9330  209.667   22.602  240.479   27.479 -30.81194 35.58004 
1 1 1   17   37    6 o  255.049   28.071   53.787   10.777   0.0000   0.0000   53.787   10.777  ?   ?   255.049   28.071 0.000000 28.07092 
1 1 1   17   37    7 o  320.049   13.367   79.663   6.5480   87.053   7.9921   64.573   11.421  333.578   15.653  280.351   26.946 53.22693 31.16262 
1 1 1   17   37    8 o   88.180   34.347   4.9120   6.6763   4.9120   6.6763   0.0000   0.0000   88.180   34.347  ?   ?  0.000000 34.34715 
1 1 1   17   37    9 o  194.825   24.772   31.108   7.2200   31.108   7.2200   0.0000   0.0000  194.825   24.772  ?   ?  0.000000 24.77162 
1 1 1   17   37   10 o  179.029   24.782   26.358   6.6088   26.358   6.6088   0.0000   0.0000  179.029   24.782  ?   ?  0.000000 24.78183 
1 1 1   17   37   11 o  140.545   27.356   16.665   5.6732   19.368   6.6046   9.0558   11.080  150.648   29.698  111.489   44.002 39.15884 53.08654 
1 1 1   17   37   12 o  283.328   15.112   63.000   6.5298   60.248   7.5815   70.907   12.851  275.589   18.073  291.144   29.231 -15.55548 34.36740 
1 1 1   17   37   13 o  218.929   18.752   38.244   6.2230   40.124   7.1247   32.197   12.780  223.085   21.117  183.346   45.702 39.73891 50.34491 
1 1 1   17   37   14 o   84.526   32.361   4.8136   5.8521   3.5778   6.7495   8.5561   11.745   83.335   33.845  110.756   44.764 -27.42065 56.11912 
1 1 1   17   37   15 o  154.646   27.548   20.229   6.2818   15.533   7.3584   32.846   12.062  131.420   35.668  186.811   43.066 -55.39076 55.91875 
1 1 1   17   37   16 o  269.204   16.810   57.372   6.8921   49.603   8.1104   77.561   13.075  247.555   21.621  304.268   28.402 -56.71397 35.69546 
1 1 1   17   37   17 o  158.976   26.887   21.331   6.3092   28.348   7.4404   3.3722   11.903  183.469   27.329   98.827   42.774 84.64214 50.75959 
1 1 1   17   37   18 o  149.684   42.329   21.440   10.131   21.440   10.131   0.0000   0.0000  149.684   42.329  ?   ?  0.000000 42.32884 
1 1 1   17   37   19 o  185.200   36.856   31.143   10.080   31.143   10.080   0.0000   0.0000  185.200   36.856  ?   ?  0.000000 36.85629 
1 1 1   17   37   20 o  115.488   37.375   12.179   7.5385   11.774   10.110   12.687   11.314  115.048   42.864  118.710   45.104 -3.662445 62.22295 
1 1 1   17   37   21 o   72.242   34.446  -9.3721   10.570   0.0000   0.0000  -9.3721   10.570  ?   ?    72.242   34.446 0.000000 34.44642 
1 1 1   17   37   22 o   66.845   30.965  -3.9927   7.5226  -1.6621   11.041  -6.0121   10.277   84.891   38.649   75.348   35.329 9.543076 52.36285 
1 1 1   17   37   23 o   95.215   36.910   7.0994   7.6813   13.694   11.729   2.1468   10.164  119.278   45.779   88.746   38.948 30.53139 60.10535 
1 1 1   17   37   24 o   67.533   29.927  -0.3466   6.1397  -8.3369   7.7808   12.837   9.9947   60.660   29.093  115.499   42.701 -54.83965 51.67045 
1 1 1   17   37   25 o   55.112   26.185  -5.7680   5.9984  -5.1976   7.7640  -6.6126   9.4476   65.181   30.608   70.263   33.231 -5.082077 45.17895 
1 1 1   17   37   26 o  105.867   33.940   10.445   6.2278   14.311   8.1401   4.9891   9.6713  120.299   38.828   92.254   39.215 28.04494 55.18520 
1 1 1   17   37   27 o   65.627   29.236  -0.4657   5.9367  -6.0088   7.6101   8.1523   9.4890   62.733   29.715   99.481   40.225 -36.74753 50.01084 
1 1 1   17   38    0 o  130.430   48.899   18.870   9.1137   18.870   9.1137   18.870   9.1137  130.430   48.899  130.430   48.899 0.000000 0.000000 
1 1 1   17   38    1 o  241.779   18.539   46.488   6.8085   34.258   9.1645   61.552   10.171  200.764   30.807  274.762   24.440 -73.99756 39.32419 
1 1 1   17   38    2 o   66.140   29.347  -1.0829   5.9229  -7.8831   8.3149   5.9218   8.4389   65.595   31.068   96.420   38.291 -30.82491 49.30928 
1 1 1   17   38    3 o  301.859   16.322   71.764   7.5132   67.594   10.120   76.883   11.214  288.895   23.080  307.522   24.014 -18.62677 33.30714 
1 1 1   17   38    4 o  324.883   13.233   82.188   6.5804   81.262   8.0545   84.045   11.411  321.172   16.439  322.082   23.305 -0.9094543 28.51955 
1 1 1   17   38    5 o  353.339   12.878   97.137   6.9646   93.959   8.5017  103.622   12.144  345.945   16.056  358.592   22.235 -12.64722 27.42562 
1 1 1   17   38    6 o  213.577   18.375   36.337   5.9485   31.317   7.0916   48.253   10.926  195.355   24.237  238.669   30.615 -43.31389 39.04778 
1 1 1   17   38    7 o   89.258   32.027   6.1394   5.5635   10.145   6.6440  -3.2592   10.177  108.329   35.091   81.306   37.051 27.02251 51.03098 
1 1 1   17   38    8 o  165.066   23.728   22.424   5.8225   23.377   6.7982   19.802   11.280  166.633   27.622  143.814   45.633 22.81847 53.34156 
1 1 1   17   38    9 o   61.076   27.688  -2.2753   5.5907  -5.6267   6.4688   7.6177   11.114   59.276   27.868  107.097   43.454 -47.82144 51.62246 
1 1 1   17   38   10 o  413.555   23.633  139.009   14.898   0.0000   0.0000  139.009   14.898  ?   ?   413.555   23.633 0.000000 23.63349 
1 1 1   17   38   11 o  240.134   26.078   47.783   9.4309   47.783   9.4309   0.0000   0.0000  240.134   26.078  ?   ?  0.000000 26.07752 
1 1 1   17   38   12 o  141.984   38.183   18.522   8.4785   18.522   8.4785   0.0000   0.0000  141.984   38.183  ?   ?  0.000000 38.18343 
1 1 1   17   38   13 o  262.319   24.370   56.535   9.6730   56.535   9.6730   0.0000   0.0000  262.319   24.370  ?   ?  0.000000 24.36974 
1 1 1   17   38   14 f   58.136   27.719  -7.4027   6.8417  -8.3010   8.7169  -5.9613   11.041   66.354   31.538   79.598   37.090 -13.24352 48.68615 
1 1 1   17   38   15 o  145.948   34.994   19.259   7.7163   14.851   10.010   25.712   12.113  125.698   43.128  160.354   46.584 -34.65636 63.48254 
1 1 1   17   38   16 o  107.676   37.309   10.194   7.5006   10.194   7.5006   0.0000   0.0000  107.676   37.309  ?   ?  0.000000 37.30938 
1 1 1   17   38   17 o  103.772   37.085   9.2841   7.4521   9.2841   7.4521   0.0000   0.0000  103.772   37.085  ?   ?  0.000000 37.08484 
1 1 1   17   38   18 o  265.436   16.738   56.128   6.7654   62.998   8.3892   43.350   11.441  279.146   19.762  219.031   35.329 60.11534 40.48087 
1 1 1   17   38   19 o  260.771   17.338   54.422   6.8811   63.740   8.7595   39.406   11.120  279.838   20.595  207.085   36.412 72.75343 41.83286 
1 1 1   17   38   20 o   94.430   33.697   7.5736   6.1508   7.8545   7.8812   7.1359   9.8378   98.109   37.556   99.582   40.700 -1.472626 55.37982 
1 1 1   17   38   21 o  148.329   29.208   19.438   6.3952   13.814   7.9174   29.995   10.848  119.872   38.252  174.384   41.281 -54.51133 56.27899 
1 1 1   17   38   22 o   89.279   33.887   6.3273   6.3822   9.3894   8.2024   1.6291   10.160  102.872   38.554   86.923   38.510 15.94859 54.49245 
1 1 1   17   38   23 o  115.025   33.449   12.378   6.2423   12.979   8.0037   11.444   9.9739  115.492   38.570  110.212   42.235 5.279678 57.19653 
1 1 1   17   38   24 o   82.263   34.772   3.3619   7.5341  -4.2004   11.757   8.6314   9.8140   81.339   38.026  101.586   40.967 -20.24686 55.89545 
1 1 1   17   39    0 o   68.781   41.896   4.3538   8.2931   4.3538   8.2931   4.3538   8.2931   68.781   41.896   68.781   41.896 0.000000 0.000000 
1 1 1   17   39    1 o  269.279   17.480   57.536   7.1655   55.415   9.8643   59.905   10.426  259.417   25.159  269.476   25.584 -10.05856 35.88203 
1 1 1   17   39    2 o  214.744   19.977   37.085   6.4909   35.990   8.9591   38.296   9.4172  206.095   29.219  212.281   29.804 -6.185852 41.73737 
1 1 1   17   39    3 o  117.094   33.690   12.153   6.3628   12.800   8.2947   11.228   9.9179  119.230   39.240  114.808   42.519 4.422310 57.85884 
1 1 1   17   39    4 o  123.982   29.317   13.311   5.4759   11.623   6.5686   17.157   9.9151  114.471   34.576  134.879   42.781 -20.40855 55.00671 
1 1 1   17   39    5 o  133.475   27.264   15.178   5.3819   8.8382   6.2799   32.715   10.444  101.861   34.164  190.676   37.120 -88.81553 50.44909 
1 1 1   17   39    6 o   80.770   31.572   4.0887   5.6565   2.4286   6.7675   7.9368   10.304   79.529   33.246  105.553   42.184 -26.02414 53.71017 
1 1 1   17   39    7 o  102.129   32.021   9.0251   5.5693   5.6070   6.4682   18.823   10.951   88.985   34.033  139.438   45.039 -50.45267 56.45160 
1 1 1   17   39    8 o  135.507   28.402   15.802   5.7024   17.036   6.5692   12.028   11.486  139.182   31.562  118.224   45.320 20.95792 55.22767 
1 1 1   17   39    9 o  152.574   25.383   19.541   5.7196   13.710   6.5622   37.976   11.667  123.627   33.738  203.596   38.857 -79.96893 51.45959 
1 1 1   17   39   10 o  123.062   30.215   13.299   5.6496   19.124   6.6439  -1.9096   10.736  148.088   30.332   84.655   38.374 63.43295 48.91385 
1 1 1   17   39   11 o  240.867   17.466   46.273   6.3954   44.666   7.4240   50.898   12.593  234.608   20.893  238.643   35.563 -4.035126 41.24561 
1 1 1   17   39   12 o  190.465   20.903   29.579   5.9938   28.329   6.9236   33.317   11.975  183.842   25.273  185.525   43.007 -1.682770 49.88298 
1 1 1   17   39   13 o  120.986   34.996   13.417   6.8492   13.417   6.8492   0.0000   0.0000  120.986   34.996  ?   ?  0.000000 34.99578 
1 1 1   17   39   14 o   54.957   26.340  -7.4048   6.3541  -7.4048   6.3541   0.0000   0.0000   54.957   26.340  ?   ?  0.000000 26.34030 
1 1 1   17   39   15 o  111.603   44.553   10.569   11.480   10.569   11.480   0.0000   0.0000  111.603   44.553  ?   ?  0.000000 44.55319 
1 1 1   17   39   16 o  132.694   36.473   16.608   7.6371   16.608   7.6371   0.0000   0.0000  132.694   36.473  ?   ?  0.000000 36.47270 
1 1 1   17   39   17 o  124.497   32.847   14.225   6.3500   17.888   7.8808   7.4436   10.722  137.225   36.775  101.816   42.143 35.40887 55.93207 
1 1 1   17   39   18 o  160.847   26.639   22.316   6.3289   24.295   7.7842   18.456   10.871  163.945   32.169  133.196   44.948 30.74962 55.27364 
1 1 1   17   39   19 o  121.522   33.367   13.745   6.3957   15.250   8.0517   11.172   10.528  124.986   38.390  110.352   43.091 14.63450 57.71094 
1 1 1   17   39   20 o  152.268   28.157   20.420   6.3207   25.098   8.0723   13.007   10.162  165.305   33.059  115.074   42.955 50.23087 54.20366 
1 1 1   17   39   21 o   72.509   30.924   1.7814   6.0502   2.6288   7.7107   0.4240   9.7591   80.985   34.734   82.750   37.128 -1.764801 50.84212 
1 1 1   17   40    0 f   47.704   33.399  -7.8135   9.1268  -7.8135   9.1268  -7.8135   9.1268   47.704   33.399   47.704   33.399 0.000000 0.000000 
1 1 1   17   40    1 o  216.170   21.945   38.230   7.1605   32.865   10.016   43.839   10.241  190.773   35.610  225.270   30.483 -34.49757 46.87569 
1 1 1   17   40    2 o   94.630   33.795   7.3718   6.1875   19.397   8.6985  -4.9458   8.8035  143.517   38.709   71.520   33.257 71.99655 51.03369 
1 1 1   17   40    3 o  209.499   21.431   35.837   6.7756   34.597   9.1208   37.364   10.121  199.443   30.875  205.444   33.328 -6.000427 45.43192 
1 1 1   17   40    4 o  236.484   16.817   44.540   6.0475   46.820   7.3625   39.811   10.603  240.455   20.191  211.605   33.879 28.85056 39.43962 
1 1 1   17   40    5 o  314.513   14.000   77.615   6.7396   73.640   8.1337   86.323   12.038  303.768   17.569  322.836   24.546 -19.06815 30.18530 
1 1 1   17   40    6 o   71.144   29.709   1.8861   5.3959   1.1214   6.4544   3.6611   9.8331   73.649   31.688   92.141   39.363 -18.49177 50.53260 
1 1 1   17   40    7 o  251.728   16.765   50.494   6.4225   47.811   7.6997   56.630   11.644  242.246   20.973  255.767   30.335 -13.52101 36.87875 
1 1 1   17   40    8 o  158.410   26.134   21.359   6.1157   31.305   7.2208  -3.8785   11.503  193.087   25.021   83.126   38.431 109.9611 45.85819 
1 1 1   17   40    9 o   61.403   27.915  -2.1488   5.7333  -3.7073   6.7128   2.0536   11.023   63.375   29.320   91.632   40.377 -28.25701 49.89977 
1 1 1   17   40   10 o   66.076   30.036  -2.1749   6.6356  -2.1749   6.6356   0.0000   0.0000   66.076   30.036  ?   ?  0.000000 30.03590 
1 1 1   17   40   11 o   98.214   35.776   8.2151   6.9762   8.2151   6.9762   0.0000   0.0000   98.214   35.776  ?   ?  0.000000 35.77614 
1 1 1   17   40   12 o  144.408   28.482   18.271   6.0719   17.338   7.0040   21.091   12.181  137.321   33.598  140.803   47.580 -3.482330 58.24672 
1 1 1   17   40   13 f   56.006   26.336  -4.6999   5.7814  -3.3187   6.8863  -7.9980   10.641   64.676   29.843   73.470   34.899 -8.794518 45.91862 
1 1 1   17   40   14 o  138.525   29.130   17.019   5.9805   13.873   6.9813   25.694   11.592  121.282   35.404  156.296   45.620 -35.01399 57.74675 
1 1 1   17   40   15 o  305.306   20.571   76.303   9.5568   69.552   13.676   82.747   13.361  278.183   32.745  308.946   28.578 -30.76242 43.46141 
1 1 1   17   40   16 o  240.119   24.349   48.629   8.8253   62.709   13.171   37.157   11.889  262.744   33.515  193.673   41.362 69.07048 53.23584 
1 1 1   17   40   17 o  180.581   29.411   28.875   7.8495   28.875   7.8495   0.0000   0.0000  180.581   29.411  ?   ?  0.000000 29.41108 
1 1 1   17   41    0 o   57.326   38.390  -1.5124   9.3724  -1.5124   9.3724  -1.5124   9.3724   57.326   38.390   57.326   38.390 0.000000 0.000000 
1 1 1   17   41    1 o  368.042   14.885  106.976   8.3852  105.504   11.561  108.610   12.181  359.429   21.106  363.736   21.982 -4.306885 30.47379 
1 1 1   17   41    2 o  167.363   27.854   24.252   6.8845   25.920   9.3306   22.258   10.200  165.520   37.675  148.870   42.603 16.64980 56.87184 
1 1 1   17   41    3 o  177.405   21.765   26.037   5.7862   28.412   7.1724   21.609   9.7921  182.320   26.476  147.416   41.590 34.90378 49.30170 
1 1 1   17   41    4 o  157.801   25.476   21.229   5.9436   19.419   7.2994   24.790   10.239  145.596   33.457  157.996   41.721 -12.39990 53.47878 
1 1 1   17   41    5 o  161.698   24.815   22.176   5.9456   23.898   7.3113   18.814   10.216  164.348   30.176  135.961   43.458 28.38651 52.90771 
1 1 1   17   41    6 o  204.810   24.587   35.334   7.5537   35.334   7.5537   0.0000   0.0000  204.810   24.587  ?   ?  0.000000 24.58717 
1 1 1   17   41    7 o  178.109   28.144   27.573   7.4178   27.573   7.4178   0.0000   0.0000  178.109   28.144  ?   ?  0.000000 28.14441 
1 1 1   17   41    8 o  161.174   31.464   23.350   7.4836   23.350   7.4836   0.0000   0.0000  161.174   31.464  ?   ?  0.000000 31.46438 
1 1 1   17   41    9 o  124.375   32.119   14.189   6.1572   15.267   7.2161   11.303   11.807  126.891   35.669  112.085   45.029 14.80578 57.44463 
1 1 1   17   41   10 o   76.577   31.572   3.0534   5.9845   5.5261   7.0856  -3.1002   11.178   88.090   35.054   81.885   37.867 6.205406 51.60099 
1 1 1   17   41   11 o  240.258   18.375   46.756   6.7060   43.146   7.9382   55.754   12.532  227.136   23.157  247.207   34.020 -20.07094 41.15380 
1 1 1   17   41   12 o   87.238   32.618   6.1173   5.8644  -2.2492   6.7725   31.190   11.724   65.939   30.117  173.751   44.030 -107.8115 53.34438 
1 1 1   18    0    0 o  518.959   10.378  206.396   8.2360  206.396   8.2360  206.396   8.2360  518.959   10.378  518.959   10.378 0.000000 0.000000 
1 1 1   18    0    1 o  240.368   10.914   44.507   3.9965   44.507   3.9965   44.507   3.9965  240.368   10.914  240.368   10.914 0.000000 0.000000 
1 1 1   18    0    2 o  115.294   18.364   10.927   2.9943   10.927   2.9943   10.927   2.9943  115.294   18.364  115.294   18.364 0.000000 0.000000 
1 1 1   18    0    3 o  991.035   14.431  752.645   21.879  752.645   21.879  752.645   21.879  991.035   14.431  991.035   14.431 0.000000 0.000000 
1 1 1   18    0    4 o  760.001   12.432  442.627   14.453  442.627   14.453  442.627   14.453  760.001   12.432  760.001   12.432 0.000000 0.000000 
1 1 1   18    0    5 o   30.296   20.818  -2.2475   3.1421  -2.2475   3.1421  -2.2475   3.1421   30.296   20.818   30.296   20.818 0.000000 0.000000 
1 1 1   18    0    7 o  404.053   7.3876  125.093   4.5654  125.093   4.5654  125.093   4.5654  404.053   7.3876  404.053   7.3876 0.000000 0.000000 
1 1 1   18    0    8 o  263.794   8.0576   53.417   3.2466   53.417   3.2466   53.417   3.2466  263.794   8.0576  263.794   8.0576 0.000000 0.000000 
1 1 1   18    0    9 o  236.023   8.7227   42.819   3.1414   42.819   3.1414   42.819   3.1414  236.023   8.7227  236.023   8.7227 0.000000 0.000000 
1 1 1   18    0   10 o   92.454   20.767   7.4571   2.5652   7.4571   2.5652   7.4571   2.5652   92.454   20.767   92.454   20.767 0.000000 0.000000 
1 1 1   18    0   11 o  1432.41   13.566  1571.78   29.736  1571.78   29.736  1571.78   29.736  1432.41   13.566  1432.41   13.566 0.000000 0.000000 
1 1 1   18    0   12 o  947.777   10.151  687.978   14.722  687.978   14.722  687.978   14.722  947.777   10.151  947.777   10.151 0.000000 0.000000 
1 1 1   18    0   13 o   47.976   26.544   2.4209   2.8534   2.4209   2.8534   2.4209   2.8534   47.976   26.544   47.976   26.544 0.000000 0.000000 
1 1 1   18    0   14 o  198.612   8.5771   30.367   2.5964   30.367   2.5964   30.367   2.5964  198.612   8.5771  198.612   8.5771 0.000000 0.000000 
1 1 1   18    0   15 f  480.897   7.1846  177.145   5.2858  177.145   5.2858  177.145   5.2858  480.897   7.1846  480.897   7.1846 0.000000 0.000000 
1 1 1   18    0   16 o  192.684   9.0220   28.610   2.6475   28.610   2.6475   28.610   2.6475  192.684   9.0220  192.684   9.0220 0.000000 0.000000 
1 1 1   18    0   17 f  1645.51   10.873  2073.64   27.383  2073.64   27.383  2073.64   27.383  1645.51   10.873  1645.51   10.873 0.000000 0.000000 
1 1 1   18    0   18 o   41.805   24.180   1.6449   2.5119   1.6449   2.5119   1.6449   2.5119   41.805   24.180   41.805   24.180 0.000000 0.000000 
1 1 1   18    0   19 o  576.023   7.4589  254.132   6.5738  254.132   6.5738  254.132   6.5738  576.023   7.4589  576.023   7.4589 0.000000 0.000000 
1 1 1   18    0   20 o  726.551   7.7543  404.258   8.6212  404.258   8.6212  404.258   8.6212  726.551   7.7543  726.551   7.7543 0.000000 0.000000 
1 1 1   18    0   21 o  149.086   13.180   17.422   2.9536   17.422   2.9536   17.422   2.9536  149.086   13.180  149.086   13.180 0.000000 0.000000 
1 1 1   18    0   22 o   37.326   23.545   0.4490   2.8555   0.4490   2.8555   0.4490   2.8555   37.326   23.545   37.326   23.545 0.000000 0.000000 
1 1 1   18    0   23 o  756.302   7.0744  438.012   8.1879  438.012   8.1879  438.012   8.1879  756.302   7.0744  756.302   7.0744 0.000000 0.000000 
1 1 1   18    0   24 o  262.905   9.3353   53.130   3.7459   53.130   3.7459   53.130   3.7459  262.905   9.3353  262.905   9.3353 0.000000 0.000000 
1 1 1   18    0   25 o  366.026   9.5510  102.816   5.3427  102.816   5.3427  102.816   5.3427  366.026   9.5510  366.026   9.5510 0.000000 0.000000 
1 1 1   18    0   26 o  401.942   8.7312  123.899   5.3659  123.899   5.3659  123.899   5.3659  401.942   8.7312  401.942   8.7312 0.000000 0.000000 
1 1 1   18    0   27 o  548.039   8.6808  230.199   7.2777  230.199   7.2777  230.199   7.2777  548.039   8.6808  548.039   8.6808 0.000000 0.000000 
1 1 1   18    0   28 o   80.093   33.245   6.9571   4.0582   6.9571   4.0582   6.9571   4.0582   80.093   33.245   80.093   33.245 0.000000 0.000000 
1 1 1   18    0   29 o   42.027   26.094   0.9178   3.3638   0.9178   3.3638   0.9178   3.3638   42.027   26.094   42.027   26.094 0.000000 0.000000 
1 1 1   18    0   30 o   36.973   24.239  -0.5101   3.4260  -0.5101   3.4260  -0.5101   3.4260   36.973   24.239   36.973   24.239 0.000000 0.000000 
1 1 1   18    0   31 o  342.809   8.7975   90.213   4.6093   90.213   4.6093   90.213   4.6093  342.809   8.7975  342.809   8.7975 0.000000 0.000000 
1 1 1   18    0   32 o  316.973   11.159   77.324   5.3989   77.324   5.3989   77.324   5.3989  316.973   11.159  316.973   11.159 0.000000 0.000000 
1 1 1   18    0   33 o  227.599   11.389   40.026   3.9449   40.026   3.9449   40.026   3.9449  227.599   11.389  227.599   11.389 0.000000 0.000000 
1 1 1   18    0   34 o  221.085   12.923   37.901   4.3388   37.901   4.3388   37.901   4.3388  221.085   12.923  221.085   12.923 0.000000 0.000000 
1 1 1   18    0   35 o   25.341   18.205  -5.7069   3.4001  -5.7069   3.4001  -5.7069   3.4001   25.341   18.205   25.341   18.205 0.000000 0.000000 
1 1 1   18    0   36 o  669.030   7.6594  343.121   7.8412  343.121   7.8412  343.121   7.8412  669.030   7.6594  669.030   7.6594 0.000000 0.000000 
1 1 1   18    0   37 o  108.203   25.720   10.444   3.6972   10.444   3.6972   10.444   3.6972  108.203   25.720  108.203   25.720 0.000000 0.000000 
1 1 1   18    0   38 o   45.899   27.793   1.5997   3.6034   1.5997   3.6034   1.5997   3.6034   45.899   27.793   45.899   27.793 0.000000 0.000000 
1 1 1   18    0   39 o  308.972   11.840   73.665   5.5809   73.665   5.5809   73.665   5.5809  308.972   11.840  308.972   11.840 0.000000 0.000000 
1 1 1   18    0   40 o  211.439   15.178   34.976   4.8540   34.976   4.8540   34.976   4.8540  211.439   15.178  211.439   15.178 0.000000 0.000000 
1 1 1   18    0   41 o   50.991   30.135   2.3803   4.0434   2.3803   4.0434   2.3803   4.0434   50.991   30.135   50.991   30.135 0.000000 0.000000 
1 1 1   18    0   42 o   45.360   28.421   1.0105   4.0827   1.0105   4.0827   1.0105   4.0827   45.360   28.421   45.360   28.421 0.000000 0.000000 
1 1 1   18    0   43 o   54.173   30.914   3.0697   4.0235   3.0697   4.0235   3.0697   4.0235   54.173   30.914   54.173   30.914 0.000000 0.000000 
1 1 1   18    0   44 o  156.339   27.582   20.829   5.9871   20.829   5.9871   20.829   5.9871  156.339   27.582  156.339   27.582 0.000000 0.000000 
1 1 1   18    0   45 o  282.812   11.846   61.895   5.1075   61.895   5.1075   61.895   5.1075  282.812   11.846  282.812   11.846 0.000000 0.000000 
1 1 1   18    0   46 o   29.367   21.221  -9.1315   4.9491  -9.1315   4.9491  -9.1315   4.9491   29.367   21.221   29.367   21.221 0.000000 0.000000 
1 1 1   18    0   47 o   25.160   18.392 -10.5130   4.3728 -10.5130   4.3728 -10.5130   4.3728   25.160   18.392   25.160   18.392 0.000000 0.000000 
1 1 1   18    0   48 o   52.725   31.605   2.4963   4.5659   2.4963   4.5659   2.4963   4.5659   52.725   31.605   52.725   31.605 0.000000 0.000000 
1 1 1   18    0   49 o  208.964   16.473   34.520   5.1934   34.520   5.1934   34.520   5.1934  208.964   16.473  208.964   16.473 0.000000 0.000000 
1 1 1   18    0   50 o   96.697   41.022   10.883   6.1564   10.883   6.1564   10.883   6.1564   96.697   41.022   96.697   41.022 0.000000 0.000000 
1 1 1   18    0   51 o   90.186   38.909   9.5320   5.5231   9.5320   5.5231   9.5320   5.5231   90.186   38.909   90.186   38.909 0.000000 0.000000 
1 1 1   18    0   52 o   37.722   26.307  -4.6144   5.5086  -4.6144   5.5086  -4.6144   5.5086   37.722   26.307   37.722   26.307 0.000000 0.000000 
1 1 1   18    0   53 o  213.521   16.653   36.270   5.3664   36.270   5.3664   36.270   5.3664  213.521   16.653  213.521   16.653 0.000000 0.000000 
1 1 1   18    0   54 o   53.819   32.993   2.5398   5.2178   2.5398   5.2178   2.5398   5.2178   53.819   32.993   53.819   32.993 0.000000 0.000000 
1 1 1   18    0   55 o   87.098   37.025   9.0328   5.0133   9.0328   5.0133   9.0328   5.0133   87.098   37.025   87.098   37.025 0.000000 0.000000 
1 1 1   18    0   56 o   39.867   26.616  -0.8376   4.4458  -0.8376   4.4458  -0.8376   4.4458   39.867   26.616   39.867   26.616 0.000000 0.000000 
1 1 1   18    0   57 f   49.664   31.538   1.6307   5.2189   1.6307   5.2189   1.6307   5.2189   49.664   31.538   49.664   31.538 0.000000 0.000000 
1 1 1   18    0   58 o   49.505   30.592   2.2346   4.5682   2.2346   4.5682   2.2346   4.5682   49.505   30.592   49.505   30.592 0.000000 0.000000 
1 1 1   18    1    1 o  479.911   7.2950  176.324   5.3586  186.914   7.8437  167.056   7.3380  494.025   10.373  467.048   10.265 26.97684 14.59327 
1 1 1   18    1    2 o  542.138   6.0759  224.990   5.0419  218.725   8.6920  228.167   6.1896  534.403   10.626  545.920   7.4074 -11.51648 12.95327 
1 1 1   18    1    3 o  443.028   5.9038  150.245   4.0034  153.691   7.2049  148.706   4.8152  447.968   10.508  440.729   7.1379 7.238495 12.70293 
1 1 1   18    1    4 o  262.026   8.1369   52.568   3.2634   56.093   4.6870   49.251   4.5465  270.614   11.316  253.565   11.714 17.04904 16.28712 
1 1 1   18    1    5 o  245.927   6.4100   46.299   2.4129   54.352   4.7355   43.475   2.8042  266.373   11.615  238.296   7.6881 28.07787 13.92865 
1 1 1   18    1    6 o  995.729   7.2185  759.060   11.002  753.661   15.492  764.554   15.626  992.006   10.203  999.148   10.218 -7.142029 14.43964 
1 1 1   18    1    7 o  584.567   5.5356  261.577   4.9530  259.201   7.0597  263.881   6.9509  581.841   7.9270  587.076   7.7353 -5.234863 11.07578 
1 1 1   18    1    8 o  1037.82   7.4784  824.629   11.880  844.953   17.293  806.468   16.347  1050.31   10.757  1026.14   10.408 24.17151 14.96789 
1 1 1   18    1    9 o  436.187   5.3535  145.638   3.5742  142.788   5.1090  148.370   5.0022  431.849   7.7291  440.218   7.4238 -8.368561 10.71689 
1 1 1   18    1   10 o  498.864   5.5333  190.503   4.2251  188.700   6.0201  192.254   5.9313  496.439   7.9226  501.097   7.7332 -4.658569 11.07115 
1 1 1   18    1   11 o  795.875   5.7986  484.886   7.0638  484.415   11.191  485.198   9.1075  795.335   9.1924  796.064   7.4745 -0.7284546 11.84774 
1 1 1   18    1   12 o  655.328   5.4110  328.742   5.4276  324.537   8.5383  331.594   7.0310  651.011   8.5687  658.115   6.9798 -7.103699 11.05169 
1 1 1   18    1   13 o  388.940   6.0342  115.806   3.5923  122.380   5.2871  110.169   4.8960  399.766   8.6405  379.303   8.4330 20.46320 12.07372 
1 1 1   18    1   14 o  853.345   6.0758  557.469   7.9359  566.484   17.876  555.256   8.8564  859.693   13.585  851.617   6.7943 8.076538 15.18946 
1 1 1   18    1   15 o  466.720   4.4749  166.735   3.1967  163.444   4.7917  169.374   4.2913  462.040   6.7755  470.369   5.9604 -8.328217 9.024116 
1 1 1   18    1   16 o  229.346   6.1250   40.269   2.1502   41.631   2.7294   38.039   3.4906  233.173   7.6476  222.841   10.234 10.33186 12.77566 
1 1 1   18    1   17 o  582.785   4.4177  259.977   3.9407  256.443   5.5145  263.666   5.6335  578.759   6.2250  586.852   6.2716 -8.092773 8.836529 
1 1 1   18    1   18 o  498.196   4.4711  189.987   3.4095  191.785   4.8810  188.274   4.7646  500.499   6.3714  495.899   6.2771 4.600159 8.944072 
1 1 1   18    1   19 o  361.066   5.4883   99.803   3.0332  102.028   5.1615   98.630   3.7487  364.967   9.2396  358.907   6.8239 6.059967 11.48638 
1 1 1   18    1   20 o  940.608   5.6500  677.337   8.1344  682.531   10.894  670.791   12.229  944.083   7.5388  935.849   8.5372 8.234680 11.38933 
1 1 1   18    1   21 o  615.853   5.0053  290.346   4.7182  283.474   6.1940  299.845   7.2823  608.455   6.6508  625.730   7.6035 -17.27515 10.10182 
1 1 1   18    1   22 o  548.932   4.7681  230.673   4.0062  230.265   5.6940  231.073   5.6375  548.369   6.7839  549.335   6.7048 -0.9657593 9.538074 
1 1 1   18    1   23 o  702.422   4.9245  377.723   5.2945  380.443   7.5745  375.125   7.4037  704.830   7.0210  699.894   6.9111 4.935730 9.851777 
1 1 1   18    1   24 o  409.308   5.2797  128.267   3.3077  131.686   4.7977  125.170   4.5664  414.640   7.5595  404.260   7.3798 10.37976 10.56447 
1 1 1   18    1   25 o  692.318   5.0005  366.964   5.2989  363.019   7.5332  370.827   7.4550  688.446   7.1489  695.821   6.9997 -7.375793 10.00515 
1 1 1   18    1   26 o  207.192   8.5571   32.896   2.7137   31.990   3.6264   34.049   4.0911  203.877   11.669  210.242   12.773 -6.365509 17.30132 
1 1 1   18    1   27 o  245.125   8.3785   46.047   3.1436   42.250   4.4243   49.918   4.4674  234.292   12.381  255.071   11.442 -20.77943 16.85897 
1 1 1   18    1   28 o   77.325   20.823   4.7738   2.5195   5.1238   4.0489   4.5527   3.2184   83.041   27.420   77.168   24.363 5.873032 36.67987 
1 1 1   18    1   29 o   67.853   20.362   3.5913   2.2835   4.6332   3.2571   2.5841   3.2024   77.741   24.505   65.274   24.164 12.46677 34.41493 
1 1 1   18    1   30 o  230.631   7.6837   40.769   2.7124   45.027   3.9511   36.974   3.7303  242.206   10.658  219.171   11.156 23.03467 15.42899 
1 1 1   18    1   31 o  158.529   10.650   19.381   2.5692   17.641   3.7146   20.977   3.5574  150.385   16.404  164.479   14.272 -14.09406 21.74313 
1 1 1   18    1   32 o  340.584   7.5513   88.930   3.9365   92.535   5.8392   85.927   5.3299  347.079   10.991  334.520   10.409 12.55838 15.13821 
1 1 1   18    1   33 o  104.914   16.617   8.7043   2.5795   12.952   4.0699   5.8523   3.3349  127.414   21.643   85.510   24.323 41.90395 32.55797 
1 1 1   18    1   34 f  146.192   12.103   16.554   2.6839   19.157   3.6768   13.585   3.9267  156.783   15.526  130.795   20.270 25.98776 25.53234 
1 1 1   18    1   35 o  286.490   7.1145   62.940   3.1198   67.400   4.5610   59.018   4.2767  296.172   10.061  277.142   10.082 19.03030 14.24324 
1 1 1   18    1   36 o  350.425   6.3688   94.143   3.4160  103.323   4.9881   86.035   4.6879  366.810   8.8844  334.686   9.1510 32.12390 12.75433 
1 1 1   18    1   37 o  290.379   7.0744   64.683   3.1443   73.696   4.6400   57.030   4.2758  309.618   9.7909  272.309   10.258 37.30963 14.18093 
1 1 1   18    1   38 o  180.080   10.920   25.060   2.9956   26.586   4.0437   23.204   4.4596  184.860   14.405  172.012   17.168 12.84787 22.41045 
1 1 1   18    1   39 o  370.897   6.8915  105.560   3.9124  103.662   5.9174  107.034   5.2148  366.898   10.537  373.104   9.1314 -6.206085 13.94307 
1 1 1   18    1   40 o  166.248   12.633   21.478   3.1906   20.849   4.1204   22.421   5.0424  162.838   16.771  168.019   20.000 -5.181305 26.10114 
1 1 1   18    1   41 o  257.691   9.9342   51.154   3.9183   46.269   4.9423   59.420   6.4292  244.105   13.278  276.106   15.272 -32.00053 20.23696 
1 1 1   18    1   42 o  148.762   13.158   17.272   2.9651   16.990   4.2677   17.535   4.1227  145.832   19.617  148.515   18.540 -2.682678 26.99142 
1 1 1   18    1   43 o   63.483   24.954   2.0377   3.5500  -1.8101   6.9377   3.4025   4.1320   70.649   31.529   72.949   27.359 -2.300598 41.74468 
1 1 1   18    1   44 o  137.197   17.493   14.976   3.5898   14.623   4.5103   15.586   5.9296  133.824   22.839  135.830   29.375 -2.005646 37.20928 
1 1 1   18    1   45 o  205.697   11.393   32.835   3.5732   35.438   5.5454   30.988   4.6725  211.874   17.249  198.641   15.490 13.23340 23.18373 
1 1 1   18    1   46 o  117.966   20.791   11.353   3.6169   8.3984   5.0375   14.497   5.1964   99.812   30.309  131.411   26.744 -31.59972 40.42120 
1 1 1   18    1   47 o  224.239   10.776   38.915   3.6986   45.740   5.3278   32.567   5.1386  241.627   14.472  202.935   16.691 38.69128 22.09162 
1 1 1   18    1   48 f   55.173   23.057   0.7289   3.2537   0.0045   4.5117   1.5140   4.6969   60.845   26.335   67.134   27.849 -6.289124 38.32853 
1 1 1   18    1   49 o  144.634   16.725   16.698   3.6342   20.172   5.3816   13.785   4.9275  156.421   23.179  127.573   26.114 28.84813 34.91719 
1 1 1   18    1   50 o  280.513   10.874   61.072   4.6688   56.944   6.6416   65.104   6.5644  268.126   16.260  287.481   14.970 -19.35474 22.10176 
1 1 1   18    1   51 o   56.577   23.832   0.7339   3.5197  -0.4084   4.8438   2.0117   5.1230   60.963   26.818   70.281   29.114 -9.318001 39.58302 
1 1 1   18    1   52 o  208.408   12.938   34.165   4.1067   26.410   5.8599   41.649   5.7570  178.640   21.889  228.257   16.591 -49.61719 27.46619 
1 1 1   18    1   53 o   65.365   24.949   2.8401   3.4717   0.7594   4.9991   4.7785   4.8250   64.722   27.867   79.211   29.593 -14.48863 40.64879 
1 1 1   18    1   54 o   75.059   26.888   4.4892   3.9198   4.5173   6.4288   4.4726   4.9455   82.205   33.155   77.761   29.754 4.443649 44.54885 
1 1 1   18    1   55 o   90.862   26.280   7.3913   3.8626   9.0410   5.0003   4.9506   6.0823   98.724   30.241   81.806   32.501 16.91809 44.39442 
1 1 1   18    1   56 o   88.390   23.708   6.9558   3.2736   8.6932   4.6303   5.2194   4.6290   96.330   29.015   78.716   29.069 17.61374 41.07117 
1 1 1   18    1   57 o   65.775   24.665   3.3291   3.3580   3.8641   4.9411   2.8699   4.5776   72.946   29.191   67.948   27.766 4.998344 40.28727 
1 1 1   18    1   58 o   79.104   25.339   5.7053   3.4717   6.3703   4.6426   4.8618   5.2291   82.711   29.301   76.847   30.260 5.863098 42.12201 
1 1 1   18    2    0 o  839.070   12.770  539.472   16.392  539.472   16.392  539.472   16.392  839.070   12.770  839.070   12.770 0.000000 0.000000 
1 1 1   18    2    1 o  314.263   9.8345   75.632   4.7306   0.0000   0.0000   75.632   4.7306  ?   ?   314.263   9.8345 0.000000 9.834484 
1 1 1   18    2    2 o  544.184   7.3916  226.719   6.1568  241.690   9.3904  215.431   8.1541  561.744   10.921  530.384   10.044 31.36041 14.83780 
1 1 1   18    2    3 o  1456.87   13.553  1626.33   30.223  1625.38   42.971  1627.26   42.516  1455.54   19.288  1456.42   19.072 -0.8824463 27.12515 
1 1 1   18    2    4 o  348.697   5.8836   93.076   3.1402   78.606   5.5149  100.019   3.8200  320.349   11.247  361.453   6.9046 -41.10403 13.19742 
1 1 1   18    2    5 o  537.478   5.1991  221.127   4.2772  213.549   8.9872  223.346   4.8633  528.016   11.120  540.154   5.8822 -12.13831 12.57996 
1 1 1   18    2    6 o  858.798   6.5672  564.612   8.6326  564.175   12.342  565.030   12.078  858.333   9.3945  858.995   9.1865 -0.6619263 13.13959 
1 1 1   18    2    7 o  960.657   7.0655  706.524   10.389  720.466   15.112  694.031   14.306  969.908   10.180  951.971   9.8180 17.93652 14.14269 
1 1 1   18    2    8 o  379.984   5.2889  110.524   3.0761  113.922   4.6284  107.835   4.1169  385.735   7.8392  375.303   7.1667 10.43188 10.62143 
1 1 1   18    2    9 o  575.878   5.0460  253.852   4.4478  255.757   7.2200  252.687   5.6466  577.948   8.1616  574.522   6.4211 3.426208 10.38472 
1 1 1   18    2   10 o  577.077   5.1187  254.913   4.5213  263.841   7.4406  249.687   5.6928  587.004   8.2813  571.097   6.5125 15.90698 10.53532 
1 1 1   18    2   11 o  430.853   5.0647  142.096   3.3400  144.647   5.4202  140.534   4.2409  434.636   8.1474  428.452   6.4667 6.184570 10.40183 
1 1 1   18    2   12 o  426.305   5.7854  139.121   3.7751  139.694   5.5034  138.613   5.1880  427.119   8.4180  425.475   7.9663 1.644287 11.58990 
1 1 1   18    2   13 o   70.985   18.493   4.0099   2.0295   5.0455   3.3164   3.3899   2.5660   80.865   24.600   67.486   21.802 13.37885 32.87102 
1 1 1   18    2   14 o  836.816   6.6457  536.115   8.5122  534.129   11.733  538.322   12.368  835.125   9.1791  838.367   9.6380 -3.241699 13.30968 
1 1 1   18    2   15 o  289.137   5.7155   63.998   2.5294   58.830   4.8720   65.905   2.9596  277.098   11.487  293.400   6.5902 -16.30127 13.24321 
1 1 1   18    2   16 o  391.013   4.6922  117.033   2.8083  119.594   4.3522  115.205   3.6759  395.217   7.1946  387.919   6.1909 7.297821 9.491532 
1 1 1   18    2   17 o  536.398   4.9814  220.249   4.0899  220.744   7.0135  219.993   5.0345  536.881   8.5347  536.055   6.1359 0.8261108 10.51142 
1 1 1   18    2   18 o  486.006   5.0852  180.814   3.7828  179.038   6.4739  181.734   4.6614  483.495   8.7479  487.210   6.2507 -3.715668 10.75161 
1 1 1   18    2   19 o  380.944   5.1496  111.091   3.0026  104.375   4.6093  116.042   3.9576  369.174   8.1571  389.306   6.6415 -20.13199 10.51891 
1 1 1   18    2   20 o  600.323   4.9310  275.881   4.5310  276.175   6.0722  275.512   6.8060  600.580   6.6055  599.822   7.4131 0.7584229 9.929074 
1 1 1   18    2   21 o  377.500   4.9944  109.093   2.8858  105.086   4.0900  113.066   4.0723  370.444   7.2133  384.263   6.9238 -13.81842 9.998520 
1 1 1   18    2   22 o  696.400   5.2038  371.280   5.5469  364.846   7.3123  380.000   8.5128  690.252   6.9211  704.379   7.8958 -14.12714 10.49979 
1 1 1   18    2   23 o  192.186   7.8838   28.290   2.3191   29.428   3.4679   27.370   3.1192  195.573   11.637  188.652   10.848 6.921021 15.90930 
1 1 1   18    2   24 o  456.328   4.9892  159.423   3.4848  162.421   5.0765  156.752   4.7922  460.508   7.2021  452.414   6.9203 8.094330 9.988065 
1 1 1   18    2   25 o  428.784   5.1817  140.768   3.4008  144.800   5.0239  137.358   4.6203  434.778   7.5493  423.478   7.1280 11.29990 10.38274 
1 1 1   18    2   26 o  769.992   5.9945  454.033   7.0650  459.158   8.8690  445.134   11.687  774.188   7.4845  761.976   10.020 12.21301 12.50703 
1 1 1   18    2   27 o  382.216   5.9218  111.880   3.4644  115.670   5.4701  109.342   4.4767  388.449   9.2000  377.764   7.7423 10.68481 12.02432 
1 1 1   18    2   28 o  590.728   5.1258  267.213   4.6347  256.565   6.5866  277.656   6.5227  578.658   7.4365  602.007   7.0787 -23.34888 10.26694 
1 1 1   18    2   29 o  375.828   6.2269  108.197   3.5820  111.788   5.8136  105.999   4.5479  381.744   9.9495  371.882   7.9897 9.861755 12.76041 
1 1 1   18    2   30 f   76.994   20.456   4.7471   2.4517   3.4279   3.6061   5.8810   3.3432   71.905   25.787   85.885   24.326 -13.98017 35.45031 
1 1 1   18    2   31 o  294.598   7.2871   66.520   3.2859   61.748   5.5812   69.051   4.0651  283.385   12.867  300.044   8.8516 -16.65903 15.61765 
1 1 1   18    2   32 o  236.282   8.5880   42.824   3.1059   48.713   4.4441   37.202   4.3425  251.774   11.532  219.525   12.981 32.24861 17.36386 
1 1 1   18    2   33 o  281.026   6.9178   60.538   2.9757   58.554   4.3337   62.308   4.0931  276.116   10.254  284.913   9.3857 -8.796692 13.90104 
1 1 1   18    2   34 o  175.072   9.7460   23.611   2.6013   25.219   3.7652   22.142   3.5981  180.395   13.739  168.917   14.044 11.47853 19.64685 
1 1 1   18    2   35 o  372.064   6.4872  106.121   3.6944   99.699   4.9069  114.525   5.6133  360.365   8.8961  386.148   9.4972 -25.78253 13.01297 
1 1 1   18    2   36 o  338.393   6.8369   87.813   3.5412   85.569   4.8077   90.475   5.2356  333.739   9.4115  343.092   9.9699 -9.353149 13.71041 
1 1 1   18    2   37 o  427.364   5.8884  140.005   3.8518  134.358   5.4911  145.476   5.4044  418.272   8.5769  435.314   8.1110 -17.04178 11.80475 
1 1 1   18    2   38 o  163.336   12.312   20.691   3.0554   19.000   4.1084   22.784   4.5703  155.386   17.584  170.273   17.799 -14.88644 25.01977 
1 1 1   18    2   39 o   83.046   23.888   5.5794   3.1993   7.1931   4.2496   3.4682   4.8607   93.995   27.675   77.054   29.495 16.94102 40.44537 
1 1 1   18    2   40 f  107.708   17.134   9.2494   2.7301   9.9022   3.9076   8.6269   3.8158  109.840   23.920  102.308   24.657 7.532082 34.35313 
1 1 1   18    2   41 o  213.096   9.5828   34.966   3.1256   32.846   4.7086   36.636   4.1792  205.081   15.107  217.286   12.620 -12.20499 19.68459 
1 1 1   18    2   42 o  204.684   9.9653   32.289   3.1221   32.504   4.3773   32.066   4.4543  204.190   14.092  202.709   14.451 1.481812 20.18430 
1 1 1   18    2   43 o  186.025   12.774   26.930   3.6152   26.757   6.4998   27.007   4.3502  181.752   23.947  185.589   15.454 -3.837082 28.50090 
1 1 1   18    2   44 o   86.790   25.371   6.1982   3.5829   9.1100   4.7928   2.5094   5.3945  103.989   29.012   74.971   30.324 29.01859 41.96740 
1 1 1   18    2   45 o  125.429   17.447   12.569   3.2588   9.3500   4.8828   15.154   4.3760  105.051   29.274  136.534   21.663 -31.48244 36.41799 
1 1 1   18    2   46 o   93.502   23.222   7.2807   3.3083   9.2358   4.9131   5.6587   4.4749  104.201   29.481   84.843   28.838 19.35715 41.24009 
1 1 1   18    2   47 o  138.603   17.358   15.345   3.6016   9.8378   4.8300   22.242   5.4054  107.224   28.813  165.444   21.882 -58.21965 36.18045 
1 1 1   18    2   48 o  314.969   8.8412   76.537   4.2623   82.577   6.5637   72.132   5.6049  325.574   13.171  304.739   12.016 20.83453 17.82906 
1 1 1   18    2   49 o   76.547   25.301   4.6813   3.4470   1.4456   4.8981   7.8561   4.8518   67.767   28.302   96.070   29.849 -28.30324 41.13380 
1 1 1   18    2   50 o   93.315   26.403   7.4413   3.9404   18.468   5.7982  -2.0222   5.3715  147.427   26.677   60.013   27.179 87.41372 38.08356 
1 1 1   18    2   51 o  132.593   18.707   14.307   3.6911   8.1132   4.9380   22.150   5.5565   96.570   30.131  163.365   22.846 -66.79467 37.81292 
1 1 1   18    2   52 o   79.485   25.328   5.2969   3.4722  -1.5029   4.7554   13.061   5.0816   57.041   25.727  121.933   27.840 -64.89157 37.90655 
1 1 1   18    2   53 o  122.939   22.533   12.802   4.0839   8.4995   5.7467   17.191   5.8048   97.403   32.682  139.518   28.153 -42.11529 43.13566 
1 1 1   18    2   54 o  158.644   17.404   20.470   4.1567   24.486   6.6962   17.953   5.3018  167.221   27.088  144.165   24.929 23.05659 36.81348 
1 1 1   18    2   55 o   92.934   25.134   7.6853   3.6614   7.4434   4.7476   8.0403   5.7514   90.576   29.681   93.573   32.657 -2.996849 44.12965 
1 1 1   18    2   56 f   79.991   24.731   5.6769   3.3353   9.9851   4.6669   1.1792   4.7684  103.286   28.561   63.352   27.246 39.93491 39.47296 
1 1 1   18    2   57 o  187.883   12.832   28.221   3.6680   28.042   5.3326   28.381   5.0534  182.440   19.394  184.606   18.118 -2.166321 26.53985 
1 1 1   18    3    0 o  1077.81   15.074  890.242   24.857  890.242   24.857  890.242   24.857  1077.81   15.074  1077.81   15.074 0.000000 0.000000 
1 1 1   18    3    1 o  584.260   7.5846  261.347   6.7828  254.866   9.5826  267.854   9.6020  576.854   10.853  591.380   10.608 -14.52600 15.17600 
1 1 1   18    3    2 o  524.324   10.010  210.537   8.0337   0.0000   0.0000  210.537   8.0337  ?   ?   524.324   10.010 0.000000 10.01027 
1 1 1   18    3    3 o  383.590   6.9819  112.646   4.0993  119.998   6.5663  107.951   5.2475  395.818   10.838  375.467   9.1308 20.35101 14.17168 
1 1 1   18    3    4 o  1115.98   10.942  953.895   18.690  962.805   27.146  945.865   25.772  1120.68   15.825  1110.86   15.157 9.825439 21.91302 
1 1 1   18    3    5 o  468.131   5.5477  167.751   3.9751  179.950   8.2676  164.084   4.5335  484.698   11.144  462.969   6.3975 21.72882 12.84976 
1 1 1   18    3    6 o  816.082   5.6445  509.804   7.0507  542.562   12.119  493.042   8.6689  841.728   9.4062  802.504   7.0574 39.22369 11.75945 
1 1 1   18    3    7 o  505.292   5.2792  195.438   4.0830  208.596   6.3163  185.993   5.3514  521.960   7.9060  492.892   7.0933 29.06732 10.62167 
1 1 1   18    3    8 o  301.435   6.8647   69.562   3.1673   68.335   3.8595   72.093   5.5424  298.738   8.4406  306.767   11.804 -8.029053 14.51105 
1 1 1   18    3    9 o  625.903   5.9643  299.893   5.7140  320.985   8.4742  282.309   7.7375  647.451   8.5511  607.201   8.3253 40.24957 11.93445 
1 1 1   18    3   10 o  1014.78   6.6557  788.359   10.338  804.784   16.839  778.422   13.097  1025.02   10.733  1008.26   8.4864 16.76514 13.68247 
1 1 1   18    3   11 o  387.020   5.6212  114.660   3.3299  124.895   5.2250  107.660   4.3210  403.862   8.4525  374.985   7.5284 28.87695 11.31911 
1 1 1   18    3   12 o  550.640   5.7506  232.107   4.8467  231.466   7.1643  232.648   6.5814  549.794   8.5134  551.221   7.8005 -1.427185 11.54667 
1 1 1   18    3   13 o  780.024   5.2498  465.750   6.2679  473.276   8.9344  458.456   8.7955  786.213   7.4243  773.806   7.4261 12.40735 10.50083 
1 1 1   18    3   14 o  378.624   4.8441  109.734   2.8073  101.605   3.8690  118.772   4.0796  364.293   6.9387  393.871   6.7670 -29.57791 9.692128 
1 1 1   18    3   15 o  1153.63   7.2778  1018.99   12.851  1027.74   28.209  1016.70   14.436  1157.56   15.921  1152.26   8.1852 5.306885 17.90185 
1 1 1   18    3   16 o  633.423   6.3811  307.176   6.1867  316.512   13.541  304.713   6.9551  642.546   13.768  630.847   7.2029 11.69940 15.53847 
1 1 1   18    3   17 o  408.498   4.7757  127.736   2.9860  125.947   4.7165  128.933   3.8575  405.561   7.5980  410.379   6.1413 -4.817535 9.769542 
1 1 1   18    3   18 o  134.560   9.5782   13.940   1.9599   16.399   3.1009   12.304   2.5291  145.562   14.094  125.986   13.317 19.57555 19.39031 
1 1 1   18    3   19 o  353.457   5.1997   95.639   2.8131   87.495   4.4358  101.117   3.6383  337.993   8.5742  363.410   6.5408 -25.41711 10.78420 
1 1 1   18    3   20 o  423.322   5.3971  137.189   3.4971  136.491   5.2085  137.762   4.7189  422.161   8.0605  424.150   7.2685 -1.988922 10.85374 
1 1 1   18    3   21 o  495.181   4.6903  187.706   3.5550  191.043   5.2391  184.859   4.8396  499.491   6.8527  491.356   6.4349 8.135101 9.400381 
1 1 1   18    3   22 o  424.676   4.8848  138.065   3.1752  137.789   4.6642  138.303   4.3347  424.178   7.1839  424.988   6.6636 -0.8099365 9.798606 
1 1 1   18    3   23 o  157.664   10.196   19.130   2.4474   17.513   3.3485   20.985   3.5861  150.336   14.741  164.741   14.365 -14.40468 20.58332 
1 1 1   18    3   24 o   70.048   20.807   3.8271   2.3935   1.6428   3.2734   6.3366   3.5086   60.942   23.960   89.279   24.793 -28.33700 34.47816 
1 1 1   18    3   25 o  594.857   5.7365  270.955   5.2231  273.235   6.5962  267.122   8.5524  597.262   7.2153  590.364   9.4646 6.898254 11.90122 
1 1 1   18    3   26 o  443.159   5.1930  150.373   3.5225  151.812   5.2924  149.228   4.7198  445.142   7.7675  441.382   6.9862 3.760345 10.44703 
1 1 1   18    3   27 o  525.268   5.3647  211.275   4.3132  218.510   6.9452  206.733   5.5030  533.957   8.4978  519.493   6.9208 14.46436 10.95944 
1 1 1   18    3   28 o  127.921   12.732   12.691   2.4598   12.149   3.6728   13.131   3.3124  123.920   20.048  129.471   17.136 -5.550583 26.37375 
1 1 1   18    3   29 o  519.343   5.5988  206.572   4.4506  207.661   7.0976  205.867   5.7134  520.412   8.9104  518.328   7.2014 2.084229 11.45667 
1 1 1   18    3   30 o  146.888   11.322   16.665   2.5259   15.999   3.8126   17.187   3.3721  142.917   17.816  148.674   15.024 -5.756989 23.30511 
1 1 1   18    3   31 o  391.762   6.5864  117.605   3.9495  112.268   7.3699  119.755   4.6779  382.139   12.600  395.234   7.7327 -13.09485 14.78352 
1 1 1   18    3   32 o  367.649   6.7175  103.590   3.7802  103.962   5.4651  103.250   5.2343  368.025   9.7018  366.804   9.3230 1.220459 13.45524 
1 1 1   18    3   33 o  186.941   9.0762   26.820   2.5970   29.115   3.9382   25.054   3.4546  194.009   13.343  180.014   12.618 13.99519 18.36426 
1 1 1   18    3   34 f  214.000   8.3715   35.139   2.7421   33.709   4.1482   36.248   3.6544  208.818   13.044  216.867   11.046 -8.049164 17.09239 
1 1 1   18    3   35 o  481.113   5.9957  177.403   4.4153  179.309   6.0879  175.288   6.4130  483.383   8.2282  477.844   8.7681 5.539001 12.02431 
1 1 1   18    3   36 o  263.016   7.4271   53.070   2.9900   54.426   4.4444   51.950   4.0413  265.982   10.917  259.951   10.157 6.030151 14.91093 
1 1 1   18    3   37 o  276.686   7.7475   58.757   3.2811   59.042   4.5215   58.439   4.7687  277.004   10.664  275.494   11.309 1.509216 15.54400 
1 1 1   18    3   38 f  122.597   18.716   11.965   3.4008   11.984   3.9807   11.915   6.5430  121.822   22.165  119.499   34.096 2.322861 40.66730 
1 1 1   18    3   39 o  187.556   11.289   27.212   3.2257   30.531   4.7413   24.352   4.4012  197.735   15.797  176.288   16.503 21.44615 22.84517 
1 1 1   18    3   40 o  232.151   8.7614   41.443   3.1133   42.497   4.5809   40.538   4.2440  234.107   12.833  228.786   12.163 5.321182 17.68109 
1 1 1   18    3   41 o  212.817   9.4855   34.871   3.0898   32.843   4.8616   36.246   4.0021  204.919   15.617  216.228   12.141 -11.30855 19.78181 
1 1 1   18    3   42 o  147.046   13.216   16.883   2.9428   15.742   4.5224   17.721   3.8755  139.562   21.890  149.673   17.231 -10.11148 27.85871 
1 1 1   18    3   43 o  123.567   18.317   12.219   3.3594   2.6284   6.3646   15.923   3.9553   80.006   32.722  141.243   18.760 -61.23674 37.71778 
1 1 1   18    3   44 o  327.344   8.7527   82.512   4.3855   80.729   5.9244   84.673   6.5227  322.923   11.986  330.421   12.897 -7.497192 17.60679 
1 1 1   18    3   45 o  178.297   12.341   24.760   3.3473   25.866   5.0899   23.917   4.4433  180.272   18.719  173.901   16.907 6.370972 25.22380 
1 1 1   18    3   46 o  111.401   20.676   10.148   3.3958   4.9534   5.3831   13.581   4.3764   84.108   31.290  128.423   23.114 -44.31463 38.90153 
1 1 1   18    3   47 o  166.722   14.869   21.892   3.7546   21.222   5.2893   22.572   5.3305  161.498   21.967  166.892   21.357 -5.394211 30.63787 
1 1 1   18    3   48 o   44.717   20.554  -2.1168   3.2228  -0.0965   4.7749  -3.8072   4.3678   62.121   26.989   49.400   23.121 12.72038 35.53864 
1 1 1   18    3   49 o  240.244   11.034   44.769   4.0576   46.549   5.6016   42.805   5.8855  243.118   15.128  232.403   16.656 10.71552 22.50028 
1 1 1   18    3   50 o  229.747   11.469   41.038   4.0332   40.801   6.3168   41.201   5.2405  225.642   18.451  228.456   15.071 -2.813889 23.82402 
1 1 1   18    3   51 o   73.594   25.819   4.1945   3.5975   5.7227   4.9717   2.5151   5.2120   84.786   30.292   72.418   29.614 12.36789 42.36220 
1 1 1   18    3   52 o  116.154   21.247   11.285   3.6383   10.718   5.2092   11.826   5.0837  109.300   30.155  115.372   28.861 -6.072021 41.74054 
1 1 1   18    3   53 o   51.697   22.999  -0.7557   3.6607   0.7278   5.5495  -1.8985   4.8706   67.343   29.177   56.430   25.683 10.91358 38.87049 
1 1 1   18    3   54 o   55.577   24.558  -0.4088   4.1056   0.8624   6.3091  -1.3424   5.4072   70.714   30.868   60.623   27.379 10.09070 41.26106 
1 1 1   18    3   55 o   58.254   24.150   1.3989   3.5290   2.4701   4.6104  -0.1165   5.4839   67.781   27.800   63.610   28.231 4.171398 39.62138 
1 1 1   18    3   56 o   70.830   25.050   4.1551   3.3918   8.1755   4.8994   0.4549   4.7002   93.168   30.129   60.700   26.566 32.46749 40.16841 
1 1 1   18    3   57 o   81.696   23.934   6.0103   3.1854   2.0653   4.3914   10.391   4.6274   64.117   26.790  104.653   28.236 -40.53587 38.92250 
1 1 1   18    4    0 o  222.954   12.314   38.409   4.1731   38.409   4.1731   38.409   4.1731  222.954   12.314  222.954   12.314 0.000000 0.000000 
1 1 1   18    4    1 o  287.336   7.6976   63.211   3.3854   64.178   5.0261   62.408   4.5803  289.457   11.344  285.457   10.483 3.999969 15.44626 
1 1 1   18    4    2 o  596.450   10.500  272.466   9.5863   0.0000   0.0000  272.466   9.5863  ?   ?   596.450   10.500 0.000000 10.50045 
1 1 1   18    4    3 o  682.912   8.1661  357.081   8.5359  340.229   12.233  373.075   11.917  666.428   11.992  697.902   11.156 -31.47412 16.37867 
1 1 1   18    4    4 o  738.794   6.8901  417.857   7.7915  449.686   14.919  405.920   9.1364  766.114   12.723  728.116   8.1979 37.99854 15.13539 
1 1 1   18    4    5 o  455.289   7.6342  158.704   5.3201  179.008   8.4216  145.221   6.8629  483.417   11.382  435.447   10.297 47.97025 15.34808 
1 1 1   18    4    6 o  390.828   6.3689  116.932   3.8100  117.521   4.8185  115.951   6.2233  391.777   8.0354  389.090   10.450 2.686554 13.18187 
1 1 1   18    4    7 o   84.968   14.003   5.6789   1.7577   4.5391   2.6546   6.5687   2.3456   76.004   21.729   91.025   17.470 -15.02122 27.88129 
1 1 1   18    4    8 o  310.392   7.0074   73.759   3.3292   80.462   4.2198   62.709   5.4180  324.161   8.5048  286.091   12.373 38.06976 15.01378 
1 1 1   18    4    9 o  405.907   5.8390  126.125   3.6277  128.870   5.2916  123.691   4.9830  410.244   8.4271  401.924   8.0999 8.320129 11.68866 
1 1 1   18    4   10 o  269.437   10.062   55.602   4.1498   54.785   6.5846   56.140   5.3450  266.799   16.201  270.672   12.901 -3.872467 20.71010 
1 1 1   18    4   11 o  1152.11   11.709  1016.92   20.648  1049.39   30.414  989.158   28.123  1169.67   16.988  1135.72   16.178 33.94641 23.45873 
1 1 1   18    4   12 o  669.161   6.0703  342.791   6.2175  355.664   13.938  339.593   6.9469  681.225   13.367  666.008   6.8146 15.21735 15.00424 
1 1 1   18    4   13 o  827.621   5.8833  524.356   7.4529  541.058   12.073  514.072   9.4735  840.513   9.3842  819.389   7.5535 21.12408 12.04654 
1 1 1   18    4   14 f  155.010   6.9370   18.397   1.6459   20.133   2.3483   16.719   2.3076  161.853   9.5208  147.380   10.294 14.47336 14.02183 
1 1 1   18    4   15 o  646.812   4.8771  320.248   4.8285  315.380   8.1044  322.927   6.0120  641.752   8.2506  649.474   6.0477 -7.722412 10.22966 
1 1 1   18    4   16 o  280.960   5.0679   60.427   2.1794   63.248   3.4827   58.611   2.7941  287.395   7.9172  276.683   6.5977 10.71228 10.30593 
1 1 1   18    4   17 o  583.259   5.1286  260.418   4.5785  263.301   8.6273  259.288   5.4020  586.294   9.6137  581.963   6.0645 4.330322 11.36667 
1 1 1   18    4   18 o  762.546   5.0629  445.126   5.9093  439.701   9.0554  449.150   7.7987  757.752   7.8074  765.914   6.6523 -8.162476 10.25716 
1 1 1   18    4   19 o  413.907   4.9557  131.147   3.1396  136.091   5.0884  128.107   3.9896  421.555   7.8860  409.048   6.3721 12.50677 10.13864 
1 1 1   18    4   20 o  544.360   5.8508  226.870   4.8750  233.177   8.7286  224.011   5.8770  551.654   10.337  540.871   7.0989 10.78308 12.54014 
1 1 1   18    4   21 o  655.772   5.0365  329.212   5.0554  335.230   8.0433  325.283   6.4997  661.591   7.9428  651.781   6.5151 9.810059 10.27302 
1 1 1   18    4   22 o  479.031   5.1301  175.676   3.7615  171.147   6.0594  178.516   4.7978  472.684   8.3751  482.839   6.4919 -10.15488 10.59653 
1 1 1   18    4   23 f  594.414   6.3767  270.559   5.8017  270.023   7.6079  271.303   8.9687  593.705   8.3719  595.000   9.8478 -1.295288 12.92551 
1 1 1   18    4   24 o  443.139   5.4911  150.355   3.7245  155.145   5.1973  145.298   5.3401  450.052   7.5448  435.512   8.0110 14.54025 11.00451 
1 1 1   18    4   25 o  413.796   5.5877  131.111   3.5390  137.669   5.1260  125.137   4.8921  423.909   7.9002  404.154   7.9082 19.75500 11.17822 
1 1 1   18    4   26 o  754.437   5.1176  435.807   5.9096  451.883   8.8727  422.989   7.9226  768.009   7.5478  743.107   6.9654 24.90192 10.27064 
1 1 1   18    4   27 o  242.370   7.4773   45.008   2.7739   46.897   4.6262   43.947   3.4661  247.172   12.228  239.416   9.4584 7.756241 15.45917 
1 1 1   18    4   28 o  476.182   5.1440  173.636   3.7492  176.547   5.6553  171.354   5.0080  479.982   7.6976  472.929   6.9182 7.052765 10.34967 
1 1 1   18    4   29 o  230.133   7.4979   40.587   2.6411   37.521   3.9726   43.016   3.5357  220.735   11.801  236.806   9.7546 -16.07109 15.31041 
1 1 1   18    4   30 o  537.714   6.4277  221.523   5.2903  234.631   14.065  219.364   5.7095  551.662   16.657  535.034   6.9719 16.62775 18.05731 
1 1 1   18    4   31 o   67.606   22.395   3.3801   2.7002   6.3780   6.0206   2.6253   3.0211   94.992   33.397   64.400   23.530 30.59205 40.85418 
1 1 1   18    4   32 o  330.799   6.7492   83.868   3.4173   83.023   4.8672   84.690   4.7991  328.877   9.6689  332.187   9.4386 -3.310211 13.51205 
1 1 1   18    4   33 o  489.084   5.8385  183.281   4.3707  181.082   6.0100  185.749   6.3677  485.881   8.0812  492.050   8.4548 -6.169495 11.69574 
1 1 1   18    4   34 o  474.313   5.5244  172.372   4.0107  177.747   6.0384  168.129   5.3651  481.321   8.1963  468.215   7.4862 13.10635 11.10055 
1 1 1   18    4   35 o  193.939   9.8425   28.973   2.9121   27.618   4.0441   30.432   4.1969  188.686   14.105  198.149   13.926 -9.462875 19.82143 
1 1 1   18    4   36 o  146.449   12.427   16.643   2.7594   14.037   3.8089   19.521   4.0032  133.031   19.267  157.861   16.827 -24.82990 25.58051 
1 1 1   18    4   37 o  235.751   9.6245   42.726   3.4730   42.715   4.3752   42.744   5.7103  235.095   12.201  234.353   16.015 0.7423248 20.13301 
1 1 1   18    4   38 o  127.647   14.711   12.773   2.8217   12.305   3.8646   13.308   4.1294  123.727   21.168  128.626   21.750 -4.899216 30.34991 
1 1 1   18    4   39 o   52.264   21.466   0.7739   2.7534  -2.6892   4.4265   2.9594   3.5164   53.256   24.333   68.269   25.311 -15.01299 35.11058 
1 1 1   18    4   40 o  143.779   12.533   16.095   2.7307   17.005   4.0590   15.342   3.6907  146.403   18.528  139.165   17.729 7.238220 25.64404 
1 1 1   18    4   41 o   55.280   21.523   1.5604   2.6206   2.4520   4.0614   0.9244   3.4302   68.385   26.747   57.798   23.873 10.58640 35.85128 
1 1 1   18    4   42 o  183.637   11.007   26.123   3.0795   19.928   4.8631   30.270   3.9789  157.768   20.633  197.212   13.258 -39.44484 24.52542 
1 1 1   18    4   43 o   42.857   20.067  -3.1129   3.2962  -2.5104   6.5067  -3.3209   3.8230   66.628   30.068   46.743   21.796 19.88580 37.13670 
1 1 1   18    4   44 o  246.463   10.673   46.917   4.0264   50.270   5.6727   43.513   5.7159  253.687   14.672  235.526   15.949 18.16089 21.67113 
1 1 1   18    4   45 o  271.259   8.9762   56.705   3.7269   59.298   5.9856   55.063   4.7627  275.602   14.238  266.668   11.668 8.934265 18.40837 
1 1 1   18    4   46 o  113.615   20.284   10.526   3.3980   14.100   5.8240   8.6817   4.1840  128.158   30.187  101.399   26.620 26.75896 40.24767 
1 1 1   18    4   47 o  184.083   13.558   26.537   3.7933   26.071   5.4555   26.973   5.2779  180.030   20.143  183.607   19.058 -3.576309 27.73009 
1 1 1   18    4   48 o   50.241   22.017  -0.4759   3.2374  -0.3895   4.6995  -0.5540   4.4662   60.735   26.573   58.744   25.799 1.991528 37.03671 
1 1 1   18    4   49 o  249.375   10.727   48.208   4.0945   50.144   5.6790   46.111   5.9087  252.505   14.758  241.498   16.077 11.00648 21.82337 
1 1 1   18    4   50 o  125.171   20.084   12.844   3.7178   19.496   5.5953   7.5852   4.9747  152.453   24.833   94.277   30.346 58.17602 39.21178 
1 1 1   18    4   51 o  181.426   13.232   25.908   3.6491   25.932   5.2722   25.885   5.0558  178.634   19.604  178.913   18.740 -0.2789917 27.12067 
1 1 1   18    4   52 o   68.708   24.908   3.5036   3.3756   6.5519   4.7080   0.2788   4.8424   87.775   29.580   62.637   27.196 25.13831 40.18270 
1 1 1   18    4   53 o  196.187   13.355   30.432   3.9865   33.509   6.0381   28.055   5.3077  202.183   19.764  185.349   18.976 16.83409 27.39934 
1 1 1   18    4   54 o   87.647   26.263   6.7628   3.8008  -0.2331   6.1637   11.055   4.8280   67.155   29.861  110.556   28.385 -43.40123 41.19946 
1 1 1   18    4   55 o  151.404   16.729   18.711   3.8121   18.414   4.6787   19.297   6.5752  147.419   21.357  143.924   30.779 3.495056 37.46282 
1 1 1   18    4   56 o   91.092   24.364   7.4548   3.4631   8.9770   4.9494   5.9948   4.8473   97.130   30.143   82.434   29.853 14.69651 42.42407 
1 1 1   18    4   57 o   75.511   24.374   5.0633   3.2078   6.0314   4.4238   3.9899   4.6583   81.451   28.629   72.527   28.560 8.924156 40.43876 
1 1 1   18    5    0 o  1245.81   16.890  1189.62   32.194  1189.62   32.194  1189.62   32.194  1245.81   16.890  1245.81   16.890 0.000000 0.000000 
1 1 1   18    5    1 o  585.159   7.7338  262.160   6.9268  264.748   10.091  259.854   9.5255  587.908   11.214  582.471   10.684 5.436096 15.48885 
1 1 1   18    5    2 o  917.630   7.7790  644.698   10.926  688.458   20.612  627.598   12.885  947.801   14.208  905.298   9.2988 42.50256 16.98069 
1 1 1   18    5    4 o  882.070   9.5237  595.828   12.858  609.683   18.902  583.895   17.543  891.951   13.845  872.943   13.129 19.00830 19.08029 
1 1 1   18    5    5 o  919.565   9.8251  647.591   13.829  651.658   19.973  643.847   19.166  922.110   14.151  916.610   13.661 5.499207 19.66924 
1 1 1   18    5    6 o  564.516   8.1154  244.005   7.0122  247.525   10.454  241.125   9.4548  568.414   12.015  561.064   11.010 7.349915 16.29662 
1 1 1   18    5    7 o  858.205   7.8793  563.921   10.350  582.113   13.182  534.672   16.714  871.825   9.8781  835.322   13.073 36.50311 16.38506 
1 1 1   18    5    8 o  613.025   8.5912  287.762   8.0612  287.762   8.0612   0.0000   0.0000  613.025   8.5912  ?   ?  0.000000 8.591207 
1 1 1   18    5    9 o  726.928   7.3448  404.576   8.1722  416.720   10.331  384.275   13.357  737.675   9.1501  708.194   12.322 29.48138 15.34821 
1 1 1   18    5   10 o  469.930   5.9446  169.053   4.2759  164.430   6.1023  173.513   5.9933  463.390   8.6035  476.028   8.2256 -12.63788 11.90292 
1 1 1   18    5   11 o  696.438   6.3967  371.318   6.8188  382.046   9.9259  361.730   9.3833  706.307   9.1813  687.283   8.9197 19.02313 12.80072 
1 1 1   18    5   12 o  194.757   9.0714   29.048   2.7042   32.269   4.0621   26.485   3.6239  204.785   13.027  185.460   12.845 19.32449 18.29487 
1 1 1   18    5   13 o  914.910   6.3511  640.831   8.8940  657.814   11.592  616.527   13.867  926.852   8.1711  897.161   10.098 29.69000 12.99024 
1 1 1   18    5   14 o  759.804   5.2182  441.922   6.0686  454.747   8.8307  430.445   8.3538  770.654   7.4862  749.789   7.2790 20.86511 10.44165 
1 1 1   18    5   15 o  167.230   6.3879   21.411   1.6351   24.382   2.7945   19.864   2.0163  178.108   10.295  160.847   8.2171 17.26044 13.17191 
1 1 1   18    5   16 o  351.418   4.6246   94.531   2.4875   95.182   3.9812   94.114   3.1860  352.572   7.3774  350.619   5.9366 1.952911 9.469378 
1 1 1   18    5   17 o  865.016   5.2980  572.805   7.0147  569.637   10.789  575.125   9.2324  862.459   8.1727  866.681   6.9597 -4.221863 10.73454 
1 1 1   18    5   18 o  481.462   5.1757  177.452   3.8142  173.423   7.4413  178.888   4.4421  475.778   10.218  483.383   6.0038 -7.605225 11.85143 
1 1 1   18    5   19 o  183.414   7.4815   25.761   2.1003   23.079   3.6923   27.044   2.5538  172.905   14.074  187.902   8.8793 -14.99699 16.64067 
1 1 1   18    5   20 o  154.655   9.5333   18.393   2.2457   11.209   3.7627   22.368   2.7989  118.916   21.462  170.509   10.780 -51.59277 24.01699 
1 1 1   18    5   21 o  534.010   5.0225  218.309   4.1052  226.466   6.6789  213.356   5.2044  543.766   8.0246  527.866   6.4414 15.89996 10.29009 
1 1 1   18    5   22 o  217.677   8.2929   36.296   2.7631   32.276   4.5435   38.655   3.4807  204.560   14.607  224.590   10.125 -20.02948 17.77309 
1 1 1   18    5   23 o  181.134   8.8228   25.138   2.4461   29.567   4.5838   23.374   2.8924  195.620   15.434  174.274   10.898 21.34570 18.89370 
1 1 1   18    5   24 o  196.766   11.181   29.784   3.3535   26.737   4.9141   32.439   4.5879  185.658   17.499  205.010   14.719 -19.35240 22.86600 
1 1 1   18    5   25 o  587.374   5.6080  264.182   5.0419  277.779   9.7274  259.188   5.8956  601.885   10.559  581.733   6.6211 20.15198 12.46306 
1 1 1   18    5   26 o  388.835   5.8309  115.784   3.4703  127.676   6.4414  110.921   4.1192  408.037   10.314  380.524   7.0723 27.51346 12.50555 
1 1 1   18    5   27 o  319.329   6.1377   78.101   3.0000   80.256   4.9885   76.880   3.7548  323.491   10.075  316.750   7.7446 6.740143 12.70759 
1 1 1   18    5   28 o  532.438   5.0784  217.086   4.1387  219.279   6.2059  215.330   5.5542  534.927   7.5795  530.152   6.8447 4.774902 10.21265 
1 1 1   18    5   29 o  390.492   5.7352  116.794   3.4279  128.197   5.6705  110.227   4.3033  408.859   9.0611  379.251   7.4131 29.60800 11.70717 
1 1 1   18    5   30 o  430.324   6.6999  141.893   4.4130  151.527   12.345  140.482   4.7252  442.962   18.208  428.137   7.2106 14.82532 19.58348 
1 1 1   18    5   31 o  396.262   5.6844  120.288   3.4477  127.199   5.3351  115.333   4.5178  407.238   8.5590  387.866   7.6099 19.37204 11.45288 
1 1 1   18    5   32 o  164.164   10.982   20.797   2.7435   26.063   3.9607   15.940   3.8038  183.402   14.220  142.513   17.828 40.88876 22.80483 
1 1 1   18    5   33 o  224.211   8.0240   38.560   2.7537   40.114   4.2645   37.448   3.6063  228.016   12.264  220.764   10.672 7.251816 16.25759 
1 1 1   18    5   34 o  400.477   5.8030  122.900   3.5572  129.055   5.4470  118.324   4.6971  410.056   8.6785  392.745   7.8135 17.31021 11.67765 
1 1 1   18    5   35 o  372.233   6.5607  106.230   3.7380  112.115   5.2660  100.253   5.3068  382.104   9.0040  361.243   9.5976 20.86093 13.16000 
1 1 1   18    5   36 o  231.553   8.7019   41.174   3.0841   42.478   4.2777   39.763   4.4507  234.536   11.956  226.734   12.878 7.802612 17.57188 
1 1 1   18    5   37 o  289.265   8.2433   64.252   3.6498   61.446   4.6783   68.614   5.8340  282.539   10.818  298.226   12.780 -15.68777 16.74422 
1 1 1   18    5   38 o  113.332   15.621   10.138   2.6378   13.118   3.9584   7.7576   3.5377  127.875   20.950   97.316   23.920 30.55936 31.79682 
1 1 1   18    5   39 o   98.515   18.472   7.8092   2.6830   10.987   4.2550   5.7114   3.4569  115.704   24.773   84.149   25.008 31.55415 35.20116 
1 1 1   18    5   40 o  289.588   7.4131   64.405   3.2859   69.735   5.0594   60.517   4.3213  300.702   10.992  280.296   10.072 20.40598 14.90915 
1 1 1   18    5   41 f  346.873   6.8645   92.380   3.6446   98.225   5.6270   88.156   4.7835  356.962   10.299  338.409   9.2350 18.55283 13.83295 
1 1 1   18    5   42 o  172.892   13.512   23.313   3.5472   23.201   8.6646   23.335   3.8880  164.174   35.513  172.640   14.858 -8.465088 38.49598 
1 1 1   18    5   43 o  174.844   11.823   23.753   3.1455   32.631   5.1303   18.406   3.9818  203.696   16.599  152.394   17.381 51.30241 24.03414 
1 1 1   18    5   44 o  128.255   18.628   13.190   3.5500   13.520   5.2113   12.903   4.8492  126.839   27.625  124.296   26.308 2.542305 38.14787 
1 1 1   18    5   45 o  105.444   19.793   9.0586   3.0772   8.2823   4.6260   9.6747   4.1213   99.185   28.781  107.432   25.453 -8.247635 38.42183 
1 1 1   18    5   46 o   91.144   22.743   6.9130   3.1626   7.7132   4.7494   6.2755   4.2391   95.933   29.487   87.607   27.993 8.326149 40.65834 
1 1 1   18    5   47 o  148.064   16.774   17.445   3.7344   23.750   5.4584   11.898   5.1202  171.228   21.286  117.809   28.667 53.41892 35.70560 
1 1 1   18    5   48 o  289.727   9.1748   64.813   4.0687   68.743   6.5537   62.347   5.1900  296.460   14.443  283.289   11.969 13.17026 18.75791 
1 1 1   18    5   49 o  335.681   9.0297   87.036   4.6395   96.605   6.4890   77.028   6.6358  352.402   12.030  313.869   13.813 38.53336 18.31703 
1 1 1   18    5   50 o   53.955   23.528  -0.2413   3.6564  -1.4648   5.5848   0.6766   4.8372   62.570   28.079   64.490   27.581 -1.919975 39.35921 
1 1 1   18    5   51 o  129.937   18.507   13.750   3.5767   15.333   5.2380   12.367   4.8958  133.453   26.577  119.151   27.414 14.30165 38.18190 
1 1 1   18    5   52 o  121.261   19.194   12.115   3.4438   15.146   4.8626   9.0646   4.8780  133.019   24.795  100.797   29.643 32.22162 38.64588 
1 1 1   18    5   53 o   77.661   25.877   5.0367   3.6032   7.4608   5.6169   3.3416   4.6970   92.422   32.271   72.515   28.640 19.90714 43.14710 
1 1 1   18    5   54 o  203.021   12.930   32.608   3.9972   33.695   6.4506   31.931   5.0928  200.967   21.295  198.622   16.913 2.344589 27.19373 
1 1 1   18    5   55 o   42.878   20.343  -3.6193   3.5950  -7.3416   4.8286   1.0102   5.3850   44.705   21.790   66.137   28.698 -21.43252 36.03294 
1 1 1   18    5   56 o  145.929   15.554   17.359   3.4206   19.770   4.4178   13.749   5.4051  153.473   19.228  120.524   29.531 32.94907 35.23935 
1 1 1   18    5   57 o   48.804   21.676  -0.3746   3.2384  -4.6150   4.4048   4.6135   4.7773   46.031   22.028   75.337   29.135 -29.30613 36.52515 
1 1 1   18    6    1 o  742.060   6.8130  421.560   7.7384  460.980   14.884  406.957   9.0590  775.677   12.536  729.044   8.1182 46.63318 14.93527 
1 1 1   18    6    2 o  310.668   12.598   73.947   5.9906   73.947   5.9906   0.0000   0.0000  310.668   12.598  ?   ?  0.000000 12.59809 
1 1 1   18    6    3 f  1001.75   14.310  769.115   21.941   0.0000   0.0000  769.115   21.941  ?   ?   1001.75   14.310 0.000000 14.30963 
1 1 1   18    6    4 o  416.962   7.7448  133.113   4.9429  152.750   8.1942  121.880   6.1973  446.527   11.989  398.921   10.150 47.60617 15.70844 
1 1 1   18    6    5 o  311.624   8.5088   74.358   4.0585   73.326   6.6447   74.973   5.1258  309.314   14.035  312.861   10.704 -3.547760 17.65064 
1 1 1   18    6    6 o  253.624   9.7051   49.263   3.7676   45.721   6.2504   51.284   4.7217  243.589   16.868  258.728   11.923 -15.13940 20.65648 
1 1 1   18    6    7 o  1185.32   9.6465  1076.00   17.502  1082.62   21.647  1063.51   29.739  1188.75   11.897  1177.64   16.498 11.11084 20.34055 
1 1 1   18    6    8 o  374.122   8.8782  107.183   5.0840  107.183   5.0840   0.0000   0.0000  374.122   8.8782  ?   ?  0.000000 8.878205 
1 1 1   18    6    9 o  1390.07   10.908  1480.17   23.208  1522.77   29.411  1409.86   37.782  1409.57   13.632  1355.54   18.210 54.03064 22.74704 
1 1 1   18    6   10 o  667.293   7.3192  340.923   7.4756  333.448   9.1577  355.852   12.943  659.863   9.0670  681.477   12.408 -21.61414 15.36777 
1 1 1   18    6   11 o  904.515   7.1959  626.402   9.9625  636.514   14.364  617.028   13.830  911.586   10.294  897.541   10.067 14.04492 14.39834 
1 1 1   18    6   12 o  228.766   8.2574   40.075   2.8914   35.217   4.2281   44.341   3.9628  213.974   12.971  240.589   10.761 -26.61490 16.85373 
1 1 1   18    6   13 o  870.635   7.1633  580.368   9.5460  612.433   14.205  553.962   12.891  894.146   10.379  850.428   9.9030 43.71875 14.34565 
1 1 1   18    6   14 o   84.017   14.268   5.5623   1.7692   5.7501   2.0632   5.0404   3.4387   85.146   16.427   81.122   25.117 4.023422 30.01125 
1 1 1   18    6   15 o  383.017   5.9889  112.310   3.5110  104.639   4.4625  124.775   5.6884  369.661   7.8869  403.622   9.2076 -33.96143 12.12368 
1 1 1   18    6   16 o  653.875   4.7035  327.281   4.7074  331.210   7.4041  324.615   6.0988  657.688   7.3550  651.159   6.1191 6.529297 9.567629 
1 1 1   18    6   17 o  1210.02   6.4772  1120.99   11.996  1123.66   18.465  1119.05   15.780  1211.11   9.9610  1208.78   8.5289 2.330078 13.11346 
1 1 1   18    6   18 o  426.160   5.2472  139.030   3.4227  141.590   7.1088  138.258   3.9051  429.866   10.804  424.955   6.0037 4.911011 12.36031 
1 1 1   18    6   19 o  744.005   5.5486  423.778   6.3187  446.804   12.141  415.225   7.3998  763.626   10.388  736.408   6.5649 27.21777 12.28822 
1 1 1   18    6   20 o  852.453   6.3804  556.400   8.3251  557.765   11.038  554.599   12.679  853.345   8.4509  850.803   9.7358 2.541321 12.89200 
1 1 1   18    6   21 o  568.500   5.4523  247.436   4.7444  254.235   7.1118  241.984   6.3687  576.130   8.0647  562.114   7.4021 14.01563 10.94669 
1 1 1   18    6   22 o  458.835   5.1989  161.181   3.6512  163.776   6.2123  159.811   4.5129  462.358   8.7782  456.836   6.4540 5.522217 10.89548 
1 1 1   18    6   23 o  723.207   5.7392  400.477   6.3530  395.017   9.3796  405.104   8.6355  718.048   8.5342  727.227   7.7580 -9.178162 11.53338 
1 1 1   18    6   24 o  241.739   9.5011   44.789   3.5155   48.847   5.2948   41.589   4.7014  251.877   13.786  232.406   13.271 19.47092 19.13585 
1 1 1   18    6   25 o  388.648   5.7614  115.667   3.4273  115.630   6.1610  115.684   4.1244  388.327   10.365  388.624   6.9336 -0.2971191 12.47064 
1 1 1   18    6   26 o  279.300   6.8828   59.756   2.9424   61.240   5.7463   59.229   3.4256  282.388   13.294  278.018   8.0499 4.369537 15.54170 
1 1 1   18    6   27 o  161.675   10.798   20.143   2.6567   16.037   6.2471   21.050   2.9354  140.847   29.902  165.195   11.685 -24.34721 32.10369 
1 1 1   18    6   28 o  480.060   5.9037  176.517   4.3380  177.753   8.4507  176.075   5.0548  481.190   11.474  479.388   6.8888 1.802704 13.38299 
1 1 1   18    6   29 f  368.076   6.3489  103.792   3.5769  115.777   7.6028  100.385   4.0535  388.131   12.798  361.923   7.3172 26.20773 14.74174 
1 1 1   18    6   30 o  123.777   15.091   11.972   2.7999   5.2723   7.1484   13.186   3.0431   94.649   35.878  129.902   15.618 -35.25301 39.12976 
1 1 1   18    6   31 o  225.758   7.8377   39.079   2.7083   44.223   4.3999   35.941   3.4365  239.855   11.985  216.351   10.377 23.50385 15.85309 
1 1 1   18    6   32 o  459.793   5.8754  161.980   4.1349  162.835   5.9291  161.170   5.7695  460.729   8.4076  458.390   8.2230 2.339020 11.76036 
1 1 1   18    6   33 o  276.241   7.5512   58.521   3.1928   57.155   4.4270   60.001   4.6092  272.728   10.605  279.417   10.777 -6.689880 15.11979 
1 1 1   18    6   34 o   52.340   21.089   0.9875   2.5980   0.5320   3.7026   1.4292   3.6462   58.583   24.548   61.982   24.980 -3.398933 35.02290 
1 1 1   18    6   35 o  150.421   10.928   17.495   2.4988   15.467   3.8926   18.916   3.2590  139.955   18.634  155.992   13.792 -16.03716 23.18270 
1 1 1   18    6   36 o  374.140   7.3292  107.395   4.1972  112.359   5.3747   99.636   6.7195  382.420   9.1822  359.581   12.209 22.83844 15.27630 
1 1 1   18    6   37 o  236.530   8.5840   42.976   3.1077   37.456   4.3806   48.568   4.4095  219.903   13.074  251.084   11.474 -31.18022 17.39436 
1 1 1   18    6   38 o  291.866   7.0635   65.373   3.1555   74.769   4.8888   58.662   4.1314  311.667   10.248  276.136   9.7747 35.53168 14.16220 
1 1 1   18    6   39 o  145.463   12.396   16.458   2.7337   15.717   4.2705   16.972   3.5584  140.187   20.509  146.950   16.083 -6.762527 26.06268 
1 1 1   18    6   40 o   94.439   18.797   7.2145   2.6216   6.6225   3.9086   7.6986   3.5346   90.067   26.548   96.653   24.002 -6.585945 35.78940 
1 1 1   18    6   41 o  132.360   13.805   13.725   2.7556   15.752   4.1337   12.104   3.6969  140.312   19.798  122.500   20.437 17.81221 28.45355 
1 1 1   18    6   42 o  150.961   15.518   17.923   3.5346   37.628   12.234   16.129   3.6921  207.443   39.980  142.660   17.259 64.78291 43.54665 
1 1 1   18    6   43 o   49.612   21.193   0.0765   2.8499  -0.6513   4.6475   0.5150   3.6078   60.180   26.376   57.174   24.109 3.005974 35.73405 
1 1 1   18    6   44 o  106.406   20.345   9.2330   3.1928   10.806   4.5135   7.6580   4.5170  113.479   26.471   95.873   28.608 17.60674 38.97598 
1 1 1   18    6   45 o  120.748   16.767   11.635   3.0152   8.6104   4.4080   14.294   4.1334  101.002   27.687  132.658   21.061 -31.65541 34.78703 
1 1 1   18    6   46 o   78.389   25.090   4.9383   3.4044   5.1836   4.7006   4.6677   4.9371   82.943   29.473   81.280   30.020 1.663048 42.06945 
1 1 1   18    6   47 o  240.907   10.649   44.921   3.9266   46.351   5.4306   43.353   5.6842  243.080   14.664  234.545   15.928 8.534988 21.65027 
1 1 1   18    6   48 o  163.848   16.613   21.346   4.1088   26.376   5.1966   12.956   6.7111  181.311   19.008  120.629   34.569 60.68200 39.44983 
1 1 1   18    6   49 o   60.326   24.585   1.4781   3.5767  -0.9679   5.2925   3.5345   4.8526   62.388   27.709   75.384   29.305 -12.99529 40.33097 
1 1 1   18    6   50 o  239.130   11.032   44.432   4.0379   37.050   6.3888   49.343   5.2106  214.086   19.718  250.662   13.632 -36.57602 23.97172 
1 1 1   18    6   51 o   90.135   24.271   6.9557   3.4230   4.1479   4.8354   9.7762   4.8463   77.173   29.447  105.174   29.114 -28.00072 41.40925 
1 1 1   18    6   52 o   75.891   24.666   4.7831   3.2814   5.5673   4.6923   4.0325   4.5905   82.735   29.442   75.383   28.709 7.351357 41.12212 
1 1 1   18    6   53 o   98.458   25.586   8.5134   3.8912   2.1913   6.3779   12.262   4.9111   75.035   31.869  117.309   27.780 -42.27461 42.27734 
1 1 1   18    6   54 o  229.098   12.209   41.370   4.2657   60.149   7.2118   31.265   5.2903  272.448   17.384  195.825   17.846 76.62303 24.91374 
1 1 1   18    6   55 o  227.011   13.590   41.088   4.7002   27.808   7.1108   51.392   6.2637  176.347   27.220  251.771   16.342 -75.42349 31.74928 
1 1 1   18    6   56 o  155.312   14.246   19.470   3.3489   18.171   4.4467   21.172   5.0903  146.151   20.437  156.893   21.785 -10.74191 29.87058 
1 1 1   18    6   57 f   59.585   24.161   2.0452   3.4335  -0.2117   4.4763   5.2710   5.3516   56.881   25.360   79.032   30.760 -22.15148 39.86620 
1 1 1   18    7    0 o  113.996   11.250   10.237   1.9190   10.237   1.9190   10.237   1.9190  113.996   11.250  113.996   11.250 0.000000 0.000000 
1 1 1   18    7    1 o  766.613   5.9391  449.886   6.9690  460.862   10.119  439.983   9.6116  775.804   8.5216  758.037   8.2839 17.76605 11.88452 
1 1 1   18    7    2 o  603.539   6.1680  278.849   5.6980  288.747   10.762  274.994   6.7166  613.950   11.452  599.318   7.3219 14.63196 13.59275 
1 1 1   18    7    3 f  151.414   14.427   17.731   3.3032   0.0000   0.0000   17.731   3.3032  ?   ?   151.414   14.427 0.000000 14.42708 
1 1 1   18    7    4 o  692.278   8.5496  366.973   9.0593  365.828   13.194  367.993   12.461  690.988   12.475  693.075   11.747 -2.086243 17.13474 
1 1 1   18    7    5 o  131.884   15.018   13.506   2.9775   12.659   5.4172   13.873   3.5642  125.741   28.770  133.288   17.925 -7.546791 33.89690 
1 1 1   18    7    6 o  563.151   8.4164  242.840   7.2547  228.984   10.377  256.089   10.147  546.678   12.401  578.177   11.466 -31.49957 16.88906 
1 1 1   18    7    7 o  387.505   7.1101  114.964   4.2172  112.828   5.2919  118.680   6.9809  383.844   9.0072  393.592   11.588 -9.748199 14.67663 
1 1 1   18    7    8 o  803.092   9.5872  493.947   11.785  493.947   11.785   0.0000   0.0000  803.092   9.5872  ?   ?  0.000000 9.587233 
1 1 1   18    7    9 o  781.747   7.7079  467.926   9.2230  487.536   11.768  436.698   14.850  797.855   9.6361  754.895   12.852 42.95996 16.06331 
1 1 1   18    7   10 o  1142.56   9.5183  999.813   16.646  1014.79   20.804  973.158   27.753  1150.86   11.810  1126.46   16.096 24.40051 19.96384 
1 1 1   18    7   11 o  489.947   7.3661  183.795   5.5240  187.439   7.0222  177.879   8.9474  494.715   9.2736  481.811   12.132 12.90372 15.27073 
1 1 1   18    7   12 o  730.260   7.7790  408.338   8.6951  412.963   10.907  400.275   14.402  734.278   9.7046  722.677   13.020 11.60095 16.23912 
1 1 1   18    7   13 o  871.021   7.1901  580.891   9.5859  588.541   13.836  573.830   13.293  876.526   10.313  865.524   10.034 11.00208 14.38883 
1 1 1   18    7   14 o  967.546   6.6686  716.736   9.8760  726.167   12.799  702.857   15.526  973.761   8.5873  957.838   10.590 15.92401 13.63421 
1 1 1   18    7   15 o  301.411   6.6041   69.557   3.0468   66.924   3.9492   73.428   4.7887  295.606   8.7283  309.600   10.105 -13.99405 13.35289 
1 1 1   18    7   16 o  774.124   5.5503  458.767   6.5765  458.579   9.2318  458.960   9.3710  773.852   7.7939  774.166   7.9082 -0.3141479 11.10341 
1 1 1   18    7   17 o  498.672   5.3523  190.370   4.0853  192.955   5.7079  187.655   5.8497  501.978   7.4288  495.026   7.7204 6.952759 10.71410 
1 1 1   18    7   18 o  213.324   7.5935   34.849   2.4794   42.012   5.4986   33.021   2.7779  233.487   15.473  207.633   8.7408 25.85423 17.77149 
1 1 1   18    7   19 o  469.573   5.2450  168.804   3.7698  161.445   5.6648  174.654   5.0505  459.125   8.0609  477.586   6.9090 -18.46063 10.61660 
1 1 1   18    7   20 o  952.317   6.1544  694.389   8.9709  696.562   13.020  692.425   12.377  953.564   8.9208  950.769   8.5053 2.794250 12.32556 
1 1 1   18    7   21 f  445.888   5.1156  152.209   3.4913  156.305   5.9402  150.048   4.3153  451.706   8.5916  442.669   6.3689 9.037140 10.69480 
1 1 1   18    7   22 o  330.477   5.7862   83.624   2.9269   80.849   5.3854   84.787   3.4868  324.754   10.834  332.736   6.8462 -7.982666 12.81598 
1 1 1   18    7   23 o  322.883   6.4197   79.838   3.1727   77.794   5.3782   80.929   3.9293  318.525   11.031  325.028   7.8981 -6.503143 13.56711 
1 1 1   18    7   24 o  391.378   6.4926  117.312   3.8894  124.792   6.2030  112.466   4.9929  403.460   10.045  383.110   8.5145 20.35001 13.16774 
1 1 1   18    7   25 o  284.650   6.5416   62.060   2.8502   67.975   5.5703   59.962   3.3173  297.611   12.228  279.753   7.7471 17.85837 14.47559 
1 1 1   18    7   26 o  302.413   6.4462   70.050   2.9838   63.975   5.6165   72.439   3.5219  288.649   12.712  307.481   7.4833 -18.83157 14.75131 
1 1 1   18    7   27 o  236.919   8.2661   43.023   2.9976   45.740   8.4392   42.631   3.2067  241.979   23.064  235.809   8.8843 6.170624 24.71641 
1 1 1   18    7   28 o  209.743   8.4241   33.726   2.7044   32.052   5.4774   34.265   3.1100  203.106   17.799  211.358   9.6132 -8.252792 20.22871 
1 1 1   18    7   29 o  157.378   10.542   19.096   2.5246   21.400   5.3072   18.422   2.8702  164.856   21.548  154.361   12.249 10.49525 24.78592 
1 1 1   18    7   30 o  238.806   8.5155   43.737   3.1126   36.774   7.4866   45.192   3.4224  216.393   22.954  242.702   9.2128 -26.30983 24.73361 
1 1 1   18    7   31 o  568.576   5.6575  247.660   4.9236  263.185   8.6377  240.189   5.9924  585.564   9.6373  559.785   6.9937 25.77911 11.90754 
1 1 1   18    7   32 o  268.097   9.7560   55.186   4.0035   55.547   6.2255   54.932   5.2277  267.923   15.244  267.169   12.784 0.7539978 19.89479 
1 1 1   18    7   33 o  352.336   7.4847   95.204   4.0365   90.775   6.6378   97.803   5.0846  343.385   12.629  356.911   9.3074 -13.52625 15.68827 
1 1 1   18    7   34 o  137.330   11.674   14.616   2.4306   13.428   3.7523   15.474   3.1904  130.110   19.438  140.777   15.039 -10.66727 24.57619 
1 1 1   18    7   35 o   94.800   18.347   7.2080   2.5660   4.0088   3.6972   10.181   3.5642   75.045   26.184  112.429   21.495 -37.38407 33.87650 
1 1 1   18    7   36 o  199.426   10.874   30.698   3.3067   31.717   4.1808   28.995   5.4040  202.247   13.584  192.217   18.600 10.02963 23.03259 
1 1 1   18    7   37 o   88.456   18.778   6.3202   2.4638   7.6675   3.7925   5.3364   3.2408   96.735   25.319   81.600   24.206 15.13525 35.02811 
1 1 1   18    7   38 o   59.743   21.184   2.4544   2.4272   2.2695   3.6269   2.6045   3.2665   65.411   25.361   65.124   24.345 0.2872696 35.15508 
1 1 1   18    7   39 o  290.204   7.3856   64.670   3.2806   64.148   5.3875   64.977   4.1359  288.196   12.213  290.609   9.2979 -2.412811 15.34964 
1 1 1   18    7   40 o  117.460   15.245   10.892   2.6763   8.7328   4.1212   12.466   3.5193  102.592   26.163  124.821   19.022 -22.22924 32.34710 
1 1 1   18    7   41 o  255.441   10.068   50.291   3.9364   45.129   11.797   50.938   4.1757  231.595   34.316  256.977   10.616 -25.38176 35.92107 
1 1 1   18    7   42 o  278.187   8.4847   59.543   3.6128   50.329   6.0668   64.606   4.4971  253.667   15.703  289.440   10.151 -35.77342 18.69792 
1 1 1   18    7   43 o  120.281   15.950   11.479   2.8640   13.161   4.2778   10.112   3.8557  126.815   22.880  110.645   23.493 16.17026 32.79321 
1 1 1   18    7   44 o  177.307   13.737   24.581   3.6990   27.785   4.6118   18.802   6.1934  187.826   16.200  149.849   28.033 37.97690 32.37755 
1 1 1   18    7   45 o  164.517   13.823   21.208   3.4486   21.816   4.7685   20.541   4.9935  165.129   19.226  159.528   20.957 5.600800 28.44065 
1 1 1   18    7   46 o   85.828   23.930   6.1295   3.2618   6.7450   4.4299   5.4007   4.8205   90.341   28.589   84.266   29.857 6.075706 41.33761 
1 1 1   18    7   47 o  145.587   16.156   16.837   3.5396   20.172   4.9227   13.268   5.0931  157.701   20.910  124.892   27.396 32.80859 34.46381 
1 1 1   18    7   48 o  186.872   15.325   27.572   4.3448   26.341   4.9879   31.444   8.8461  181.492   18.201  191.096   31.329 -9.603943 36.23235 
1 1 1   18    7   49 o  198.798   11.581   30.821   3.5088   27.493   5.2840   33.446   4.6927  184.837   18.945  205.847   14.997 -21.01031 24.16215 
1 1 1   18    7   50 o  243.936   10.983   46.244   4.1009   56.559   6.7525   40.217   5.1619  266.703   16.624  225.531   15.040 41.17232 22.41752 
1 1 1   18    7   51 o   59.058   23.743   1.6802   3.2852   2.8053   4.5672   0.4741   4.7290   70.428   28.106   62.789   27.069 7.638699 39.02153 
1 1 1   18    7   52 o  127.559   17.714   13.267   3.3652   4.7384   4.6018   23.070   4.9336   78.532   28.987  167.768   19.581 -89.23663 34.98073 
1 1 1   18    7   53 o   64.482   25.670   2.3774   3.8013   0.7893   6.2439   3.3126   4.7916   70.461   30.735   72.619   28.849 -2.157890 42.15296 
1 1 1   18    7   54 o  117.117   21.943   11.725   3.7891   20.795   6.0181   5.7677   4.8771  153.559   26.566   82.768   29.949 70.79050 40.03391 
1 1 1   18    7   55 o  121.838   18.585   12.410   3.3562   14.197   4.5157   10.204   5.0165  127.079   24.098  103.943   29.917 23.13564 38.41487 
1 1 1   18    7   56 o  141.347   15.551   16.325   3.3088   13.546   4.3313   20.220   5.1275  123.607   23.757  152.466   22.661 -28.85907 32.83108 
1 1 1   18    7   57 o  100.067   21.905   8.8621   3.2620   8.2691   4.3191   9.6495   4.9769   93.194   28.012   99.228   30.125 -6.033607 41.13619 
1 1 1   18    8    0 o  579.977   7.3662  257.608   6.5368  257.608   6.5368  257.608   6.5368  579.977   7.3662  579.977   7.3662 0.000000 0.000000 
1 1 1   18    8    1 o  360.457   6.8434   99.471   3.7757   99.471   3.7757   0.0000   0.0000  360.457   6.8434  ?   ?  0.000000 6.843361 
1 1 1   18    8    2 o  495.412   4.9379  187.868   3.7444  193.099   5.4735  183.266   5.1336  502.212   7.1204  489.266   6.8551 12.94650 9.883919 
1 1 1   18    8    3 o  747.285   12.120  427.851   13.863   0.0000   0.0000  427.851   13.863  ?   ?   747.285   12.120 0.000000 12.11979 
1 1 1   18    8    4 o  509.400   7.9794  198.686   6.2216  198.585   9.1550  198.773   8.4809  509.126   11.748  509.406   10.877 -0.2792664 16.01011 
1 1 1   18    8    5 o  1296.13   12.531  1287.23   24.861  1264.92   34.605  1311.03   35.739  1284.09   17.607  1307.24   17.861 -23.15320 25.08030 
1 1 1   18    8    6 o  380.878   8.6780  111.087   5.0591  102.116   7.5501  118.398   6.8155  365.022   13.513  393.130   11.326 -28.10770 17.63226 
1 1 1   18    8    7 o  764.204   7.5983  447.153   8.8878  434.866   10.769  473.403   15.740  753.545   9.3366  785.965   13.084 -32.42029 16.07377 
1 1 1   18    8    8 o  457.200   8.8426  160.075   6.1881  160.075   6.1881   0.0000   0.0000  457.200   8.8426  ?   ?  0.000000 8.842630 
1 1 1   18    8    9 o  281.629   8.6670   60.738   3.7361   68.499   4.8581   49.505   5.8449  299.034   10.614  253.647   15.124 45.38661 18.47646 
1 1 1   18    8   10 o  767.676   7.8362  451.252   9.2077  476.773   11.864  412.604   14.600  788.970   9.8247  733.735   13.000 55.23438 16.29524 
1 1 1   18    8   11 o  489.899   7.5092  183.765   5.6308  185.493   7.0422  180.702   9.3760  492.131   9.3488  485.585   12.615 6.545685 15.70140 
1 1 1   18    8   12 o  625.210   7.5700  299.304   7.2442  300.331   8.9943  297.406   12.222  626.198   9.3839  622.931   12.819 3.266418 15.88633 
1 1 1   18    8   13 o  426.667   7.8902  139.400   5.1529  146.360   6.5921  128.468   8.2620  437.119   9.8526  409.388   13.185 27.73157 16.45957 
1 1 1   18    8   14 o  447.099   5.5887  153.029   3.8246  147.635   4.7635  162.816   6.4158  439.108   7.0874  461.062   9.0912 -21.95364 11.52740 
1 1 1   18    8   15 o  476.335   6.0781  173.708   4.4315  172.842   5.9145  174.818   6.6913  475.078   8.1336  477.744   9.1505 -2.666382 12.24283 
1 1 1   18    8   16 o  785.254   6.1578  472.092   7.4013  480.729   9.6299  459.628   11.569  792.303   7.9407  774.593   9.7577 17.71033 12.58047 
1 1 1   18    8   17 o  243.408   7.1116   45.367   2.6496   47.732   3.8894   43.319   3.6192  249.602   10.181  237.789   9.9438 11.81252 14.23102 
1 1 1   18    8   18 o  791.885   6.4360  480.137   7.8010  485.551   12.778  476.921   9.8497  796.031   10.487  789.117   8.1547 6.914001 13.28461 
1 1 1   18    8   19 o  814.404   5.8695  507.807   7.3167  510.798   10.415  504.892   10.281  816.629   8.3319  811.899   8.2733 4.730042 11.74174 
1 1 1   18    8   20 o  472.042   6.1992  170.614   4.4791  175.550   6.1141  164.895   6.5803  478.727   8.3440  463.923   9.2669 14.80371 12.46983 
1 1 1   18    8   21 o  665.304   5.1201  338.874   5.2140  341.928   8.4382  336.987   6.6314  668.103   8.2515  663.375   6.5309 4.727661 10.52335 
1 1 1   18    8   22 o  188.965   8.5831   27.358   2.4825   33.223   4.6259   24.985   2.9421  207.505   14.659  180.213   10.714 27.29204 18.15693 
1 1 1   18    8   23 o  323.053   5.8992   79.916   2.9170   87.723   5.5496   76.936   3.4288  338.242   10.719  316.933   7.0682 21.30923 12.83989 
1 1 1   18    8   24 o  527.095   5.9078  212.760   4.7664  216.533   7.2075  209.827   6.3542  531.540   8.8589  523.318   7.9327 8.222412 11.89148 
1 1 1   18    8   25 o  362.000   6.0638  100.362   3.3599  104.834   7.2339   99.132   3.7939  369.519   12.790  359.737   6.8902 9.781860 14.52777 
1 1 1   18    8   26 o  257.963   7.1729   50.984   2.8322   58.960   6.5993   49.183   3.1356  276.400   15.663  253.328   8.0867 23.07198 17.62747 
1 1 1   18    8   27 o  532.093   5.6690  216.841   4.6170  227.151   9.1176  213.285   5.3543  544.040   10.949  527.640   6.6297 16.39978 12.79985 
1 1 1   18    8   28 o  457.446   5.5627  160.273   3.8949  162.025   6.9084  159.457   4.7158  459.557   9.8213  456.194   6.7536 3.362488 11.91927 
1 1 1   18    8   29 o  271.121   7.0126   56.332   2.9101   60.548   5.7334   54.870   3.3776  280.580   13.350  267.508   8.2489 13.07205 15.69313 
1 1 1   18    8   30 o   93.285   22.395   7.0272   3.1573   15.114   7.3436   5.1934   3.4970  135.521   35.116   81.694   25.334 53.82697 43.30116 
1 1 1   18    8   31 o  105.727   19.338   8.9216   3.0141   10.332   5.4897   8.3131   3.6063  112.636   30.908  101.321   23.679 11.31519 38.93582 
1 1 1   18    8   32 o  440.630   7.4939  148.884   5.0542  148.227   7.2579  149.503   7.0424  439.190   10.797  441.136   10.430 -1.946136 15.01157 
1 1 1   18    8   33 o  144.919   12.264   16.279   2.6949   9.7959   5.5924   18.239   3.0755  109.703   31.591  153.306   13.236 -43.60323 34.25182 
1 1 1   18    8   34 o  367.512   7.1794  103.589   4.0386  105.524   6.9245  102.591   4.9718  370.179   12.221  365.530   8.8862 4.649139 15.11023 
1 1 1   18    8   35 o  180.420   11.760   25.171   3.2299   26.443   6.0987   24.676   3.8077  182.590   22.284  178.230   14.072 4.359680 26.35547 
1 1 1   18    8   36 o  503.175   7.7198  194.332   5.9456  199.736   8.4513  189.037   8.3661  509.403   10.839  495.521   11.030 13.88177 15.46465 
1 1 1   18    8   37 o  126.195   14.871   12.495   2.8173   14.822   6.2433   11.901   3.1571  133.270   31.163  122.576   17.309 10.69476 35.64741 
1 1 1   18    8   38 o  202.288   9.0395   31.466   2.7989   32.063   4.4820   31.084   3.5835  202.944   14.525  200.399   11.734 2.545013 18.67214 
1 1 1   18    8   39 o  269.280   7.7545   55.705   3.1962   51.178   5.2126   58.432   4.0460  256.833   13.305  275.517   9.5942 -18.68347 16.40357 
1 1 1   18    8   40 o  423.138   6.5054  137.418   4.2133  140.155   7.1374  135.954   5.2199  426.225   10.940  420.547   8.1091 5.677979 13.61793 
1 1 1   18    8   41 o   66.718   23.941   3.0775   3.1088  -9.2401   7.8582   5.3630   3.3849   62.078   29.628   81.547   24.863 -19.46880 38.67806 
1 1 1   18    8   42 o   38.325   18.031  -2.8108   2.7164  -1.6894   4.2910  -3.5607   3.5091   54.685   24.572   43.562   20.495 11.12285 31.99722 
1 1 1   18    8   43 o  165.493   13.308   21.389   3.3426   20.769   4.5678   22.104   4.9043  161.455   18.838  166.348   19.640 -4.892944 27.21420 
1 1 1   18    8   44 o   67.436   25.024   2.9830   3.4388   2.3130   4.1873   4.3711   6.0267   68.010   26.984   84.267   32.686 -16.25767 42.38538 
1 1 1   18    8   45 f  131.211   17.729   13.775   3.4695   14.056   4.7685   13.458   5.0574  130.044   24.863  126.399   26.963 3.645592 36.67626 
1 1 1   18    8   46 o  156.081   15.076   19.219   3.5569   14.977   4.7441   24.666   5.3754  134.505   23.920  174.967   20.458 -40.46236 31.47503 
1 1 1   18    8   47 o  273.108   10.412   57.722   4.3526   61.579   5.6618   52.148   6.8060  281.160   13.156  256.503   17.439 24.65649 21.84480 
1 1 1   18    8   48 o  105.684   25.580   9.4966   4.0935   11.837   4.7112   2.2851   8.2693  117.748   26.749   85.009   36.201 32.73940 45.01128 
1 1 1   18    8   49 o  165.862   13.219   21.622   3.3281   27.375   5.1254   17.427   4.3762  184.628   18.381  146.253   20.079 38.37517 27.22164 
1 1 1   18    8   50 o   63.588   24.039   2.6356   3.2037   1.2949   4.9817   3.5810   4.1835   67.107   28.315   72.494   27.455 -5.387398 39.43999 
1 1 1   18    8   51 o  169.763   13.337   22.752   3.4376   28.530   5.2571   18.437   4.5437  187.677   18.543  149.658   20.364 38.01877 27.54161 
1 1 1   18    8   52 o  150.067   14.919   17.996   3.3813   13.576   4.8765   22.090   4.6926  124.662   26.379  164.364   19.003 -39.70216 32.51130 
1 1 1   18    8   53 o  118.447   21.547   11.869   3.7626   15.550   6.5384   10.047   4.6007  128.642   33.034  105.714   27.992 22.92815 43.29903 
1 1 1   18    8   54 o   86.654   26.071   6.6757   3.7399   5.7150   5.2490   7.6664   5.3299   82.953   30.890   91.781   31.471 -8.827972 44.09783 
1 1 1   18    8   55 o   77.255   23.974   5.2377   3.1308   4.0368   4.1530   6.8187   4.7653   72.190   27.351   86.544   29.752 -14.35323 40.41367 
1 1 1   18    8   56 o  124.891   16.968   12.948   3.1597   11.357   4.2298   14.957   4.7529  111.748   25.316  128.977   24.978 -17.22903 35.56367 
1 1 1   18    9    0 o  263.710   7.2997   53.355   2.9414   53.355   2.9414   53.355   2.9414  263.710   7.2997  263.710   7.2997 0.000000 0.000000 
1 1 1   18    9    1 o  846.626   6.3466  548.728   8.2244  545.138   11.565  552.401   11.698  843.722   8.9552  849.321   8.9987 -5.599609 12.69533 
1 1 1   18    9    2 o  650.095   6.3076  323.539   6.2764  318.865   10.623  326.046   7.7793  645.192   10.757  652.555   7.7885 -7.363342 13.28058 
1 1 1   18    9    3 o  554.630   6.2179  235.492   5.2786  236.352   6.3629  233.596   9.4531  555.604   7.4821  552.206   11.184 3.397461 13.45615 
1 1 1   18    9    4 o  673.201   8.5257  347.038   8.7851  352.087   12.626  342.299   12.231  677.881   12.169  668.406   11.955 9.475464 17.05893 
1 1 1   18    9    5 o  467.191   6.0256  167.091   4.3089  167.741   5.0929  165.456   8.0829  468.072   7.1085  464.728   11.363 3.343903 13.40342 
1 1 1   18    9    6 o  788.952   9.3259  476.699   11.262  496.932   16.632  459.568   15.304  805.213   13.495  774.398   12.912 30.81543 18.67649 
1 1 1   18    9    7 o  412.342   7.2171  130.179   4.5550  130.551   5.6737  129.503   7.6400  412.884   8.9778  411.112   12.141 1.771973 15.10010 
1 1 1   18    9    8 o  579.967   8.9691  257.595   7.9620  257.595   7.9620   0.0000   0.0000  579.967   8.9691  ?   ?  0.000000 8.969136 
1 1 1   18    9    9 o  903.057   8.3684  624.494   11.567  631.271   14.373  612.036   19.488  907.802   10.344  893.500   14.250 14.30170 17.60808 
1 1 1   18    9   10 o  999.651   8.8518  765.300   13.544  781.329   16.964  737.115   22.494  1009.88   10.974  980.448   14.989 29.43280 18.57722 
1 1 1   18    9   11 o  864.336   8.3024  572.099   10.984  582.960   13.700  552.554   18.378  872.361   10.260  848.948   14.143 23.41241 17.47295 
1 1 1   18    9   12 o  220.743   11.268   37.432   3.7945   34.451   4.5705   44.046   6.8073  211.499   14.201  238.786   18.776 -27.28729 23.54179 
1 1 1   18    9   13 o  859.430   8.4357  565.657   11.097  566.786   13.666  563.472   19.012  860.139   10.380  857.208   14.490 2.931702 17.82460 
1 1 1   18    9   14 o  912.532   7.3366  637.623   10.247  640.115   11.824  630.106   20.539  914.235   8.4498  906.405   14.804 7.829529 17.04569 
1 1 1   18    9   15 o  540.714   7.1331  223.871   5.9035  221.082   6.9192  231.337   11.319  537.280   8.4136  549.292   13.463 -12.01263 15.87568 
1 1 1   18    9   16 o  588.758   5.8923  265.383   5.3100  263.698   6.7496  268.118   8.6016  586.818   7.5146  591.610   9.4989 -4.792175 12.11189 
1 1 1   18    9   17 o  438.292   5.5662  147.067   3.7341  147.184   5.3094  146.953   5.2528  438.388   7.9125  438.047   7.8343 0.3411865 11.13484 
1 1 1   18    9   18 o  158.332   12.033   19.329   2.8943   20.585   5.2869   18.791   3.4585  162.108   21.865  155.814   14.675 6.294907 26.33285 
1 1 1   18    9   19 o  859.426   6.0205  565.529   7.9197  583.258   11.482  549.441   10.938  872.586   8.5968  846.927   8.4378 25.65948 12.04583 
1 1 1   18    9   20 o  571.410   6.1216  250.009   5.3540  257.633   7.1955  240.552   8.0140  579.946   8.1059  560.310   9.3444 19.63654 12.37029 
1 1 1   18    9   21 f  712.362   6.3711  388.598   6.9468  405.716   9.2481  366.432   10.524  727.732   8.3025  691.452   9.9433 36.28015 12.95378 
1 1 1   18    9   22 o  498.698   5.8000  190.436   4.4273  202.848   6.6398  180.500   5.9406  514.540   8.4307  485.397   7.9958 29.14301 11.61937 
1 1 1   18    9   23 o  275.463   8.2007   58.140   3.4577   61.140   6.3044   56.849   4.1351  281.739   14.670  272.315   9.9207 9.423950 17.70959 
1 1 1   18    9   24 o  243.080   8.8516   45.288   3.2933   50.214   6.1278   43.287   3.9053  255.067   15.773  237.566   10.740 17.50143 19.08230 
1 1 1   18    9   25 o  253.978   6.7458   49.413   2.6224   54.225   5.2483   47.812   3.0274  265.726   12.904  249.785   7.9184 15.94185 15.13952 
1 1 1   18    9   26 o  270.363   6.6851   55.998   2.7664   50.756   5.3357   57.925   3.2353  256.633   13.632  274.932   7.6880 -18.29855 15.65073 
1 1 1   18    9   27 o  201.257   8.3332   31.051   2.5670   36.022   5.9150   29.898   2.8494  215.343   18.114  197.436   9.4287 17.90685 20.42065 
1 1 1   18    9   28 o  260.607   6.9071   52.043   2.7552   56.135   5.5396   50.699   3.1758  270.184   13.395  257.159   8.0684 13.02567 15.63753 
1 1 1   18    9   29 o  141.762   13.818   15.610   2.9602   20.215   5.2230   13.430   3.5930  159.994   21.903  130.570   18.495 29.42384 28.66711 
1 1 1   18    9   30 o  256.547   9.6637   50.518   3.7947   45.648   7.9220   51.968   4.3229  241.529   21.659  260.102   10.858 -18.57339 24.22817 
1 1 1   18    9   31 o  496.950   5.7176  189.211   4.3491  196.079   7.9064  186.231   5.2077  505.277   10.223  492.897   6.9027 12.37979 12.33525 
1 1 1   18    9   32 o  436.656   6.3380  146.136   4.2360  157.935   7.2741  140.082   5.2107  453.363   10.483  427.333   7.9664 26.02963 13.16613 
1 1 1   18    9   33 o  194.392   10.272   29.121   3.0454   21.284   5.8260   32.068   3.5724  163.287   24.029  203.845   11.496 -40.55768 26.63732 
1 1 1   18    9   34 o  337.172   6.7337   87.175   3.4752   79.185   6.6320   90.199   4.0802  320.404   13.523  342.860   7.7748 -22.45511 15.59880 
1 1 1   18    9   35 o  104.263   18.900   8.7072   2.9052   5.9660   5.7674   9.6393   3.3631   91.593   32.636  109.401   20.845 -17.80870 38.72478 
1 1 1   18    9   36 o  121.352   18.149   11.697   3.2675   8.6877   5.9290   13.010   3.9159  104.038   33.091  127.453   20.790 -23.41511 39.07986 
1 1 1   18    9   37 o  118.152   15.696   11.010   2.7683   12.444   5.9948   10.621   3.1209  121.927   31.793  115.416   18.275 6.510864 36.67153 
1 1 1   18    9   38 o  117.160   17.298   10.910   3.0087   8.2004   8.7689   11.271   3.2032  107.452   39.943  118.904   18.177 -11.45171 43.88505 
1 1 1   18    9   39 o  167.312   13.464   21.810   3.4189   2.5101   14.038   23.027   3.5250  108.165   46.635  171.935   13.503 -63.77073 48.55012 
1 1 1   18    9   40 o  182.869   11.996   25.953   3.3393   26.991   7.6727   25.711   3.7089  180.925   28.662  181.689   13.432 -0.7640076 31.65292 
1 1 1   18    9   41 o  121.949   17.206   11.838   3.1224   6.4507   6.7962   13.279   3.5153   95.236   35.212  128.977   18.322 -33.74122 39.69305 
1 1 1   18    9   42 o  245.305   10.419   46.439   3.9119   48.289   5.9398   45.022   5.1987  248.364   15.706  240.279   14.198 8.085190 21.17213 
1 1 1   18    9   43 o  168.463   14.263   22.230   3.6431   23.240   4.7614   20.805   5.6583  170.971   18.489  159.686   23.883 11.28522 30.20369 
1 1 1   18    9   44 o   44.221   20.366  -2.2309   3.1854  -0.6811   4.3752  -3.9792   4.6467   58.096   25.524   51.275   23.949 6.820885 35.00029 
1 1 1   18    9   45 o  101.547   21.767   8.5232   3.2816   3.8637   4.4340   14.166   4.8796   75.862   28.363  130.298   25.379 -54.43601 38.06036 
1 1 1   18    9   46 o  344.040   8.4158   91.218   4.4317  101.857   6.0734   79.102   6.4813  362.683   10.940  318.733   13.285 43.94986 17.21018 
1 1 1   18    9   47 o  112.977   25.524   10.796   4.3097   11.811   4.8687   7.1227   9.2633  117.525   27.546  101.585   40.188 15.94029 48.72244 
1 1 1   18    9   48 o   84.008   25.254   5.8958   3.5104  -0.0920   4.5827   14.398   5.4609   60.751   26.417  129.289   28.374 -68.53845 38.76796 
1 1 1   18    9   49 o  198.580   11.258   30.743   3.4079   28.272   5.1879   32.618   4.5200  187.601   18.300  203.311   14.622 -15.70964 23.42433 
1 1 1   18    9   50 o   47.802   21.227  -0.7565   3.1042  -3.2979   4.7021   1.2068   4.1328   52.425   24.354   62.107   25.973 -9.681278 35.60472 
1 1 1   18    9   51 o  254.015   9.3779   50.030   3.6462   39.695   5.1186   60.677   5.1952  223.539   15.047  278.498   12.187 -54.95905 19.36380 
1 1 1   18    9   52 o  151.408   16.875   18.542   3.8442   21.413   7.1260   17.363   4.5655  153.669   31.358  144.222   21.325 9.446838 37.92223 
1 1 1   18    9   53 o   65.942   24.269   3.2069   3.2222   0.9677   4.6198   5.3279   4.4963   62.983   26.945   80.394   28.798 -17.41140 39.43836 
1 1 1   18    9   54 o  102.538   23.527   9.2303   3.6141   8.9635   5.1302   9.4931   5.0922   97.877   30.740  100.636   30.454 -2.759041 43.27073 
1 1 1   18    9   55 o   51.216   21.943   0.4831   3.0717  -0.9543   4.2435   2.0653   4.4522   53.936   24.316   64.897   27.033 -10.96038 36.36034 
1 1 1   18    9   56 o  133.349   16.090   14.644   3.2178   17.924   4.3852   10.818   4.7363  144.830   20.343  106.638   28.480 38.19251 34.99892 
1 1 1   18   10    0 o  330.005   7.3462   83.487   3.7065   83.487   3.7065   83.487   3.7065  330.005   7.3462  330.005   7.3462 0.000000 0.000000 
1 1 1   18   10    1 o  1001.32   7.1532  767.647   10.963  774.698   15.650  760.851   15.363  1005.70   10.166  996.675   10.071 9.020569 14.30995 
1 1 1   18   10    2 o  557.109   6.1448  237.603   5.2399  247.807   9.3872  232.985   6.3153  568.766   10.783  551.628   7.4796 17.13818 13.12299 
1 1 1   18   10    3 f  140.683   10.753   15.250   2.2980   16.093   2.6628   12.790   4.5483  144.411   12.160  126.876   24.306 17.53551 27.17795 
1 1 1   18   10    4 o  187.310   8.7373   26.868   2.5050   27.298   2.8990   25.600   4.9767  188.515   10.083  181.753   18.131 6.762695 20.74663 
1 1 1   18   10    5 o  400.473   6.4315  122.782   3.9423  122.984   4.6375  122.257   7.4859  400.776   7.5599  399.436   12.244 1.339203 14.38995 
1 1 1   18   10    6 o  375.774   9.0531  108.141   5.2070  114.163   7.4527  102.398   7.2781  385.970   12.615  365.526   13.009 20.44308 18.12087 
1 1 1   18   10    7 o  487.145   6.4863  181.682   4.8365  181.682   4.8365   0.0000   0.0000  487.145   6.4863  ?   ?  0.000000 6.486325 
1 1 1   18   10    8 o  721.614   7.6133  398.719   8.4091  408.664   10.505  380.981   14.030  730.462   9.3958  705.041   13.001 25.42035 16.04076 
1 1 1   18   10    9 f  201.777   11.416   31.294   3.5114   30.332   4.1428   33.750   6.6173  198.444   13.724  208.548   21.017 -10.10414 25.10067 
1 1 1   18   10   10 o  544.686   5.9480  227.128   4.9589  227.501   5.5653  225.690   10.924  545.111   6.6702  542.622   13.153 2.489258 14.74789 
1 1 1   18   10   11 o  174.110   14.142   23.396   3.7363   19.674   4.4661   32.075   6.8199  158.990   18.710  203.046   22.312 -44.05699 29.11869 
1 1 1   18   10   12 o  1375.79   11.064  1450.29   23.300  1471.60   29.036  1411.74   39.046  1385.44   13.692  1355.89   18.814 29.54565 23.26900 
1 1 1   18   10   13 o  332.514   6.7451   84.655   3.4330   84.083   3.7485   87.631   8.5482  331.374   7.3905  337.930   16.526 -6.556183 18.10368 
1 1 1   18   10   14 o  262.540   8.2649   52.788   3.3212   56.550   3.7085   37.543   7.4648  271.720   8.9168  219.786   22.507 51.93373 24.20908 
1 1 1   18   10   15 o  469.601   6.5629  168.848   4.7173  171.028   5.3078  160.656   10.291  472.595   7.3376  457.646   14.691 14.94916 16.42156 
1 1 1   18   10   16 o  722.498   6.8232  399.704   7.5457  397.571   8.5356  407.333   16.142  720.514   7.7397  728.699   14.473 -8.185486 16.41221 
1 1 1   18   10   17 o  967.467   6.2700  716.659   9.2847  726.887   13.173  706.564   13.088  974.123   8.8351  960.402   8.9035 13.72119 12.54318 
1 1 1   18   10   18 f  188.291   10.438   27.253   2.9964   25.719   5.4699   27.911   3.5815  181.785   19.989  190.391   12.357 -8.605377 23.49975 
1 1 1   18   10   19 o  350.944   6.7853   94.316   3.6448   97.040   4.6814   90.123   5.8079  355.910   8.5935  342.879   11.066 13.03043 14.01122 
1 1 1   18   10   20 o  370.894   9.3344  105.412   5.2992  104.741   7.0963  106.257   7.9673  369.525   12.546  372.086   13.989 -2.561157 18.79144 
1 1 1   18   10   21 o  549.993   6.1773  231.640   5.2003  249.682   8.5966  221.227   6.5307  570.748   9.8404  537.384   7.9397 33.36365 12.64407 
1 1 1   18   10   22 o  105.217   17.473   8.7410   2.7153   12.725   4.7109   6.7591   3.3227  126.068   25.293   91.812   23.535 34.25606 34.54871 
1 1 1   18   10   23 o  596.199   5.8103  272.203   5.3023  287.551   7.9804  260.073   7.0946  612.557   8.5116  582.604   7.9558 29.95276 11.65082 
1 1 1   18   10   24 o  148.065   12.043   16.938   2.7057   18.857   4.4200   15.787   3.4216  155.276   18.993  142.381   15.976 12.89528 24.81875 
1 1 1   18   10   25 o  341.854   6.8289   89.529   3.5733   99.246   5.6365   83.000   4.6203  359.698   10.238  329.018   9.1745 30.68036 13.74710 
1 1 1   18   10   26 o  153.955   12.536   18.327   2.9285   17.548   5.3030   18.669   3.5126  148.569   24.149  155.059   14.987 -6.490326 28.42183 
1 1 1   18   10   27 f   56.051   22.079   1.3892   2.7847  -3.2268   4.9095   3.5786   3.3813   55.989   25.599   71.735   25.039 -15.74641 35.80895 
1 1 1   18   10   28 o  352.189   6.9558   95.056   3.7497   98.614   5.9584   92.724   4.8249  358.369   10.862  347.676   9.0665 10.69321 14.14904 
1 1 1   18   10   29 o  193.794   8.4149   28.804   2.4961   31.590   5.1779   27.961   2.8489  201.598   16.937  190.613   9.7979 10.98457 19.56709 
1 1 1   18   10   30 f  589.059   5.9562  265.864   5.3703  297.130   11.707  257.531   6.0437  621.558   12.305  579.650   6.8119 41.90741 14.06457 
1 1 1   18   10   31 o   88.819   19.140   6.3451   2.5253   4.2843   5.0002   7.0506   2.9258   81.928   30.220   93.463   20.968 -11.53513 36.78227 
1 1 1   18   10   32 o  529.253   6.6484  214.732   5.3858  218.557   8.0133  211.582   7.2737  533.415   9.8147  524.979   9.0519 8.436890 13.35161 
1 1 1   18   10   33 o  370.647   6.3361  105.313   3.5946  112.194   6.6418  102.462   4.2748  381.865   11.363  365.459   7.6420 16.40643 13.69392 
1 1 1   18   10   34 o  227.899   9.2714   39.901   3.2341   38.632   5.7823   40.479   3.9014  222.595   17.102  229.352   11.114 -6.756805 20.39593 
1 1 1   18   10   35 o  349.517   6.6704   93.694   3.5685   94.360   6.7313   93.434   4.2086  349.796   12.572  348.882   7.8811 0.9143982 14.83825 
1 1 1   18   10   36 o  224.936   10.585   38.950   3.6443   29.589   6.1639   43.981   4.5187  193.287   21.181  238.442   12.424 -45.15443 24.55609 
1 1 1   18   10   37 o   44.459   19.958  -1.2358   2.8237   0.8481   8.1371  -1.5211   3.0108   83.793   35.802   45.187   20.417 38.60593 41.21484 
1 1 1   18   10   38 o   56.668   21.904   1.7001   2.6990  -4.9518   7.2352   2.7753   2.9090   66.089   30.528   64.139   23.142 1.950050 38.30828 
1 1 1   18   10   39 o  301.287   7.9815   69.764   3.6807   77.878   8.1828   67.706   4.1212  315.552   17.005  296.627   9.0770 18.92523 19.27571 
1 1 1   18   10   40 o  197.895   10.533   30.288   3.1790   24.862   6.5468   31.962   3.6366  174.857   25.188  203.052   11.751 -28.19547 27.79422 
1 1 1   18   10   41 o  211.211   10.243   34.407   3.3115   40.131   7.3118   32.930   3.7142  224.221   21.571  206.034   11.827 18.18687 24.60073 
1 1 1   18   10   42 o  146.673   19.457   17.220   4.2603   24.947   10.201   15.588   4.6888  167.249   40.320  138.264   22.961 28.98550 46.39927 
1 1 1   18   10   43 o   50.607   23.416  -3.1573   4.2836  -6.9117   7.3050  -1.1897   5.2882   62.316   29.395   62.550   27.744 -0.2342453 40.41970 
1 1 1   18   10   44 o  208.251   13.613   33.873   4.3154   25.576   7.5473   37.904   5.2600  174.420   29.309  219.609   15.753 -45.18954 33.27453 
1 1 1   18   10   45 o  184.971   15.239   26.929   4.2760   29.667   7.7774   25.743   5.1191  188.545   27.782  179.494   18.917 9.051498 33.61131 
1 1 1   18   10   46 o  130.969   23.999   14.249   4.6337   3.3498   7.4489   21.128   5.9181   85.419   35.221  159.640   25.044 -74.22138 43.21692 
1 1 1   18   10   47 o  162.878   17.113   21.145   4.2026   22.502   5.0909   18.242   7.4463  166.743   20.371  143.096   34.418 23.64673 39.99435 
1 1 1   18   10   48 o   75.905   25.393   4.5881   3.4692   9.8405   4.6847  -1.7900   5.1623  106.618   28.253   59.420   26.802 47.19806 38.94304 
1 1 1   18   10   49 o   96.039   22.436   7.7782   3.2385   9.5912   5.1488   6.5915   4.1657  104.408   30.383   88.209   27.700 16.19897 41.11473 
1 1 1   18   10   50 o  130.828   16.608   13.790   3.2509   16.247   5.1063   12.116   4.2155  138.151   25.072  119.435   23.894 18.71564 34.63394 
1 1 1   18   10   51 o  148.978   14.162   17.648   3.1905   13.316   4.7830   21.120   4.2825  123.794   26.067  161.523   17.607 -37.72982 31.45601 
1 1 1   18   10   52 o   61.018   24.843   1.7544   3.6479   7.8459   6.5831  -0.9449   4.3823   94.987   34.730   55.879   24.989 39.10802 42.78621 
1 1 1   18   10   53 o   91.425   23.122   7.2767   3.2377   7.0373   4.6765   7.4972   4.4870   88.907   29.474   91.322   28.759 -2.415459 41.18014 
1 1 1   18   10   54 o  100.494   25.294   9.0634   3.8878   6.1074   5.8923   11.342   5.1737   85.068   32.495  109.769   29.957 -24.70179 44.19675 
1 1 1   18   10   55 o  134.990   17.745   15.157   3.5777   9.1200   5.4219   19.812   4.7614   96.973   31.716  152.332   20.977 -55.35908 38.02555 
1 1 1   18   10   56 o  104.090   22.917   9.6598   3.5524   1.3109   5.5381   15.496   4.6305   66.299   28.932  131.908   23.810 -65.60870 37.46960 
1 1 1   18   11    0 o  952.775   9.9059  695.248   14.443  695.248   14.443  695.248   14.443  952.775   9.9059  952.775   9.9059 0.000000 0.000000 
1 1 1   18   11    1 o  146.316   10.194   16.478   2.2688   16.828   4.7380   16.374   2.5843  146.410   21.808  145.719   11.685 0.6916351 24.74130 
1 1 1   18   11    2 o  430.758   6.4746  142.056   4.2689  140.087   4.9958  147.385   8.2177  427.733   7.6307  438.565   12.242 -10.83240 14.42538 
1 1 1   18   11    3 o  471.876   12.404  170.632   8.9590   0.0000   0.0000  170.632   8.9590  ?   ?   471.876   12.404 0.000000 12.40400 
1 1 1   18   11    4 o  396.166   6.6780  120.160   4.0494  120.668   4.7339  118.774   7.8180  396.975   7.7909  393.667   12.975 3.308136 15.13413 
1 1 1   18   11    5 o  393.478   6.7583  118.537   4.0703  115.754   4.6882  127.056   8.2026  388.804   7.8779  407.150   13.162 -18.34564 15.33966 
1 1 1   18   11    6 o  358.790   6.9828   98.561   3.8348   98.538   4.4105   98.633   7.7630  358.723   8.0326  358.685   14.140 0.3854370E-01 16.26217 
1 1 1   18   11    7 o  288.092   7.2580   63.549   3.2005   63.549   3.2005   0.0000   0.0000  288.092   7.2580  ?   ?  0.000000 7.257991 
1 1 1   18   11    8 o  311.867   6.3823   74.463   3.0466   72.819   3.3235   83.114   7.6238  308.393   7.0409  329.206   15.130 -20.81332 16.68790 
1 1 1   18   11    9 o  306.905   6.4141   72.113   3.0131   72.505   3.2465   69.674   8.0923  307.730   6.8925  300.781   17.655 6.948486 18.95232 
1 1 1   18   11   10 o  240.329   5.4530   44.215   2.0059   44.773   2.0801   36.818   7.5781  241.836   5.6195  217.581   23.108 24.25508 23.78176 
1 1 1   18   11   11 o  164.726   6.6704   20.775   1.6818   20.792   1.7281   20.470   7.3183  164.791   6.8511  160.145   30.976 4.646332 31.72446 
1 1 1   18   11   12 o  855.300   7.0529  560.135   9.2333  559.064   10.510  563.754   19.327  854.419   8.0367  857.343   14.728 -2.924133 16.77765 
1 1 1   18   11   13 o  306.112   6.8448   71.748   3.2071   72.835   3.4782   65.580   8.2854  308.410   7.3681  291.613   18.660 16.79715 20.06244 
1 1 1   18   11   14 o   97.204   17.112   7.4671   2.4530   8.1410   2.6275   2.8941   6.8445  101.535   17.541   86.107   34.393 15.42790 38.60765 
1 1 1   18   11   15 o  498.231   6.4390  190.066   4.9104  193.267   5.4804  177.032   11.058  502.383   7.1270  480.344   15.040 22.03851 16.64313 
1 1 1   18   11   16 o  407.887   6.8267  127.397   4.2620  131.700   4.7386  109.174   9.7514  414.696   7.4654  377.055   16.896 37.64087 18.47210 
1 1 1   18   11   17 o  445.406   8.8417  151.978   6.0278  151.404   7.2890  153.221   10.721  444.461   10.714  446.752   15.679 -2.290405 18.98997 
1 1 1   18   11   18 o  512.592   6.0555  201.186   4.7511  201.669   5.9811  200.362   7.8210  513.132   7.6153  511.323   9.9931 1.809387 12.56397 
1 1 1   18   11   19 o  295.389   8.7531   66.851   3.9576   65.616   4.7883   69.514   7.0304  292.568   10.693  300.482   15.337 -7.913330 18.69644 
1 1 1   18   11   20 o  603.673   6.8585  279.101   6.3373  294.077   8.9262  263.881   8.9988  619.456   9.4143  586.738   10.020 32.71753 13.74881 
1 1 1   18   11   21 o  797.747   6.4053  487.384   7.8212  507.728   12.376  473.856   10.092  813.828   9.9349  786.402   8.3844 27.42584 13.00002 
1 1 1   18   11   22 o  331.727   6.6392   84.285   3.3711   87.144   4.9416   81.796   4.6105  337.160   9.5754  326.670   9.2208 10.49014 13.29332 
1 1 1   18   11   23 o  219.026   8.5767   36.768   2.8753   34.040   4.2779   39.015   3.8833  210.106   13.372  225.503   11.251 -15.39662 17.47509 
1 1 1   18   11   24 o  337.533   6.7015   87.275   3.4622   88.810   5.1647   86.023   4.6659  340.292   9.9156  334.967   9.1005 5.324982 13.45882 
1 1 1   18   11   25 o   38.344   17.746  -2.0638   2.4619  -3.4100   3.9944  -1.2391   3.1263   48.566   22.521   47.537   21.193 1.029274 30.92522 
1 1 1   18   11   26 o  207.552   9.5163   33.043   3.0232   30.058   4.9003   34.878   3.8413  196.841   16.414  212.777   11.842 -15.93588 20.23976 
1 1 1   18   11   27 o  294.591   7.4792   66.519   3.3724   58.619   5.0251   72.992   4.5490  276.224   11.885  308.438   9.6356 -32.21426 15.30055 
1 1 1   18   11   28 o  157.732   11.762   19.223   2.8192   12.931   4.5767   23.071   3.5787  126.817   24.464  172.619   13.656 -45.80205 28.01771 
1 1 1   18   11   29 o  164.731   11.707   20.962   2.9327   15.574   4.7787   24.218   3.7145  139.706   23.158  176.819   13.835 -37.11343 26.97610 
1 1 1   18   11   30 o  202.642   13.596   31.765   4.1927   34.758   7.8868   30.586   4.9502  209.471   25.098  198.332   16.455 11.13817 30.01139 
1 1 1   18   11   31 o  111.730   14.718   9.7925   2.4558   12.108   5.0473   9.0741   2.8110  121.754   27.707  106.882   17.809 14.87182 32.93694 
1 1 1   18   11   32 o  284.123   7.3961   61.916   3.2165   54.610   5.7082   65.314   3.8934  265.710   14.086  291.693   8.7204 -25.98334 16.56660 
1 1 1   18   11   33 o  331.660   7.2350   84.373   3.6728   88.736   6.2752   82.100   4.5298  339.444   12.078  326.954   9.0516 12.49048 15.09317 
1 1 1   18   11   34 o  427.163   6.6262  139.932   4.3324  141.393   7.2155  139.108   5.4177  428.619   10.998  425.654   8.3155 2.964783 13.78798 
1 1 1   18   11   35 f  252.367   8.3215   48.913   3.2144   45.780   8.5780   49.425   3.4670  240.139   23.644  253.616   8.9313 -13.47740 25.27471 
1 1 1   18   11   36 o  246.177   10.975   46.686   4.1353   57.529   8.9050   43.705   4.6693  269.899   21.740  237.553   12.890 32.34555 25.27412 
1 1 1   18   11   37 o  298.664   7.5248   68.496   3.4399   73.010   7.3954   67.250   3.8859  306.196   15.834  295.785   8.5831 10.41089 18.01040 
1 1 1   18   11   38 o  265.947   8.5837   54.385   3.4941   45.260   8.2603   56.373   3.8561  238.206   22.939  270.653   9.3082 -32.44656 24.75561 
1 1 1   18   11   39 o   42.297   19.136  -1.3720   2.6547  -0.9946   5.6680  -1.4781   3.0047   65.793   28.974   45.171   20.404 20.62206 35.43794 
1 1 1   18   11   40 o  107.597   17.904   9.2878   2.8451   7.6431   6.0958   9.7459   3.2170   98.473   33.657  109.744   19.883 -11.27121 39.09109 
1 1 1   18   11   41 o  239.681   9.3847   44.260   3.4429   44.852   7.0266   44.073   3.9495  237.950   19.463  238.915   10.800 -0.9655457 22.25855 
1 1 1   18   11   42 o   93.792   27.595   7.3037   4.2264   13.606   10.594   6.1108   4.6091  126.126   44.304   87.810   29.268 38.31687 53.09842 
1 1 1   18   11   43 o   94.988   27.653   7.5389   4.2643   11.221   7.0798   5.4425   5.3420  114.292   36.140   86.319   31.327 27.97292 47.82767 
1 1 1   18   11   44 o   59.966   26.247  -0.5054   4.5883   0.0000   0.0000  -0.5054   4.5883  ?   ?    59.966   26.247 0.000000 26.24664 
1 1 1   18   11   45 o   83.168   28.821   5.3684   4.4758   7.2073   7.6841   4.4241   5.5063   98.744   37.254   82.129   31.403 16.61515 48.72353 
1 1 1   18   11   46 o  120.774   28.919   12.548   5.2752   9.8373   7.5551   15.127   7.3689  107.775   37.439  129.914   35.875 -22.13885 51.85265 
1 1 1   18   11   47 o   73.329   27.684   3.5861   4.2452  -6.8256   7.4412   8.6098   5.1688   62.414   29.510  100.078   30.762 -37.66435 42.62794 
1 1 1   18   11   48 o  164.406   18.122   21.722   4.4846   19.107   7.7621   23.032   5.4944  145.088   35.291  167.557   21.951 -22.46939 41.56107 
1 1 1   18   11   49 o   87.038   25.422   6.4511   3.5986  -0.6709   8.0811   8.2128   4.0191   76.282   34.037   97.526   26.315 -21.24364 43.02322 
1 1 1   18   11   50 o   50.152   22.053  -0.4367   3.2725   2.5049   5.9257  -1.7275   3.9254   75.004   31.211   50.874   23.116 24.13007 38.83911 
1 1 1   18   11   51 o  102.341   22.851   8.9577   3.4890   19.502   6.8407   5.2502   4.0563  146.706   31.411   79.791   27.449 66.91479 41.71451 
1 1 1   18   11   52 o   84.514   24.866   6.2042   3.4318   7.1916   5.7989   5.6721   4.2574   91.105   32.697   81.930   28.125 9.175415 43.12881 
1 1 1   18   11   53 o   61.593   24.405   2.2514   3.4211   2.6764   5.7599   2.0198   4.2524   73.171   30.636   64.579   26.618 8.592140 40.58443 
1 1 1   18   11   54 f   52.022   23.981  -2.1676   4.4306   0.0130   11.620  -2.5386   4.7927   83.928   38.740   53.368   24.720 30.55988 45.95522 
1 1 1   18   11   55 o  157.671   16.065   20.364   3.8229   14.915   6.7699   22.914   4.6321  120.499   34.775  165.554   18.602 -45.05457 39.43748 
1 1 1   18   12    0 o  853.080   13.563  557.825   17.700  557.825   17.700  557.825   17.700  853.080   13.563  853.080   13.563 0.000000 0.000000 
1 1 1   18   12    1 o  207.881   7.1243   33.087   2.2669   33.733   3.2409   32.469   3.1719  209.851   10.090  205.884   10.065 3.966522 14.25181 
1 1 1   18   12    2 o  252.537   8.1568   48.836   3.1529   48.011   3.5736   51.736   6.6985  250.372   9.3249  259.120   16.983 -8.747925 19.37477 
1 1 1   18   12    3 o  515.493   6.6625  203.449   5.2569  202.511   6.1728  205.926   10.029  514.264   7.8420  518.355   12.640 -4.091187 14.87542 
1 1 1   18   12    4 o  435.017   6.8236  144.888   4.5435  141.855   5.2212  154.350   9.2219  430.409   7.9253  448.728   13.427 -18.31949 15.59119 
1 1 1   18   12    5 o  467.254   6.8142  167.158   4.8734  168.891   5.6422  162.068   9.6712  469.637   7.8490  459.788   13.742 9.849609 15.82571 
1 1 1   18   12    6 o  694.248   8.4901  369.110   9.0219  369.110   9.0219   0.0000   0.0000  694.248   8.4901  ?   ?  0.000000 8.490088 
1 1 1   18   12    7 o   62.315   20.288   2.8728   2.2195   3.1502   2.3486   0.5565   6.7866   64.909   20.846   78.626   33.105 -13.71746 39.12212 
1 1 1   18   12    8 o  437.949   6.0601  146.838   4.0623  146.034   4.4768  150.585   9.6669  436.732   6.6970  443.152   14.252 -6.420349 15.74670 
1 1 1   18   12    9 o  729.606   6.5132  407.563   7.2737  407.322   8.1918  408.463   15.813  729.349   7.3379  729.851   14.155 -0.5020142 15.94361 
1 1 1   18   12   10 o   67.964   18.829   3.6526   2.0262   4.3617   2.1153  -4.2399   7.0569   73.940   18.683   68.234   31.001 5.706154 36.19524 
1 1 1   18   12   11 o  411.450   5.1528  129.596   3.2451  129.905   3.4440  127.150   9.6904  411.933   5.4621  407.100   15.551 4.833069 16.48281 
1 1 1   18   12   12 o  926.166   7.3218  656.847   10.380  658.699   11.844  650.717   21.548  927.392   8.3440  920.955   15.286 6.437073 17.41495 
1 1 1   18   12   13 o  389.256   7.0437  116.024   4.1967  114.929   4.6663  120.657   9.5989  387.388   7.8697  396.513   15.816 -9.125000 17.66564 
1 1 1   18   12   14 o  633.132   6.6099  306.935   6.4056  304.670   7.1439  316.229   14.469  630.751   7.3996  642.007   14.724 -11.25586 16.47863 
1 1 1   18   12   15 o  182.781   10.875   25.695   3.0286   27.275   3.2302   14.212   8.7095  188.303   11.259  133.960   39.668 54.34238 41.23524 
1 1 1   18   12   16 f  286.184   14.618   63.015   6.3821   60.074   8.7711   66.323   9.3037  278.649   20.713  292.833   20.894 -14.18381 29.42100 
1 1 1   18   12   17 o  587.508   7.6211  264.370   6.8533  262.734   7.8967  269.360   13.795  585.610   8.8098  592.326   15.216 -6.715820 17.58224 
1 1 1   18   12   18 o  283.797   7.2519   61.686   3.1501   61.188   3.8451   62.703   5.4935  282.594   8.8895  285.907   12.553 -3.313538 15.38190 
1 1 1   18   12   19 o  1050.76   8.0789  845.841   12.993  861.014   15.230  805.256   24.908  1059.95   9.3873  1023.73   15.896 36.21613 18.46054 
1 1 1   18   12   20 o   70.002   20.099   3.8611   2.2668   3.3779   3.1228   4.3991   3.2955   69.590   24.076   76.526   24.706 -6.936325 34.49674 
1 1 1   18   12   21 o  426.655   5.8255  139.400   3.8044  142.507   5.3363  136.189   5.4251  431.260   8.0841  421.571   8.4075 9.688904 11.66360 
1 1 1   18   12   22 o  719.870   5.8643  396.865   6.4616  410.175   9.3079  384.483   8.9773  731.592   8.3121  708.313   8.2804 23.27893 11.73271 
1 1 1   18   12   23 o  623.575   5.7373  297.797   5.4761  307.688   7.8776  288.549   7.6176  633.622   8.1226  613.601   8.1108 20.02130 11.47871 
1 1 1   18   12   24 o  167.707   10.416   21.661   2.6604   22.612   3.9185   20.849   3.6235  170.777   15.148  164.012   14.586 6.764587 21.02910 
1 1 1   18   12   25 o  225.602   8.3184   39.019   2.8724   40.578   4.2124   37.664   3.9271  229.538   12.032  221.166   11.642 8.372696 16.74173 
1 1 1   18   12   26 o  327.886   7.1699   82.392   3.5984   74.053   5.4826   88.702   4.7693  310.511   11.536  340.061   9.1629 -29.54996 14.73187 
1 1 1   18   12   27 o  277.289   7.5541   58.942   3.2062   57.483   4.7866   60.129   4.3180  273.546   11.432  279.887   10.079 -6.340668 15.24082 
1 1 1   18   12   28 o  380.441   7.3364  110.954   4.2721  108.223   5.6769  114.520   6.4872  375.475   9.8777  386.108   10.977 -10.63263 14.76684 
1 1 1   18   12   29 o  434.345   7.1531  144.628   4.7555  153.708   6.4775  134.011   7.0040  447.487   9.4571  417.620   10.957 29.86783 14.47396 
1 1 1   18   12   30 o  249.368   9.7354   47.753   3.7159   47.346   7.7199   47.876   4.2393  246.005   20.694  249.562   11.098 -3.556290 23.48238 
1 1 1   18   12   31 o  125.622   16.773   12.418   3.1446   8.6182   4.8018   15.271   4.1610  103.007   29.146  138.788   20.179 -35.78143 35.44975 
1 1 1   18   12   32 o  542.651   6.3921  225.748   5.3092  234.390   8.0697  219.152   7.0499  552.361   9.5448  534.291   8.6206 18.06940 12.86150 
1 1 1   18   12   33 o  220.149   11.664   37.422   3.9163   38.945   5.3556   35.670   5.7416  223.803   15.734  213.680   17.715 10.12378 23.69323 
1 1 1   18   12   34 o   77.445   25.057   4.6200   3.3885   17.252   7.7592   1.6432   3.7666  143.087   35.579   63.503   25.461 79.58441 43.75029 
1 1 1   18   12   35 o  206.243   10.637   32.834   3.3464   45.128   5.7446   26.520   4.1170  240.779   15.673  184.534   14.698 56.24536 21.48632 
1 1 1   18   12   36 o  420.389   7.6154  135.702   4.9002  144.854   8.2553  130.723   6.0889  433.135   12.452  412.191   9.6509 20.94366 15.75418 
1 1 1   18   12   37 o  210.286   9.1180   34.017   2.9348   26.071   6.3359   36.187   3.3115  180.137   23.542  216.782   9.9799 -36.64462 25.57043 
1 1 1   18   12   38 o  251.848   8.4510   48.771   3.2577   47.511   7.2031   49.094   3.6527  245.449   19.329  252.534   9.4497 -7.085632 21.51550 
1 1 1   18   12   39 o  104.727   17.715   8.7968   2.7385   12.232   6.0021   7.8936   3.0775  120.071   32.057   98.289   21.088 21.78185 38.37106 
1 1 1   18   12   40 o  149.890   12.771   17.522   2.9021   17.426   6.3149   17.548   3.2675  144.033   29.633  149.614   14.448 -5.580475 32.96750 
1 1 1   18   12   41 o  190.059   11.121   28.004   3.2212   29.594   7.0814   27.589   3.6171  190.749   24.844  188.294   12.623 2.454712 27.86691 
1 1 1   18   12   42 o   70.149   27.347   2.7330   4.2350   3.3514   10.693   2.6179   4.6121   97.779   41.383   71.519   28.337 26.26033 50.15505 
1 1 1   18   12   43 o  123.826   22.448   12.581   4.0980   12.777   6.8871   12.474   5.0988  120.995   35.120  121.373   28.014 -0.3780823 44.92430 
1 1 1   18   12   44 o  147.154   20.475   17.507   4.4868   16.893   7.2405   17.890   5.7168  138.625   34.309  146.307   26.504 -7.682053 43.35373 
1 1 1   18   12   45 o  229.721   13.005   41.188   4.5540   38.024   7.9452   42.735   5.5575  215.434   24.532  232.998   15.674 -17.56464 29.11229 
1 1 1   18   12   46 o  336.468   12.206   87.998   6.2860   94.672   8.7918   81.019   8.9909  346.751   16.565  319.211   18.481 27.54047 24.81808 
1 1 1   18   12   47 o   95.329   28.033   7.7683   4.3627   5.9312   7.7193   8.6305   5.2883   93.464   36.778  100.054   31.175 -6.590683 48.21339 
1 1 1   18   12   48 o  159.251   15.239   20.131   3.6691   17.950   7.3054   20.867   4.2431  140.845   34.224  161.275   17.468 -20.43039 38.42386 
1 1 1   18   12   49 o   58.029   24.229   1.0025   3.5886  -9.5499   7.5915   4.0390   4.0723   58.471   28.220   74.183   27.287 -15.71215 39.25446 
1 1 1   18   12   50 o  167.996   14.519   22.427   3.6968   14.322   7.3561   25.166   4.2760  122.828   36.475  177.382   15.919 -54.55386 39.79784 
1 1 1   18   12   51 o   52.041   22.597  -0.0050   3.3430   1.7579   5.9527  -0.8171   4.0403   72.200   30.730   54.108   24.110 18.09217 39.05936 
1 1 1   18   12   52 o  255.126   10.506   50.791   4.1028   46.734   7.4792   52.537   4.9069  237.465   20.787  258.498   12.402 -21.03336 24.20508 
1 1 1   18   12   53 o   65.105   25.897   2.6137   3.8659   7.0073   7.6980   1.1320   4.4705   91.421   36.488   62.206   26.557 29.21485 45.12889 
1 1 1   18   12   54 o   77.202   26.070   5.2080   3.6569   8.6869   5.8929   3.0293   4.6634   95.017   33.062   69.405   28.152 25.61220 43.42365 
1 1 1   18   12   55 o   63.894   25.051   2.8109   3.5694  -1.6205   6.2230   4.9837   4.3575   62.230   28.588   76.384   28.204 -14.15379 40.15911 
1 1 1   18   13    0 o  546.685   8.1313  228.947   6.8007  228.947   6.8007  228.947   6.8007  546.685   8.1313  546.685   8.1313 0.000000 0.000000 
1 1 1   18   13    1 o  614.101   6.9263  288.743   6.5105  286.269   7.7498  294.677   12.002  611.406   8.2812  620.057   12.646 -8.650940 15.11605 
1 1 1   18   13    2 o  703.995   7.2051  379.480   7.7639  373.389   9.1691  394.910   14.594  698.252   8.5792  717.749   13.284 -19.49725 15.81341 
1 1 1   18   13    3 o  556.190   6.9278  236.855   5.8978  232.594   6.8592  248.936   11.552  551.119   8.1313  569.860   13.244 -18.74066 15.54053 
1 1 1   18   13    4 o  177.815   11.005   24.318   2.9804   24.781   3.3111   22.343   6.8424  179.411   12.128  168.119   27.544 11.29166 30.09650 
1 1 1   18   13    5 o  537.068   7.9417  220.882   6.5285  220.882   6.5285   0.0000   0.0000  537.068   7.9417  ?   ?  0.000000 7.941655 
1 1 1   18   13    6 o  972.320   8.4538  724.034   12.581  728.851   15.165  713.398   22.535  975.399   10.158  964.397   15.266 11.00177 18.33666 
1 1 1   18   13    7 o  272.584   7.9863   56.900   3.3321   57.752   3.6723   52.931   7.9267  274.600   8.7371  261.723   19.937 12.87686 21.76743 
1 1 1   18   13    8 o  356.344   7.3191   97.233   3.9920   98.132   4.4228   93.278   9.2733  357.968   8.0721  348.587   17.380 9.380981 19.16316 
1 1 1   18   13    9 o  464.185   7.0265  164.984   4.9923  162.657   5.5925  174.114   11.077  460.867   7.9279  476.410   15.190 -15.54260 17.13452 
1 1 1   18   13   10 o  677.390   7.4575  351.378   7.7322  360.185   9.1460  329.311   14.477  685.753   8.7135  655.245   14.434 30.50854 16.86041 
1 1 1   18   13   11 o  237.095   8.6900   43.057   3.1536   42.991   3.3949   43.472   8.5183  236.897   9.3625  236.417   23.867 0.4806671 25.63734 
1 1 1   18   13   12 o  981.314   11.122  738.019   16.706  750.857   23.750  725.445   23.504  989.124   15.687  972.224   15.795 16.90033 22.26112 
1 1 1   18   13   13 o  224.677   9.6271   38.676   3.3107   38.465   3.5713   39.962   8.8297  224.044   10.414  226.153   25.980 -2.108246 27.98924 
1 1 1   18   13   14 o  867.440   8.7869  576.417   11.667  570.074   14.113  590.107   20.733  862.454   10.691  876.797   15.449 -14.34241 18.78711 
1 1 1   18   13   15 o  142.796   19.586   15.973   4.1680   17.222   4.8313   12.339   8.2423  147.955   22.003  125.780   38.876 22.17514 44.67081 
1 1 1   18   13   16 o  407.970   7.6410  127.483   4.7714  128.222   5.3165  124.421   10.818  409.112   8.4901  402.338   17.566 6.774841 19.51003 
1 1 1   18   13   17 o  167.645   10.928   21.639   2.7888   21.792   2.9456   20.310   8.6630  168.187   11.512  158.273   36.505 9.914520 38.27669 
1 1 1   18   13   18 o  304.535   8.5772   71.060   3.9981   71.060   3.9981   0.0000   0.0000  304.535   8.5772  ?   ?  0.000000 8.577234 
1 1 1   18   13   19 o  334.619   7.3880   85.773   3.7840   85.188   4.2635   87.942   8.2130  333.433   8.3538  338.253   15.863 -4.819458 17.92831 
1 1 1   18   13   20 o  533.484   6.2445  217.968   5.0991  214.687   6.2761  224.341   8.7459  529.350   7.7460  540.865   10.564 -11.51459 13.09997 
1 1 1   18   13   21 o  669.186   6.3824  342.992   6.5373  339.865   8.1586  348.600   10.927  665.975   8.0036  674.159   10.589 -8.184143 13.27355 
1 1 1   18   13   22 f  434.452   5.9062  144.559   3.9275  150.178   5.4970  138.700   5.6135  442.669   8.1130  425.377   8.6216 17.29166 11.83861 
1 1 1   18   13   23 o  252.226   7.4981   48.750   2.8948   52.255   4.1417   45.403   4.0475  260.981   10.368  243.241   10.871 17.74045 15.02281 
1 1 1   18   13   24 o  213.101   8.2933   34.813   2.7051   37.012   3.9384   32.850   3.7219  219.224   11.780  206.489   11.825 12.73537 16.69176 
1 1 1   18   13   25 o  176.675   10.174   24.033   2.7398   27.159   4.2903   21.881   3.5603  187.218   15.100  168.080   13.965 19.13780 20.56785 
1 1 1   18   13   26 o  383.374   7.5184  112.664   4.4118  105.096   5.9885  121.648   6.5243  369.980   10.575  398.034   10.709 -28.05380 15.05008 
1 1 1   18   13   27 f  457.736   6.7586  160.575   4.7352  163.934   6.2350  155.998   7.2789  462.272   8.8118  450.711   10.551 11.56000 13.74677 
1 1 1   18   13   28 o  303.853   7.3289   70.784   3.4086   71.039   5.0215   70.565   4.6417  304.089   10.789  303.153   10.003 0.9353943 14.71270 
1 1 1   18   13   29 o  261.783   9.2940   52.607   3.7240   62.365   7.6007   49.525   4.2719  283.387   17.610  253.843   10.995 29.54384 20.76039 
1 1 1   18   13   30 o  104.351   17.444   8.6497   2.6878   11.153   4.3025   7.0473   3.4422  117.259   24.749   93.204   23.988 24.05537 34.46643 
1 1 1   18   13   31 o  386.296   7.2668  114.450   4.2967  121.793   6.1812  107.585   5.9768  398.088   10.144  374.103   10.438 23.98489 14.55529 
1 1 1   18   13   32 o  393.208   9.5871  118.806   5.7700  132.013   9.4559  110.972   7.2831  413.298   14.948  379.480   12.539 33.81793 19.51038 
1 1 1   18   13   33 o  219.846   11.263   37.308   3.7773   27.056   8.2106   40.061   4.2542  181.867   30.580  227.657   12.254 -45.78970 32.94401 
1 1 1   18   13   34 o  122.712   16.278   11.876   2.9820   16.018   4.9493   9.5159   3.7363  140.866   23.803  108.050   23.278 32.81519 33.29334 
1 1 1   18   13   35 f   54.263   22.329   0.8108   2.9865  -1.3068   5.3987   1.7446   3.5851   63.638   28.138   62.700   24.939 0.9377174 37.59965 
1 1 1   18   13   36 o  144.367   14.369   16.302   3.1330   19.635   5.1909   14.392   3.9293  156.426   22.313  134.249   19.709 22.17654 29.77065 
1 1 1   18   13   37 o   48.263   21.265  -0.7391   3.0568  -4.2352   5.6849   0.6829   3.6255   58.177   26.939   58.205   24.333 -0.2817917E-01 36.30125 
1 1 1   18   13   38 o   76.872   23.980   4.6938   3.1279   3.0011   5.1398   5.6894   3.9418   76.048   29.983   84.588   26.990 -8.539841 40.34172 
1 1 1   18   13   39 o  103.910   17.449   8.6571   2.6768   2.2237   5.3462   10.809   3.0923   73.994   30.095  116.250   17.958 -42.25607 35.04537 
1 1 1   18   13   40 o   81.293   22.199   5.4179   2.8401  -2.1135   5.7438   7.8551   3.2675   63.128   28.391   97.645   22.345 -34.51710 36.13008 
1 1 1   18   13   41 o  102.639   18.873   8.5325   2.8556   6.9434   6.1744   8.9649   3.2208   95.186   33.784  104.734   20.825 -9.548477 39.68642 
1 1 1   18   13   42 o  261.330   13.389   53.194   5.3375   70.468   12.119   49.037   5.9451  293.265   27.312  250.097   15.608 43.16801 31.45767 
1 1 1   18   13   43 o  119.249   25.514   11.905   4.5162   10.559   7.2158   12.772   5.7907  111.235   36.599  121.744   30.994 -10.50889 47.95933 
1 1 1   18   13   44 o   49.345   22.751  -2.7151   3.9905  -1.8288   6.8494  -3.1706   4.9098   69.391   31.122   54.802   25.256 14.58901 40.08010 
1 1 1   18   13   45 o  162.125   21.930   21.417   5.3023   31.419   7.7826   12.753   7.2436  194.176   26.909  119.742   36.341 74.43388 45.21864 
1 1 1   18   13   46 o  122.149   23.979   12.483   4.3231   10.664   7.2884   13.471   5.3696  110.401   36.804  125.025   28.671 -14.62330 46.65366 
1 1 1   18   13   47 o   53.786   24.305  -1.7011   4.2678  -1.6579   7.7657  -1.7197   5.1084   73.374   33.005   59.234   26.695 14.13986 42.44884 
1 1 1   18   13   48 o  117.359   19.220   11.285   3.3331   17.715   6.7151   9.1828   3.8394  140.966   31.870  103.696   24.567 37.26923 40.24002 
1 1 1   18   13   49 o  135.676   18.192   14.969   3.6827   20.226   9.5238   14.045   3.9933  143.186   41.223  130.246   20.725 12.93994 46.14021 
1 1 1   18   13   50 o  129.734   18.198   13.754   3.5143   6.5912   6.4433   16.787   4.1929   90.520   34.122  142.808   19.707 -52.28839 39.40431 
1 1 1   18   13   51 o  174.781   13.382   24.204   3.5528   20.858   6.2521   25.800   4.3177  154.111   27.514  179.250   15.902 -25.13896 31.77918 
1 1 1   18   13   52 o  117.451   19.236   11.518   3.3383   7.9840   5.7635   13.302   4.0952   93.707   32.692  124.760   22.262 -31.05322 39.55156 
1 1 1   18   13   53 o  175.682   15.778   25.027   4.1976   19.344   7.9231   27.245   4.9493  137.714   36.860  181.840   18.019 -44.12648 41.02832 
1 1 1   18   13   54 o  185.725   12.882   27.532   3.6393   23.044   5.6558   30.704   4.7544  162.439   23.425  193.941   16.163 -31.50285 28.45989 
1 1 1   18   13   55 o   99.020   23.265   8.7938   3.4663   4.3988   5.5631   11.583   4.4317   76.336   30.823  111.900   26.316 -35.56457 40.52907 
1 1 1   18   14    0 o  564.181   8.2818  243.839   7.1483  243.839   7.1483  243.839   7.1483  564.181   8.2818  564.181   8.2818 0.000000 0.000000 
1 1 1   18   14    1 o  245.761   8.8730   46.260   3.3377   45.019   3.8132   50.324   6.9025  242.411   10.277  255.419   17.766 -13.00797 20.52442 
1 1 1   18   14    2 o  558.699   6.9430  239.002   5.9374  235.516   6.9841  248.089   11.276  554.556   8.2280  568.885   12.950 -14.32898 15.34249 
1 1 1   18   14    3 o  587.527   7.0338  264.307   6.3254  260.748   7.4292  273.689   12.061  583.500   8.3182  597.493   13.188 -13.99310 15.59186 
1 1 1   18   14    4 o  647.133   8.4381  320.729   8.3581  320.729   8.3581   0.0000   0.0000  647.133   8.4381  ?   ?  0.000000 8.438064 
1 1 1   18   14    5 o  312.019   7.8529   74.555   3.7504   71.868   4.1628   86.135   8.6427  306.319   8.8785  334.568   16.932 -28.24875 19.11878 
1 1 1   18   14    6 o  552.589   6.9892  233.811   5.9115  232.796   6.8168  236.890   11.871  551.341   8.0778  555.795   13.954 -4.453979 16.12365 
1 1 1   18   14    7 o  745.256   7.5353  425.315   8.5956  420.429   10.027  438.862   16.695  740.879   8.8417  756.428   14.420 -15.54895 16.91459 
1 1 1   18   14    8 o  818.625   6.9129  513.138   8.6620  513.144   9.8195  513.120   18.390  818.569   7.8372  817.868   14.690 0.7012939 16.64983 
1 1 1   18   14    9 o  305.039   7.0975   71.252   3.3138   70.344   3.5494   77.420   9.2505  303.076   7.6513  316.839   19.165 -13.76291 20.63570 
1 1 1   18   14   10 o  540.645   6.3779  223.804   5.2779  219.844   5.7893  243.290   12.843  535.813   7.0590  563.105   14.901 -27.29150 16.48814 
1 1 1   18   14   11 o  353.366   6.8374   95.616   3.6982   97.091   3.9951   86.784   9.7750  356.067   7.3304  335.477   19.116 20.59021 20.47294 
1 1 1   18   14   12 o  145.972   23.533   16.827   5.0792   16.263   6.4584   17.741   8.2234  142.290   30.566  148.143   36.502 -5.853378 47.60981 
1 1 1   18   14   13 o   51.019   23.074  -2.1429   3.8563  -4.9970   4.3882   7.5349   8.0805   48.192   22.748  106.986   38.575 -58.79391 44.78261 
1 1 1   18   14   14 o  458.069   6.5232  160.677   4.5736  163.149   5.0136  148.421   11.164  461.554   7.0968  439.550   16.594 22.00406 18.04757 
1 1 1   18   14   15 o  246.180   8.2225   46.427   3.0983   46.181   3.2846   48.413   9.3331  245.511   8.7406  249.205   24.797 -3.694458 26.29263 
1 1 1   18   14   16 f  443.764   6.7195  150.816   4.5642  151.784   4.9696  145.597   11.538  445.159   7.2934  435.166   17.322 9.993103 18.79454 
1 1 1   18   14   17 o  562.110   6.8031  241.999   5.8533  244.494   6.4915  231.149   13.537  564.954   7.5070  548.401   16.127 16.55328 17.78834 
1 1 1   18   14   18 o  240.685   9.3700   44.402   3.4519   44.402   3.4519   0.0000   0.0000  240.685   9.3700  ?   ?  0.000000 9.369999 
1 1 1   18   14   19 o  498.837   6.2259  190.578   4.7536  193.345   5.8921  185.419   8.0456  502.351   7.6628  491.691   10.690 10.66052 13.15313 
1 1 1   18   14   20 o  663.394   6.3317  337.079   6.4293  344.892   8.1940  324.563   10.371  670.880   7.9796  650.515   10.415 20.36444 13.12080 
1 1 1   18   14   21 o  402.734   6.5781  124.245   4.0550  125.138   4.9642  122.455   7.0294  404.086   8.0261  399.440   11.497 4.646393 14.02163 
1 1 1   18   14   22 o  503.275   6.3150  194.022   4.8646  192.085   6.0005  197.735   8.3089  500.634   7.8307  507.634   10.694 -7.000214 13.25412 
1 1 1   18   14   23 o  242.412   7.6117   45.037   2.8243   43.683   3.9240   46.492   4.0681  238.571   10.746  246.119   10.799 -7.547516 15.23448 
1 1 1   18   14   24 o  319.304   7.3104   78.139   3.5728   76.097   4.4738   81.732   5.9365  314.970   9.2798  326.184   11.890 -11.21436 15.08297 
1 1 1   18   14   25 o  537.825   7.0021  221.681   5.7642  219.933   7.7466  223.850   8.6282  535.394   9.4529  539.989   10.439 -4.595337 14.08314 
1 1 1   18   14   26 o  270.625   7.4291   56.144   3.0773   56.075   4.3416   56.214   4.3624  270.232   10.497  270.564   10.534 -0.3326721 14.87075 
1 1 1   18   14   27 o   84.612   19.385   5.7638   2.4566   2.8912   3.5135   8.5113   3.4362   68.425   25.314  102.679   22.486 -34.25356 33.85895 
1 1 1   18   14   28 o  511.936   6.0720  200.830   4.7579  201.659   6.8090  200.040   6.6512  512.649   8.6775  510.611   8.5102 2.037354 12.15409 
1 1 1   18   14   29 o  314.948   8.4971   76.118   4.0962   76.307   7.7728   76.046   4.8198  313.811   16.238  314.634   10.008 -0.8222656 19.07442 
1 1 1   18   14   30 o  102.739   18.946   8.4443   2.8696   10.814   4.2960   6.5347   3.8561  115.302   25.058   90.219   26.306 25.08328 36.33009 
1 1 1   18   14   31 o   82.523   27.514   5.1357   4.0731   7.2971   6.9401   4.0001   5.0305  100.664   35.808   80.529   30.191 20.13445 46.83690 
1 1 1   18   14   32 o  172.909   11.329   23.114   2.9816   20.718   4.6332   24.808   3.8955  162.120   19.033  178.628   14.369 -16.50755 23.84823 
1 1 1   18   14   33 o  363.858   7.4928  101.608   4.1730  105.809   6.8221   99.096   5.2749  370.481   12.031  359.009   9.5993 11.47226 15.39088 
1 1 1   18   14   34 o   53.535   21.793   0.9405   2.8064  -6.1958   4.7880   4.6755   3.4638   48.274   23.064   77.869   25.345 -29.59462 34.26789 
1 1 1   18   14   35 o   88.877   21.442   6.4482   2.8833   3.3239   4.6870   8.3503   3.6571   75.567   28.954  100.824   24.037 -25.25617 37.63119 
1 1 1   18   14   36 o  167.193   12.388   21.714   3.1478   16.220   4.8709   25.655   4.1248  141.516   23.298  181.217   15.006 -39.70085 27.71240 
1 1 1   18   14   37 o   40.196   18.908  -3.0856   2.9841  -7.7420   5.3629  -0.9973   3.5915   49.449   23.828   51.719   22.905 -2.270641 33.05199 
1 1 1   18   14   38 o   75.014   24.036   4.4135   3.1238   7.7551   5.4240   2.7552   3.8211   97.912   31.705   68.505   26.168 29.40704 41.10889 
1 1 1   18   14   39 o  301.323   9.0335   69.907   4.1664   76.726   6.7670   65.744   5.2874  314.336   14.065  291.584   11.847 22.75177 18.38929 
1 1 1   18   14   40 o  298.784   9.4301   68.795   4.3127   63.030   6.9601   72.388   5.4945  283.701   16.095  305.910   11.735 -22.20889 19.91825 
1 1 1   18   14   41 o   66.653   26.395   2.2152   3.9995   6.4061   10.399   1.4876   4.3327  104.397   42.146   65.512   26.919 38.88562 50.00956 
1 1 1   18   14   42 o   71.990   27.879   3.0245   4.3789   2.3264   6.2831   3.6837   6.1059   78.159   32.299   81.974   32.566 -3.814949 45.86634 
1 1 1   18   14   43 f  152.438   17.199   18.483   3.9428   17.238   6.6203   19.168   4.9082  141.387   31.408  153.722   21.444 -12.33530 38.03015 
1 1 1   18   14   44 o   54.527   24.953  -2.6174   4.6787  -2.0309   6.6394  -3.1959   6.5943   67.732   30.487   64.915   29.676 2.816887 42.54562 
1 1 1   18   14   45 o  101.933   25.662   8.8102   4.0012   9.7942   6.8182   8.2933   4.9416  106.771   35.598   98.623   30.035 8.147530 46.57540 
1 1 1   18   14   46 o   50.315   21.895  -0.2480   3.1522 -15.8783   7.1223   3.5594   3.5152   49.131   24.416   70.273   25.427 -21.14228 35.25159 
1 1 1   18   14   47 o   54.195   24.005  -0.7825   3.9459  -7.5899   6.5246   3.1431   4.9547   55.874   26.756   73.983   29.353 -18.10936 39.71770 
1 1 1   18   14   48 o  106.860   22.734   9.6447   3.6042   10.560   8.7965   9.4600   3.9510  109.113   40.108  104.973   24.956 4.139839 47.23866 
1 1 1   18   14   49 o  147.796   15.135   17.442   3.3756   14.998   6.2344   18.455   4.0150  128.432   31.866  150.951   17.714 -22.51869 36.45892 
1 1 1   18   14   50 o  228.459   11.407   40.770   3.9890   24.005   6.5580   50.615   5.0257  166.602   26.613  253.487   12.997 -86.88512 29.61682 
1 1 1   18   14   51 o  155.845   14.744   19.445   3.4752   13.126   6.1257   22.444   4.2200  118.068   32.749  166.472   16.791 -48.40464 36.80276 
1 1 1   18   14   52 o   46.967   21.396  -1.4801   3.3908   0.7054   5.5609  -2.7736   4.2781   66.229   28.944   49.837   23.177 16.39225 37.08001 
1 1 1   18   14   53 o   74.592   26.681   4.6622   3.8583  -5.4037   7.5841   8.1772   4.4816   62.141   29.501   93.742   28.615 -31.60073 41.09895 
1 1 1   18   14   54 o   51.992   22.459   0.3999   3.2686  -7.8005   5.1830   5.8147   4.2117   45.787   22.373   80.492   27.954 -34.70510 35.80468 
1 1 1   18   15    0 f  135.120   16.439   14.601   3.2657   14.601   3.2657   14.601   3.2657  135.120   16.439  135.120   16.439 0.000000 0.000000 
1 1 1   18   15    1 o  409.169   7.3160  128.201   4.5819  127.498   5.3765  130.068   8.7574  408.000   8.6093  411.832   13.893 -3.832214 16.34402 
1 1 1   18   15    2 o  778.942   7.6223  464.643   9.0879  466.051   10.961  461.544   16.256  780.012   9.1805  775.805   13.690 4.207642 16.48295 
1 1 1   18   15    4 o  491.935   7.0631  185.306   5.3183  183.826   6.1949  189.455   10.370  489.917   8.2612  497.044   13.631 -7.127014 15.93920 
1 1 1   18   15    5 o  850.486   7.9717  553.961   10.377  551.787   12.364  559.143   19.089  848.689   9.5179  853.749   14.607 -5.059570 17.43471 
1 1 1   18   15    6 o  325.897   7.9136   81.340   3.9475   81.758   4.4012   79.622   8.9266  326.705   8.8014  321.439   18.218 5.266235 20.23283 
1 1 1   18   15    7 o  164.784   12.032   20.926   3.0136   19.551   3.2643   28.865   7.8417  159.091   13.534  191.465   27.551 -32.37424 30.69610 
1 1 1   18   15    8 o  399.221   6.6348  122.037   4.0543  122.361   4.4120  120.280   10.279  399.732   7.2110  395.767   16.968 3.965240 18.43644 
1 1 1   18   15    9 f   59.867   21.192   2.3876   2.4281   2.3866   2.5504   2.3971   7.9353   60.561   21.689   89.674   36.590 -29.11321 42.53577 
1 1 1   18   15   10 o  648.409   6.5855  321.940   6.5359  323.996   7.3218  313.876   14.501  650.432   7.3544  639.527   14.814 10.90491 16.53912 
1 1 1   18   15   11 o  306.075   8.1418   71.759   3.8143   71.789   4.1510   71.594   9.6688  306.115   8.8592  304.280   20.887 1.835052 22.68781 
1 1 1   18   15   12 o  480.286   8.4733  176.713   6.2291  176.660   7.3992  176.844   11.542  480.116   10.069  479.887   15.713 0.2290649 18.66217 
1 1 1   18   15   13 o  399.344   9.0730  122.194   5.5459  121.218   6.4718  124.892   10.759  397.658   10.633  403.085   17.439 -5.427002 20.42482 
1 1 1   18   15   14 o  219.210   13.465   37.015   4.4960   33.769   5.0851   48.639   9.6229  209.044   16.014  249.600   25.548 -40.55595 30.15222 
1 1 1   18   15   15 o  114.045   25.098   10.442   4.2623   9.8932   4.7861   12.546   9.3703  110.875   28.151  128.107   41.685 -17.23167 50.30014 
1 1 1   18   15   16 o  423.511   6.8228  137.377   4.4228  137.341   4.7731  137.597   11.762  423.428   7.3647  422.828   18.174 0.5999451 19.60937 
1 1 1   18   15   17 o  123.728   14.453   11.919   2.6855   11.919   2.6855   0.0000   0.0000  123.728   14.453  ?   ?  0.000000 14.45280 
1 1 1   18   15   18 o  334.186   7.4187   85.561   3.7948   85.180   4.0590   88.205   10.692  333.415   7.9537  337.460   20.800 -4.045471 22.26911 
1 1 1   18   15   19 o   75.095   21.477   4.4599   2.5929   5.2365   2.6952  -5.1877   9.4992   80.907   21.425   79.405   36.034 1.502510 41.92253 
1 1 1   18   15   20 f  312.513   6.9995   74.824   3.3481   74.329   3.9732   76.039   6.2185  311.406   8.3358  314.635   12.912 -3.228302 15.36936 
1 1 1   18   15   21 o  387.092   6.6144  114.792   3.9190  116.159   4.7587  111.911   6.9086  389.299   7.9861  381.775   11.823 7.524200 14.26719 
1 1 1   18   15   22 o  320.016   8.0494   78.503   3.9428   78.556   4.2523   78.182   10.527  320.081   8.6795  317.012   21.828 3.068878 23.49052 
1 1 1   18   15   23 o  424.444   8.2805  138.126   5.3796  139.333   5.9779  132.986   12.336  426.206   9.1634  414.762   19.432 11.44470 21.48410 
1 1 1   18   15   24 o  619.852   6.2508  294.375   5.9305  292.366   8.8726  295.997   7.9734  617.300   9.3904  621.280   8.3846 -3.979553 12.58897 
1 1 1   18   15   25 o   79.729   22.335   5.0780   2.8345   6.7017   3.4677   1.8090   4.9203   91.178   24.377   71.500   28.947 19.67865 37.84370 
1 1 1   18   15   26 o  193.874   9.0514   28.842   2.6860   31.092   3.7671   26.516   3.8307  200.693   12.323  185.090   13.617 15.60263 18.36535 
1 1 1   18   15   27 o   84.872   19.264   5.8018   2.4453   8.2555   3.5456   3.5760   3.3770  100.943   23.404   71.510   25.020 29.43222 34.25958 
1 1 1   18   15   28 o  239.803   9.8989   44.170   3.6334   42.368   7.0357   44.825   4.2430  232.760   19.941  241.425   11.482 -8.664856 23.01030 
1 1 1   18   15   29 o  260.767   9.2670   52.219   3.6988   61.041   7.3745   49.254   4.2755  280.243   17.276  253.075   11.037 27.16838 20.50102 
1 1 1   18   15   30 o  183.275   17.145   26.247   4.7538   27.935   6.8695   24.696   6.5852  187.186   24.570  175.632   25.220 11.55377 35.20962 
1 1 1   18   15   31 o  160.024   11.963   19.834   2.9089   24.595   4.7652   17.007   3.6726  177.129   17.818  147.250   16.584 29.87985 24.34104 
1 1 1   18   15   32 o  194.986   10.439   29.336   3.1044   24.880   5.0189   32.097   3.9508  177.838   18.719  203.586   12.743 -25.74814 22.64466 
1 1 1   18   15   33 o  327.399   7.4253   82.274   3.7210   78.949   5.5373   85.012   5.0246  320.100   11.302  332.431   9.8748 -12.32999 15.00794 
1 1 1   18   15   34 o  198.836   10.339   30.524   3.1358   29.812   4.7606   31.069   4.1678  195.295   16.068  199.959   13.700 -4.664078 21.11586 
1 1 1   18   15   35 o  287.637   8.2167   63.582   3.6175   63.711   5.6225   63.490   4.7255  287.086   12.795  287.006   10.757 0.7949829E-01 16.71607 
1 1 1   18   15   36 o   71.182   22.890   3.9351   2.8309   6.3497   4.5936   2.4564   3.5947   89.582   29.188   65.955   25.336 23.62604 38.65071 
1 1 1   18   15   37 o  210.175   10.876   34.168   3.4870   30.241   5.7155   36.497   4.4009  195.419   19.363  216.673   13.335 -21.25395 23.51035 
1 1 1   18   15   38 f  105.271   20.517   9.0152   3.1872   13.519   5.3056   6.4721   3.9866  127.115   28.023   89.046   26.946 38.06907 38.87624 
1 1 1   18   15   39 o  150.952   15.125   17.910   3.4476   24.589   5.6789   14.011   4.3386  174.963   21.669  131.189   22.411 43.77344 31.17382 
1 1 1   18   15   40 o  122.125   20.878   12.110   3.7624   14.086   5.6770   10.562   5.0242  128.945   29.415  111.670   29.100 17.27480 41.37664 
1 1 1   18   15   41 o  212.601   16.104   35.543   5.2015   36.354   10.878   35.303   5.9224  204.827   36.011  210.973   18.528 -6.145935 40.49748 
1 1 1   18   15   42 o  105.114   24.566   9.2437   3.8814   20.743   6.2237   1.9246   4.9653  157.841   26.714   70.392   28.859 87.44855 39.32474 
1 1 1   18   15   43 o   95.234   26.707   7.6427   4.0506   5.0245   6.4953   9.3088   5.1815   87.798   33.967  104.325   30.514 -16.52669 45.66093 
1 1 1   18   15   44 o   89.458   29.913   6.5090   4.8142   1.4803   6.2940   13.599   7.4734   75.068   31.759  123.292   36.800 -48.22414 48.60922 
1 1 1   18   15   45 o  134.256   20.850   14.735   4.1456  -0.0199   6.6163   24.271   5.3192   72.148   31.550  173.139   20.467 -100.9910 37.60708 
1 1 1   18   15   46 o  148.834   18.716   17.890   4.1695   19.505   6.9820   16.995   5.1981  148.954   31.602  142.331   24.759 6.622223 40.14646 
1 1 1   18   15   47 o  122.160   23.594   12.571   4.2520   14.744   7.2203   11.418   5.2610  126.459   35.725  113.707   29.849 12.75181 46.55422 
1 1 1   18   15   48 o  245.229   12.834   47.216   4.8005   48.613   7.6904   46.324   6.1446  243.954   20.794  240.761   16.779 3.192963 26.71934 
1 1 1   18   15   49 o  107.799   24.903   10.061   4.0263   13.270   6.2043   7.7260   5.2919  119.918   32.838   93.874   31.362 26.04329 45.40838 
1 1 1   18   15   50 o  146.474   15.309   17.218   3.3815   13.516   6.2147   18.775   4.0303  120.282   32.836  151.890   17.665 -31.60844 37.28598 
1 1 1   18   15   51 o  106.849   21.315   9.7386   3.3637  -0.3782   5.8770   14.667   4.1021   65.143   29.049  131.875   21.029 -66.73202 35.86176 
1 1 1   18   15   52 o  105.571   21.559   9.6162   3.3659   8.2024   5.7510   10.353   4.1511   93.655   32.657  107.353   25.619 -13.69846 41.50691 
1 1 1   18   15   53 o   65.970   25.844   3.0010   3.7966   0.6820   7.5294   3.7917   4.3964   72.868   32.659   71.508   27.867 1.360153 42.93232 
1 1 1   18   15   54 o   48.144   21.675  -0.8416   3.3582   0.6422   5.1804  -1.9171   4.4105   62.996   27.723   52.032   23.964 10.96349 36.64430 
1 1 1   18   16    0 o  503.931   12.844  194.914   9.8925  194.914   9.8925  194.914   9.8925  503.931   12.844  503.931   12.844 0.000000 0.000000 
1 1 1   18   16    1 o  541.527   8.4901  224.618   7.0373  224.618   7.0373   0.0000   0.0000  541.527   8.4901  ?   ?  0.000000 8.490118 
1 1 1   18   16    2 o  129.434   17.858   13.110   3.4437   13.110   3.4437   0.0000   0.0000  129.434   17.858  ?   ?  0.000000 17.85796 
1 1 1   18   16    3 o  248.173   9.2151   47.183   3.5004   48.363   4.0102   43.406   7.1744  251.222   10.429  236.762   19.984 14.46056 22.54155 
1 1 1   18   16    4 o  257.420   8.9998   50.763   3.5461   52.393   4.0411   45.307   7.3939  261.487   10.097  241.898   20.153 19.58887 22.54097 
1 1 1   18   16    5 o  414.980   7.4022  131.882   4.7017  131.652   5.3931  132.609   9.5982  414.574   8.4990  415.685   15.085 -1.110962 17.31479 
1 1 1   18   16    6 o  1022.51   8.8860  800.950   13.907  791.100   16.567  824.455   25.593  1015.99   10.653  1036.24   16.136 -20.25134 19.33543 
1 1 1   18   16    7 o  586.325   7.3628  263.279   6.6077  267.639   7.7244  251.383   12.759  591.089   8.5377  572.350   14.564 18.73956 16.88183 
1 1 1   18   16    8 o  242.105   8.4392   44.901   3.1273   45.651   3.3652   40.150   8.4694  244.102   9.0066  226.813   24.800 17.28915 26.38482 
1 1 1   18   16    9 o  299.836   7.5837   68.857   3.4804   69.397   3.7451   65.439   9.4254  300.991   8.1291  290.750   21.328 10.24161 22.82468 
1 1 1   18   16   10 o  340.908   8.1887   89.028   4.2729   89.341   4.7285   87.631   9.9766  341.473   9.0469  336.936   19.427 4.536194 21.43050 
1 1 1   18   16   11 o  140.027   14.128   15.202   2.9866   15.868   3.1798   10.212   8.7008  143.015   14.737  118.308   40.211 24.70683 42.82658 
1 1 1   18   16   12 o  862.814   8.7716  570.410   11.584  576.847   14.138  557.260   20.207  867.427   10.649  851.745   15.500 15.68195 18.80513 
1 1 1   18   16   13 o  266.478   11.716   54.466   4.7789   57.354   5.4457   44.790   9.9668  273.383   13.014  238.888   27.776 34.49469 30.67406 
1 1 1   18   16   14 o  521.196   8.5825  208.154   6.8467  204.501   7.9700  218.443   13.376  516.481   10.082  533.041   16.394 -16.56079 19.24610 
1 1 1   18   16   15 o  427.025   9.1068  139.762   5.9524  147.010   7.0251  121.315   11.208  437.852   10.482  396.938   18.447 40.91418 21.21691 
1 1 1   18   16   16 f  542.327   10.255  225.540   8.5128  225.540   8.5128   0.0000   0.0000  542.327   10.255  ?   ?  0.000000 10.25517 
1 1 1   18   16   17 o  174.187   10.390   23.353   2.7576   23.353   2.7576   0.0000   0.0000  174.187   10.390  ?   ?  0.000000 10.39025 
1 1 1   18   16   18 o  406.259   6.9258  126.441   4.3067  122.594   4.6057  153.221   12.152  399.994   7.5226  445.948   17.803 -45.95337 19.32671 
1 1 1   18   16   19 o  358.535   7.3146   98.498   4.0142   99.373   4.2806   92.111   11.559  360.098   7.7663  344.366   22.045 15.73209 23.37302 
1 1 1   18   16   20 o  458.051   7.0065  160.760   4.9123  157.030   5.3138  182.679   12.882  452.654   7.6695  486.830   17.288 -34.17599 18.91290 
1 1 1   18   16   21 o  246.192   8.0427   46.462   3.0307   47.267   3.5465   44.283   5.8356  248.245   9.3337  239.238   16.029 9.006927 18.54840 
1 1 1   18   16   22 f  584.911   7.7525  262.257   6.9406  273.446   10.039  252.014   9.6060  596.767   10.991  572.909   10.954 23.85736 15.51770 
1 1 1   18   16   23 o  449.013   6.6356  154.494   4.5605  155.003   5.5617  153.448   7.9672  449.615   8.0816  446.900   11.647 2.714600 14.17652 
1 1 1   18   16   24 o  108.591   17.095   9.3205   2.7475   9.7265   3.2551   8.3149   5.1234  110.415   19.997  102.067   30.471 8.347565 36.44635 
1 1 1   18   16   25 o  219.399   9.2966   36.943   3.1220   36.513   3.7297   37.948   5.7062  217.693   11.232  221.005   16.999 -3.312073 20.37421 
1 1 1   18   16   26 o  236.617   7.9313   42.942   2.8725   41.160   3.9567   44.928   4.1769  231.407   11.171  241.755   11.288 -10.34798 15.88091 
1 1 1   18   16   27 o  142.584   14.371   15.833   3.0936   15.152   6.3231   16.048   3.5472  135.733   31.102  143.169   16.488 -7.435638 35.20199 
1 1 1   18   16   28 o  446.756   8.7995  153.219   6.0172  154.723   9.0836  152.042   8.0324  448.077   13.245  444.494   11.806 3.583069 17.74266 
1 1 1   18   16   29 o  474.645   7.7847  172.859   5.6556  170.423   6.5445  180.044   11.240  471.072   9.0765  482.669   15.214 -11.59769 17.71540 
1 1 1   18   16   30 o  134.245   13.128   14.030   2.6630   15.311   4.1920   13.163   3.4481  138.759   20.341  129.027   17.945 9.732391 27.12582 
1 1 1   18   16   31 o  106.580   16.574   9.0099   2.6159   10.202   4.1322   8.2130   3.3792  111.708   24.813  100.451   22.533 11.25616 33.51714 
1 1 1   18   16   32 f   93.603   19.693   7.0875   2.7321   6.0991   4.1299   7.8567   3.6431   87.738   27.585   97.928   24.395 -10.19061 36.82478 
1 1 1   18   16   33 o  133.949   13.944   14.027   2.8170   18.232   4.3747   11.048   3.6820  151.627   19.286  116.954   21.355 34.67302 28.77509 
1 1 1   18   16   34 o  186.108   10.657   26.775   3.0231   32.215   4.6701   22.851   3.9663  203.229   15.121  170.930   15.323 32.29845 21.52776 
1 1 1   18   16   35 o  110.184   17.494   9.6916   2.8517   5.6959   4.2767   12.891   3.8266   85.461   28.179  126.627   20.439 -41.16658 34.81092 
1 1 1   18   16   36 o   96.868   20.481   7.6444   2.9418   4.2384   4.8520   9.6243   3.6993   80.018   29.719  108.328   23.020 -28.30974 37.59156 
1 1 1   18   16   37 o  216.397   10.266   36.106   3.4004   39.213   5.3901   34.052   4.3825  223.848   15.834  209.100   13.770 14.74776 20.98378 
1 1 1   18   16   38 o  205.762   11.272   32.804   3.5364   34.158   5.6126   31.913   4.5541  208.112   17.791  202.034   14.831 6.077759 23.16133 
1 1 1   18   16   39 o  138.906   18.759   15.425   3.8864   16.767   5.5744   14.156   5.4214  142.130   26.601  129.809   28.100 12.32101 38.69442 
1 1 1   18   16   40 o  222.707   11.475   38.473   3.8984   45.237   6.3861   34.455   4.9219  239.480   17.544  209.571   15.453 29.90857 23.37919 
1 1 1   18   16   41 o  240.206   13.569   45.012   4.9684   58.760   10.813   41.333   5.5938  267.669   26.752  229.279   16.041 38.38972 31.19216 
1 1 1   18   16   42 o  151.546   16.775   18.239   3.8260   14.346   5.9808   20.935   4.9777  129.022   30.725  161.059   20.669 -32.03752 37.03016 
1 1 1   18   16   43 o  119.457   26.470   12.070   4.7126   12.350   6.4157   11.742   6.9450  118.584   33.738  115.614   35.678 2.969986 49.10309 
1 1 1   18   16   44 o  158.629   16.819   20.032   4.0213   18.817   6.8558   20.669   4.9652  147.102   31.404  159.576   20.825 -12.47462 37.68147 
1 1 1   18   16   45 o  128.427   21.332   13.569   4.0461   12.705   6.3076   14.173   5.2743  119.436   33.269  128.573   27.624 -9.136932 43.24205 
1 1 1   18   16   46 o   74.513   27.122   4.0838   4.0083   5.1044   6.4860   3.4532   5.0985   86.668   33.827   75.756   29.864 10.91196 45.12407 
1 1 1   18   16   47 o  101.400   25.937   8.8934   4.0417   6.2381   6.0280   11.062   5.4475   89.206   33.126  111.257   30.892 -22.05059 45.29506 
1 1 1   18   16   48 o   56.278   24.878  -0.5677   4.2173  -9.1760   6.8430   4.7043   5.3552   54.791   26.528   80.804   30.952 -26.01332 40.76443 
1 1 1   18   16   49 o   87.131   27.450   6.5846   4.0873   5.0546   6.0346   7.8814   5.5556   83.620   32.632   94.522   32.132 -10.90172 45.79588 
1 1 1   18   16   50 o   75.892   26.975   4.6588   3.9377   9.0895   5.7628   0.7783   5.3931   99.299   32.709   66.285   28.741 33.01348 43.54191 
1 1 1   18   16   51 o   80.090   27.076   5.5511   3.9448   2.9964   5.6076   8.0539   5.5504   73.484   30.452   93.459   32.111 -19.97557 44.25394 
1 1 1   18   16   52 f   97.716   28.185   8.8751   4.4483   10.397   5.6731   6.4464   7.1674  103.392   32.302   87.835   35.155 15.55727 47.74191 
1 1 1   18   16   53 o  169.297   19.508   24.144   4.9625   27.690   7.7107   21.637   6.4838  171.002   30.582  152.389   28.854 18.61246 42.04541 
1 1 1   18   17    1 o  512.910   8.8544  201.543   6.9514  209.878   9.5360  192.090   10.155  523.193   11.908  500.420   13.257 22.77286 17.82011 
1 1 1   18   17    2 o  855.631   8.0661  560.770   10.564  548.429   12.585  590.201   19.435  846.000   9.7189  876.964   14.479 -30.96362 17.43836 
1 1 1   18   17    3 o  631.316   7.3216  305.241   7.0749  308.194   8.5092  298.630   12.734  634.264   8.7649  623.928   13.334 10.33679 15.95659 
1 1 1   18   17    4 o  179.182   12.422   24.740   3.3858   25.942   3.8340   20.480   7.2169  183.367   13.761  159.994   30.585 23.37231 33.53778 
1 1 1   18   17    5 o  257.450   9.2986   50.786   3.6642   47.991   4.1207   61.345   8.0096  250.216   10.759  281.836   18.673 -31.62015 21.55085 
1 1 1   18   17    6 o  189.739   11.586   27.706   3.3487   26.338   3.7300   33.392   7.6033  184.809   13.275  206.602   24.522 -21.79207 27.88465 
1 1 1   18   17    7 o  609.489   7.4497  284.523   6.9499  281.812   8.1065  292.042   13.500  606.488   8.7326  616.831   14.299 -10.34326 16.75485 
1 1 1   18   17    8 o  371.816   7.0447  105.880   4.0092  106.306   4.4024  103.810   9.7055  372.535   7.7206  367.491   17.255 5.044373 18.90308 
1 1 1   18   17    9 o  588.551   7.6570  265.336   6.8978  270.354   8.1116  252.231   13.109  593.995   8.9218  573.111   14.944 20.88354 17.40457 
1 1 1   18   17   10 o  326.168   8.3465   81.508   4.1669   78.982   4.6269   92.356   9.5868  321.024   9.4162  346.012   18.165 -24.98752 20.46052 
1 1 1   18   17   11 o  529.002   6.6806  214.326   5.4093  213.730   5.9570  217.125   12.915  528.224   7.3679  531.537   15.874 -3.312927 17.50080 
1 1 1   18   17   12 o  392.621   9.1475  118.144   5.4973  120.886   6.3395  109.833   11.038  397.065   10.431  377.161   19.183 19.90384 21.83551 
1 1 1   18   17   13 o  408.733   9.2322  128.052   5.7758  126.504   6.7216  132.421   11.292  406.139   10.813  414.788   17.786 -8.648376 20.81486 
1 1 1   18   17   14 o  632.759   15.213  307.759   14.734   0.0000   0.0000  307.759   14.734  ?   ?   632.759   15.213 0.000000 15.21299 
1 1 1   18   17   15 o  263.480   12.109   53.284   4.8832   57.051   5.5704   40.780   10.149  272.548   13.353  226.972   29.944 45.57556 32.78671 
1 1 1   18   17   16 o  502.879   10.346  193.972   7.9633  193.972   7.9633   0.0000   0.0000  502.879   10.346  ?   ?  0.000000 10.34571 
1 1 1   18   17   17 o  297.034   11.247   67.711   5.1134   64.727   5.8030   78.079   10.815  290.273   13.061  316.885   22.442 -26.61240 25.96636 
1 1 1   18   17   18 o  275.894   7.8800   58.338   3.3276   58.019   3.4962   61.411   10.847  275.116   8.3026  280.029   25.589 -4.913086 26.90257 
1 1 1   18   17   19 o  127.013   13.197   12.531   2.5281   12.384   2.6123   14.701   10.039  126.178   13.748  135.972   43.040 -9.793602 45.18266 
1 1 1   18   17   20 o  380.961   7.4502  111.232   4.3443  114.308   4.6811   92.139   11.663  386.155   7.9199  344.061   22.266 42.09387 23.63252 
1 1 1   18   17   21 o  556.281   7.7030  237.215   6.5588  245.503   9.3116  229.053   9.2400  565.474   10.758  546.152   11.053 19.32159 15.42442 
1 1 1   18   17   22 o  345.983   7.0354   91.744   3.7257   91.815   4.4475   91.578   6.8224  346.010   8.3976  345.075   12.917 0.9346008 15.40663 
1 1 1   18   17   23 o  254.004   8.6515   49.491   3.3636   49.937   4.0526   48.505   6.0302  255.015   10.382  250.292   15.822 4.722794 18.92411 
1 1 1   18   17   24 o  223.345   8.8528   38.275   3.0264   36.699   3.5263   42.679   5.8963  218.583   10.540  234.529   16.531 -15.94579 19.60535 
1 1 1   18   17   25 o  342.619   7.2381   90.004   3.7958   87.595   4.5223   95.747   6.9833  337.862   8.7447  352.674   12.936 -14.81250 15.61483 
1 1 1   18   17   26 o  103.478   25.197   8.7147   3.9536   12.618   6.1203   5.9190   5.1793  123.763   32.053   89.992   31.013 33.77134 44.60063 
1 1 1   18   17   27 o   41.109   19.891  -6.1525   3.8322  -9.5986   6.0623  -3.8588   4.9457   51.643   24.995   54.490   25.195 -2.846542 35.48985 
1 1 1   18   17   28 o  142.191   14.334   15.762   3.0770   15.734   3.7484   15.818   5.3882  141.390   17.709  139.661   26.167 1.729660 31.59630 
1 1 1   18   17   29 o   66.564   21.166   3.4055   2.4258   6.6930   3.6567   0.8218   3.2417   90.850   25.340   56.359   23.236 34.49102 34.38057 
1 1 1   18   17   30 f  191.978   9.4864   28.330   2.7875   25.995   4.1343   30.275   3.7745  182.727   14.912  197.751   12.535 -15.02438 19.48060 
1 1 1   18   17   31 o  164.543   10.876   20.937   2.7237   21.417   4.1424   20.572   3.6150  165.313   16.595  162.400   14.702 2.913406 22.17110 
1 1 1   18   17   32 o  193.463   9.8729   28.874   2.9138   29.824   4.2272   28.014   4.0220  195.808   14.201  189.800   13.942 6.008209 19.90094 
1 1 1   18   17   33 o  141.312   12.718   15.552   2.7214   15.665   4.0043   15.454   3.7099  140.336   19.141  139.738   17.745 0.5978546 26.10137 
1 1 1   18   17   34 o  301.829   7.9162   69.997   3.6572   64.940   5.3125   74.552   5.0421  289.987   11.969  311.011   10.592 -21.02435 15.98248 
1 1 1   18   17   35 o   76.085   22.230   4.6695   2.7514   6.9871   4.3865   3.1663   3.5327   92.644   28.315   69.257   25.424 23.38718 38.05408 
1 1 1   18   17   36 o  123.969   16.565   12.185   3.0645   8.6581   5.0138   14.289   3.8720  102.046   30.065  133.591   19.512 -31.54528 35.84121 
1 1 1   18   17   37 o   50.940   21.700   0.1393   2.9732   0.9727   4.8096  -0.3761   3.7824   66.610   27.948   55.181   23.998 11.42926 36.83744 
1 1 1   18   17   38 o  112.390   20.928   10.285   3.4677   9.6192   5.0823   10.865   4.7433  106.780   29.905  113.717   27.543 -6.937325 40.65649 
1 1 1   18   17   39 o   69.389   24.517   3.4696   3.2482   3.1786   5.1705   3.6593   4.1748   76.404   30.089   74.178   27.563 2.225563 40.80555 
1 1 1   18   17   40 o   83.474   26.693   5.6185   3.8540   18.003   9.8508   3.3802   4.1878  140.692   42.308   72.771   27.491 67.92085 50.45488 
1 1 1   18   17   41 o  128.926   20.462   13.491   3.9030   18.606   5.9180   9.5540   5.1922  149.189   26.906  105.789   30.433 43.39902 40.62120 
1 1 1   18   17   42 o  123.188   24.693   12.668   4.4938   17.896   5.8499   5.1422   7.0190  145.880   27.200   89.831   35.154 56.04881 44.44843 
1 1 1   18   17   43 o   69.662   25.877   3.2734   3.6791   4.9069   5.8586   2.2097   4.7276   84.986   32.417   69.907   28.349 15.07959 43.06394 
1 1 1   18   17   44 o  179.074   17.551   25.591   4.7488   4.7955   11.638   29.744   5.2014  101.203   43.019  193.064   17.802 -91.86070 46.55664 
1 1 1   18   17   45 f  140.124   19.499   15.964   4.0688   12.346   6.5515   18.235   5.1913  117.129   34.327  147.987   23.720 -30.85764 41.72496 
1 1 1   18   17   46 o   47.437   21.964  -2.6546   3.7781   3.0889   5.8502  -6.7638   4.9483   77.164   31.444   47.349   22.835 29.81485 38.86051 
1 1 1   18   17   47 o  114.579   24.305   11.227   4.1305   11.523   6.6665   11.042   5.2624  111.822   35.029  111.088   30.169 0.7337875 46.22993 
1 1 1   18   17   48 o   88.167   27.203   6.7400   4.0378   8.9527   5.9923   4.8999   5.4646   99.844   33.373   81.677   31.271 18.16653 45.73487 
1 1 1   18   17   49 o  103.609   26.213   9.4807   4.1602   11.059   6.2014   8.1893   5.6098  108.614   33.746   95.550   32.289 13.06344 46.70522 
1 1 1   18   17   50 o  151.103   18.569   18.827   4.2043   14.168   5.9788   23.384   5.9134  122.739   31.628  164.806   24.159 -42.06746 39.79900 
1 1 1   18   17   51 o   68.088   26.456   3.2368   3.9534   0.7963   5.6340   5.6040   5.5488   66.484   29.092   82.452   31.525 -15.96884 42.89698 
1 1 1   18   17   52 o   68.786   29.442   1.9450   5.5200  -3.8468   7.8369   7.6479   7.7765   65.408   30.727   91.830   36.666 -26.42224 47.83860 
1 1 1   18   18    0 o  273.166   16.611   57.853   6.8867   57.853   6.8867   57.853   6.8867  273.166   16.611  273.166   16.611 0.000000 0.000000 
1 1 1   18   18    1 f  439.552   9.4067  148.057   6.3288  149.927   8.8143  146.068   9.0927  442.053   13.027  436.277   13.616 5.776337 18.84423 
1 1 1   18   18    2 o  126.249   17.302   12.478   3.2554   14.431   3.7459   6.4507   6.5805  135.740   18.512   97.881   34.863 37.85942 39.47268 
1 1 1   18   18    3 o  778.099   9.7412  464.012   11.602  473.309   16.348  454.580   16.466  785.324   13.601  769.569   13.979 15.75494 19.50373 
1 1 1   18   18    4 o  293.608   11.068   66.098   4.9742   67.528   6.5708   64.178   7.6129  296.572   14.475  288.409   17.326 8.162018 22.57664 
1 1 1   18   18    5 o  425.758   9.7583  138.934   6.3593  139.950   8.4387  137.597   9.6742  427.077   12.909  423.287   14.932 3.789856 19.73834 
1 1 1   18   18    6 o  174.215   12.786   23.413   3.3857   25.141   3.8164   17.026   7.3363  180.437   13.926  145.023   33.693 35.41359 36.45735 
1 1 1   18   18    7 o  237.842   9.9058   43.362   3.6062   48.342   4.0731   25.298   7.7573  251.099   10.598  178.304   29.452 72.79504 31.30041 
1 1 1   18   18    8 o  479.270   7.7683  175.970   5.6987  175.036   6.6230  178.632   11.184  477.910   9.0540  482.201   15.153 -4.290192 17.65189 
1 1 1   18   18    9 o   97.467   19.100   7.5665   2.7475   7.4475   2.9129   8.5260   8.2703   96.511   20.359  110.809   39.124 -14.29764 44.10426 
1 1 1   18   18   10 o  186.414   10.453   26.730   2.9704   25.070   3.1774   38.239   8.3664  180.408   11.568  220.901   25.195 -40.49318 27.72348 
1 1 1   18   18   11 o  293.971   7.8728   66.213   3.5425   66.195   3.8188   66.323   9.4853  293.904   8.4889  292.394   21.341 1.509552 22.96760 
1 1 1   18   18   12 o  453.936   8.6498  157.926   6.0099  159.090   7.1418  155.103   11.125  455.473   10.244  449.053   16.185 6.420044 19.15491 
1 1 1   18   18   13 o  517.060   8.4907  204.904   6.7198  208.238   8.0102  196.984   12.346  521.099   10.043  506.047   15.939 15.05200 18.83929 
1 1 1   18   18   14 o  309.954   10.691   73.702   5.0721   80.018   5.8579   54.785   10.138  322.873   11.853  264.610   25.341 58.26373 27.97589 
1 1 1   18   18   15 o  172.173   18.838   23.130   4.8835   23.130   4.8835   0.0000   0.0000  172.173   18.838  ?   ?  0.000000 18.83819 
1 1 1   18   18   16 o  449.394   9.1913  154.861   6.3223  156.495   7.3896  150.397   12.213  451.604   10.690  441.640   18.066 9.964294 20.99225 
1 1 1   18   18   17 o  398.215   9.6472  121.635   5.8802  119.032   6.7733  129.598   11.848  393.773   11.238  409.734   18.891 -15.96072 21.98115 
1 1 1   18   18   18 o  357.318   10.250   97.976   5.6058   94.032   6.4115  110.774   11.551  349.882   11.972  377.995   20.036 -28.11316 23.34032 
1 1 1   18   18   19 o  406.345   10.140  126.717   6.3069  132.825   7.3764  110.116   12.161  415.846   11.589  376.463   21.191 39.38306 24.15279 
1 1 1   18   18   20 o  124.169   13.585   12.001   2.5397   12.621   2.6236   2.7632   10.127  127.359   13.672   98.930   40.953 28.42848 43.17533 
1 1 1   18   18   21 o  183.190   9.3955   25.818   2.6256   26.419   3.0005   23.852   5.4244  185.182   10.630  174.236   20.748 10.94641 23.31253 
1 1 1   18   18   22 o  126.912   13.718   12.542   2.6225   13.727   3.0125   8.8347   5.3288  132.609   15.112  104.934   31.017 27.67538 34.50254 
1 1 1   18   18   23 f  125.460   13.741   12.265   2.5955   13.584   2.9814   8.1347   5.2751  131.892   15.037  101.230   31.070 30.66269 34.51742 
1 1 1   18   18   24 o  129.383   20.303   13.298   3.8884   16.302   5.7528   10.771   5.2761  141.798   27.498  114.720   29.784 27.07807 40.53715 
1 1 1   18   18   25 o  109.451   26.624   9.7775   4.4175   1.2075   8.0808   13.430   5.2756   85.549   36.078  128.300   27.677 -42.75144 45.47105 
1 1 1   18   18   26 o  163.130   12.805   20.624   3.1717   21.684   3.8551   18.404   5.5796  166.868   15.263  151.348   24.955 15.51952 29.25265 
1 1 1   18   18   27 o  224.455   9.5068   38.705   3.2661   42.417   3.9178   30.247   5.9139  234.829   10.900  196.179   19.973 38.65034 22.75405 
1 1 1   18   18   28 o  103.111   16.052   8.4203   2.4510   7.7690   3.4097   9.1169   3.5258   97.668   23.160  106.028   22.426 -8.359642 32.23799 
1 1 1   18   18   29 o   48.054   19.644   0.6772   2.2923   4.8811   3.3123  -3.1870   3.1756   78.884   24.688   41.837   19.623 37.04733 31.53694 
1 1 1   18   18   30 o  323.127   6.9592   80.108   3.4419   81.216   4.9585   79.078   4.7816  324.925   9.9701  320.657   9.7423 4.267334 13.93967 
1 1 1   18   18   31 o   85.304   19.125   5.8993   2.4355   10.625   3.6449   2.0872   3.2736  114.603   21.570   62.455   24.128 52.14859 32.36404 
1 1 1   18   18   32 o   61.481   20.892   2.7675   2.3487   3.0408   3.4899   2.5413   3.1755   68.526   25.252   64.233   24.005 4.293709 34.84142 
1 1 1   18   18   33 o  207.999   9.2983   33.289   2.9603   34.832   4.3658   31.977   4.0276  211.707   13.544  202.926   13.036 8.781097 18.79806 
1 1 1   18   18   34 o  184.208   10.548   26.242   2.9616   23.571   4.3247   28.601   4.0641  173.214   16.512  191.610   13.953 -18.39587 21.61761 
1 1 1   18   18   35 o  156.394   12.937   19.059   3.0690   18.653   4.7354   19.354   4.0300  152.579   20.820  156.584   17.092 -4.004349 26.93728 
1 1 1   18   18   36 o  183.921   12.878   26.323   3.6024   26.408   4.8364   26.216   5.3990  182.963   17.482  181.554   19.747 1.408707 26.37378 
1 1 1   18   18   37 o   35.372   17.203  -5.0674   2.9642  -5.8055   4.5602  -4.5275   3.9007   47.039   22.484   44.567   21.158 2.472004 30.87341 
1 1 1   18   18   38 o   80.911   23.597   5.3516   3.1025   13.637   5.1607   0.6626   3.8824  127.582   27.255   59.577   25.060 68.00466 37.02460 
1 1 1   18   18   39 o  202.011   13.674   31.866   4.2032   35.598   9.8902   31.043   4.6434  204.722   32.660  198.853   15.375 5.869568 36.09808 
1 1 1   18   18   40 o   88.655   28.434   6.4121   4.3705   1.5733   9.5084   7.7082   4.9212   89.123   38.403   96.175   30.091 -7.052292 48.78769 
1 1 1   18   18   41 o   70.386   27.657   2.7215   4.3590   1.8680   5.5393   4.1098   7.0644   72.935   30.248   86.675   34.827 -13.74070 46.12885 
1 1 1   18   18   42 o  216.283   11.991   36.422   3.9540   36.657   6.1496   36.256   5.1625  214.297   18.943  214.437   15.841 -0.1401215 24.69376 
1 1 1   18   18   43 o  180.775   15.386   25.817   4.2167   24.057   6.9826   26.828   5.2903  168.604   28.042  182.755   19.199 -14.15128 33.98456 
1 1 1   18   18   44 f  116.147   22.493   11.242   3.8544   7.3347   6.1429   13.780   4.9500   94.898   33.696  127.235   26.287 -32.33737 42.73656 
1 1 1   18   18   45 o  113.458   22.612   10.795   3.7891   7.3988   5.6409   13.587   5.1147   93.896   32.365  125.404   27.411 -31.50806 42.41352 
1 1 1   18   18   46 o   89.016   26.134   6.8112   3.7944   6.1760   5.6927   7.3190   5.0899   88.086   32.283   92.350   30.755 -4.263596 44.58763 
1 1 1   18   18   47 o   57.110   24.815   0.0534   4.0374  -8.9088   6.5888   5.4417   5.1089   53.742   26.023   83.213   30.569 -29.47127 40.14559 
1 1 1   18   18   48 o  141.997   20.171   16.696   4.2609   10.353   6.5256   21.410   5.6257  105.590   34.807  158.857   23.875 -53.26784 42.20856 
1 1 1   18   18   49 o   88.263   26.900   6.8969   3.9628   10.144   5.7973   4.0491   5.4294  104.010   32.679   77.250   30.702 26.75996 44.83938 
1 1 1   18   18   50 o  118.729   23.224   12.253   4.0693   10.887   5.7068   13.667   5.8041  106.622   32.233  120.113   31.266 -13.49077 44.90595 
1 1 1   18   18   51 o  215.575   15.677   37.660   5.1375   31.564   6.0956   52.611   9.5460  193.127   20.957  243.871   25.973 -50.74391 33.37380 
1 1 1   18   18   52 o   76.164   28.627   4.8220   4.5285  -5.0081   7.4695   10.535   5.6944   61.749   29.304  103.052   32.390 -41.30301 43.67868 
1 1 1   18   19    0 o  430.379   13.578  142.397   8.9241  142.397   8.9241  142.397   8.9241  430.379   13.578  430.379   13.578 0.000000 0.000000 
1 1 1   18   19    1 o  341.818   10.381   89.581   5.4313   92.177   7.5920   86.860   7.7731  346.453   14.317  336.246   15.103 10.20679 20.81043 
1 1 1   18   19    2 o  432.296   7.5626  143.160   5.0040  145.045   5.9738  138.727   9.1616  435.047   8.9711  425.043   14.082 10.00403 16.69698 
1 1 1   18   19    3 o  119.446   17.750   11.214   3.1466   11.996   3.6359   8.8798   6.2798  123.240   19.957  107.414   34.044 15.82600 39.46289 
1 1 1   18   19    4 o  374.711   7.8484  107.571   4.5014  105.554   5.2322  113.315   8.8305  371.107   9.2112  384.042   15.022 -12.93530 17.62146 
1 1 1   18   19    5 o  427.313   7.5866  139.885   4.9621  140.497   5.7774  138.162   9.6880  428.172   8.8155  424.059   14.926 4.113159 17.33480 
1 1 1   18   19    6 o  653.576   9.3085  327.421   9.3121  331.947   12.502  321.782   13.956  657.679   12.420  647.276   14.086 10.40332 18.77938 
1 1 1   18   19    7 o  326.353   8.8693   81.628   4.4304   78.321   5.0418   92.836   9.2820  319.593   10.307  346.873   17.539 -27.27991 20.34354 
1 1 1   18   19    8 o  187.594   14.043   27.182   4.0031   28.395   4.6066   23.444   8.0896  191.518   15.857  170.722   32.137 20.79616 35.83623 
1 1 1   18   19    9 o  197.299   13.601   30.039   4.0822   29.380   4.7103   32.028   8.1821  194.811   15.936  201.379   27.244 -6.568512 31.56289 
1 1 1   18   19   10 o  363.644   9.2862  101.377   5.1687  107.994   6.1944   86.210   9.3783  375.211   10.786  333.998   18.416 41.21265 21.34199 
1 1 1   18   19   11 o  673.812   6.9266  347.815   7.1438  351.969   8.1233  333.641   15.007  677.729   7.8308  658.755   14.883 18.97363 16.81731 
1 1 1   18   19   12 o  271.076   11.019   56.384   4.5719   56.820   5.3589   55.218   8.7636  271.993   12.872  266.410   21.679 5.582489 25.21272 
1 1 1   18   19   13 o  313.994   11.885   75.692   5.7120   75.692   5.7120   0.0000   0.0000  313.994   11.885  ?   ?  0.000000 11.88489 
1 1 1   18   19   14 o  258.163   13.822   51.379   5.4418   51.379   5.4418   0.0000   0.0000  258.163   13.822  ?   ?  0.000000 13.82151 
1 1 1   18   19   15 o  233.587   12.974   42.057   4.6205   43.226   5.2339   37.929   9.8367  236.611   14.522  218.263   30.258 18.34782 33.56253 
1 1 1   18   19   16 o  457.068   9.2205  160.231   6.4507  158.683   7.4454  164.891   12.918  454.684   10.698  462.204   18.260 -7.520050 21.16278 
1 1 1   18   19   17 o  171.595   17.599   22.954   4.5570   19.653   5.0911   36.253   10.220  157.848   21.642  212.445   32.459 -54.59746 39.01212 
1 1 1   18   19   18 o  303.605   11.616   70.812   5.3979   72.116   6.2021   66.738   10.961  306.216   13.233  291.794   24.776 14.42197 28.08837 
1 1 1   18   19   19 o  340.428   10.754   88.995   5.6038   86.207   6.4750   97.316   11.185  334.837   12.634  353.771   20.747 -18.93433 24.29116 
1 1 1   18   19   20 o  377.000   10.508  109.145   6.0636  112.799   7.1477   99.763   11.452  383.034   12.192  358.027   20.990 25.00711 24.27332 
1 1 1   18   19   21 o  296.736   8.1228   67.532   3.6893   68.759   3.9090   57.533   11.162  299.386   8.5303  269.612   27.429 29.77325 28.72481 
1 1 1   18   19   22 o  446.365   10.066  153.014   6.8775  124.703   12.376  165.661   8.2723  400.356   20.263  464.174   11.643 -63.81784 23.36958 
1 1 1   18   19   23 o  414.547   9.9548  131.992   6.3165  147.197   11.644  125.652   7.5189  436.157   17.442  404.113   12.156 32.04428 21.25995 
1 1 1   18   19   24 o  323.693   11.310   80.582   5.6034   93.956   10.084   74.608   6.7396  347.472   19.033  311.033   14.157 36.43906 23.72031 
1 1 1   18   19   25 o  407.927   6.9799  127.604   4.3581  128.288   5.2383  126.065   7.8552  408.842   8.3708  404.539   12.686 4.302307 15.19884 
1 1 1   18   19   26 o  250.327   8.7550   48.116   3.3545   49.991   3.9361   43.139   6.4126  255.020   10.084  235.130   17.954 19.88986 20.59146 
1 1 1   18   19   27 o  138.968   13.884   15.055   2.9137   15.099   3.2597   14.880   6.4985  138.841   15.609  133.753   32.142 5.088165 35.73168 
1 1 1   18   19   28 o  134.237   14.516   14.090   2.9351   15.549   3.4321   10.119   5.6625  140.737   16.230  110.797   31.754 29.94034 35.66146 
1 1 1   18   19   29 o  273.801   7.4712   57.541   3.1311   56.799   4.3210   58.361   4.5434  271.661   10.392  275.313   10.782 -3.651581 14.97432 
1 1 1   18   19   30 o   65.308   21.190   3.2553   2.4221   3.6975   3.4277   2.8143   3.4230   71.955   25.205   67.069   24.951 4.886154 35.46640 
1 1 1   18   19   31 o   41.241   18.515  -1.0788   2.4304  -2.5680   3.5611   0.2197   3.3252   46.763   21.536   54.215   23.018 -7.452362 31.52180 
1 1 1   18   19   32 o  247.764   8.0525   47.170   3.0538   50.900   4.3970   43.694   4.2445  256.895   11.182  237.937   11.654 18.95749 16.15152 
1 1 1   18   19   33 o  142.306   12.371   15.767   2.6678   18.994   3.8799   12.873   3.6743  155.324   16.576  126.760   19.567 28.56312 25.64428 
1 1 1   18   19   34 o   57.720   22.636   1.6481   2.9147   5.1803   4.0534  -2.1341   4.1944   81.970   27.448   52.847   23.968 29.12306 36.43927 
1 1 1   18   19   35 o   97.983   21.448   7.8659   3.1275   13.393   4.5425   2.8851   4.3123  127.771   24.111   71.489   27.672 56.28290 36.70213 
1 1 1   18   19   36 o  292.050   8.5900   65.640   3.8399   69.241   5.6943   62.637   5.2001  299.046   12.440  284.556   11.939 14.49002 17.24261 
1 1 1   18   19   37 o  170.839   12.801   22.749   3.3231   15.733   4.8613   28.904   4.5531  138.602   23.770  191.880   15.639 -53.27853 28.45337 
1 1 1   18   19   38 o  200.406   11.402   31.169   3.4832   29.436   5.1472   32.633   4.7310  192.879   17.630  203.973   15.264 -11.09380 23.31954 
1 1 1   18   19   39 o   64.918   26.140   1.8588   3.9889  -0.9456   9.2954   2.4918   4.4162   82.909   36.778   69.865   27.714 13.04401 46.05076 
1 1 1   18   19   40 o  133.850   23.671   14.786   4.6722   19.205   5.5602   4.1684   8.6183  152.542   24.655   92.270   37.946 60.27181 45.25228 
1 1 1   18   19   41 o  208.198   12.179   33.767   3.8641   33.278   5.9076   34.132   5.1083  204.089   19.135  207.947   16.177 -3.859039 25.05644 
1 1 1   18   19   42 o  325.716   9.5672   81.977   4.7698   82.788   7.6027   81.451   6.1251  324.917   15.287  323.633   12.365 1.284027 19.66188 
1 1 1   18   19   43 o  166.517   16.052   22.023   4.0405   16.696   6.0738   26.251   5.4115  138.895   29.482  180.234   19.951 -41.33856 35.59777 
1 1 1   18   19   44 o   89.556   25.358   6.8237   3.6334   10.790   5.4832   3.7185   4.8514  110.445   31.109   75.896   29.358 34.54912 42.77437 
1 1 1   18   19   45 o  184.591   14.535   26.969   4.0734   29.022   6.1216   25.337   5.4568  187.876   21.686  175.982   20.651 11.89412 29.94547 
1 1 1   18   19   46 o  278.151   14.442   61.148   6.1275   0.0000   0.0000   61.148   6.1275  ?   ?   278.151   14.442 0.000000 14.44213 
1 1 1   18   19   47 f  107.441   24.844   10.008   4.0042   10.703   6.2661   9.5275   5.2057  107.581   33.998  102.710   30.726 4.870941 45.82525 
1 1 1   18   19   48 o  162.746   17.327   21.522   4.2499   17.402   6.3079   24.947   5.7512  137.994   30.661  172.202   22.346 -34.20851 37.94021 
1 1 1   18   19   49 o   73.819   27.141   4.3044   4.0284   0.7156   5.8023   7.6443   5.5974   67.472   29.524   91.818   32.207 -24.34666 43.69130 
1 1 1   18   19   50 o   88.357   27.580   7.1056   4.1367   8.2890   5.6331   5.7205   6.0945   93.835   32.343   83.774   32.765 10.06115 46.03945 
1 1 1   18   19   51 o   99.044   35.139   9.8094   6.6791   14.268   8.1179   0.4668   11.751  114.674   38.842   83.938   38.819 30.73624 54.91450 
1 1 1   18   20    0 o  276.448   16.554   59.265   6.9472   59.265   6.9472   59.265   6.9472  276.448   16.554  276.448   16.554 0.000000 0.000000 
1 1 1   18   20    1 o  219.303   13.337   37.067   4.4557   42.512   6.2311   31.369   6.3740  234.363   17.496  200.530   21.082 33.83279 27.39667 
1 1 1   18   20    2 o  177.563   15.285   24.414   4.1138   26.362   5.5766   22.089   6.0932  183.807   20.152  167.216   24.536 16.59065 31.75101 
1 1 1   18   20    3 o   96.092   21.479   7.4078   3.0798   9.2635   3.5722   2.0348   6.0785  107.536   22.429   79.005   32.107 28.53049 39.16482 
1 1 1   18   20    4 o  416.460   7.8162  132.894   4.9824  137.362   6.0219  123.198   8.8711  423.298   9.2943  400.399   14.475 22.89926 17.20199 
1 1 1   18   20    5 o  436.675   9.4807  146.195   6.3368  144.468   8.1734  148.797   10.033  433.823   12.309  439.969   14.898 -6.145355 19.32521 
1 1 1   18   20    6 o  153.652   14.248   18.296   3.3128   18.432   3.7280   17.788   7.2231  153.966   16.055  148.070   32.740 5.895432 36.46464 
1 1 1   18   20    7 o  700.007   6.8901  375.380   7.3824  371.272   8.3663  389.828   15.691  696.065   7.8526  712.177   14.394 -16.11212 16.39685 
1 1 1   18   20    8 o  540.010   6.7330  223.388   5.5652  220.523   6.2237  234.819   12.431  536.467   7.5794  552.658   14.696 -16.19135 16.53514 
1 1 1   18   20    9 o  373.266   7.2825  106.752   4.1607  105.016   4.5727  115.104   10.030  370.170   8.0706  386.609   16.950 -16.43921 18.77305 
1 1 1   18   20   10 o  588.519   6.7494  265.341   6.0799  265.994   6.8626  262.960   13.109  589.161   7.6100  584.768   14.646 4.393616 16.50509 
1 1 1   18   20   11 o  394.035   7.2120  118.969   4.3497  119.510   4.8052  116.516   10.235  394.879   7.9502  388.856   17.196 6.022705 18.94528 
1 1 1   18   20   12 o  353.532   11.560   95.959   6.2552   95.959   6.2552   0.0000   0.0000  353.532   11.560  ?   ?  0.000000 11.55966 
1 1 1   18   20   13 o  242.424   13.987   45.345   5.1681   45.345   5.1681   0.0000   0.0000  242.424   13.987  ?   ?  0.000000 13.98744 
1 1 1   18   20   14 o  207.608   14.171   33.309   4.4761   31.120   5.0907   40.771   9.3973  200.235   16.764  227.008   27.614 -26.77284 32.30442 
1 1 1   18   20   15 o  451.408   9.1279  156.298   6.3068  156.288   7.3701  156.327   12.189  451.207   10.672  450.057   17.694 1.149963 20.66288 
1 1 1   18   20   16 o  282.943   11.756   61.507   5.0911   60.729   5.8533   63.924   10.318  280.963   13.611  285.796   23.803 -4.832703 27.41972 
1 1 1   18   20   17 o  237.387   13.554   43.499   4.9045   39.259   5.5188   59.425   10.696  225.069   16.127  274.868   25.723 -49.79886 30.36041 
1 1 1   18   20   18 o   80.288   28.649   4.3799   4.4458   3.9164   4.9720   6.2286   9.9297   80.360   30.037  107.334   41.866 -26.97368 51.52639 
1 1 1   18   20   19 o  460.291   12.085  162.905   8.5142  170.350   11.187  152.656   13.126  469.973   15.552  443.971   19.315 26.00250 24.79781 
1 1 1   18   20   20 o  384.490   13.311  113.814   7.8334  120.280   10.089  103.998   12.430  394.588   16.704  364.918   22.362 29.67029 27.91210 
1 1 1   18   20   21 o   64.705   31.315 -14.7480   9.5119   0.0000   0.0000 -14.7480   9.5119  ?   ?    64.705   31.315 0.000000 31.31538 
1 1 1   18   20   22 o   65.925   27.821   0.4978   4.8106  -5.1243   5.4230   21.261   10.422   55.140   25.793  158.637   42.188 -103.4966 49.44834 
1 1 1   18   20   23 o  253.475   8.1314   49.299   3.1548   49.083   3.6879   49.890   6.0917  252.795   9.5310  253.606   15.771 -0.8105164 18.42744 
1 1 1   18   20   24 o  290.855   7.8836   64.910   3.5097   67.097   4.1480   59.400   6.5850  295.580   9.1684  276.768   15.608 18.81158 18.10160 
1 1 1   18   20   25 o  418.466   7.1181  134.317   4.5593  137.353   5.5316  127.883   8.0516  422.962   8.5443  407.282   12.916 15.67987 15.48608 
1 1 1   18   20   26 o  338.659   7.7192   88.019   4.0013   85.800   4.7047   93.819   7.6071  334.168   9.1981  348.468   14.262 -14.30051 16.97100 
1 1 1   18   20   27 o  296.543   8.5469   67.544   3.8794   70.069   4.4223   59.114   8.0809  301.896   9.5702  274.742   19.340 27.15442 21.57791 
1 1 1   18   20   28 f   54.355   21.169   1.4697   2.5359   3.5043   2.9072  -5.0036   5.1856   68.819   23.244   53.458   25.075 15.36152 34.19127 
1 1 1   18   20   29 o  264.362   8.8055   53.720   3.5631   56.944   4.2383   45.948   6.5796  271.982   10.181  242.233   17.872 29.74969 20.56852 
1 1 1   18   20   30 o  131.160   12.380   13.401   2.4560   10.220   3.2617   17.565   3.7324  112.757   19.611  149.401   16.603 -36.64407 25.69485 
1 1 1   18   20   31 o  358.409   6.8999   98.601   3.7852  102.828   5.3134   94.246   5.3937  365.527   9.4970  349.819   10.073 15.70758 13.84437 
1 1 1   18   20   32 o  152.915   12.328   18.185   2.8610   20.127   3.7588   15.511   4.4112  160.208   15.523  138.834   21.450 21.37415 26.47746 
1 1 1   18   20   33 o  385.118   7.7215  113.970   4.5516  123.651   6.1518  102.259   6.7658  400.584   10.033  363.709   12.153 36.87497 15.75966 
1 1 1   18   20   34 o  155.689   12.912   18.895   3.0491   13.093   4.5059   23.797   4.1413  126.291   24.191  174.138   15.706 -47.84768 28.84252 
1 1 1   18   20   35 o   31.983   15.673  -5.0234   2.5987  -4.2200   3.9222  -5.6520   3.4694   45.431   21.463   38.719   18.780 6.711617 28.51961 
1 1 1   18   20   36 o  340.307   7.8935   89.065   4.1116   89.886   6.0099   88.343   5.6372  340.932   11.517  338.179   10.891 2.753418 15.85058 
1 1 1   18   20   37 o   83.095   23.377   5.6852   3.0983   6.2661   4.4888   5.1565   4.2820   88.299   28.857   82.007   28.203 6.291611 40.34994 
1 1 1   18   20   38 o  441.793   10.967  150.949   7.4159  144.368   11.395  155.784   9.7676  428.701   17.365  447.201   14.270 -18.50009 22.47632 
1 1 1   18   20   39 o  166.572   18.301   22.125   4.5892   19.853   5.2459   29.534   9.4728  156.044   22.623  184.214   34.873 -28.16962 41.56845 
1 1 1   18   20   40 f  276.019   9.9907   58.870   4.2209   58.262   6.4628   59.322   5.5739  272.322   15.570  276.096   13.189 -3.774231 20.40519 
1 1 1   18   20   41 o  170.532   14.819   22.922   3.8296   21.605   5.9359   23.861   5.0122  161.431   24.818  172.309   19.338 -10.87801 31.46230 
1 1 1   18   20   42 o   51.999   22.821  -0.5018   3.4894   7.0457   5.5475  -5.4429   4.4886   92.853   32.091   46.765   22.339 46.08813 39.10104 
1 1 1   18   20   43 o  163.083   15.307   21.096   3.7762   19.639   5.7741   22.185   4.9916  152.666   25.617  165.219   20.156 -12.55316 32.59615 
1 1 1   18   20   44 o   61.833   25.123   1.7024   3.7208  -3.9023   5.3742   6.8625   5.1566   55.498   25.866   90.516   30.955 -35.01762 40.33967 
1 1 1   18   20   45 o   68.956   25.701   3.3426   3.6350   2.4874   5.3837   4.0591   4.9279   72.763   29.966   76.980   29.641 -4.216866 42.14907 
1 1 1   18   20   46 o  179.144   16.417   25.750   4.4516   20.433   7.0664   29.249   5.7319  150.345   31.705  188.901   20.135 -38.55598 37.55827 
1 1 1   18   20   47 o  134.302   19.833   14.958   3.9543   7.0773   5.8479   21.597   5.3674   90.825   32.806  160.175   22.514 -69.35009 39.78839 
1 1 1   18   20   48 o  198.553   14.744   31.551   4.4490   31.833   6.0944   31.228   6.5097  195.427   20.689  192.101   22.569 3.326477 30.61679 
1 1 1   18   20   49 o  154.337   22.173   20.352   5.0876   23.646   5.8288   9.8163   10.425  165.346   23.710  101.919   41.804 63.42693 48.05943 
1 1 1   18   20   50 o   82.307   30.122   5.9284   4.9535   6.0466   5.4729   5.3928   11.650   83.513   31.455   92.351   41.060 -8.838623 51.72332 
1 1 1   18   21    0 o  262.969   16.444   53.693   6.5594   53.693   6.5594   53.693   6.5594  262.969   16.444  262.969   16.444 0.000000 0.000000 
1 1 1   18   21    1 o  664.290   9.2817  338.345   9.4374  329.876   13.008  347.758   13.713  655.346   12.967  672.808   13.316 -17.46204 18.58714 
1 1 1   18   21    2 o  356.154   9.7671   97.277   5.3244   98.163   7.3170   96.281   7.7625  357.450   13.374  353.905   14.330 3.544708 19.60107 
1 1 1   18   21    3 o  380.777   9.7252  111.193   5.6681  108.422   7.6162  114.633   8.4860  375.672   13.245  386.155   14.357 -10.48285 19.53371 
1 1 1   18   21    4 o   81.202   23.700   5.2046   3.1287   5.1355   3.6302   5.4041   6.1686   81.874   25.878   91.810   33.611 -9.935738 42.41914 
1 1 1   18   21    5 o   90.198   22.862   6.5409   3.1605   6.9021   3.6429   5.4418   6.3552   92.769   25.063   92.634   34.085 0.1352158 42.30767 
1 1 1   18   21    6 o  427.374   7.7607  139.975   5.0767  142.894   5.9775  132.421   9.6163  431.701   9.0463  414.886   15.143 16.81512 17.63921 
1 1 1   18   21    7 o  536.435   6.7719  220.463   5.5603  221.084   6.3240  218.349   11.672  537.107   7.6924  532.875   14.310 4.231445 16.24637 
1 1 1   18   21    8 o  550.427   6.8043  232.122   5.7326  231.015   6.4747  236.137   12.332  549.028   7.7047  554.083   14.540 -5.055237 16.45561 
1 1 1   18   21    9 o   87.417   20.962   6.1456   2.7685   6.4421   3.0225   4.6004   6.9001   89.468   22.181   91.497   35.113 -2.028694 41.53268 
1 1 1   18   21   10 o  165.751   11.935   21.209   3.0077   19.396   3.2486   32.094   7.9593  158.261   13.541  201.386   26.462 -43.12474 29.72525 
1 1 1   18   21   11 o  240.955   10.025   44.549   3.6973   44.549   3.6973   0.0000   0.0000  240.955   10.025  ?   ?  0.000000 10.02483 
1 1 1   18   21   12 o  149.186   18.052   17.425   4.0382   16.924   4.5979   19.115   8.4454  146.385   21.133  152.401   36.653 -6.015945 42.30896 
1 1 1   18   21   13 o  115.397   23.683   10.715   4.0429   10.825   4.5871   10.334   8.5574  115.576   26.496  117.279   39.878 -1.702431 47.87796 
1 1 1   18   21   14 o  240.285   15.865   44.694   5.8020   52.630   7.2406   30.456   9.6983  260.376   18.284  193.762   33.937 66.61368 38.54935 
1 1 1   18   21   15 o   66.525   28.440  -0.0129   5.1400   2.7407   6.1897  -6.1298   9.2255   81.552   32.659   75.860   34.834 5.691559 47.74973 
1 1 1   18   21   16 o  386.724   12.304  114.990   7.2833  123.009   9.4482  103.245   11.434  399.448   15.453  364.370   20.585 35.07864 25.74020 
1 1 1   18   21   17 o  199.136   19.891   31.027   5.9816   33.722   7.4914   26.287   9.9355  206.667   24.137  178.290   37.592 28.37711 44.67370 
1 1 1   18   21   18 o  316.117   11.389   76.810   5.5108   78.743   6.4943   71.839   10.415  319.823   13.266  302.992   22.621 16.83115 26.22446 
1 1 1   18   21   19 o  314.975   11.555   76.281   5.5707   72.110   6.3056   91.114   11.890  305.987   13.463  341.194   22.901 -35.20670 26.56495 
1 1 1   18   21   20 o  125.126   32.086   12.897   6.1743   9.2356   7.5388   20.357   10.761  110.202   37.430  155.316   43.521 -45.11450 57.40284 
1 1 1   18   21   21 o   84.324   29.772   5.0044   4.7889   2.4679   5.3860   14.579   10.464   76.217   30.485  134.352   44.067 -58.13544 53.58400 
1 1 1   18   21   22 o  174.523   20.106   23.989   5.2728   23.305   5.9608   26.447   11.305  171.148   23.365  176.317   42.409 -5.169388 48.41977 
1 1 1   18   21   23 o  639.922   6.7954  314.016   6.6560  317.159   8.2065  307.973   11.379  642.796   8.3409  632.493   11.753 10.30255 14.41223 
1 1 1   18   21   24 o  409.544   7.1249  128.659   4.4663  129.273   5.2629  127.077   8.4436  410.341   8.3794  405.791   13.594 4.549988 15.96930 
1 1 1   18   21   25 o  253.320   8.6363   49.286   3.3486   50.069   3.8539   46.874   6.7650  255.186   9.8668  244.911   18.176 10.27472 20.68147 
1 1 1   18   21   26 o  255.150   9.1355   50.034   3.5678   51.286   3.9964   45.119   7.9185  258.200   10.112  238.996   21.889 19.20349 24.11238 
1 1 1   18   21   27 o   98.803   17.772   7.8187   2.5888   7.4448   2.8920   9.3272   5.8084   95.832   20.345  106.760   32.574 -10.92763 38.40509 
1 1 1   18   21   28 f  298.393   8.2124   68.405   3.7509   71.735   4.4049   59.620   7.1536  305.387   9.4236  276.349   16.994 29.03790 19.43229 
1 1 1   18   21   29 o  326.675   8.0818   81.991   4.0410   86.040   4.7753   71.776   7.5846  334.427   9.3288  303.395   16.393 31.03214 18.86182 
1 1 1   18   21   30 o  254.554   10.156   49.909   3.9570   50.031   4.1563   48.733   12.932  254.781   10.658  240.696   36.223 14.08574 37.75828 
1 1 1   18   21   31 o  280.315   10.103   60.533   4.3349   62.964   4.5840   39.980   13.330  285.816   10.478  213.809   42.230 72.00717 43.51072 
1 1 1   18   21   32 o  321.973   7.5096   79.643   3.7009   83.560   5.1465   75.448   5.3257  329.259   10.212  312.661   11.128 16.59772 15.10381 
1 1 1   18   21   33 o  131.698   14.140   13.610   2.8057   19.762   4.2443   8.8352   3.7393  157.971   17.868  103.380   24.079 54.59102 29.98437 
1 1 1   18   21   34 o  118.919   15.404   11.188   2.7380   13.851   3.9683   8.7679   3.7825  131.086   20.445  102.818   24.401 28.26790 31.83411 
1 1 1   18   21   35 o  134.856   14.396   14.296   2.9256   21.508   4.3697   8.4369   3.9387  164.786   17.597  100.565   25.540 64.22139 31.01468 
1 1 1   18   21   36 o  235.592   9.8820   42.821   3.5635   37.691   5.0722   47.820   5.0074  219.341   15.202  247.839   13.248 -28.49846 20.16454 
1 1 1   18   21   37 o  258.084   11.434   51.555   4.5166   68.492   9.9271   47.133   5.0720  292.128   22.371  245.864   13.530 46.26418 26.14437 
1 1 1   18   21   38 o  130.376   22.343   13.928   4.2982   10.566   4.9831   23.698   8.4951  111.269   28.973  164.689   34.790 -53.41951 45.27512 
1 1 1   18   21   39 o  193.267   12.755   29.152   3.7519   29.541   5.7577   28.865   4.9462  191.954   19.885  190.845   17.114 1.109558 26.23586 
1 1 1   18   21   40 o  281.008   11.717   61.285   5.0395   70.782   6.3104   44.564   8.3733  301.236   13.686  233.652   23.743 67.58447 27.40505 
1 1 1   18   21   41 o  103.944   22.623   9.0307   3.4971   9.9970   5.3422   8.3061   4.6261  107.167   30.881   98.452   28.843 8.714592 42.25568 
1 1 1   18   21   42 o  181.975   13.066   25.981   3.6150   23.592   5.2137   28.193   5.0169  170.389   20.396  187.750   17.665 -17.36140 26.98281 
1 1 1   18   21   43 o  142.204   17.046   16.257   3.6364   22.871   5.1342   9.5985   5.1511  167.367   20.468  104.326   30.399 63.04086 36.64757 
1 1 1   18   21   44 o  104.687   22.918   9.2971   3.5705   8.2757   5.2468   10.178   4.8727   97.129   31.154  107.264   28.989 -10.13440 42.55548 
1 1 1   18   21   45 o  155.245   16.766   19.408   3.9207   19.556   6.2385   19.311   5.0405  149.460   28.306  152.066   22.320 -2.606201 36.04750 
1 1 1   18   21   46 o  100.208   24.852   8.7561   3.7932   8.6170   5.7645   8.8624   5.0374   97.767   32.733   99.100   30.353 -1.333099 44.63980 
1 1 1   18   21   47 o   57.793   25.113   0.2609   4.1351   4.4723   5.5713  -4.9050   6.1704   79.183   31.218   57.087   26.955 22.09648 41.24437 
1 1 1   18   21   48 f  120.540   25.671   12.933   4.5912   14.611   5.6242   9.5815   7.9491  125.443   29.744  100.095   37.860 25.34774 48.14603 
1 1 1   18   21   49 o   73.755   27.730   4.3148   4.2498   7.8275   5.2775  -2.1639   7.1674   91.478   31.316   66.002   30.451 25.47645 43.68055 
1 1 1   18   22    0 o  568.242   12.884  247.995   11.193  247.995   11.193  247.995   11.193  568.242   12.884  568.242   12.884 0.000000 0.000000 
1 1 1   18   22    1 o  899.270   10.362  620.512   14.263  626.529   20.241  614.577   20.101  902.448   14.654  893.786   14.693 8.662292 20.75139 
1 1 1   18   22    2 o  547.568   9.1411  229.932   7.6614  223.808   10.378  237.266   11.358  539.739   12.562  555.592   13.356 -15.85291 18.33521 
1 1 1   18   22    3 o  346.902   10.119   92.330   5.3728   86.323   7.1466  100.139   8.1480  335.051   13.935  360.765   14.756 -25.71436 20.29592 
1 1 1   18   22    4 o  616.638   7.6224  291.424   7.1944  284.606   8.5230  308.324   13.418  609.190   9.1404  633.218   13.844 -24.02789 16.58963 
1 1 1   18   22    5 o  605.251   7.6529  280.769   7.0898  276.904   8.4485  289.971   13.036  600.876   9.1860  614.059   13.870 -13.18317 16.63577 
1 1 1   18   22    6 f  534.081   7.6513  218.627   6.2548  220.055   7.4290  215.149   11.592  535.663   9.0609  528.829   14.321 6.833496 16.94683 
1 1 1   18   22    7 o  281.230   9.4437   60.669   4.0651   63.245   4.6854   52.827   8.1754  287.046   10.664  260.495   20.674 26.55167 23.26248 
1 1 1   18   22    8 o  407.086   8.1022  127.049   5.0485  128.557   5.8810  122.821   9.8430  409.375   9.3855  399.232   16.108 10.14273 18.64249 
1 1 1   18   22    9 o  286.012   10.567   62.795   4.6259   62.795   4.6259   0.0000   0.0000  286.012   10.567  ?   ?  0.000000 10.56674 
1 1 1   18   22   10 o  147.195   16.628   16.917   3.6806   16.917   3.6806   0.0000   0.0000  147.195   16.628  ?   ?  0.000000 16.62773 
1 1 1   18   22   11 o  173.790   13.303   23.365   3.5118   24.368   3.8364   18.183   8.7227  177.363   14.252  148.320   38.192 29.04300 40.76493 
1 1 1   18   22   12 f  313.800   12.856   75.727   6.1747   69.853   7.8066   85.542   10.091  300.363   17.051  331.810   19.963 -31.44678 26.25329 
1 1 1   18   22   13 o  336.832   10.402   87.114   5.3627   90.186   6.2609   78.653   10.391  342.541   11.941  317.667   21.498 24.87479 24.59189 
1 1 1   18   22   14 o  143.520   20.114   16.262   4.2972   16.133   4.8936   16.696   8.9816  142.230   23.285  142.055   39.745 0.1747131 46.06369 
1 1 1   18   22   15 f  173.415   16.941   23.445   4.4393   24.781   5.0464   18.870   9.3353  177.967   18.811  150.477   39.887 27.48958 44.09954 
1 1 1   18   22   16 o  552.993   9.0750  234.685   7.6813  231.839   9.0256  242.160   14.629  549.326   10.734  559.763   17.074 -10.43640 20.16840 
1 1 1   18   22   17 o  351.762   10.560   95.069   5.6859   89.859   6.4980  112.092   11.746  341.731   12.423  379.447   20.298 -37.71524 23.79764 
1 1 1   18   22   18 o   93.972   29.206   6.9632   4.6445   8.8724   5.3671   1.2706   9.2678  104.930   31.156   91.071   38.534 13.85872 49.55328 
1 1 1   18   22   19 o  208.669   20.990   34.210   6.6132   32.846   8.5625   36.225   10.411  202.264   28.443  210.859   33.368 -8.594406 43.84587 
1 1 1   18   22   20 o  477.483   9.8576  175.164   7.2044  167.832   8.3052  197.455   14.481  467.030   11.618  504.395   18.757 -37.36459 22.06359 
1 1 1   18   22   21 o  140.915   23.457   15.934   4.8814   16.067   5.3917   15.331   11.496  140.846   25.966  137.599   46.224 3.246902 53.01783 
1 1 1   18   22   22 o  307.320   12.586   72.789   5.9203   73.632   6.7074   69.815   12.595  308.803   14.191  295.676   28.172 13.12741 31.54393 
1 1 1   18   22   23 o  180.387   19.355   25.612   5.2606   24.516   5.8351   30.371   12.158  175.677   22.196  187.921   43.175 -12.24348 48.54644 
1 1 1   18   22   24 o  222.370   13.583   38.325   4.6010   39.487   6.3319   37.025   6.6971  224.516   18.593  216.842   20.418 7.674042 27.61511 
1 1 1   18   22   25 o  132.111   13.857   13.634   2.7604   14.721   2.9866   7.2629   7.2311  137.214   14.437  100.753   36.466 36.46129 39.21987 
1 1 1   18   22   26 o  197.515   10.111   30.102   3.0467   30.161   3.4411   29.886   6.5540  197.488   11.433  193.734   22.522 3.753738 25.25787 
1 1 1   18   22   27 o  212.211   9.4731   34.644   3.0770   36.065   3.5153   29.987   6.3635  216.377   10.614  194.180   21.786 22.19643 24.23401 
1 1 1   18   22   28 o  419.424   8.2466  135.183   5.2941  133.479   5.6224  148.515   15.724  416.650   8.8162  432.583   23.840 -15.93314 25.41767 
1 1 1   18   22   29 o  269.376   9.7415   55.863   4.0166   55.457   4.2191   59.792   13.123  268.306   10.273  269.214   32.504 -0.9080811 34.08889 
1 1 1   18   22   30 o  449.263   7.4977  155.036   5.1559  157.541   6.1597  149.175   9.4229  452.541   8.8927  438.684   14.033 13.85706 16.61370 
1 1 1   18   22   31 o  154.029   13.903   18.541   3.2424   19.850   3.6585   13.747   7.0009  159.102   15.208  126.674   34.963 32.42831 38.12733 
1 1 1   18   22   32 o  410.864   8.8864  129.920   5.5885  134.069   7.0726  123.023   9.1182  416.724   11.088  397.766   14.977 18.95782 18.63452 
1 1 1   18   22   33 o  144.490   12.746   16.293   2.7900   14.996   3.8768   17.685   4.0183  136.947   19.007  149.232   17.952 -12.28578 26.14498 
1 1 1   18   22   34 o   73.054   22.094   4.2881   2.6808  -1.3612   3.7079   10.476   3.8805   51.281   22.956  112.753   23.257 -61.47157 32.67813 
1 1 1   18   22   35 o  118.737   16.179   11.211   2.8639   12.273   4.0050   10.100   4.0969  122.495   22.177  110.091   24.896 12.40374 33.34140 
1 1 1   18   22   36 o  168.080   15.056   22.209   3.8324   32.143   8.7226   19.833   4.2662  195.698   30.083  157.859   17.977 37.83922 35.04532 
1 1 1   18   22   37 o  196.856   14.592   30.386   4.3654   29.537   5.3464   32.083   7.5613  192.745   18.343  197.617   25.599 -4.872101 31.49298 
1 1 1   18   22   38 o   99.502   21.198   8.1727   3.1297   9.6011   4.5742   6.9155   4.2914  106.217   27.809   91.153   28.031 15.06376 39.48507 
1 1 1   18   22   39 o   96.381   22.403   7.7463   3.2422   3.2629   4.6901   11.850   4.4871   73.998   28.798  118.595   25.478 -44.59679 38.45082 
1 1 1   18   22   40 o   70.879   24.673   3.7976   3.2820   1.7885   4.9235   5.4043   4.4029   69.152   28.585   82.777   28.590 -13.62448 40.42920 
1 1 1   18   22   41 o   91.817   23.028   7.1063   3.2306   8.6305   4.6781   5.7167   4.4666   99.913   28.929   84.222   28.810 15.69045 40.82747 
1 1 1   18   22   42 o   72.729   25.289   4.0971   3.4476   6.5222   4.9419   1.7978   4.8119   88.721   30.304   68.103   28.214 20.61862 41.40493 
1 1 1   18   22   43 o  146.791   16.518   17.297   3.6468   19.157   5.2569   15.570   5.0633  151.224   23.472  135.055   25.427 16.16847 34.60438 
1 1 1   18   22   44 o   76.861   26.218   4.7929   3.6989   5.5017   5.9208   4.3392   4.7371   85.541   32.598   77.409   29.239 8.132050 43.78975 
1 1 1   18   22   45 o   84.733   26.755   6.1884   3.8813   1.6822   6.1432   9.1824   5.0074   72.824   31.112  100.925   30.122 -28.10138 43.30462 
1 1 1   18   22   46 o   93.349   30.235   7.8601   4.9326   5.0435   5.6391   17.035   10.178   81.698   31.638  126.160   43.475 -44.46243 53.76793 
1 1 1   18   22   47 o  185.815   15.936   27.916   4.4884   29.173   5.6022   25.662   7.5007  187.309   19.842  167.104   30.447 20.20518 36.34215 
1 1 1   18   22   48 o   59.251   24.454   1.6196   3.5952  -1.6106   5.1257   4.7476   5.0440   57.533   26.248   77.737   29.973 -20.20373 39.84101 
1 1 1   18   22   49 o  124.455   21.754   13.395   3.9931   12.915   5.2170   14.073   6.2049  116.945   29.226  119.165   32.925 -2.219337 44.02574 
1 1 1   18   23    0 o  132.332   32.334   15.717   5.6734   15.717   5.6734   15.717   5.6734  132.332   32.334  132.332   32.334 0.000000 0.000000 
1 1 1   18   23    1 o  598.505   9.2633  274.780   8.4860  267.571   11.720  282.724   12.303  589.942   12.980  606.357   13.256 -16.41486 18.55239 
1 1 1   18   23    2 o  359.445   9.9855   99.148   5.4938   89.636   7.2586  111.904   8.4059  341.336   13.893  381.311   14.402 -39.97440 20.01122 
1 1 1   18   23    3 o  306.172   10.686   71.966   5.0078   72.366   6.7071   71.462   7.5280  306.644   14.290  304.055   16.234 2.589172 21.62753 
1 1 1   18   23    4 o  191.265   11.964   28.216   3.4850   26.298   4.0432   33.759   6.8733  184.283   14.450  207.535   21.972 -23.25154 26.29729 
1 1 1   18   23    5 o  483.386   7.8282  179.131   5.7920  181.538   6.9472  173.644   10.489  486.448   9.3304  474.953   14.429 11.49442 17.18252 
1 1 1   18   23    6 o  201.281   11.928   31.239   3.6586   32.852   4.2245   26.399   7.3176  206.224   13.457  181.987   27.096 24.23747 30.25416 
1 1 1   18   23    7 o  148.049   13.740   17.008   3.0781   15.204   3.3619   26.362   7.6548  139.536   16.032  181.455   28.500 -41.91948 32.70028 
1 1 1   18   23    8 o  440.974   8.2059  149.115   5.5387  149.115   5.5387   0.0000   0.0000  440.974   8.2059  ?   ?  0.000000 8.205944 
1 1 1   18   23    9 o  478.247   7.2039  175.315   5.2734  174.071   5.9147  180.138   11.644  476.448   8.1105  483.368   15.738 -6.920013 17.70525 
1 1 1   18   23   10 f  308.644   8.4451   73.064   3.9896   71.228   4.3826   81.947   9.6397  304.662   9.3982  324.777   19.481 -20.11481 21.62988 
1 1 1   18   23   11 o  448.069   7.3250  153.909   5.0237  154.624   5.6182  151.056   11.221  449.016   8.1746  442.364   16.572 6.652649 18.47878 
1 1 1   18   23   12 o  264.123   11.657   53.624   4.7124   59.347   5.5093   38.023   9.0967  277.715   12.961  218.547   27.825 59.16762 30.69522 
1 1 1   18   23   13 o  605.584   8.7680  281.386   8.1273  281.779   9.7073  280.465   14.862  605.676   10.471  602.760   16.109 2.915833 19.21302 
1 1 1   18   23   14 o  423.959   9.5191  137.990   6.1772  139.376   7.2460  134.303   11.817  425.841   11.117  416.446   18.539 9.395172 21.61640 
1 1 1   18   23   15 o   83.357   27.661   5.2229   4.1186   5.2301   4.7462   5.2008   8.2871   85.375   29.673   98.125   38.254 -12.74964 48.41363 
1 1 1   18   23   16 o  135.391   22.700   14.662   4.5377   12.642   5.1747   21.383   9.4401  124.408   27.867  159.697   38.965 -35.28842 47.90414 
1 1 1   18   23   17 f  479.291   12.232  176.822   8.9737  183.338   12.127  168.938   13.341  486.967   16.270  466.703   18.676 20.26331 24.76883 
1 1 1   18   23   18 o  264.013   16.973   54.177   6.8224   55.180   8.8470   52.705   10.716  265.090   22.003  257.156   27.660 7.933594 35.34399 
1 1 1   18   23   19 o  276.532   12.728   58.922   5.3875   62.187   6.1818   48.611   10.987  283.489   14.292  245.891   29.800 37.59801 33.04974 
1 1 1   18   23   20 o  120.847   26.140   11.929   4.6946   10.158   5.2647   18.804   10.373  111.128   30.174  148.712   43.082 -37.58443 52.59748 
1 1 1   18   23   21 o  224.082   15.666   39.047   5.3393   36.871   6.0542   46.663   11.326  217.064   18.395  239.671   31.649 -22.60750 36.60677 
1 1 1   18   23   22 o  246.373   15.167   47.142   5.6916   45.425   6.3617   54.032   12.741  241.283   17.341  257.199   33.135 -15.91631 37.39832 
1 1 1   18   23   23 o   77.501   30.040   3.2829   5.0876   2.1347   5.6899   7.8615   11.362   76.128   31.014  114.036   44.700 -37.90867 54.40572 
1 1 1   18   23   24 o  473.897   10.045  172.805   7.2865  180.639   9.0959  158.773   12.173  483.875   12.281  451.734   17.606 32.14114 21.46622 
1 1 1   18   23   25 o  233.689   16.771   42.664   5.9590   40.335   6.7444   50.954   12.724  226.321   19.665  247.988   34.452 -21.66727 39.66947 
1 1 1   18   23   26 o  135.211   14.286   14.311   2.9118   14.112   3.0044   17.383   11.818  134.132   14.885  142.133   46.841 -8.000916 49.14926 
1 1 1   18   23   27 o  407.515   7.4211  127.520   4.6290  128.404   5.3903  125.037   9.0340  408.688   8.6170  401.575   14.697 7.112823 17.03725 
1 1 1   18   23   28 o  261.497   8.9399   52.596   3.5782   53.026   4.0803   51.164   7.4457  262.372   10.160  254.936   19.222 7.436096 21.74246 
1 1 1   18   23   29 o  257.663   9.2669   51.098   3.6548   53.621   4.2016   43.255   7.4084  263.752   10.408  233.518   20.950 30.23399 23.39242 
1 1 1   18   23   30 o  178.082   12.312   24.637   3.3353   25.300   3.7652   22.218   7.1876  180.146   13.759  163.320   29.853 16.82640 32.87076 
1 1 1   18   23   31 o  146.372   15.625   16.862   3.4466   19.721   3.9732   8.1724   6.9277  158.133   16.666  102.326   35.833 55.80630 39.51974 
1 1 1   18   23   32 o  244.444   11.146   46.156   4.1702   50.021   4.9649   36.899   7.6843  253.782   12.823  213.893   23.879 39.88849 27.10398 
1 1 1   18   23   33 f  251.024   10.625   48.652   4.0822   51.503   4.8903   42.101   7.4139  257.865   12.390  229.591   21.341 28.27390 24.67720 
1 1 1   18   23   34 o  178.186   11.533   24.665   3.1287   24.906   4.3394   24.403   4.5150  177.821   16.118  175.724   16.999 2.097687 23.42571 
1 1 1   18   23   35 o   90.920   33.215   6.0822   6.0192   10.786   11.230   4.1861   7.1300  117.749   44.888   87.601   35.063 30.14818 56.95901 
1 1 1   18   23   36 o  118.788   21.078   11.526   3.6920   11.296   4.2406   12.248   7.5053  116.402   24.573  118.402   37.180 -1.999588 44.56649 
1 1 1   18   23   37 o   71.827   23.452   4.0606   2.9650   2.3957   4.0109   6.0664   4.4026   67.220   26.492   86.676   28.591 -19.45611 38.97776 
1 1 1   18   23   38 o   55.793   23.103   0.9134   3.2241  -1.7904   4.6313   3.4560   4.4912   56.311   25.394   73.994   28.345 -17.68361 38.05612 
1 1 1   18   23   39 o  126.744   16.838   12.870   3.1858   13.325   4.6741   12.476   4.3537  125.829   25.148  122.060   24.158 3.769165 34.87187 
1 1 1   18   23   40 o  173.477   13.039   23.613   3.4368   29.986   4.9753   17.797   4.7531  194.059   16.919  147.163   21.757 46.89610 27.56144 
1 1 1   18   23   41 o   56.687   23.123   1.2787   3.1677  -0.6806   4.4663   3.2617   4.4933   57.919   25.602   72.434   28.188 -14.51482 38.07933 
1 1 1   18   23   42 o  160.276   14.956   20.416   3.6266   25.215   5.1808   15.804   5.0783  176.085   19.552  136.215   25.288 39.87010 31.96520 
1 1 1   18   23   43 o   59.912   24.263   1.6613   3.4581   1.9909   5.1685   1.3942   4.6530   70.004   29.141   65.400   27.468 4.604324 40.04571 
1 1 1   18   23   44 o  203.746   37.984   39.510   11.410   0.0000   0.0000   39.510   11.410  ?   ?   203.746   37.984 0.000000 37.98392 
1 1 1   18   23   45 o  102.842   28.108   9.5398   4.5507   11.722   5.2052   2.4611   9.3742  113.206   29.677   85.121   37.380 28.08511 47.72815 
1 1 1   18   23   46 o   76.943   25.644   5.0550   3.5385   5.3907   5.1218   4.7484   4.8944   81.350   30.470   78.081   29.666 3.269730 42.52657 
1 1 1   18   23   47 o  100.837   23.416   8.9600   3.5447   3.3055   5.0901   14.284   4.9393   72.355   29.390  125.985   26.456 -53.62983 39.54351 
1 1 1   18   23   48 o   73.987   25.756   4.6605   3.5765   1.0596   5.1768   7.9487   4.9468   64.784   28.124   91.933   30.306 -27.14935 41.34498 
1 1 1   18   24    0 o  220.092   19.356   38.126   6.4046   38.126   6.4046   38.126   6.4046  220.092   19.356  220.092   19.356 0.000000 0.000000 
1 1 1   18   24    1 o  316.197   10.852   76.787   5.2523   71.180   7.1715   83.274   7.7139  303.493   15.490  328.706   15.332 -25.21320 21.79433 
1 1 1   18   24    2 o  475.929   9.5439  173.826   6.9524  173.361   9.7688  174.303   9.8968  474.654   13.446  475.913   13.586 -1.259674 19.11497 
1 1 1   18   24    3 o  150.403   18.686   17.755   4.2089   16.884   5.4205   19.077   6.6795  145.139   25.320  153.459   29.509 -8.319824 38.88287 
1 1 1   18   24    4 o  252.607   12.392   49.065   4.7912   54.117   6.3241   42.258   7.3405  264.467   15.693  232.546   20.844 31.92064 26.09086 
1 1 1   18   24    5 o  179.716   15.099   25.064   4.1149   25.064   4.1149   0.0000   0.0000  179.716   15.099  ?   ?  0.000000 15.09881 
1 1 1   18   24    6 o  143.329   18.572   16.148   3.9786   16.148   3.9786   0.0000   0.0000  143.329   18.572  ?   ?  0.000000 18.57195 
1 1 1   18   24    7 o  292.258   8.8355   65.532   3.9525   65.604   4.4294   65.251   8.7562  292.326   9.8994  289.515   19.880 2.810883 22.20831 
1 1 1   18   24    8 o  194.260   11.353   29.099   3.3611   28.074   3.7533   33.251   7.5526  190.577   12.943  205.068   24.550 -14.49152 27.75294 
1 1 1   18   24    9 o  169.007   12.619   22.096   3.2409   21.115   3.5668   26.738   7.7607  164.943   14.268  182.403   28.749 -17.46021 32.09492 
1 1 1   18   24   10 o  193.344   11.344   28.831   3.3424   31.193   3.6741   17.496   8.0500  201.042   11.994  145.225   36.311 55.81752 38.24064 
1 1 1   18   24   11 o  306.228   8.6111   71.953   4.0362   71.446   4.4520   74.295   9.5643  305.057   9.5347  308.708   20.355 -3.650818 22.47779 
1 1 1   18   24   12 o  260.545   11.941   52.218   4.7620   51.141   5.5651   55.161   9.2023  257.193   14.192  265.059   22.907 -7.866364 26.94708 
1 1 1   18   24   13 o  390.184   9.7089  116.920   5.7984  117.872   6.8236  114.445   10.999  391.516   11.387  384.231   18.702 7.284882 21.89561 
1 1 1   18   24   14 o  165.986   17.917   21.581   4.4798   27.866   5.2307   4.2832   8.6775  188.760   18.336   96.629   38.679 92.13161 42.80493 
1 1 1   18   24   15 o  363.753   10.417  101.696   5.7997  100.029   6.8586  105.880   10.865  360.434   12.432  368.770   19.316 -8.336212 22.97078 
1 1 1   18   24   16 o  311.313   14.756   74.831   7.0313   66.841   9.2482   85.777   10.824  292.254   20.810  331.020   21.480 -38.76581 29.90717 
1 1 1   18   24   17 o  311.640   11.709   74.760   5.5854   72.669   6.4940   80.704   10.949  306.900   13.824  320.581   22.454 -13.68106 26.36880 
1 1 1   18   24   18 o  235.006   14.411   42.812   5.1588   41.055   5.7963   49.505   11.315  229.637   16.603  247.650   30.496 -18.01320 34.72204 
1 1 1   18   24   19 o  256.566   14.154   50.994   5.5368   53.474   6.2992   42.569   11.610  262.377   15.758  227.584   34.403 34.79256 37.84064 
1 1 1   18   24   20 o  182.977   18.629   26.306   5.1447   30.255   5.8690   13.204   10.690  196.036   19.832  128.846   44.548 67.18938 48.76279 
1 1 1   18   24   21 f  146.852   23.529   17.352   5.1102   15.382   5.6814   25.694   11.694  136.790   28.076  171.762   44.217 -34.97173 52.37730 
1 1 1   18   24   22 o  109.094   29.830   9.8508   5.1243   11.561   5.7059   2.7218   11.650  117.790   31.165  102.256   43.232 15.53375 53.29386 
1 1 1   18   24   23 o  422.557   12.705  137.874   8.2174  137.874   8.2174   0.0000   0.0000  422.557   12.705  ?   ?  0.000000 12.70515 
1 1 1   18   24   24 o  137.926   26.196   15.580   5.3282   14.819   5.9770   18.522   11.759  133.322   30.013  146.006   46.619 -12.68385 55.44492 
1 1 1   18   24   25 o  202.775   15.383   32.086   4.7388   32.966   6.5369   31.112   6.8796  203.803   21.269  197.256   23.231 6.546448 31.49659 
1 1 1   18   24   26 o  293.222   11.997   66.384   5.3845   76.935   7.5235   55.304   7.7097  314.708   15.619  265.209   19.121 49.49854 24.68885 
1 1 1   18   24   27 o  101.457   18.163   8.2728   2.7171   8.6289   2.9699   6.4445   6.7294  103.344   19.490   95.499   35.084 7.845627 40.13444 
1 1 1   18   24   28 o  102.129   18.151   8.3862   2.7335   8.9599   3.0188   5.7751   6.4406  105.321   19.443   91.908   34.219 13.41354 39.35675 
1 1 1   18   24   29 o   85.357   21.503   5.9727   2.8079   5.8649   3.1159   6.4386   6.4778   84.608   23.313   94.481   34.466 -9.873009 41.61003 
1 1 1   18   24   30 o  146.893   14.106   16.899   3.1326   16.399   3.5171   18.817   6.8896  144.156   16.222  149.263   31.162 -5.107834 35.13165 
1 1 1   18   24   31 o  159.639   14.546   19.971   3.5153   19.261   4.0622   22.086   7.0150  156.000   17.304  162.661   29.251 -6.661896 33.98605 
1 1 1   18   24   32 o  127.949   17.273   13.038   3.2964   14.849   3.7075   6.2016   7.2025  136.409   18.212   95.081   36.020 41.32775 40.36236 
1 1 1   18   24   33 o   87.462   24.245   6.3316   3.3585   7.5928   3.8939   2.6678   6.6366   95.358   25.974   80.995   33.303 14.36291 42.23433 
1 1 1   18   24   34 o  103.969   33.937   9.0264   6.2088   1.7101   11.171   12.297   7.4687   95.471   41.380  118.910   37.049 -23.43861 55.54190 
1 1 1   18   24   35 o  165.948   12.818   21.510   3.2306   19.962   4.5029   23.153   4.6377  157.920   19.011  170.574   18.037 -12.65359 26.20570 
1 1 1   18   24   36 o  137.821   15.553   15.047   3.2235   15.728   4.3986   14.256   4.7376  138.964   21.364  130.962   24.536 8.002518 32.53345 
1 1 1   18   24   37 o  144.145   14.782   16.412   3.2153   17.479   4.4375   15.233   4.6652  146.885   20.278  135.783   23.285 11.10231 30.87696 
1 1 1   18   24   38 o   54.373   22.365   0.9767   2.9945   5.3592   4.3457  -2.9856   4.1321   82.422   28.408   49.552   22.953 32.86966 36.52193 
1 1 1   18   24   39 o  107.981   19.611   9.5741   3.1219   11.090   4.4043   8.0429   4.4259  114.029   25.833   96.763   28.173 17.26594 38.22377 
1 1 1   18   24   40 o  303.385   9.7472   71.288   4.5263   76.820   6.3545   65.591   6.4489  313.362   13.248  288.520   14.651 24.84201 19.75274 
1 1 1   18   24   41 o  127.374   18.289   13.201   3.4634   16.713   5.2018   10.405   4.6418  140.269   25.152  109.054   27.742 31.21445 37.44683 
1 1 1   18   24   42 o   73.762   27.715   3.8761   4.2438   1.8268   5.2137   7.8998   7.3055   69.681   29.159   97.420   36.410 -27.73889 46.64692 
1 1 1   18   24   43 o  207.782   17.213   34.775   5.4250   43.351   6.3370   11.247   10.496  231.588   18.019  110.537   43.064 121.0507 46.68171 
1 1 1   18   24   44 o  168.426   14.913   22.705   3.8047   25.344   5.4295   20.158   5.3332  174.621   20.718  153.893   23.377 20.72789 31.23627 
1 1 1   18   24   45 o   65.827   24.624   3.1537   3.3428   7.2061   4.8300  -0.5720   4.6311   89.538   29.962   57.949   25.818 31.58916 39.55128 
1 1 1   18   24   46 o  101.911   23.463   9.1398   3.5841   14.364   5.3932   5.0071   4.7966  124.758   28.823   78.516   29.472 46.24174 41.22285 
1 1 1   18   24   47 o   44.740   20.800  -2.3105   3.4412  -6.7880   5.1225   1.3720   4.6455   47.192   22.874   63.418   27.073 -16.22628 35.44243 
1 1 1   18   25    0 o   63.382   36.508   3.9924   5.6888   3.9924   5.6888   3.9924   5.6888   63.382   36.508   63.382   36.508 0.000000 0.000000 
1 1 1   18   25    1 o  244.661   12.971   46.196   4.8402   49.288   6.7859   42.992   6.9059  251.858   17.715  234.774   19.391 17.08398 26.26515 
1 1 1   18   25    2 o  227.108   13.755   39.867   4.7589   50.183   6.6028   28.715   6.8652  254.274   17.064  190.436   24.091 63.83847 29.52233 
1 1 1   18   25    3 o  155.531   24.911   19.341   5.7302   19.341   5.7302   0.0000   0.0000  155.531   24.911  ?   ?  0.000000 24.91124 
1 1 1   18   25    4 o  329.072   15.430   83.547   7.7717   83.547   7.7717   0.0000   0.0000  329.072   15.430  ?   ?  0.000000 15.42964 
1 1 1   18   25    5 o  191.128   15.646   28.376   4.5372   28.950   5.8522   27.510   7.1836  192.135   20.202  185.783   25.972 6.352295 32.90408 
1 1 1   18   25    6 o  279.409   9.8765   59.951   4.2239   61.626   4.9628   55.547   8.0458  283.121   11.452  266.877   19.838 16.24368 22.90648 
1 1 1   18   25    7 o  214.540   10.540   35.364   3.4612   33.849   3.8693   41.430   7.7433  209.418   12.123  229.629   22.312 -20.21074 25.39315 
1 1 1   18   25    8 o   57.363   23.003   1.2643   3.0752   0.0852   3.4264   6.1476   6.9730   54.807   23.320   96.758   35.688 -41.95151 42.63198 
1 1 1   18   25    9 o  263.930   9.4865   53.487   3.8324   53.728   4.3162   52.592   8.3302  264.407   10.665  259.191   21.183 5.215912 23.71586 
1 1 1   18   25   10 o  390.427   9.6108  117.064   5.7434  116.193   6.8856  119.057   10.413  388.669   11.574  392.208   17.345 -3.539856 20.85208 
1 1 1   18   25   11 o  187.120   15.510   27.225   4.4021   24.714   5.1012   34.550   8.7122  177.483   19.078  207.620   28.140 -30.13731 33.99734 
1 1 1   18   25   12 o   80.362   27.292   4.7563   4.0081   3.7010   4.5860   8.1702   8.2483   77.382   28.862  107.679   38.951 -30.29693 48.47859 
1 1 1   18   25   13 o  356.088   10.341   97.464   5.6361   90.341   6.5518  117.739   11.053  342.487   12.498  389.509   18.540 -47.02249 22.35929 
1 1 1   18   25   14 o  499.609   9.6702  191.782   7.3950  192.043   9.0066  191.243   12.954  499.474   11.781  496.862   17.034 2.612640 20.71089 
1 1 1   18   25   15 o  239.681   18.114   44.836   6.5963   45.129   8.7449   44.451   10.047  238.646   24.278  235.351   28.470 3.294693 37.41631 
1 1 1   18   25   16 o  339.005   10.991   88.433   5.7030   89.440   6.6009   85.467   11.326  340.629   12.661  329.686   22.580 10.94281 25.88744 
1 1 1   18   25   17 o  168.673   18.371   22.365   4.6664   15.774   5.2455   47.369   10.217  139.455   25.514  242.952   27.985 -103.4971 37.87043 
1 1 1   18   25   18 o  213.928   15.723   35.630   5.1123   37.543   5.8027   28.997   10.806  219.204   17.439  184.795   39.407 34.40939 43.09294 
1 1 1   18   25   19 o  281.881   13.010   61.333   5.6134   61.053   6.4730   62.182   11.273  280.421   15.137  278.884   26.736 1.536957 30.72389 
1 1 1   18   25   20 o  170.221   20.075   22.939   5.1298   22.971   5.7897   22.823   11.064  169.508   22.901  161.801   43.664 7.706970 49.30555 
1 1 1   18   25   21 o  368.418   13.253  104.884   7.4735  104.884   7.4735   0.0000   0.0000  368.418   13.253  ?   ?  0.000000 13.25298 
1 1 1   18   25   22 o  271.752   16.041   57.537   6.6426   57.537   6.6426   0.0000   0.0000  271.752   16.041  ?   ?  0.000000 16.04084 
1 1 1   18   25   23 o  102.286   30.411   8.6002   5.1112   11.798   5.7083  -4.3340   11.480  118.674   31.063   87.519   39.676 31.15445 50.38939 
1 1 1   18   25   24 o  169.558   21.471   22.942   5.4476   27.731   6.1284   4.9100   11.892  186.508   21.883  107.187   44.376 79.32140 49.47810 
1 1 1   18   25   25 o  252.904   15.931   49.918   6.1355   51.133   6.9356   45.543   13.158  255.348   17.858  231.118   38.553 24.22969 42.48841 
1 1 1   18   25   26 o  417.877   10.057  134.525   6.4326  140.498   8.9026  128.000   9.3049  425.873   13.657  405.996   14.973 19.87708 20.26636 
1 1 1   18   25   27 o  209.053   15.640   34.180   4.9684   31.081   6.9239   37.469   7.1334  196.663   23.465  216.827   21.789 -20.16376 32.02108 
1 1 1   18   25   28 o   69.141   22.796   3.6588   2.7988   2.9973   3.0819   6.7716   6.6855   66.134   23.826   96.290   35.031 -30.15617 42.36534 
1 1 1   18   25   29 o  203.319   11.280   32.028   3.4967   29.733   3.9204   40.953   7.7324  195.438   13.183  226.110   22.647 -30.67188 26.20392 
1 1 1   18   25   30 o  232.410   11.151   41.731   3.9667   42.938   4.5913   38.177   7.8772  235.059   12.809  217.437   24.072 17.62181 27.26815 
1 1 1   18   25   31 o  340.437   9.4010   89.325   4.8987   88.206   5.8142   92.062   9.0945  337.788   11.245  342.297   17.416 -4.508118 20.73092 
1 1 1   18   25   32 o   68.960   29.660   0.3120   5.6514   4.4150   9.8149  -1.7230   6.9122   97.504   40.336   70.410   31.443 27.09419 51.14407 
1 1 1   18   25   33 o   58.753   26.917  -3.1094   5.4651  -6.3835   8.0677  -0.3331   7.4292   67.131   31.420   76.140   33.360 -9.009918 45.82716 
1 1 1   18   25   34 o  133.222   18.808   14.265   3.7286   17.697   4.2225   2.1140   7.9442  148.568   19.004   84.415   35.695 64.15259 40.43842 
1 1 1   18   25   35 o  145.738   17.266   16.932   3.7765   17.258   4.1501   15.360   9.1078  146.574   18.942  130.076   40.975 16.49788 45.14167 
1 1 1   18   25   36 o  146.640   14.659   16.973   3.2462   18.263   4.4556   15.514   4.7393  150.346   19.847  136.970   23.449 13.37628 30.72028 
1 1 1   18   25   37 o   93.528   21.663   7.2953   3.0403   14.365   4.2791   0.0879   4.3205  132.088   21.934   59.784   25.823 72.30404 33.88145 
1 1 1   18   25   38 o  223.255   13.750   39.128   4.6758   24.476   9.8612   43.377   5.3108  161.490   40.083  234.619   14.866 -73.12880 42.75035 
1 1 1   18   25   39 o  158.623   14.038   19.880   3.3732   17.988   4.8415   21.665   4.7024  147.469   22.132  163.528   19.150 -16.05908 29.26658 
1 1 1   18   25   40 o  184.743   15.158   27.092   4.2486   28.224   5.1008   24.527   7.6778  187.232   18.021  166.561   31.264 20.67049 36.08588 
1 1 1   18   25   41 o   82.543   29.202   5.4961   4.6098   5.9943   5.1056   3.2988   10.723   85.896   30.696   92.795   40.381 -6.899010 50.72337 
1 1 1   18   25   42 o  115.159   29.168   11.901   5.1471   15.458   6.0278   2.3275   9.8893  130.669   30.665   87.522   38.414 43.14669 49.15306 
1 1 1   18   25   43 o  147.469   16.839   17.652   3.7328   16.093   5.7152   18.811   4.9294  133.840   28.755  149.285   22.253 -15.44469 36.36006 
1 1 1   18   25   44 o  143.818   16.383   16.814   3.5420   15.984   5.2412   17.513   4.8055  134.250   26.447  143.187   22.682 -8.937088 34.84126 
1 1 1   18   25   45 o   93.524   24.479   7.7832   3.5451   3.7378   5.1932   11.314   4.8512   74.467   29.882  110.691   28.471 -36.22434 41.27400 
1 1 1   18   25   46 o   58.026   23.844   1.5956   3.3994  -2.4548   4.8921   5.3773   4.7270   54.111   25.033   79.663   29.384 -25.55137 38.60112 
1 1 1   18   26    2 o  193.290   15.407   29.024   4.5204   25.863   6.1480   32.743   6.6695  180.767   22.722  203.973   21.695 -23.20624 31.41621 
1 1 1   18   26    3 o  320.284   11.054   78.867   5.4193   76.479   7.4742   81.514   7.8691  314.703   15.517  324.839   15.827 -10.13602 22.16404 
1 1 1   18   26    4 o  121.391   23.170   11.869   4.1480   8.3518   5.4929   16.536   6.3276  102.444   31.749  142.098   30.032 -39.65427 43.70259 
1 1 1   18   26    5 o  316.150   11.210   76.861   5.4246   74.107   7.1142   80.686   8.3843  309.851   15.000  322.478   17.047 -12.62692 22.70698 
1 1 1   18   26    6 o  173.947   13.949   23.477   3.6827   23.933   4.3448   22.315   6.9405  175.188   16.394  166.095   28.316 9.093185 32.71901 
1 1 1   18   26    7 o  176.354   12.735   24.075   3.4145   24.606   3.8614   22.174   7.3113  178.036   14.291  164.994   30.058 13.04219 33.28228 
1 1 1   18   26    8 o  291.543   11.156   65.373   4.9783   68.701   6.0450   58.361   8.7760  298.570   13.228  272.936   21.173 25.63376 24.96500 
1 1 1   18   26    9 o  239.910   12.620   44.455   4.6180   45.293   5.5241   42.512   8.4150  241.712   15.005  231.806   24.068 9.906158 28.36230 
1 1 1   18   26   10 o  755.404   7.6104  437.772   8.7994  435.288   10.065  445.827   18.126  752.971   8.7331  759.399   15.594 -6.427979 17.87272 
1 1 1   18   26   11 o  497.446   7.6282  189.851   5.8081  188.209   6.5327  196.043   12.688  495.120   8.6202  503.208   16.474 -8.087524 18.59260 
1 1 1   18   26   12 o  138.638   16.436   15.085   3.4199   15.310   3.7190   13.854   8.7042  139.378   17.842  129.433   39.942 9.944824 43.74553 
1 1 1   18   26   13 o  144.096   27.247   16.913   5.7895   22.635   7.8803   10.202   8.5338  165.620   32.245  115.203   39.803 50.41744 51.22545 
1 1 1   18   26   14 o  192.153   16.317   28.805   4.7537   29.206   5.5315   27.670   9.2969  192.860   18.984  182.574   34.533 10.28564 39.40736 
1 1 1   18   26   15 o   88.998   28.360   6.2212   4.3533   5.3142   4.8902   9.6845   9.5558   85.798   30.103  115.256   41.889 -29.45823 51.58342 
1 1 1   18   26   16 o  239.557   13.942   44.491   5.0899   37.941   5.6813   71.123   11.457  220.457   16.967  299.168   25.256 -78.71150 30.42593 
1 1 1   18   26   17 o   68.396   27.705   1.7670   4.5097   0.4679   5.0312   7.0766   10.172   66.799   28.335  108.517   42.360 -41.71827 50.96338 
1 1 1   18   26   18 o  374.472   11.148  108.033   6.3895  103.057   7.3415  123.574   12.975  365.280   13.131  396.440   21.462 -31.16034 25.16002 
1 1 1   18   26   19 o  361.237   11.505  100.598   6.3612   99.648   7.2926  103.622   13.009  359.097   13.268  361.728   23.625 -2.631256 27.09571 
1 1 1   18   26   20 o  175.862   22.080   24.670   5.8125   24.670   5.8125   0.0000   0.0000  175.862   22.080  ?   ?  0.000000 22.08032 
1 1 1   18   26   21 o  312.491   14.793   75.688   7.0757   75.688   7.0757   0.0000   0.0000  312.491   14.793  ?   ?  0.000000 14.79322 
1 1 1   18   26   22 o  287.747   13.726   64.083   6.0454   61.852   6.7376   73.297   13.692  281.798   15.683  300.097   30.220 -18.29956 34.04723 
1 1 1   18   26   23 o  185.814   19.321   27.306   5.4148   27.363   6.0547   27.077   12.101  185.221   21.772  174.213   45.048 11.00789 50.03341 
1 1 1   18   26   24 o  148.825   25.882   18.125   5.6817   23.089   6.2885  -3.9388   13.257  168.682   25.123   94.502   42.758 74.17976 49.59231 
1 1 1   18   26   25 o  305.717   14.019   72.464   6.5602   73.513   7.4668   68.912   13.736  306.950   15.948  289.292   31.532 17.65851 35.33531 
1 1 1   18   26   26 o  144.419   27.515   17.272   5.8601   18.309   6.5782   13.289   12.898  147.806   30.100  129.475   48.381 18.33136 56.97978 
1 1 1   18   26   27 o  172.336   19.108   23.585   4.9554   23.232   6.9081   23.959   7.1125  167.746   27.884  170.234   28.289 -2.487259 39.72164 
1 1 1   18   26   28 o  222.808   18.011   39.144   6.0898   35.388   10.200   41.224   7.5914  204.503   33.763  227.032   22.127 -22.52898 40.36776 
1 1 1   18   26   29 o   60.706   23.643   1.9486   3.1632  -0.8168   3.5219   13.487   7.1942   51.622   22.781  124.751   35.803 -73.12943 42.43646 
1 1 1   18   26   30 o  372.458   8.4847  106.786   4.8371  108.465   5.5959  101.828   9.6200  375.025   9.7486  360.358   17.441 14.66797 19.98059 
1 1 1   18   26   31 o  129.528   27.760   14.119   5.3381   18.575   7.9183   10.406   7.2274  145.510   35.798  111.057   36.632 34.45290 51.21931 
1 1 1   18   26   32 o  113.403   19.422   10.424   3.2499   8.7758   3.5719   18.346   7.8318  102.789   23.248  144.372   35.653 -41.58332 42.56267 
1 1 1   18   26   33 o   89.149   23.807   6.6225   3.3099   5.9274   3.6850   9.5252   7.5301   84.905   25.953  107.308   37.371 -22.40290 45.49919 
1 1 1   18   26   34 f   95.923   23.578   7.6995   3.4373   5.9734   3.6728   19.877   9.7555   85.026   25.893  146.564   41.569 -61.53790 48.97407 
1 1 1   18   26   35 o  182.490   14.113   26.156   3.9115   25.775   4.3693   27.695   8.7784  180.502   15.980  178.174   33.416 2.327972 37.04024 
1 1 1   18   26   36 o  292.667   12.517   66.688   5.6073   66.688   5.6073   0.0000   0.0000  292.667   12.517  ?   ?  0.000000 12.51726 
1 1 1   18   26   37 o  113.683   18.549   10.525   3.1163   12.358   4.1559   8.1710   4.7101  121.556   23.183   97.368   29.250 24.18835 37.32265 
1 1 1   18   26   38 o  194.499   11.747   29.562   3.4806   31.422   4.8606   27.605   4.9864  198.777   16.114  185.473   17.782 13.30389 23.99768 
1 1 1   18   26   39 o   65.435   26.507   2.0539   4.1284   3.2583   4.4948  -4.4423   10.439   72.186   28.164   78.476   36.397 -6.289604 46.02162 
1 1 1   18   26   40 o  216.867   14.379   37.214   4.7459   37.944   5.3000   34.258   10.661  218.161   15.983  190.991   37.805 27.17053 41.04496 
1 1 1   18   26   41 o  183.539   13.033   26.594   3.6376   29.317   5.4961   24.472   4.8526  189.469   19.218  173.326   18.581 16.14276 26.73117 
1 1 1   18   26   42 o   59.492   23.889   1.8467   3.3214   3.9353   5.2422   0.4460   4.2931   76.438   30.235   59.502   25.721 16.93628 39.69555 
1 1 1   18   26   43 o  185.239   14.718   27.488   4.1385   24.702   5.4955   31.137   6.2903  171.389   21.416  192.376   21.744 -20.98737 30.51960 
1 1 1   18   26   44 o  120.810   20.040   12.323   3.5759   11.466   5.3986   12.994   4.7731  110.029   30.825  120.075   26.665 -10.04583 40.75747 
1 1 1   18   26   45 o   45.010   20.786  -1.9776   3.3510  -1.3632   4.8851  -2.5236   4.6053   56.754   25.788   52.254   24.214 4.499432 35.37433 
1 1 1   18   27    0 o  182.542   23.601   27.021   6.2905   27.021   6.2905   27.021   6.2905  182.542   23.601  182.542   23.601 0.000000 0.000000 
1 1 1   18   27    1 f  354.128   10.984   96.455   5.9536   95.810   8.3331   97.128   8.5090  352.084   15.463  354.447   15.684 -2.362671 22.02469 
1 1 1   18   27    2 o  467.981   10.079  168.316   7.2195  165.362   9.9029  171.667   10.547  462.958   13.975  471.525   14.614 -8.566895 20.22042 
1 1 1   18   27    3 o  107.279   35.286   9.0069   6.7076   0.0000   0.0000   9.0069   6.7076  ?   ?   107.279   35.286 0.000000 35.28590 
1 1 1   18   27    4 o  479.156   15.146  177.408   11.108   0.0000   0.0000  177.408   11.108  ?   ?   479.156   15.146 0.000000 15.14629 
1 1 1   18   27    5 o  166.802   30.048   22.710   7.3895   0.0000   0.0000   22.710   7.3895  ?   ?   166.802   30.048 0.000000 30.04812 
1 1 1   18   27    6 o  373.042   16.569  107.763   9.4607   0.0000   0.0000  107.763   9.4607  ?   ?   373.042   16.569 0.000000 16.56906 
1 1 1   18   27    7 o  346.594   10.221   92.355   5.4224   90.920   6.6707   95.151   9.3096  343.468   12.689  350.302   17.363 -6.834320 21.50496 
1 1 1   18   27    8 o  131.706   21.635   13.883   4.2099   20.926   5.1174  -0.8639   7.4050  162.486   21.072   76.589   33.437 85.89772 39.52328 
1 1 1   18   27    9 o   73.109   27.009   3.4020   3.9970   2.1586   4.6784   6.7622   7.6909   71.070   28.417  100.693   37.412 -29.62250 46.98119 
1 1 1   18   27   10 o  234.105   13.391   42.425   4.7785   46.099   5.7316   34.051   8.6536  243.614   15.451  205.473   28.264 38.14127 32.21127 
1 1 1   18   27   11 o  331.380   14.197   84.844   7.2009   87.547   10.286   82.248   10.084  334.428   20.190  324.026   20.436 10.40137 28.72748 
1 1 1   18   27   12 o  308.351   15.059   73.570   7.1075   66.060   9.7123   82.229   10.429  289.600   22.077  323.629   21.170 -34.02859 30.58702 
1 1 1   18   27   13 o  225.229   14.438   39.384   4.9512   35.896   5.7434   49.477   9.7698  214.207   17.675  248.858   26.034 -34.65097 31.46708 
1 1 1   18   27   14 o  419.005   10.175  135.079   6.5255  131.222   7.6472  145.409   12.516  412.525   12.111  431.922   18.931 -19.39713 22.47389 
1 1 1   18   27   15 o  243.378   13.840   45.935   5.1344   47.850   6.0295   40.884   9.7928  247.882   15.977  224.503   29.189 23.37915 33.27515 
1 1 1   18   27   16 o  164.757   19.176   21.456   4.7452   22.079   5.5069   19.661   9.3513  166.294   22.189  151.124   39.855 15.16965 45.61575 
1 1 1   18   27   17 o   71.691   28.113   2.6183   4.4957   0.1740   4.9890   13.176   10.369   65.481   28.008  127.413   43.883 -61.93207 52.05886 
1 1 1   18   27   18 o  253.239   14.352   49.809   5.5404   50.880   6.2855   46.079   11.731  255.460   16.158  236.115   33.392 19.34459 37.09600 
1 1 1   18   27   19 o  394.046   13.075  120.018   7.8858  120.018   7.8858   0.0000   0.0000  394.046   13.075  ?   ?  0.000000 13.07467 
1 1 1   18   27   20 o  231.070   16.156   41.695   5.6782   41.481   6.4280   42.456   12.115  229.786   18.431  224.519   36.506 5.266907 40.89522 
1 1 1   18   27   21 o  379.183   11.825  110.993   6.8630  111.975   7.8934  107.951   13.893  380.342   13.559  367.858   24.820 12.48352 28.28162 
1 1 1   18   27   22 o   76.078   29.908   3.0263   5.0998   1.1206   5.5655   13.007   12.736   71.620   30.058  129.201   48.117 -57.58015 56.73388 
1 1 1   18   27   23 o   88.791   31.227   5.8636   5.2639   4.0626   5.7525   15.134   13.051   82.889   31.995  135.257   48.985 -52.36723 58.50797 
1 1 1   18   27   24 o  220.249   17.622   38.137   5.8908   39.616   6.5719   32.094   13.288  223.896   19.368  188.092   46.435 35.80457 50.31174 
1 1 1   18   27   25 o   74.376   32.165   0.0732   6.7199  -3.5679   7.8813   9.7692   12.861   71.939   32.714  120.057   47.399 -48.11754 57.59240 
1 1 1   18   27   26 f  192.691   26.740   30.368   7.6740   36.715   9.1996   15.849   13.915  210.894   29.290  136.950   50.429 73.94409 58.31787 
1 1 1   18   27   27 f  365.243   13.581  103.529   7.5924  100.516   13.982  104.788   9.0416  352.566   26.095  366.422   16.121 -13.85648 30.67317 
1 1 1   18   27   28 o   90.214   33.253   5.8029   6.0524 -12.4986   10.386   15.214   7.4476   69.902   33.549  132.065   35.901 -62.16309 49.13672 
1 1 1   18   27   29 o  361.203   11.879  101.004   6.5674   89.016   8.9062  115.293   9.7230  336.503   17.351  383.846   16.549 -47.34326 23.97737 
1 1 1   18   27   30 o  185.634   20.183   27.573   5.6424   24.865   7.5613   30.974   8.4758  171.908   29.817  192.309   29.756 -20.40080 42.12431 
1 1 1   18   27   31 o  292.297   9.6056   65.922   4.2975   65.954   4.9382   65.822   8.7244  291.984   11.049  287.619   19.941 4.365356 22.79718 
1 1 1   18   27   32 f  134.372   16.994   14.397   3.4170   19.213   3.7713  -7.6818   8.0752  155.810   16.043   64.848   30.686 90.96273 34.62627 
1 1 1   18   27   33 o   96.641   23.326   7.8121   3.4111   9.2977   3.6781  -1.3176   9.1180  105.530   23.386   80.831   36.104 24.69813 43.01642 
1 1 1   18   27   34 o  244.359   11.398   46.323   4.2631   44.795   4.9268   50.876   8.5046  239.286   13.507  250.443   22.423 -11.15697 26.17704 
1 1 1   18   27   35 o  136.116   18.190   14.933   3.6949   16.085   4.3032   11.701   7.2090  140.378   20.644  114.461   36.497 25.91706 41.93118 
1 1 1   18   27   36 f  218.580   12.597   37.382   4.1966   39.984   4.9906   31.100   7.7542  225.273   14.551  191.836   27.167 33.43726 30.81899 
1 1 1   18   27   37 o   91.322   26.056   7.1446   3.8211   3.8512   4.1028   28.687   10.493   73.566   27.327  173.867   40.227 -100.3005 48.63128 
1 1 1   18   27   38 o  210.155   14.664   34.939   4.6873   41.253   5.1734   5.9989   11.075  228.323   14.885  100.176   42.241 128.1474 44.78672 
1 1 1   18   27   39 o  122.025   17.872   12.138   3.2391   15.137   4.6600   9.3338   4.5056  133.769   23.623  102.892   27.904 30.87708 36.56094 
1 1 1   18   27   40 o   76.233   24.168   4.8858   3.1646   5.3825   4.7142   4.4783   4.2696   81.644   29.460   76.248   27.956 5.396439 40.61293 
1 1 1   18   27   41 o  101.988   23.389   9.0146   3.5734   13.259   5.7153   6.2905   4.5787  119.726   30.958   85.331   29.169 34.39522 42.53528 
1 1 1   18   27   42 o   57.082   23.610   1.3210   3.3617  -2.5373   4.8851   4.7915   4.6331   54.398   25.113   77.751   29.008 -23.35231 38.36828 
1 1 1   18   27   43 o   42.566   19.953  -2.7046   3.2744  -4.6273   4.7855  -1.0120   4.4900   49.101   23.346   55.635   25.054 -6.534061 34.24560 
1 1 1   18   28    0 o  564.672   14.325  245.642   12.363  245.642   12.363  245.642   12.363  564.672   14.325  564.672   14.325 0.000000 0.000000 
1 1 1   18   28    1 o  173.992   17.878   23.745   4.6936   29.054   6.8082   18.936   6.4795  191.010   23.803  152.135   28.882 38.87491 37.42658 
1 1 1   18   28    2 o  346.462   11.274   92.405   5.9786   93.391   8.2125   91.292   8.7204  347.419   15.444  343.202   16.600 4.216461 22.67332 
1 1 1   18   28    3 o  631.230   10.364  306.463   10.014  276.701   13.260  345.970   15.277  598.383   14.477  668.903   14.921 -70.51965 20.79023 
1 1 1   18   28    4 o  201.930   24.577   32.517   7.4397   0.0000   0.0000   32.517   7.4397  ?   ?   201.930   24.577 0.000000 24.57734 
1 1 1   18   28    5 o  352.322   17.792   96.657   9.5638   0.0000   0.0000   96.657   9.5638  ?   ?   352.322   17.792 0.000000 17.79218 
1 1 1   18   28    6 o  189.654   16.732   28.104   4.8074   19.858   6.0642   42.051   7.8869  156.610   26.225  230.564   22.640 -73.95372 34.64621 
1 1 1   18   28    7 o   96.599   25.631   7.6299   3.8523   4.6163   4.5332   15.463   7.3085   81.195   28.934  135.645   34.976 -54.45047 45.39219 
1 1 1   18   28    8 o  119.583   23.054   11.585   4.0668   10.344   4.7697   14.889   7.7829  111.980   27.924  132.906   36.932 -20.92612 46.29995 
1 1 1   18   28    9 o  190.113   14.947   28.139   4.3144   26.479   5.0229   32.809   8.4256  183.652   18.104  201.384   28.100 -17.73251 33.42672 
1 1 1   18   28   10 o  160.110   17.687   20.163   4.2621   24.220   4.9223   8.0074   8.5201  175.413   18.618  106.883   39.444 68.53003 43.61684 
1 1 1   18   28   11 o  313.967   9.4123   75.791   4.5233   78.433   5.0522   65.119   10.155  319.239   10.339  286.768   23.337 32.47119 25.52485 
1 1 1   18   28   12 o   72.864   25.317   3.8276   3.4550   4.4092   3.7711   0.7887   8.6199   77.283   26.472   86.008   36.802 -8.724976 45.33354 
1 1 1   18   28   13 o  112.467   26.520   10.431   4.4910   10.559   5.2128   10.061   8.8462  112.742   29.768  114.471   40.458 -1.728714 50.22959 
1 1 1   18   28   14 o  161.410   20.143   20.679   4.8683   21.428   5.5812   18.296   9.9546  163.516   22.930  145.469   42.222 18.04691 48.04708 
1 1 1   18   28   15 f  216.611   15.735   36.594   5.1814   37.044   5.9600   35.199   10.485  217.303   18.083  205.385   34.583 11.91850 39.02491 
1 1 1   18   28   16 o  279.467   13.161   60.368   5.6298   59.390   6.5040   63.293   11.242  276.266   15.443  280.880   26.462 -4.614319 30.63821 
1 1 1   18   28   17 o   90.828   31.984   6.0864   5.5235   6.0864   5.5235   0.0000   0.0000   90.828   31.984  ?   ?  0.000000 31.98378 
1 1 1   18   28   18 o  132.182   29.444   14.571   5.8044   14.571   5.8044   0.0000   0.0000  132.182   29.444  ?   ?  0.000000 29.44358 
1 1 1   18   28   19 o  132.822   26.322   14.523   5.1620   21.965   5.7723 -15.1997   11.535  165.115   23.503   72.607   34.977 92.50723 42.14045 
1 1 1   18   28   20 o  278.684   14.282   60.365   6.0717   57.585   6.7778   71.660   13.662  271.513   16.386  295.965   30.601 -24.45172 34.71173 
1 1 1   18   28   21 o  129.259   33.312   14.217   6.6322   16.611   7.7932   7.9293   12.629  138.878   36.268  115.677   46.536 23.20186 58.99926 
1 1 1   18   28   22 o  194.390   23.678   30.407   6.8996   28.715   8.1441   34.710   12.986  186.375   29.533  197.247   44.118 -10.87236 53.09096 
1 1 1   18   28   23 o  267.298   18.459   56.232   7.5057   53.072   9.0534   63.180   13.423  257.590   23.211  275.880   32.405 -18.29086 39.86057 
1 1 1   18   28   24 o  263.677   16.294   54.426   6.5439   48.595   7.2681   79.387   15.038  247.973   19.301  309.354   32.231 -61.38127 37.56844 
1 1 1   18   28   25 f   74.940   30.485   2.3305   5.4869   1.9865   6.1236   3.7317   12.357   76.845   31.831  104.436   44.359 -27.59120 54.59782 
1 1 1   18   28   26 o  194.535   29.640   31.487   8.5468   40.950   11.077   17.562   13.436  219.739   34.033  140.508   49.840 79.23140 60.35176 
1 1 1   18   28   27 o  236.256   25.102   45.302   8.9382   43.980   11.497   47.321   14.211  227.540   34.058  230.732   41.777 -3.191727 53.90083 
1 1 1   18   28   28 o   89.658   30.938   6.2651   5.1550  -1.1379   6.8746   15.775   7.7916   71.592   31.699  133.801   36.866 -62.20882 48.62009 
1 1 1   18   28   29 o   62.961   27.872  -1.0680   5.3125 -11.1640   7.2585   10.579   7.7962   55.729   27.061  112.123   38.064 -56.39472 46.70288 
1 1 1   18   28   30 o   62.250   27.664  -1.2194   5.2827  -5.6985   7.4582   3.2904   7.4837   64.993   30.352   85.889   35.346 -20.89552 46.58886 
1 1 1   18   28   31 o  172.952   13.447   23.422   3.5317   22.292   3.9239   28.241   8.1032  168.104   15.422  182.571   30.042 -14.46716 33.76944 
1 1 1   18   28   32 o   65.924   24.770   2.8013   3.3898   3.9292   3.6292  -4.9110   9.4902   72.971   25.901   75.681   34.960 -2.709923 43.50940 
1 1 1   18   28   33 o  126.275   18.168   12.864   3.4103   12.850   3.8124   12.921   7.6298  125.329   20.588  119.844   37.464 5.485573 42.74811 
1 1 1   18   28   34 o   72.727   24.695   4.1314   3.2816   4.3676   3.6992   3.2589   7.1095   75.272   26.195   83.154   34.359 -7.882278 43.20557 
1 1 1   18   28   35 o   96.696   25.921   8.0164   3.9147   7.1483   4.2225   13.327   10.444   91.497   27.741  120.265   43.779 -28.76773 51.82805 
1 1 1   18   28   36 o   91.354   27.068   7.1651   4.0543   7.4660   4.4160   5.5510   10.228   93.084   28.402   97.683   40.856 -4.598625 49.75873 
1 1 1   18   28   37 o  127.266   20.140   13.347   3.7926   13.122   4.4861   13.910   7.1006  124.190   24.471  122.310   35.706 1.880447 43.28645 
1 1 1   18   28   38 o  147.011   17.702   17.520   3.9032   16.942   4.6159   18.970   7.3115  142.521   21.857  143.386   33.856 -0.8644104 40.29857 
1 1 1   18   28   39 o   60.692   23.479   2.2852   3.1032   0.0616   4.3219   4.6514   4.4583   58.618   25.570   77.491   28.543 -18.87301 38.32140 
1 1 1   18   28   40 o  262.149   16.742   55.403   6.6826   0.0000   0.0000   55.403   6.6826  ?   ?   262.149   16.742 0.000000 16.74176 
1 1 1   18   28   41 o   75.483   24.913   4.8406   3.3426   7.5405   5.0049   2.6667   4.4910   91.231   30.500   68.202   27.640 23.02921 41.16083 
1 1 1   18   28   42 o  172.398   21.183   25.087   5.4722   29.618   8.5743   21.974   7.1079  176.858   32.885  153.113   31.383 23.74492 45.45676 
1 1 1   18   29    0 o  279.181   19.340   61.062   8.1734   61.062   8.1734   61.062   8.1734  279.181   19.340  279.181   19.340 0.000000 0.000000 
1 1 1   18   29    1 o  308.999   18.053   74.530   8.5014   0.0000   0.0000   74.530   8.5014  ?   ?   308.999   18.053 0.000000 18.05321 
1 1 1   18   29    2 o  132.289   34.136   14.710   6.9583   0.0000   0.0000   14.710   6.9583  ?   ?   132.289   34.136 0.000000 34.13586 
1 1 1   18   29    3 o  212.152   23.938   35.868   7.6375   0.0000   0.0000   35.868   7.6375  ?   ?   212.152   23.938 0.000000 23.93825 
1 1 1   18   29    4 o  401.739   10.979  124.290   6.7509  121.692   9.0065  127.621   10.199  396.499   14.840  405.527   16.430 -9.027527 22.14040 
1 1 1   18   29    5 o  242.067   14.025   45.452   5.1741   48.837   6.7177   40.517   8.1126  249.985   17.670  225.615   23.854 24.36995 29.68592 
1 1 1   18   29    6 o  204.786   14.094   32.579   4.3909   32.415   5.2017   32.988   8.1895  203.622   16.841  202.134   27.156 1.487549 31.95460 
1 1 1   18   29    7 o  427.048   9.7029  140.270   6.3423  134.574   7.5385  154.068   11.734  417.794   11.788  445.181   17.220 -27.38742 20.86843 
1 1 1   18   29    9 o  155.928   18.711   19.216   4.3764   20.203   5.1077   16.489   8.4882  159.155   21.519  138.955   38.554 20.19974 44.15227 
1 1 1   18   29   10 o  218.806   14.332   37.208   4.7735   36.839   5.5232   38.296   9.4889  217.111   16.750  216.939   29.328 0.1717377 33.77420 
1 1 1   18   29   11 o  193.171   13.322   28.973   3.9150   28.564   4.3184   30.861   9.2763  191.464   14.852  192.987   32.562 -1.523651 35.78943 
1 1 1   18   29   12 o  342.469   9.3512   90.205   4.9018   87.305   5.4378  102.774   11.323  336.694   10.552  361.617   20.541 -24.92340 23.09273 
1 1 1   18   29   13 o  353.962   11.324   96.594   6.1351  101.240   7.3153   85.580   11.264  361.897   13.206  328.929   22.508 32.96802 26.09646 
1 1 1   18   29   14 o  129.174   43.211   13.910   10.046   0.0000   0.0000   13.910   10.046  ?   ?   129.174   43.211 0.000000 43.21106 
1 1 1   18   29   15 o  170.188   22.519   23.201   5.7220   23.201   5.7220   0.0000   0.0000  170.188   22.519  ?   ?  0.000000 22.51883 
1 1 1   18   29   17 o  298.863   15.813   69.618   7.2078   71.189   8.9198   66.662   12.235  300.833   19.476  286.845   28.233 13.98721 34.29916 
1 1 1   18   29   18 o   64.410   29.062  -2.5414   6.0763  -9.4869   7.3793   12.084   10.708   59.248   28.394  123.309   44.413 -64.06189 52.71406 
1 1 1   18   29   19 o  110.692   34.576   10.194   6.5003  -2.2287   7.6952   41.138   12.145   73.966   33.093  219.574   37.482 -145.6083 50.00091 
1 1 1   18   29   20 o  223.429   17.957   39.279   6.0892   40.015   6.8654   36.564   13.183  224.733   20.173  202.776   43.759 21.95718 48.18521 
1 1 1   18   29   21 o   54.981   25.658  -4.5380   5.3146  -4.9012   5.8661  -2.8743   12.555   57.831   26.977   93.205   41.942 -35.37358 49.86830 
1 1 1   18   29   22 o  155.593   24.595   19.742   5.6627   18.270   6.3312   25.628   12.662  147.884   29.006  166.870   47.368 -18.98549 55.54326 
1 1 1   18   29   23 o  114.578   31.060   11.138   5.5838   9.7986   6.2974   16.066   12.077  108.223   34.069  135.767   47.325 -27.54398 58.31221 
1 1 1   18   29   24 o  197.901   20.477   31.238   6.1129   35.126   6.9848   18.513   12.635  209.281   22.141  143.131   48.459 66.14972 53.27712 
1 1 1   18   29   25 o  249.338   23.342   50.015   8.8045   46.889   11.444   54.550   13.783  236.134   32.526  251.934   36.829 -15.80035 49.13584 
1 1 1   18   29   26 o   76.234   31.659   1.9481   6.0798   1.5839   6.7529   3.5068   13.970   78.262   32.991  107.730   46.484 -29.46867 57.00167 
1 1 1   18   29   27 o  229.513   19.472   41.883   6.7759   45.025   7.7960   32.178   13.701  236.954   21.737  184.288   48.069 52.66591 52.75534 
1 1 1   18   29   28 o  160.262   28.322   21.551   6.6934   27.190   7.7127   4.3491   13.471  180.104   28.959  107.217   45.945 72.88689 54.31020 
1 1 1   18   29   29 o  111.251   31.091   10.662   5.4993   19.753   7.6838   1.1146   7.8741  150.141   34.200   81.380   35.007 68.76086 48.93956 
1 1 1   18   29   30 o  107.668   30.819   9.9913   5.3370   11.835   7.7985   8.3668   7.3196  116.146   38.040  102.077   36.724 14.06859 52.87432 
1 1 1   18   29   31 o  101.364   33.640   8.6974   6.0913   0.7007   7.7103   21.976   9.9355   79.122   34.336  153.362   41.373 -74.24050 53.76465 
1 1 1   18   29   32 o   96.171   23.171   7.7757   3.3704   8.3620   3.7907   5.5626   7.3648   99.294   24.967   91.464   35.945 7.829361 43.76569 
1 1 1   18   29   33 o  185.362   14.798   27.136   4.1636   29.814   4.4920   10.804   11.093  194.167   15.237  113.923   44.303 80.24419 46.84957 
1 1 1   18   29   34 o  175.686   15.296   24.479   4.0723   24.244   4.3975   25.891   10.790  174.263   16.691  163.221   42.699 11.04192 45.84547 
1 1 1   18   29   35 o  163.607   15.659   21.319   3.8734   22.978   4.5392   16.873   7.4289  168.964   17.820  135.208   35.459 33.75525 39.68466 
1 1 1   18   29   36 o  198.977   13.614   31.222   4.1215   35.099   5.0277   23.278   7.1963  209.994   15.757  162.678   30.006 47.31532 33.89192 
1 1 1   18   29   37 o  111.862   23.837   10.729   3.9566   13.340   4.8057   5.2344   6.9708  123.830   26.174   86.963   34.717 36.86746 43.47826 
1 1 1   18   29   38 o   52.386   23.347  -0.7928   3.7901   1.7087   4.4682  -7.2097   7.1563   65.047   27.088   58.797   28.121 6.250679 39.04492 
1 1 1   18   29   39 o  105.775   25.949   9.9304   4.1695   12.316   5.1758   5.5207   7.0370  116.184   29.153   86.655   34.780 29.52883 45.38221 
1 1 1   18   29   40 o   45.819   20.784  -1.2800   3.1563  -2.7200   4.4833   0.1351   4.4442   51.388   23.840   58.967   25.820 -7.579079 35.14296 
1 1 1   18   29   41 o  145.957   15.778   17.299   3.4687   16.460   5.0215   18.065   4.7972  136.818   24.895  145.268   22.286 -8.449768 33.41356 
1 1 1   18   30    1 o  319.522   18.343   79.820   8.9336   79.820   8.9336   0.0000   0.0000  319.522   18.343  ?   ?  0.000000 18.34337 
1 1 1   18   30    2 o  312.036   12.455   75.150   5.9486   82.718   8.2638   67.011   8.5698  325.896   16.622  292.349   19.259 33.54678 25.44004 
1 1 1   18   30    3 o  239.333   15.099   44.556   5.5028   41.364   7.5210   48.234   8.0724  228.571   21.760  247.040   21.565 -18.46873 30.63540 
1 1 1   18   30    4 o  290.614   13.078   65.247   5.8174   63.707   7.6355   67.378   8.9815  285.586   17.553  292.794   20.164 -7.208649 26.73338 
1 1 1   18   30    5 o  162.972   21.275   21.160   5.1803   18.334   6.6811   25.421   8.2031  148.606   30.397  175.107   31.776 -26.50111 43.97395 
1 1 1   18   30    6 o  174.039   17.492   23.802   4.5967   20.385   5.4464   32.263   8.5700  159.374   22.992  198.911   29.001 -39.53612 37.00948 
1 1 1   18   30    7 o  296.601   13.989   68.071   6.3510   65.683   8.1374   71.792   10.158  289.634   18.452  301.372   22.178 -11.73822 28.84967 
1 1 1   18   30    8 o  126.483   27.958   13.246   5.2687   10.560   6.5277   18.268   8.9242  112.943   34.546  145.630   39.178 -32.68738 52.23341 
1 1 1   18   30    9 o  293.584   11.576   66.477   5.2017   64.567   5.9917   72.319   10.481  288.925   13.549  302.080   22.836 -13.15518 26.55258 
1 1 1   18   30   10 o  391.814   9.9949  118.182   5.9942  111.422   6.8218  141.080   12.556  380.025   11.728  424.705   19.314 -44.68011 22.59606 
1 1 1   18   30   11 o  250.230   15.625   48.802   5.9547   45.119   7.2552   56.404   10.423  239.179   20.001  265.029   26.031 -25.85016 32.82782 
1 1 1   18   30   12 o  354.668   12.822   97.232   6.9607   91.998   8.4330  108.422   12.330  344.038   16.014  370.459   21.842 -26.42166 27.08351 
1 1 1   18   30   13 o  213.262   35.018   38.183   11.034   0.0000   0.0000   38.183   11.034  ?   ?   213.262   35.018 0.000000 35.01825 
1 1 1   18   30   14 o   62.920   29.534  -6.6163   7.2150  -6.6163   7.2150   0.0000   0.0000   62.920   29.534  ?   ?  0.000000 29.53362 
1 1 1   18   30   15 o   49.138   23.443  -6.1282   4.9105  -2.6979   5.5414 -18.6726   10.597   60.733   27.546   64.711   31.699 -3.977417 41.99506 
1 1 1   18   30   16 o   72.399   29.084   2.3165   4.9256   2.5709   5.5399   1.3562   10.762   76.393   30.790   95.003   40.896 -18.61092 51.19059 
1 1 1   18   30   17 o  251.869   15.193   49.475   5.8296   48.145   6.7096   53.571   11.775  247.581   17.825  255.081   30.781 -7.499771 35.56960 
1 1 1   18   30   18 o  431.555   11.294  143.784   7.4599  139.424   8.6685  156.232   14.647  424.228   13.350  444.784   21.515 -20.55618 25.31989 
1 1 1   18   30   19 o  187.178   19.853   27.841   5.6010   32.912   6.4446   12.188   11.323  203.238   21.021  123.803   45.506 79.43564 50.12640 
1 1 1   18   30   20 o  208.973   18.471   34.497   5.8473   28.764   6.6445   54.183   12.312  188.831   23.497  255.027   32.262 -66.19598 39.91191 
1 1 1   18   30   21 o  114.317   30.674   11.078   5.4788   4.7499   6.1819   34.249   11.830   86.725   33.247  197.062   40.571 -110.3370 52.45304 
1 1 1   18   30   22 o  145.052   26.200   17.391   5.6029   21.281   6.3614   3.9331   11.831  160.552   26.833  103.126   43.581 57.42651 51.17919 
1 1 1   18   30   23 f   94.771   33.355   6.9285   6.0064   3.0774   6.9410   18.409   11.984   83.713   34.197  142.395   47.181 -58.68122 58.27097 
1 1 1   18   30   24 o  257.889   22.044   53.258   8.6178   39.190   11.070   74.897   13.730  213.830   35.037  300.599   30.251 -86.76900 46.28974 
1 1 1   18   30   25 o  206.663   21.669   34.307   6.7525   40.462   7.8896   17.449   13.056  223.772   23.380  138.890   49.145 84.88269 54.42255 
1 1 1   18   30   26 o  199.441   22.373   32.128   6.7120   32.708   7.6830   30.258   13.793  199.610   25.747  177.269   49.132 22.34081 55.46960 
1 1 1   18   30   27 o   75.860   32.132   1.3767   6.4554   7.2481   7.3103 -19.4161   13.757   98.306   36.485   75.652   36.853 22.65323 51.85860 
1 1 1   18   30   28 o  110.987   35.310   10.667   6.7504   9.7117   7.8233   13.449   13.355  108.034   38.062  126.339   48.754 -18.30514 61.85234 
1 1 1   18   30   29 o   68.674   30.560  -1.1900   6.4676   5.2368   7.7250 -16.2538   11.827   91.976   36.601   70.810   34.421 21.16632 50.24394 
1 1 1   18   30   30 o  125.568   38.505   14.376   8.1038   14.376   8.1038   0.0000   0.0000  125.568   38.505  ?   ?  0.000000 38.50453 
1 1 1   18   30   31 o  125.052   33.512   13.992   6.5446   14.781   8.3011   12.696   10.639  126.437   39.004  119.286   44.065 7.150566 58.84735 
1 1 1   18   30   32 o   82.530   31.122   4.8797   5.3610   15.844   8.5154  -2.3199   6.9001  129.922   39.396   67.673   30.711 62.24828 49.95178 
1 1 1   18   30   33 o   57.049   23.704   1.0070   3.4109   1.2414   3.9207   0.2773   6.9175   61.166   25.414   73.608   32.222 -12.44130 41.03832 
1 1 1   18   30   34 o  138.372   17.726   15.488   3.6680   17.002   4.2378   10.965   7.3239  144.195   19.717  109.790   36.895 34.40524 41.83292 
1 1 1   18   30   35 o  194.420   13.948   29.887   4.1230   39.972   4.9339   6.5422   7.5065  224.737   14.419   92.973   36.363 131.7638 39.11756 
1 1 1   18   30   36 o   82.787   25.684   5.8782   3.5939   2.8427   4.1602   14.806   7.1347   68.368   26.969  124.648   35.618 -56.27930 44.67625 
1 1 1   18   30   37 o  165.363   16.133   22.039   4.0315   25.341   4.8135   14.280   7.3786  176.312   18.093  120.896   36.675 55.41618 40.89492 
1 1 1   18   30   38 o   59.219   25.129   0.9636   3.9595  -0.8936   4.7408   5.2469   7.1998   57.834   25.918   85.979   34.942 -28.14486 43.50504 
1 1 1   18   30   39 o   89.388   30.755   7.1876   5.0923   7.1876   5.0923   0.0000   0.0000   89.388   30.755  ?   ?  0.000000 30.75471 
1 1 1   18   31    0 o  277.524   19.575   60.469   8.2201   60.469   8.2201   60.469   8.2201  277.524   19.575  277.524   19.575 0.000000 0.000000 
1 1 1   18   31    1 o  295.148   13.636   67.399   6.1604   68.215   8.5786   66.531   8.8521  294.816   19.114  290.791   20.010 4.024933 27.67187 
1 1 1   18   31    2 o  210.734   24.329   35.585   7.7031   35.585   7.7031   0.0000   0.0000  210.734   24.329  ?   ?  0.000000 24.32865 
1 1 1   18   31    3 o  122.580   35.122   12.687   6.9281   12.687   6.9281   0.0000   0.0000  122.580   35.122  ?   ?  0.000000 35.12190 
1 1 1   18   31    4 o  255.956   15.574   51.041   6.0726   50.559   8.0225   51.688   9.2927  252.961   20.907  254.481   24.146 -1.519592 31.93988 
1 1 1   18   31    5 o  183.247   20.445   26.640   5.6367   26.004   7.2765   27.595   8.9134  178.544   27.510  181.610   33.292 -3.065933 43.18718 
1 1 1   18   31    6 o  376.444   10.348  109.153   5.9624  104.771   7.0828  119.810   11.046  368.251   12.566  391.677   18.425 -23.42569 22.30188 
1 1 1   18   31    7 o   92.153   28.249   6.8704   4.3621   8.7460   5.1471   2.0894   8.2179  102.977   30.495   87.165   36.551 15.81174 47.60160 
1 1 1   18   31    8 o  242.299   14.105   45.627   5.2085   40.031   6.0227   62.229   10.373  225.938   17.553  279.094   24.532 -53.15550 30.16500 
1 1 1   18   31    9 o  109.673   26.822   9.9789   4.4652   13.574   5.1530  -0.8550   8.9459  128.085   27.128   83.134   36.511 44.95153 45.48624 
1 1 1   18   31   10 o  234.527   12.079   42.591   4.3214   41.619   4.7968   46.776   9.9558  231.468   13.599  240.197   27.579 -8.728073 30.74994 
1 1 1   18   31   11 o   83.831   27.613   5.4705   4.1071   5.4705   4.1071   0.0000   0.0000   83.831   27.613  ?   ?  0.000000 27.61290 
1 1 1   18   31   12 o  162.119   18.356   20.799   4.4747   20.799   4.4747   0.0000   0.0000  162.119   18.356  ?   ?  0.000000 18.35612 
1 1 1   18   31   13 o  246.180   11.895   46.816   4.4822   46.285   4.8831   49.656   11.296  244.199   13.112  245.630   30.717 -1.430511 33.39876 
1 1 1   18   31   14 o  210.750   22.412   35.492   7.1187   34.183   9.3801   37.270   10.932  202.913   31.201  209.892   35.278 -6.978561 47.09601 
1 1 1   18   31   15 o  165.260   29.527   22.699   7.1949   23.134   9.3310   22.061   11.300  163.087   38.072  156.607   44.849 6.480377 58.82975 
1 1 1   18   31   17 o  261.709   14.956   53.428   5.9663   53.625   6.9472   52.874   11.646  261.299   17.471  252.920   30.714 8.378708 35.33555 
1 1 1   18   31   18 o  101.995   31.107   8.6499   5.2979   8.4408   6.0152   9.3730   11.187  101.781   33.412  115.148   44.570 -13.36787 55.70341 
1 1 1   18   31   19 o  368.113   12.387  104.908   6.9793   97.538   8.1018  126.115   13.743  354.022   14.951  397.721   22.670 -43.69861 27.15636 
1 1 1   18   31   20 o  164.215   23.458   21.889   5.7287   22.771   6.6377   19.313   11.341  166.070   27.044  145.756   45.694 20.31445 53.09701 
1 1 1   18   31   21 o   95.546   32.620   7.2412   5.7261   5.3105   6.5659   13.374   11.702   89.885   34.310  126.675   46.306 -36.78980 57.63200 
1 1 1   18   31   22 f   74.758   33.436  -1.9075   7.8482   8.5758   10.335 -16.1879   12.062  110.247   42.792   72.812   35.245 37.43423 55.43830 
1 1 1   18   31   23 o  114.088   33.472   11.195   6.2262   10.869   7.0269   12.386   13.430  112.804   36.041  125.548   48.767 -12.74326 60.63980 
1 1 1   18   31   24 o  208.721   21.060   34.954   6.6362   42.757   7.7339   13.167   12.922  230.471   22.198  126.356   48.157 104.1143 53.02663 
1 1 1   18   31   25 o  112.131   34.816   10.863   6.6020   12.635   7.5416   5.0484   13.658  119.902   37.208  108.729   46.418 11.17356 59.49033 
1 1 1   18   31   26 o  146.745   30.030   18.426   6.5178   13.531   7.5395   32.903   12.966  123.349   36.995  186.239   45.803 -62.88976 58.87769 
1 1 1   18   31   27 o  180.120   25.241   26.834   6.7677   21.578   8.1315   38.682   12.208  156.078   34.912  206.439   40.082 -50.36092 53.15422 
1 1 1   18   31   28 o  133.258   31.835   15.572   6.4044   19.631   7.8120   7.2507   11.184  148.247   34.990  106.115   43.386 42.13264 55.73701 
1 1 1   18   31   29 o  114.455   39.196   11.662   8.2675   11.662   8.2675   0.0000   0.0000  114.455   39.196  ?   ?  0.000000 39.19564 
1 1 1   18   31   30 o   96.553   34.478   7.6515   6.4403   11.799   8.1820   0.8970   10.442  114.476   38.993   88.911   39.232 25.56570 55.31387 
1 1 1   18   31   31 o  171.742   21.946   24.236   5.6371   19.448   8.5741   27.881   7.4814  144.108   38.239  180.785   27.937 -36.67674 47.35714 
1 1 1   18   31   32 o   67.194   29.023   0.5460   5.4571   5.5103   8.6522  -2.7334   7.0323   93.533   38.191   67.137   30.674 26.39618 48.98410 
1 1 1   18   31   33 o   87.179   31.974   6.0331   5.5859   22.483   8.7397  -5.3280   7.2630  154.397   37.381   63.111   29.626 91.28641 47.69742 
1 1 1   18   31   34 o   79.750   25.926   5.3415   3.6250   7.7091   4.2055  -1.5041   7.1509   93.722   27.513   69.559   31.444 24.16372 41.78109 
1 1 1   18   31   35 o   51.285   22.676  -0.5294   3.5060  -0.2494   3.9745  -1.5111   7.4432   55.414   24.337   70.378   31.922 -14.96317 40.14079 
1 1 1   18   31   36 o  143.992   18.266   17.015   3.9352   17.956   4.5829   14.373   7.6779  146.423   21.054  120.385   37.573 26.03802 43.06971 
1 1 1   18   31   37 o  139.546   21.699   16.491   4.4843   22.588   5.5425   4.9360   7.6301  162.887   22.860   85.888   35.551 76.99925 42.26604 
1 1 1   18   31   38 o  145.232   19.862   17.637   4.2995   19.482   5.2775   13.995   7.4144  150.172   23.750  117.643   36.956 32.52883 43.92967 
1 1 1   18   32    0 o  250.584   21.690   49.816   8.1760   49.816   8.1760   49.816   8.1760  250.584   21.690  250.584   21.690 0.000000 0.000000 
1 1 1   18   32    1 o  222.819   16.724   38.872   5.6623   50.663   7.9803   26.917   8.0353  253.085   20.784  180.414   30.163 72.67079 36.63040 
1 1 1   18   32    2 o  236.744   16.483   43.830   5.9358   40.018   8.4860   47.481   8.3058  222.946   25.317  244.285   22.465 -21.33896 33.84686 
1 1 1   18   32    3 o  371.023   12.151  106.338   6.9004  115.386   9.7154   97.128   9.8025  384.986   16.487  352.104   18.251 32.88190 24.59528 
1 1 1   18   32    4 o  341.284   17.209   91.038   8.9606   91.038   8.9606   0.0000   0.0000  341.284   17.209  ?   ?  0.000000 17.20891 
1 1 1   18   32    5 o  185.504   27.660   28.131   7.6136   28.131   7.6136   0.0000   0.0000  185.504   27.660  ?   ?  0.000000 27.66002 
1 1 1   18   32    6 o  334.427   13.758   86.640   7.0425   86.640   7.0425   0.0000   0.0000  334.427   13.758  ?   ?  0.000000 13.75807 
1 1 1   18   32    7 o  132.992   24.295   14.446   4.7634   17.202   5.7267   8.2577   8.5809  144.528   26.876  106.765   39.548 37.76259 47.81581 
1 1 1   18   32    8 o  239.264   14.571   44.581   5.3109   42.732   6.2354   49.467   10.135  233.311   17.590  246.996   27.264 -13.68521 32.44555 
1 1 1   18   32    9 f  274.398   15.631   58.740   6.5378   58.740   6.5378   0.0000   0.0000  274.398   15.631  ?   ?  0.000000 15.63074 
1 1 1   18   32   10 o  116.833   25.712   11.299   4.4733   11.299   4.4733   0.0000   0.0000  116.833   25.712  ?   ?  0.000000 25.71184 
1 1 1   18   32   11 o  101.134   25.841   8.4893   4.0150   7.7846   4.3918   12.075   9.9067   97.027   28.011  121.686   42.836 -24.65893 51.18118 
1 1 1   18   32   12 o  446.419   8.9826  153.378   6.1378  143.980   6.7940  195.102   14.315  432.154   10.271  498.825   18.749 -66.67136 21.37833 
1 1 1   18   32   13 o  226.614   12.919   39.892   4.4624   39.221   4.8763   43.350   11.068  224.328   14.276  227.740   32.689 -3.411697 35.67063 
1 1 1   18   32   14 o  294.011   13.774   67.063   6.1987   58.454   7.1735   92.441   12.316  272.931   17.260  339.906   23.822 -66.97476 29.41811 
1 1 1   18   32   15 f  286.209   14.133   63.614   6.1915   61.962   7.3094   67.810   11.649  281.053   17.072  289.184   26.616 -8.130493 31.62096 
1 1 1   18   32   16 o  355.940   13.169   98.224   7.1748   96.554   8.5777  102.116   13.092  351.855   15.927  356.859   24.110 -5.003998 28.89547 
1 1 1   18   32   17 o  217.335   24.326   38.190   7.9536   48.903   10.836   25.675   11.712  243.236   29.722  167.571   44.798 75.66451 53.76165 
1 1 1   18   32   18 o  206.789   25.155   34.773   7.7978   35.397   10.468   33.995   11.688  203.471   34.866  195.992   40.308 7.478973 53.29518 
1 1 1   18   32   19 o  171.859   23.520   23.981   6.0246   21.127   7.0489   31.717   11.605  158.292   30.195  188.202   41.411 -29.90948 51.25016 
1 1 1   18   32   20 f  333.094   18.698   87.628   9.4944  131.668   14.516   54.700   12.552  404.989   23.518  254.555   32.990 150.4345 40.51495 
1 1 1   18   32   21 o  253.486   23.149   51.806   8.8827   47.896   12.171   56.262   12.993  236.526   34.647  257.225   33.820 -20.69899 48.41711 
1 1 1   18   32   22 o   63.712   28.907  -2.6232   6.1093   2.7807   6.9548 -20.8843   12.785   82.373   34.006   70.834   34.723 11.53933 48.60122 
1 1 1   18   32   23 o  108.981   34.264   10.190   6.3720   9.8758   7.2656   11.237   13.261  108.322   36.746  121.360   48.062 -13.03819 60.49987 
1 1 1   18   32   24 o   86.831   33.604   4.8978   6.3589   0.2356   7.3392   18.936   12.735   76.672   33.386  141.247   48.634 -64.57538 58.99079 
1 1 1   18   32   25 o  233.706   19.839   43.743   7.0297   46.912   8.3987   36.329   12.846  240.213   23.129  196.910   43.759 43.30324 49.49485 
1 1 1   18   32   26 o  115.386   33.698   11.760   6.3233   16.130   7.5488   1.4804   11.577  133.718   36.058   94.595   41.540 39.12296 55.00679 
1 1 1   18   32   27 o  175.548   31.187   26.698   8.0728   26.698   8.0728   0.0000   0.0000  175.548   31.187  ?   ?  0.000000 31.18670 
1 1 1   18   32   28 o  134.153   37.183   16.577   7.8997   16.577   7.8997   0.0000   0.0000  134.153   37.183  ?   ?  0.000000 37.18272 
1 1 1   18   32   29 o  153.387   30.446   20.551   6.8958   23.519   8.5015   14.842   11.790  161.003   35.457  125.362   46.372 35.64082 58.37455 
1 1 1   18   32   30 o   85.713   33.738   4.8931   6.4974   7.5944   8.0260  -0.2440   11.068   98.589   37.862   88.073   39.526 10.51649 54.73441 
1 1 1   18   32   31 o  207.530   29.742   37.413   9.1774   37.413   9.1774   0.0000   0.0000  207.530   29.742  ?   ?  0.000000 29.74168 
1 1 1   18   32   32 o   87.325   32.535   6.0305   5.8241  -0.4343   8.4470   11.889   8.0411   77.412   34.651  112.393   38.648 -34.98163 51.90718 
1 1 1   18   32   33 o   68.608   29.694   0.8554   5.7357   1.8144   8.2866  -0.0265   7.9469   81.211   35.416   75.815   33.796 5.396133 48.95368 
1 1 1   18   32   34 o   88.621   31.767   6.7150   5.4720   14.049   8.2349   0.9162   7.3223  118.732   39.099   75.103   33.007 43.62913 51.16854 
1 1 1   18   32   35 o   70.690   26.345   3.7346   3.8194   4.4613   4.4527   1.7109   7.4306   76.050   28.425   76.975   33.554 -0.9256363 43.97527 
1 1 1   18   32   36 o  114.937   25.772   11.735   4.4220   11.322   5.3643   12.610   7.8112  110.020   30.693  111.929   38.100 -1.909370 48.92471 
1 1 1   18   33    0 o   83.809   42.669   8.3951   6.8734   8.3951   6.8734   8.3951   6.8734   83.809   42.669   83.809   42.669 0.000000 0.000000 
1 1 1   18   33    1 o  404.784   11.802  126.580   7.3124  123.198   10.197  130.162   10.492  397.454   16.761  408.525   16.780 -11.07138 23.71691 
1 1 1   18   33    2 o   50.029   23.689  -5.3264   4.8276  -6.7274   6.7599  -3.8682   6.8966   59.956   28.280   66.146   30.279 -6.189999 41.43178 
1 1 1   18   33    3 o   82.513   30.349   4.6533   5.0376  -1.5990   7.0413   11.209   7.2103   71.939   31.956  115.558   36.464 -43.61945 48.48502 
1 1 1   18   33    4 o  157.326   22.337   19.934   5.2278   21.581   7.1012   17.986   7.7246  160.889   29.938  144.622   35.223 16.26723 46.22687 
1 1 1   18   33    5 o  407.387   12.262  128.332   7.6462  128.374   10.297  128.280   11.416  405.733   16.581  404.699   18.429 1.033997 24.79041 
1 1 1   18   33    6 f  129.057   29.559   14.001   5.7136   14.001   5.7136   0.0000   0.0000  129.057   29.559  ?   ?  0.000000 29.55936 
1 1 1   18   33    7 o  176.874   22.665   25.158   5.9948   25.158   5.9948   0.0000   0.0000  176.874   22.665  ?   ?  0.000000 22.66451 
1 1 1   18   33    8 o  242.637   17.444   46.247   6.4352   46.247   6.4352   0.0000   0.0000  242.637   17.444  ?   ?  0.000000 17.44384 
1 1 1   18   33    9 o  306.082   13.053   72.574   6.1155   74.372   7.1736   67.792   11.699  309.202   15.158  289.277   26.725 19.92432 30.72375 
1 1 1   18   33   10 o  223.158   16.240   39.033   5.5090   29.470   6.3067   69.825   11.317  191.828   21.870  294.334   25.368 -102.5060 33.49370 
1 1 1   18   33   11 o   51.968   23.408  -1.6990   3.9220  -3.2149   4.3248   5.3213   9.3070   50.926   23.552   99.109   39.921 -48.18313 46.35041 
1 1 1   18   33   12 o  156.500   18.732   19.484   4.3980   18.639   4.8597   23.312   10.339  152.130   21.467  161.466   41.582 -9.336533 46.79566 
1 1 1   18   33   13 o  216.837   14.470   36.709   4.7751   35.522   5.2580   42.296   11.407  212.733   16.271  223.337   34.479 -10.60477 38.12576 
1 1 1   18   33   14 o  429.766   11.740  142.856   7.7224  136.637   9.0993  158.868   14.601  419.297   14.178  447.842   21.300 -28.54419 25.58755 
1 1 1   18   33   15 o   85.316   31.475   5.0871   5.4243   9.3239   6.3874  -5.8709   10.272  105.942   34.413   78.679   36.355 27.26272 50.05956 
1 1 1   18   33   16 o  168.135   23.442   22.960   5.8688   24.719   6.8593   18.155   11.337  173.138   26.745  141.432   45.841 31.70584 53.07261 
1 1 1   18   33   17 o  199.832   20.013   31.854   6.0391   29.655   7.0828   37.712   11.558  190.678   24.860  207.865   37.716 -17.18726 45.17201 
1 1 1   18   33   18 o  162.824   25.660   21.852   6.1833   21.658   7.1643   22.418   12.242  159.923   30.379  154.443   47.320 5.479080 56.23229 
1 1 1   18   33   19 o   75.199   33.726  -2.0108   8.0437   5.2187   10.417 -12.6868   12.659  100.929   41.638   78.679   37.566 22.25026 56.07912 
1 1 1   18   33   20 o  101.443   38.270   7.5931   8.1088   13.186   10.816   0.4164   12.253  123.762   44.629   96.090   42.444 27.67212 61.58921 
1 1 1   18   33   21 o  213.392   27.301   37.766   8.7128   23.538   11.529   56.714   13.305  157.658   45.346  256.416   34.798 -98.75748 57.15864 
1 1 1   18   33   22 f   87.867   33.374   5.3344   6.1935   10.510   7.1494 -10.2304   12.398  110.419   36.435   79.966   37.893 30.45268 52.56747 
1 1 1   18   33   23 o   75.639   31.549   2.0135   6.0749  -0.8039   7.0246   10.372   12.099   72.417   32.055  116.086   45.928 -43.66884 56.00837 
1 1 1   18   33   24 o  172.290   25.372   24.692   6.4905   24.878   7.6722   24.225   12.172  170.013   30.608  156.887   46.996 13.12625 56.08475 
1 1 1   18   33   25 o  234.404   19.364   44.085   6.8852   47.329   8.2406   36.583   12.531  240.959   22.608  196.789   42.819 44.17004 48.42096 
1 1 1   18   33   26 o  265.318   21.240   57.021   8.5535   57.021   8.5535   0.0000   0.0000  265.318   21.240  ?   ?  0.000000 21.24050 
1 1 1   18   33   27 o  393.780   13.843  121.444   8.3433  127.279   10.147  109.269   14.658  401.187   16.525  361.778   26.659 39.40891 31.36516 
1 1 1   18   33   28 o  128.838   33.252   15.006   6.6018   19.895   8.0944   5.2903   11.410  146.822   36.238  100.059   42.564 46.76291 55.90124 
1 1 1   18   33   29 o  149.552   30.257   19.730   6.6883   25.596   8.3712   9.3758   11.122  168.390   33.656  108.327   43.638 60.06320 55.10874 
1 1 1   18   33   30 o  119.707   34.828   13.359   6.7660   17.418   8.7047   7.1622   10.754  133.481   39.687  101.252   42.082 32.22971 57.84443 
1 1 1   18   33   31 o  142.247   30.532   18.218   6.4489   21.261   8.2726   13.506   10.296  149.319   36.502  117.063   43.328 32.25535 56.65476 
1 1 1   18   33   32 o   85.883   33.090   5.6968   6.1441   17.157   11.878   1.5100   7.1792  126.184   46.571   76.189   33.098 49.99484 57.13414 
1 1 1   18   33   33 o   79.756   32.326   4.0988   6.1437   5.5933   11.375   3.4834   7.2999   96.268   41.741   81.423   34.311 14.84473 54.03338 
1 1 1   18   33   34 f   89.809   33.787   6.8932   6.3110   5.3655   12.488   7.4172   7.3137   97.011   42.850   93.138   36.041 3.873543 55.99184 
1 1 1   18   34    0 o  204.776   27.314   34.550   8.1348   34.550   8.1348   34.550   8.1348  204.776   27.314  204.776   27.314 0.000000 0.000000 
1 1 1   18   34    1 o  173.967   21.607   24.271   5.6296   24.781   7.7384   23.698   8.2049  172.149   30.484  166.989   33.269 5.160507 45.12338 
1 1 1   18   34    2 o  225.427   24.501   40.997   8.3180   40.997   8.3180   0.0000   0.0000  225.427   24.501  ?   ?  0.000000 24.50145 
1 1 1   18   34    3 o  135.173   35.212   15.793   7.3582   15.793   7.3582   0.0000   0.0000  135.173   35.212  ?   ?  0.000000 35.21232 
1 1 1   18   34    4 o  216.916   23.856   37.900   7.7896   37.900   7.7896   0.0000   0.0000  216.916   23.856  ?   ?  0.000000 23.85563 
1 1 1   18   34    5 f  290.213   12.927   65.252   5.7422   68.914   6.9366   57.279   10.235  297.148   15.303  266.263   25.423 30.88477 29.67352 
1 1 1   18   34    6 o  137.636   24.239   15.516   4.9198   16.578   5.8195   12.856   9.2107  141.010   27.951  123.056   41.375 17.95308 49.93117 
1 1 1   18   34    7 o  370.171   11.678  105.941   6.6167   99.213   7.8127  123.009   12.444  357.328   14.285  394.137   20.700 -36.80850 25.14991 
1 1 1   18   34    8 o  193.813   18.707   29.759   5.4805   30.598   6.4640   27.614   10.336  195.308   22.006  177.168   39.157 18.14014 44.91708 
1 1 1   18   34    9 o  297.180   15.530   69.014   7.0398   69.014   7.0398   0.0000   0.0000  297.180   15.530  ?   ?  0.000000 15.53023 
1 1 1   18   34   10 f  153.980   26.580   19.589   6.0381   19.589   6.0381   0.0000   0.0000  153.980   26.580  ?   ?  0.000000 26.57977 
1 1 1   18   34   11 o  280.305   16.464   61.612   7.0327   61.612   7.0327   0.0000   0.0000  280.305   16.464  ?   ?  0.000000 16.46385 
1 1 1   18   34   12 o  182.041   16.117   26.079   4.4445   25.115   4.8613   30.992   10.970  177.982   18.096  187.176   39.532 -9.193405 43.47666 
1 1 1   18   34   13 o   74.686   27.597   3.7690   4.1732   4.2004   4.5025   1.1388   11.117   78.019   28.693   94.475   41.114 -16.45535 50.13619 
1 1 1   18   34   14 o  303.735   14.388   71.832   6.6890   67.126   7.7298   85.862   13.347  292.002   17.373  324.140   27.151 -32.13742 32.23389 
1 1 1   18   34   15 o   62.776   28.033  -1.5526   5.4938  -1.8268   6.3142  -0.6982   11.145   66.846   29.937   90.677   40.245 -23.83165 50.15902 
1 1 1   18   34   16 o  269.366   16.466   57.053   6.7562   45.873   7.8937   87.678   13.065  238.994   21.819  327.793   26.260 -88.79883 34.14171 
1 1 1   18   34   17 o   68.814   31.506  -3.6891   7.4708 -10.6821   9.7916   6.0535   11.557   68.989   32.967  105.734   43.758 -36.74491 54.78681 
1 1 1   18   34   18 o   72.632   30.777   1.1723   5.9263  -2.0416   6.7743   11.652   12.233   68.562   30.834  120.667   46.634 -52.10443 55.90622 
1 1 1   18   34   19 o  269.092   16.607   57.105   6.8065   54.054   7.7491   67.406   14.240  260.279   19.595  280.152   33.897 -19.87323 39.15311 
1 1 1   18   34   20 o  152.384   27.767   19.615   6.2379   19.966   7.2077   18.569   12.451  151.553   32.072  139.541   48.086 12.01242 57.80048 
1 1 1   18   34   21 o   66.510   29.679  -1.3359   6.1456   3.9545   7.0665 -17.7597   12.451   85.620   34.681   71.628   34.930 13.99195 49.22229 
1 1 1   18   34   22 o   87.907   36.446   3.6717   8.0381  -1.8578   10.540   11.360   12.428   84.668   38.233  118.166   46.612 -33.49834 60.28642 
1 1 1   18   34   23 o  171.746   31.839   25.716   8.0617   19.623   10.751   33.543   12.186  142.304   44.468  187.620   43.310 -45.31586 62.07382 
1 1 1   18   34   24 o  143.347   47.367   20.536   12.082   20.536   12.082   0.0000   0.0000  143.347   47.367  ?   ?  0.000000 47.36660 
1 1 1   18   34   25 o  182.778   29.588   28.778   7.9947   28.778   7.9947   0.0000   0.0000  182.778   29.588  ?   ?  0.000000 29.58765 
1 1 1   18   34   26 o  111.049   34.790   11.140   6.5758   5.6052   7.8551   24.103   12.022   91.879   36.793  153.428   46.873 -61.54902 59.58829 
1 1 1   18   34   27 o   77.359   32.563   2.3438   6.5635   9.0114   7.9856 -11.5386   11.523  102.751   38.133   73.026   35.123 29.72521 51.84386 
1 1 1   18   34   28 o   59.597   27.914  -4.6364   6.3866  -2.7856   8.0199  -7.8446   10.559   71.069   32.577   73.462   34.857 -2.392937 47.70975 
1 1 1   18   34   29 o  150.400   33.158   20.808   7.4277   20.188   10.536   21.421   10.473  139.126   44.098  143.649   43.719 -4.523743 62.09652 
1 1 1   18   34   30 o   89.069   35.479   5.8496   7.2651   10.108   11.045   2.6023   9.6452  107.163   43.375   86.880   38.040 20.28292 57.69263 
1 1 1   18   34   31 o  110.454   34.963   11.661   6.6249   16.969   8.8209   4.7933   10.034  128.766   40.287   92.012   39.547 36.75423 56.45311 
1 1 1   18   34   32 o  122.824   33.205   14.366   6.3919   9.2369   8.5524   20.856   9.6206  100.728   38.975  140.667   41.700 -39.93940 57.07842 
1 1 1   18   35    1 o  121.088   39.473   12.583   8.4011   0.0000   0.0000   12.583   8.4011  ?   ?   121.088   39.473 0.000000 39.47337 
1 1 1   18   35    2 o  160.758   37.094   22.625   8.9418   0.0000   0.0000   22.625   8.9418  ?   ?   160.758   37.094 0.000000 37.09396 
1 1 1   18   35    3 o  178.403   34.417   27.303   9.0578   0.0000   0.0000   27.303   9.0578  ?   ?   178.403   34.417 0.000000 34.41743 
1 1 1   18   35    4 o  352.290   21.063   98.633   11.305   0.0000   0.0000   98.633   11.305  ?   ?   352.290   21.063 0.000000 21.06256 
1 1 1   18   35    5 o  182.123   18.849   26.357   5.1783   27.912   6.1345   22.503   9.6583  186.297   21.933  158.836   39.806 27.46086 45.44865 
1 1 1   18   35    6 o  187.320   18.893   27.880   5.3428   28.353   6.2086   26.531   10.489  187.708   22.028  172.267   40.468 15.44040 46.07512 
1 1 1   18   35    7 o  117.554   28.533   11.691   5.0821   11.584   5.9167   11.990   9.9243  116.253   32.164  120.046   42.807 -3.792641 53.54449 
1 1 1   18   35    8 o  181.214   19.121   26.149   5.2235   28.368   6.1295   20.263   9.9832  187.799   21.725  149.513   41.928 38.28615 47.22183 
1 1 1   18   35    9 o  214.007   17.091   36.118   5.5518   31.001   6.3636   52.423   11.359  196.461   21.514  250.947   30.178 -54.48582 37.06144 
1 1 1   18   35   10 o  155.562   22.648   19.672   5.2343   15.849   5.8580   34.813   11.658  136.929   28.860  197.827   39.879 -60.89748 49.22640 
1 1 1   18   35   11 o  275.049   14.229   59.061   5.9699   58.457   6.8030   61.081   12.450  272.774   16.370  270.452   30.616 2.321930 34.71712 
1 1 1   18   35   12 f   65.547   28.545  -0.2487   5.3663  -0.2487   5.3663   0.0000   0.0000   65.547   28.545  ?   ?  0.000000 28.54473 
1 1 1   18   35   13 o  364.646   11.320  102.943   6.3179  102.943   6.3179   0.0000   0.0000  364.646   11.320  ?   ?  0.000000 11.31968 
1 1 1   18   35   14 o  127.146   29.408   13.829   5.6092   13.829   5.6092   0.0000   0.0000  127.146   29.408  ?   ?  0.000000 29.40777 
1 1 1   18   35   15 o  346.267   17.718   94.739   9.3592   99.763   13.073   89.457   13.404  350.394   24.531  329.903   26.777 20.49112 36.31459 
1 1 1   18   35   16 f  138.069   29.935   16.371   6.1438   13.891   7.1882   23.096   11.835  124.996   35.763  155.107   46.314 -30.11097 58.51449 
1 1 1   18   35   17 o  291.861   15.921   67.057   7.0854   73.615   8.3190   49.731   13.522  304.726   17.915  235.706   38.832 69.01999 42.76475 
1 1 1   18   35   18 o  163.218   26.421   22.314   6.3751   20.558   7.5208   26.795   12.017  152.976   33.082  166.301   45.767 -13.32469 56.47158 
1 1 1   18   35   19 o  118.557   31.913   12.366   5.9194   9.9684   6.7602   20.244   12.256  107.206   35.432  143.638   47.718 -36.43219 59.43435 
1 1 1   18   35   20 o   74.497   31.263   1.8409   6.0198   2.7787   6.9664  -0.9235   11.961   81.338   33.843   90.999   40.944 -9.660400 53.11997 
1 1 1   18   35   21 o  109.456   33.767   10.592   6.2215   6.0722   7.2817   22.814   11.973   92.680   35.935  151.275   46.873 -58.59428 59.06226 
1 1 1   18   35   22 o   91.030   35.549   5.7412   7.1661   5.7412   7.1661   0.0000   0.0000   91.030   35.549  ?   ?  0.000000 35.54934 
1 1 1   18   35   23 o  160.425   31.084   22.580   7.3571   22.580   7.3571   0.0000   0.0000  160.425   31.084  ?   ?  0.000000 31.08425 
1 1 1   18   35   24 o  109.993   33.862   10.916   6.2603   7.4761   7.5201   18.682   11.299   97.049   36.796  136.122   45.825 -39.07317 58.76980 
1 1 1   18   35   25 o   90.725   37.074   5.1756   8.1613   21.571   13.241  -4.8705   10.364  141.732   49.544   77.284   35.986 64.44839 61.23466 
1 1 1   18   35   26 o  211.184   36.861   41.515   11.481   0.0000   0.0000   41.515   11.481  ?   ?   211.184   36.861 0.000000 36.86057 
1 1 1   18   35   27 o   91.121   39.121   4.0827   9.7998   0.0000   0.0000   4.0827   9.7998  ?   ?    91.121   39.121 0.000000 39.12102 
1 1 1   18   35   28 o   78.682   32.307   3.5321   6.2351   1.7043   8.1749   6.0742   9.6410   80.334   35.101   94.891   39.675 -14.55683 52.97349 
1 1 1   18   35   29 o   76.060   31.763   2.8860   6.1685   3.6624   8.1342   1.8353   9.4631   84.568   35.956   84.237   37.250 0.3314590 51.77258 
1 1 1   18   35   30 o   54.545   25.985  -5.8050   5.9869  -6.7153   7.9834  -4.6352   9.0502   63.111   30.050   70.745   33.165 -7.633907 44.75373 
1 1 1   18   36    0 o  311.983   23.362   77.448   11.012   77.448   11.012   77.448   11.012  311.983   23.362  311.983   23.362 0.000000 0.000000 
1 1 1   18   36    1 o  289.576   16.549   65.893   7.3047   71.010   9.9810   59.989   10.719  297.691   22.062  271.031   26.164 26.65942 34.22398 
1 1 1   18   36    2 f  226.991   19.404   40.985   6.6770   42.456   8.8382   39.030   10.191  227.850   25.797  214.800   31.971 13.05032 41.08044 
1 1 1   18   36    3 o  215.221   20.234   36.999   6.5873   46.634   8.9705   25.722   9.7043  239.422   24.840  170.150   38.198 69.27275 45.56440 
1 1 1   18   36    4 o  159.880   25.919   21.141   6.1257   11.539   7.6303   38.550   10.274  115.728   37.614  213.009   32.544 -97.28087 49.73873 
1 1 1   18   36    5 o  326.340   24.221   86.125   12.012   0.0000   0.0000   86.125   12.012  ?   ?   326.340   24.221 0.000000 24.22102 
1 1 1   18   36    6 o  397.187   11.577  122.182   7.0379  121.330   8.3729  124.233   12.992  394.789   13.856  394.226   21.613 0.5626526 25.67291 
1 1 1   18   36    7 o  117.044   30.384   11.768   5.4911   8.8727   6.3978   19.868   10.700  103.257   34.484  146.290   44.118 -43.03367 55.99579 
1 1 1   18   36    8 o  296.055   18.512   69.433   8.3467   68.074   12.342   70.577   11.331  286.636   28.510  294.175   25.413 -7.538361 38.19204 
1 1 1   18   36    9 f  186.953   26.823   28.992   7.4556   20.470   10.739   36.922   10.359  148.040   44.097  206.993   33.867 -58.95265 55.60139 
1 1 1   18   36   10 o  234.449   22.655   44.459   8.0284   28.875   11.331   60.168   11.376  176.808   42.415  269.418   27.996 -92.61060 50.82127 
1 1 1   18   36   11 o   84.687   35.095   3.0309   7.4480  -2.9665   10.894   8.2954   10.206   84.898   38.551  107.709   42.320 -22.81133 57.24598 
1 1 1   18   36   12 o  105.541   37.049   9.2464   7.4080   12.781   10.560   5.8211   10.395  121.306   44.042  101.378   41.681 19.92836 60.63844 
1 1 1   18   36   13 o  183.439   29.695   28.573   8.0527   27.576   11.181   29.646   11.607  171.552   42.739  177.776   43.103 -6.224136 60.70010 
1 1 1   18   36   14 o  234.602   15.252   43.315   5.4471   35.322   5.9828   82.050   13.170  210.237   18.790  314.148   27.672 -103.9108 33.44876 
1 1 1   18   36   15 o  150.980   32.901   20.036   7.3885   20.036   7.3885   0.0000   0.0000  150.980   32.901  ?   ?  0.000000 32.90129 
1 1 1   18   36   16 o  103.250   36.286   8.9375   7.1066   8.9375   7.1066   0.0000   0.0000  103.250   36.286  ?   ?  0.000000 36.28558 
1 1 1   18   36   17 o  147.293   30.902   18.901   6.7446   15.598   7.6847   29.976   14.072  130.770   36.826  171.020   50.364 -40.24982 62.39107 
1 1 1   18   36   18 o  168.145   26.432   23.792   6.5782   21.836   7.7115   29.016   12.605  157.072   33.119  170.860   46.814 -13.78835 57.34438 
1 1 1   18   36   19 o  345.748   14.449   93.759   7.6467   94.925   9.1305   91.019   13.993  346.124   17.234  328.938   28.062 17.18530 32.93130 
1 1 1   18   36   20 o  401.521   13.727  126.258   8.4362  143.708   10.273   90.116   14.785  426.856   15.723  324.509   30.108 102.3464 33.96653 
1 1 1   18   36   21 o   62.135   29.370  -6.3941   7.3618  -6.3941   7.3618   0.0000   0.0000   62.135   29.370  ?   ?  0.000000 29.37023 
1 1 1   18   36   22 o  256.009   20.997   53.472   8.1554   46.427   10.982   62.135   12.178  229.309   32.174  267.587   30.264 -38.27814 44.17111 
1 1 1   18   36   23 o  170.719   29.854   25.622   7.5170   38.785   10.424   11.360   10.850  207.020   34.083  112.438   43.789 94.58203 55.49008 
1 1 1   18   36   24 o  114.878   36.142   12.440   7.0882   15.454   9.9924   9.3881   10.056  124.055   43.059  105.401   41.818 18.65425 60.02317 
1 1 1   18   36   25 f  132.144   31.790   15.995   6.3518   24.995   8.0162   0.8114   10.412  165.340   32.833   85.935   38.468 79.40522 50.57470 
1 1 1   18   36   26 o  188.734   22.050   29.753   6.2497   30.963   7.8913   27.717   10.236  187.744   28.343  166.361   40.564 21.38263 49.48503 
1 1 1   18   36   27 o   77.888   31.726   3.6801   5.9528   1.3767   7.4706   7.6864   9.8525   76.672   33.526   98.700   40.579 -22.02802 52.63732 
1 1 1   18   36   28 o   69.514   30.407   0.7321   6.1502   3.4453   7.9342  -3.3524   9.7347   83.085   35.423   75.333   35.011 7.751999 49.80503 
1 1 1   18   37    0 o  182.509   39.597   30.305   9.6970   30.305   9.6970   30.305   9.6970  182.509   39.597  182.509   39.597 0.000000 0.000000 
1 1 1   18   37    1 o  272.273   17.889   58.728   7.4138   64.234   10.485   53.223   10.485  280.632   24.659  253.413   27.471 27.21933 36.91480 
1 1 1   18   37    2 o  300.608   16.751   71.254   7.6769   67.039   10.287   76.554   11.534  287.448   23.588  306.374   24.808 -18.92569 34.23197 
1 1 1   18   37    3 o   67.026   29.749  -1.0999   6.0901  -6.1119   8.1953   5.0813   9.1012   67.817   31.718   95.933   39.170 -28.11590 50.40172 
1 1 1   18   37    4 o  302.913   16.218   72.237   7.4924   66.596   9.8037   80.158   11.617  287.149   22.485  313.761   24.382 -26.61243 33.16686 
1 1 1   18   37    5 o   99.196   31.315   8.3266   5.3173   8.3796   6.4802   8.2173   9.3032  100.720   34.691  105.342   40.681 -4.622696 53.46396 
1 1 1   18   37    6 o  304.917   13.714   72.506   6.4006   60.947   7.4958  103.622   12.298  277.307   17.753  358.288   22.541 -80.98050 28.69237 
1 1 1   18   37    7 o   54.887   25.611  -4.2189   5.2931  -5.5153   6.1405  -0.4703   10.442   57.606   27.105   87.393   38.863 -29.78658 47.38140 
1 1 1   18   37    8 o  204.693   18.553   33.447   5.7497   33.676   6.8328   32.894   10.642  203.577   22.292  191.557   37.639 12.02020 43.74540 
1 1 1   18   37    9 o  191.456   19.981   29.498   5.7691   26.562   6.8464   36.686   10.714  178.748   25.768  203.923   35.623 -25.17451 43.96542 
1 1 1   18   37   10 o  186.682   20.608   28.161   5.7904   23.756   6.7612   40.282   11.215  168.054   27.215  213.779   35.522 -45.72490 44.74925 
1 1 1   18   37   11 f  175.886   22.640   25.317   5.9535   29.506   7.0792   15.200   11.003  188.718   25.133  128.128   45.140 60.58977 51.66459 
1 1 1   18   37   12 o   76.469   30.561   3.1866   5.4080   4.3033   6.1998  -0.3671   11.059   83.552   32.934   89.208   39.810 -5.656151 51.66707 
1 1 1   18   37   13 o   68.370   29.346   0.6532   5.5119   5.8629   6.4537 -13.3927   10.597   89.953   34.092   68.409   33.095 21.54407 47.51335 
1 1 1   18   37   14 o   65.882   27.538   1.3290   4.6427   1.6239   5.1037  -0.0855   11.178   69.337   28.918   89.802   40.053 -20.46518 49.40174 
1 1 1   18   37   15 o  229.180   19.184   42.185   6.6677   44.341   8.0335   37.411   11.954  232.768   22.842  200.675   40.317 32.09311 46.33834 
1 1 1   18   37   16 o  214.722   24.485   38.216   7.9032   37.496   10.466   39.171   12.056  205.363   34.520  205.478   39.769 -0.1152802 52.66109 
1 1 1   18   37   17 o  144.510   35.216   19.075   7.7182   25.176   9.8191   9.2102   12.486  163.224   39.687  111.143   45.686 52.08147 60.51670 
1 1 1   18   37   18 o  257.710   29.987   57.307   11.607   57.307   11.607   0.0000   0.0000  257.710   29.987  ?   ?  0.000000 29.98706 
1 1 1   18   37   19 o  107.154   40.931   9.8539   9.3487   9.8539   9.3487   0.0000   0.0000  107.154   40.931  ?   ?  0.000000 40.93100 
1 1 1   18   37   20 o  185.504   24.163   28.887   6.6980   32.262   8.0839   21.496   11.963  193.291   28.150  142.668   47.133 50.62320 54.89919 
1 1 1   18   37   21 o   69.891   30.310   0.7573   6.0004   4.4290   7.6932  -4.9458   9.5880   86.685   35.774   73.709   34.419 12.97581 49.64333 
1 1 1   18   37   22 o  179.850   24.381   27.386   6.5387   42.415   8.7408   8.2897   9.8530  222.837   26.122  101.739   41.042 121.0975 48.65001 
1 1 1   18   37   23 o  322.207   14.553   82.184   7.1774  101.795   9.4818   55.867   10.984  356.067   17.398  252.596   28.931 103.4703 33.75910 
1 1 1   18   37   24 o  102.328   33.413   9.6794   6.0185   13.365   7.7187   3.9632   9.6123  116.809   37.821   89.547   38.598 27.26195 54.03942 
1 1 1   18   37   25 o  171.923   24.545   25.320   6.2756   23.903   7.9757   27.623   10.169  159.795   33.671  165.269   40.512 -5.474258 52.67772 
1 1 1   18   38    0 o  154.778   44.873   23.896   9.2256   23.896   9.2256   23.896   9.2256  154.778   44.873  154.778   44.873 0.000000 0.000000 
1 1 1   18   38    1 o   74.687   31.841   1.2526   6.4101  -4.5693   9.0333   7.1575   9.0975   73.952   34.143  101.065   39.877 -27.11290 52.49653 
1 1 1   18   38    2 o  310.968   16.652   76.421   7.8974   84.488   11.195   68.432   11.142  322.631   22.818  288.157   25.526 34.47385 34.23767 
1 1 1   18   38    3 o  196.630   22.913   31.615   6.7667   29.176   9.2391   34.437   9.9382  181.847   34.455  198.264   33.971 -16.41713 48.38533 
1 1 1   18   38    4 o   97.860   34.322   7.8688   6.3567  -4.3453   8.4752   23.576   9.6110   71.771   33.113  159.657   39.537 -87.88593 51.57159 
1 1 1   18   38    5 f  244.521   18.323   47.678   6.8080   47.020   9.1398   48.498   10.204  238.491   25.430  240.189   28.298 -1.697998 38.04530 
1 1 1   18   38    6 o  105.890   34.190   9.7460   6.3110   23.755   8.4412  -8.0102   9.5033  163.250   34.842   70.521   33.345 92.72930 48.22750 
1 1 1   18   38    7 o  325.627   15.904   83.443   7.9266   80.610   10.325   87.509   12.370  315.879   21.483  326.217   24.963 -10.33813 32.93408 
1 1 1   18   38    8 o  232.182   20.730   43.555   7.2896   46.183   9.5397   39.867   11.301  234.963   27.017  211.286   36.248 23.67743 45.20922 
1 1 1   18   38    9 o   96.630   35.470   7.4219   6.8763   4.6644   8.9663   11.360   10.715   93.181   38.551  115.400   43.882 -22.21917 58.41049 
1 1 1   18   38   10 o  263.907   18.564   55.698   7.4511   48.856   9.4676   66.832   12.078  242.212   25.941  281.419   28.428 -39.20795 38.48491 
1 1 1   18   38   11 o  214.607   22.029   37.617   7.1335   43.218   8.8497   27.228   12.054  227.557   25.868  165.333   45.967 62.22380 52.74590 
1 1 1   18   38   12 f   86.767   33.879   5.1130   6.5079   3.4672   8.1337   8.0413   10.849   86.852   36.388  105.718   42.920 -18.86666 56.26883 
1 1 1   18   38   13 o  106.794   35.082   10.160   6.6312   14.070   8.4310   3.8164   10.738  122.425   39.516   95.203   40.914 27.22232 56.88124 
1 1 1   18   38   14 o  283.361   15.140   63.470   6.5426   61.333   7.6969   69.034   12.421  276.533   18.288  284.038   28.975 -7.504852 34.26345 
1 1 1   18   38   15 f   73.439   29.084   3.2142   4.8560   7.2276   5.4293 -12.8374   10.858   92.379   31.758   69.067   33.434 23.31220 46.11263 
1 1 1   18   38   16 o   75.270   32.851   0.7733   7.1427   0.7733   7.1427   0.0000   0.0000   75.270   32.851  ?   ?  0.000000 32.85135 
1 1 1   18   38   17 o  152.776   34.246   21.484   7.8101   21.484   7.8101   0.0000   0.0000  152.776   34.246  ?   ?  0.000000 34.24599 
1 1 1   18   38   18 o  187.237   21.832   29.053   6.1392   30.574   7.5728   26.136   10.486  188.493   27.021  161.559   42.011 26.93468 49.95002 
1 1 1   18   38   19 o  144.078   28.544   18.328   6.0722   25.254   7.6199   6.2766   10.051  168.045   30.758   96.912   40.514 71.13368 50.86728 
1 1 1   18   38   20 o  219.773   21.016   39.872   6.9833   47.298   8.4751   24.169   12.325  237.272   23.651  147.800   47.784 89.47197 53.31723 
1 1 1   18   38   21 o   84.302   35.562   3.7286   7.8550   3.7286   7.8550   0.0000   0.0000   84.302   35.562  ?   ?  0.000000 35.56197 
1 1 1   18   38   22 o  123.487   37.658   15.057   7.7646   15.057   7.7646   0.0000   0.0000  123.487   37.658  ?   ?  0.000000 37.65809 
1 1 1   18   39    0 o  163.605   43.298   26.080   9.3677   26.080   9.3677   26.080   9.3677  163.605   43.298  163.605   43.298 0.000000 0.000000 
1 1 1   18   39    1 o   88.653   33.506   5.8197   6.2230   6.2182   8.9482   5.4465   8.6602   96.887   39.102   93.970   38.271 2.917152 54.71432 
1 1 1   18   39    2 o   74.944   31.727   1.7265   6.2880 -14.1268   8.1900   24.489   9.8138   56.273   27.627  160.996   40.002 -104.7232 48.61454 
1 1 1   18   39    3 o  231.901   19.945   43.447   7.0105   35.378   8.9569   56.206   11.264  202.770   29.743  256.698   29.186 -53.92812 41.67125 
1 1 1   18   39    4 o  159.802   23.621   21.247   5.6035   14.282   6.6827   37.740   10.284  125.552   33.956  206.326   33.730 -80.77372 47.86145 
1 1 1   18   39    5 o  369.785   12.524  106.720   7.0887  110.682   8.5891   98.257   12.553  375.035   14.963  345.446   23.888 29.58936 28.18716 
1 1 1   18   39    6 o  348.107   12.979   94.737   6.9154   92.649   8.3248   99.386   12.422  342.458   15.882  347.693   23.478 -5.235016 28.34526 
1 1 1   18   39    7 o  327.672   14.199   84.321   7.1212   86.714   8.6597   79.321   12.516  329.932   17.207  306.993   26.906 22.93896 31.93824 
1 1 1   18   39    8 o  318.266   14.415   79.648   7.0224   91.624   8.6634   56.705   11.991  339.838   16.655  254.956   31.391 84.88158 35.53581 
1 1 1   18   39    9 o   56.096   26.349  -4.7392   5.7596   2.3011   6.7978 -22.6537   10.844   78.264   33.052   59.996   29.867 18.26862 44.54749 
1 1 1   18   39   10 o  243.505   17.220   47.433   6.3766   47.445   7.6218   47.406   11.641  241.139   20.855  229.852   34.124 11.28783 39.99249 
1 1 1   18   39   11 o   95.195   32.445   7.8285   5.6648   9.3603   6.7863   4.3086   10.287  102.674   35.494   94.077   40.227 8.597015 53.64735 
1 1 1   18   39   12 o   83.485   32.037   5.0646   5.7439   6.2979   6.8003   1.9943   10.730   90.709   34.847   90.172   39.780 0.5364914 52.88490 
1 1 1   18   39   13 f  179.068   23.147   26.796   6.1959   30.212   7.3886   18.701   11.373  188.023   26.401  133.998   45.969 54.02512 53.01105 
1 1 1   18   39   14 o  105.907   35.498   10.290   6.7796   10.290   6.7796   0.0000   0.0000  105.907   35.498  ?   ?  0.000000 35.49768 
1 1 1   18   39   15 o  205.089   25.150   35.697   7.7294   35.697   7.7294   0.0000   0.0000  205.089   25.150  ?   ?  0.000000 25.14958 
1 1 1   18   39   16 o  160.798   26.691   22.402   6.3389   15.998   7.6325   36.639   11.380  128.762   36.856  194.204   39.626 -65.44215 54.11597 
1 1 1   18   39   17 o  102.142   34.087   9.5795   6.2513   5.5117   7.6930   17.487   10.726   89.140   36.158  128.823   44.617 -39.68353 57.42847 
1 1 1   18   39   18 o  191.048   22.195   30.518   6.3694   35.374   7.8454   21.129   10.909  202.926   25.845  140.237   44.916 62.68883 51.82137 
1 1 1   18   40    0 o  220.422   32.166   41.891   10.177   41.891   10.177   41.891   10.177  220.422   32.166  220.422   32.166 0.000000 0.000000 
1 1 1   18   40    1 o  176.998   26.206   26.701   6.8851   21.044   9.7415   32.348   9.7325  145.738   41.610  188.050   35.104 -42.31245 54.43988 
1 1 1   18   40    2 o  112.079   35.387   11.601   6.7899   19.717   9.2951   2.3153   9.9423  141.655   40.709   88.612   38.714 53.04272 56.17830 
1 1 1   18   40    3 o  131.563   33.206   15.858   6.6872   15.971   8.8728   15.708   10.175  127.867   40.461  125.715   43.460 2.152069 59.37895 
1 1 1   18   40    4 o  211.370   18.938   36.198   6.0619   36.759   7.3652   35.021   10.673  210.114   23.293  193.564   37.377 16.55019 44.04118 
1 1 1   18   40    5 o  151.435   25.691   19.607   5.7420   20.948   6.9436   16.706   10.212  153.419   30.641  128.825   43.565 24.59328 53.26158 
1 1 1   18   40    6 o  252.402   16.676   50.938   6.4061   53.525   7.9147   46.023   10.908  256.119   20.357  227.245   32.268 28.87361 38.15291 
1 1 1   18   40    7 o  275.257   15.906   60.341   6.6728   62.838   8.1603   55.302   11.592  278.409   19.268  250.562   30.880 27.84717 36.39830 
1 1 1   18   40    8 f   52.770   25.143  -5.8855   5.6092   2.5685   6.5239 -29.8536   10.985   77.308   32.499   55.160   27.817 22.14716 42.77870 
1 1 1   18   40    9 o  148.469   28.029   19.308   6.1361   21.472   7.2945   14.070   11.348  153.944   32.001  119.309   45.209 34.63532 55.38896 
1 1 1   18   40   10 o  186.196   22.358   28.892   6.2446   31.941   7.5086   22.051   11.246  193.194   26.057  144.192   45.543 49.00203 52.47047 
1 1 1   18   40   11 o   97.425   36.886   8.0529   7.5503   8.0529   7.5503   0.0000   0.0000   97.425   36.886  ?   ?  0.000000 36.88637 
1 1 1   18   40   12 o   85.596   34.425   4.9700   6.9092   4.9700   6.9092   0.0000   0.0000   85.596   34.425  ?   ?  0.000000 34.42489 
1 1 1   18   40   13 o   93.638   32.769   7.6931   5.7932   11.983   6.9795  -1.8070   10.387  112.235   35.925   80.958   37.096 31.27691 51.64066 
1 1 1   18   40   14 o  249.592   17.028   50.158   6.4665   49.693   7.8006   51.180   11.562  245.344   20.974  237.429   32.681 7.915070 38.83213 
1 1 1   18   41    0 o  100.438   50.953   13.788   9.7811   13.788   9.7811   13.788   9.7811  100.438   50.953  100.438   50.953 0.000000 0.000000 
1 1 1   18   41    1 o   64.335   29.629  -2.9799   6.7411  -1.3110   9.7129  -4.5307   9.3635   79.820   36.305   73.093   34.092 6.726807 49.80262 
1 1 1   18   41    2 o   73.197   31.817   1.0480   6.6427   10.522   9.1779  -9.3749   9.6264  107.225   40.651   67.288   32.296 39.93693 51.91836 
1 1 1   18   41    3 o  127.096   30.056   14.584   5.7551   14.871   6.9492   13.957   10.268  125.326   34.924  118.260   43.354 7.065613 55.67090 
1 1 1   18   41    4 o   69.133   29.556   1.3176   5.5512   6.4070   6.8616  -8.3245   9.4446   90.367   34.926   67.855   32.412 22.51217 47.64797 
1 1 1   18   41    5 o  112.583   31.949   11.681   5.7610   7.6969   7.0750   19.520   9.9245   95.308   35.790  137.465   42.687 -42.15667 55.70568 
1 1 1   18   41    6 o   84.269   31.916   5.5090   5.6539   6.3254   6.7661   3.6197   10.293   89.785   34.687   90.998   39.581 -1.213211 52.62947 
1 1 1   19    0    2 o  149.920   15.864   17.788   3.5471   17.788   3.5471   17.788   3.5471  149.920   15.864  149.920   15.864 0.000000 0.000000 
1 1 1   19    0    3 o  807.604   12.837  499.849   15.860  499.849   15.860  499.849   15.860  807.604   12.837  807.604   12.837 0.000000 0.000000 
1 1 1   19    0    4 o  1102.14   15.678  931.088   26.437  931.088   26.437  931.088   26.437  1102.14   15.678  1102.14   15.678 0.000000 0.000000 
1 1 1   19    0    5 o  392.291   11.107  118.115   6.6570  118.115   6.6570  118.115   6.6570  392.291   11.107  392.291   11.107 0.000000 0.000000 
1 1 1   19    0    6 o  226.283   8.4669   39.363   2.9232   39.363   2.9232   39.363   2.9232  226.283   8.4669  226.283   8.4669 0.000000 0.000000 
1 1 1   19    0    7 o  311.866   7.8689   74.595   3.7508   74.595   3.7508   74.595   3.7508  311.866   7.8689  311.866   7.8689 0.000000 0.000000 
1 1 1   19    0    9 o  511.550   7.8251  200.461   6.1238  200.461   6.1238  200.461   6.1238  511.550   7.8251  511.550   7.8251 0.000000 0.000000 
1 1 1   19    0   10 o   27.873   19.096  -1.7423   2.5987  -1.7423   2.5987  -1.7423   2.5987   27.873   19.096   27.873   19.096 0.000000 0.000000 
1 1 1   19    0   13 o  595.104   11.743  271.524   10.687  271.524   10.687  271.524   10.687  595.104   11.743  595.104   11.743 0.000000 0.000000 
1 1 1   19    0   14 o  1281.42   12.627  1257.99   24.760  1257.99   24.760  1257.99   24.760  1281.42   12.627  1281.42   12.627 0.000000 0.000000 
1 1 1   19    0   15 o  553.720   8.9962  234.930   7.6201  234.930   7.6201  234.930   7.6201  553.720   8.9962  553.720   8.9962 0.000000 0.000000 
1 1 1   19    0   16 o  260.900   7.4407   52.236   2.9659   52.236   2.9659   52.236   2.9659  260.900   7.4407  260.900   7.4407 0.000000 0.000000 
1 1 1   19    0   17 o  285.254   8.4770   62.462   3.6938   62.462   3.6938   62.462   3.6938  285.254   8.4770  285.254   8.4770 0.000000 0.000000 
1 1 1   19    0   18 o  1171.45   8.4412  1050.83   15.134  1050.83   15.134  1050.83   15.134  1171.45   8.4412  1171.45   8.4412 0.000000 0.000000 
1 1 1   19    0   19 o  820.846   8.0317  516.009   10.089  516.009   10.089  516.009   10.089  820.846   8.0317  820.846   8.0317 0.000000 0.000000 
1 1 1   19    0   20 f   34.627   22.388  -0.0937   2.7829  -0.0937   2.7829  -0.0937   2.7829   34.627   22.388   34.627   22.388 0.000000 0.000000 
1 1 1   19    0   21 f  318.295   8.3267   77.732   4.0504   77.732   4.0504   77.732   4.0504  318.295   8.3267  318.295   8.3267 0.000000 0.000000 
1 1 1   19    0   22 o  323.838   7.5769   80.426   3.7510   80.426   3.7510   80.426   3.7510  323.838   7.5769  323.838   7.5769 0.000000 0.000000 
1 1 1   19    0   23 o  304.143   8.0713   70.982   3.7515   70.982   3.7515   70.982   3.7515  304.143   8.0713  304.143   8.0713 0.000000 0.000000 
1 1 1   19    0   24 o  479.912   8.1550  176.523   5.9865  176.523   5.9865  176.523   5.9865  479.912   8.1550  479.912   8.1550 0.000000 0.000000 
1 1 1   19    0   25 o   65.727   28.777   4.7716   3.0183   4.7716   3.0183   4.7716   3.0183   65.727   28.777   65.727   28.777 0.000000 0.000000 
1 1 1   19    0   26 o  626.933   7.9736  301.156   7.6487  301.156   7.6487  301.156   7.6487  626.933   7.9736  626.933   7.9736 0.000000 0.000000 
1 1 1   19    0   27 o   20.514   15.043  -8.2145   3.0877  -8.2145   3.0877  -8.2145   3.0877   20.514   15.043   20.514   15.043 0.000000 0.000000 
1 1 1   19    0   28 o  359.437   9.7593   99.214   5.3603   99.214   5.3603   99.214   5.3603  359.437   9.7593  359.437   9.7593 0.000000 0.000000 
1 1 1   19    0   29 o  171.721   13.568   23.044   3.5149   23.044   3.5149   23.044   3.5149  171.721   13.568  171.721   13.568 0.000000 0.000000 
1 1 1   19    0   30 o  385.134   8.0248  113.777   4.7260  113.777   4.7260  113.777   4.7260  385.134   8.0248  385.134   8.0248 0.000000 0.000000 
1 1 1   19    0   31 o   87.515   33.687   8.0839   4.2741   8.0839   4.2741   8.0839   4.2741   87.515   33.687   87.515   33.687 0.000000 0.000000 
1 1 1   19    0   32 o  283.377   9.4670   61.761   4.0959   61.761   4.0959   61.761   4.0959  283.377   9.4670  283.377   9.4670 0.000000 0.000000 
1 1 1   19    0   33 o   90.224   27.875   7.8499   3.3692   7.8499   3.3692   7.8499   3.3692   90.224   27.875   90.224   27.875 0.000000 0.000000 
1 1 1   19    0   34 o   55.484   30.548   3.3468   3.7580   3.3468   3.7580   3.3468   3.7580   55.484   30.548   55.484   30.548 0.000000 0.000000 
1 1 1   19    0   35 o  267.376   11.339   55.167   4.6215   55.167   4.6215   55.167   4.6215  267.376   11.339  267.376   11.339 0.000000 0.000000 
1 1 1   19    0   36 o  389.261   9.5004  116.430   5.6528  116.430   5.6528  116.430   5.6528  389.261   9.5004  389.261   9.5004 0.000000 0.000000 
1 1 1   19    0   37 o   79.377   31.127   6.7367   3.6220   6.7367   3.6220   6.7367   3.6220   79.377   31.127   79.377   31.127 0.000000 0.000000 
1 1 1   19    0   38 o  274.659   11.995   58.306   5.0208   58.306   5.0208   58.306   5.0208  274.659   11.995  274.659   11.995 0.000000 0.000000 
1 1 1   19    0   39 o   67.000   32.262   5.2017   3.8334   5.2017   3.8334   5.2017   3.8334   67.000   32.262   67.000   32.262 0.000000 0.000000 
1 1 1   19    0   40 o   32.962   22.886  -3.4064   4.0471  -3.4064   4.0471  -3.4064   4.0471   32.962   22.886   32.962   22.886 0.000000 0.000000 
1 1 1   19    0   41 o   64.254   33.178   4.8175   4.1895   4.8175   4.1895   4.8175   4.1895   64.254   33.178   64.254   33.178 0.000000 0.000000 
1 1 1   19    0   42 o   54.111   30.459   3.1521   3.8354   3.1521   3.8354   3.1521   3.8354   54.111   30.459   54.111   30.459 0.000000 0.000000 
1 1 1   19    0   43 o  179.387   23.054   26.311   6.0431   26.311   6.0431   26.311   6.0431  179.387   23.054  179.387   23.054 0.000000 0.000000 
1 1 1   19    0   44 o   76.976   35.495   6.9106   4.5988   6.9106   4.5988   6.9106   4.5988   76.976   35.495   76.976   35.495 0.000000 0.000000 
1 1 1   19    0   45 o   74.011   35.081   6.4546   4.5144   6.4546   4.5144   6.4546   4.5144   74.011   35.081   74.011   35.081 0.000000 0.000000 
1 1 1   19    0   46 o   57.033   33.394   3.2821   4.8833   3.2821   4.8833   3.2821   4.8833   57.033   33.394   57.033   33.394 0.000000 0.000000 
1 1 1   19    0   47 o  180.407   17.195   25.953   4.6490   25.953   4.6490   25.953   4.6490  180.407   17.195  180.407   17.195 0.000000 0.000000 
1 1 1   19    0   48 o   49.808   30.749   1.7631   4.6039   1.7631   4.6039   1.7631   4.6039   49.808   30.749   49.808   30.749 0.000000 0.000000 
1 1 1   19    0   49 o  164.537   23.284   22.539   5.5254   22.539   5.5254   22.539   5.5254  164.537   23.284  164.537   23.284 0.000000 0.000000 
1 1 1   19    0   50 o   39.210   26.732  -2.4552   4.9569  -2.4552   4.9569  -2.4552   4.9569   39.210   26.732   39.210   26.732 0.000000 0.000000 
1 1 1   19    0   51 o  129.312   28.891   15.158   4.9944   15.158   4.9944   15.158   4.9944  129.312   28.891  129.312   28.891 0.000000 0.000000 
1 1 1   19    0   52 f  100.653   37.685   11.213   5.4166   11.213   5.4166   11.213   5.4166  100.653   37.685  100.653   37.685 0.000000 0.000000 
1 1 1   19    0   53 o   29.113   20.998  -8.0948   4.7361  -8.0948   4.7361  -8.0948   4.7361   29.113   20.998   29.113   20.998 0.000000 0.000000 
1 1 1   19    0   54 o  228.318   18.329   41.949   6.3106   41.949   6.3106   41.949   6.3106  228.318   18.329  228.318   18.329 0.000000 0.000000 
1 1 1   19    0   55 o   95.864   34.580   10.114   4.6500   10.114   4.6500   10.114   4.6500   95.864   34.580   95.864   34.580 0.000000 0.000000 
1 1 1   19    0   56 o  165.103   19.723   22.669   4.7962   22.669   4.7962   22.669   4.7962  165.103   19.723  165.103   19.723 0.000000 0.000000 
1 1 1   19    0   57 o   37.871   25.661  -1.4635   4.4275  -1.4635   4.4275  -1.4635   4.4275   37.871   25.661   37.871   25.661 0.000000 0.000000 
1 1 1   19    1    0 o  311.674   10.631   74.634   5.0582   74.634   5.0582   74.634   5.0582  311.674   10.631  311.674   10.631 0.000000 0.000000 
1 1 1   19    1    1 o  771.589   8.7794  455.896   10.369  455.521   14.632  456.274   14.695  771.047   12.398  771.681   12.441 -0.6338501 17.56414 
1 1 1   19    1    2 o  586.554   6.3357  263.384   5.6881  279.901   10.397  256.328   6.7952  604.468   11.238  578.603   7.6728 25.86432 13.60719 
1 1 1   19    1    3 o  589.221   6.3744  265.786   5.7489  262.395   10.142  267.391   6.9783  585.254   11.321  590.955   7.7149 -5.700806 13.70011 
1 1 1   19    1    4 o  401.368   7.7018  123.346   4.7316  127.904   6.7955  119.057   6.5921  408.623   10.865  394.236   10.924 14.38705 15.40746 
1 1 1   19    1    5 o  338.495   8.0372   87.733   4.1641   92.459   6.0942   83.594   5.7032  347.402   11.461  330.332   11.280 17.07013 16.08046 
1 1 1   19    1    6 o  476.982   5.3156  174.157   3.8808  174.423   5.5879  173.909   5.3939  477.289   7.6489  476.592   7.3941 0.6965027 10.63855 
1 1 1   19    1    7 o  508.716   5.4231  198.104   4.2227  200.840   6.1019  195.589   5.8498  512.153   7.7839  505.420   7.5617 6.733032 10.85207 
1 1 1   19    1    8 o  439.865   5.3874  148.109   3.6272  153.049   5.3132  143.798   4.9638  447.083   7.7643  433.369   7.4831 13.71396 10.78337 
1 1 1   19    1    9 o  1015.93   7.4269  790.262   11.549  788.644   16.372  791.864   16.294  1014.66   10.542  1016.73   10.470 -2.076172 14.85760 
1 1 1   19    1   10 o  593.906   5.8177  270.023   5.2886  264.623   7.4615  275.474   7.4970  587.850   8.2926  599.787   8.1662 -11.93738 11.63852 
1 1 1   19    1   11 o  300.703   6.3550   69.226   2.9250   69.360   4.1644   69.096   4.1092  300.940   9.0408  300.368   8.9379 0.5720520 12.71309 
1 1 1   19    1   12 o  840.704   6.7342  541.132   8.6656  551.246   12.576  531.989   11.958  848.339   9.6849  833.411   9.3738 14.92761 13.47831 
1 1 1   19    1   13 o  358.564   6.2892   98.431   3.4517   98.728   6.7789   98.327   4.0105  358.916   12.339  358.352   7.3118 0.5642395 14.34311 
1 1 1   19    1   14 o  487.218   6.1208  181.737   4.5645  172.138   8.8536  185.212   5.3271  473.923   12.205  491.824   7.0764 -17.90082 14.10820 
1 1 1   19    1   15 o  771.197   4.9654  455.278   5.8613  445.318   8.7268  463.464   7.9112  762.596   7.4764  778.024   6.6432 -15.42786 10.00144 
1 1 1   19    1   16 o  238.603   5.8158   43.586   2.1240   40.867   3.1498   45.853   2.8764  230.987   8.9089  244.699   7.6798 -13.71170 11.76210 
1 1 1   19    1   17 o  715.348   5.5328  391.758   6.0581  393.382   8.6527  390.197   8.4847  716.706   7.8875  713.806   7.7658 2.900330 11.06887 
1 1 1   19    1   18 f  559.107   4.7865  239.300   4.0962  233.409   6.2287  243.790   5.4375  552.082   7.3709  564.274   6.2956 -12.19128 9.693565 
1 1 1   19    1   19 o   97.808   13.941   7.4857   2.0280   8.4688   2.8183   6.4301   2.9206  103.439   18.479   89.629   21.553 13.81004 28.39015 
1 1 1   19    1   20 o  193.928   7.9586   28.806   2.3624   20.719   3.8182   33.821   3.0070  163.566   15.434  210.099   9.3505 -46.53375 18.04517 
1 1 1   19    1   21 o  118.942   11.519   10.948   2.0707   10.860   2.8299   11.050   3.0382  117.827   16.113  118.695   17.226 -0.8679504 23.58756 
1 1 1   19    1   22 o  278.266   6.1212   59.294   2.6072   59.191   3.5352   59.417   3.8603  277.957   8.3094  278.460   9.0572 -0.5027161 12.29140 
1 1 1   19    1   23 f  228.920   6.7586   40.136   2.3681   45.328   3.4187   35.347   3.2835  243.197   9.1840  214.732   9.9903 28.46507 13.57020 
1 1 1   19    1   24 o  331.766   5.5264   84.284   2.8064   89.634   4.0848   79.502   3.8621  342.038   7.8024  322.126   7.8330 19.91183 11.05593 
1 1 1   19    1   25 o  216.734   7.7264   35.992   2.5631   40.427   3.5622   31.232   3.6909  229.599   10.136  201.365   12.030 28.23453 15.73108 
1 1 1   19    1   26 f  621.400   5.6034  295.719   5.3295  304.719   7.7715  287.728   7.3227  630.557   8.0521  612.750   7.8076 17.80646 11.21586 
1 1 1   19    1   27 o  172.477   9.8296   22.893   2.5842   23.857   3.4564   21.671   3.8915  175.737   12.941  167.110   15.387 8.627457 20.10522 
1 1 1   19    1   28 o  128.145   12.849   12.746   2.4863   10.815   3.8975   14.071   3.2286  116.161   22.735  134.214   16.034 -18.05245 27.82002 
1 1 1   19    1   29 o  153.260   10.808   18.124   2.5192   15.794   3.8901   19.808   3.3062  141.839   18.348  159.885   13.640 -18.04552 22.86299 
1 1 1   19    1   30 o  190.286   8.7039   27.776   2.5351   26.189   3.6398   29.270   3.5328  184.057   13.003  194.781   11.907 -10.72473 17.63131 
1 1 1   19    1   31 o  238.398   8.3554   43.597   3.0489   44.875   4.9561   42.818   3.8673  241.050   13.487  236.085   10.702 4.964966 17.21696 
1 1 1   19    1   32 o  343.931   6.5953   90.669   3.4720   90.066   4.5821   91.483   5.3205  342.582   8.7383  345.112   10.072 -2.529602 13.33433 
1 1 1   19    1   33 o  470.424   5.7099  169.578   4.1114  175.765   6.2626  164.892   5.4504  478.551   8.5498  463.640   7.6803 14.91141 11.49288 
1 1 1   19    1   34 o  189.973   9.5973   27.798   2.7817   28.309   3.8632   27.248   4.0085  191.162   13.286  187.387   14.079 3.774353 19.35756 
1 1 1   19    1   35 o  106.874   16.405   9.0462   2.5978   11.928   3.6254   6.0054   3.7243  122.205   20.080   86.684   26.002 35.52089 32.85252 
1 1 1   19    1   36 o  362.305   6.2268  100.653   3.4531  104.544   5.0800   97.312   4.7081  368.853   8.9978  355.921   8.6421 12.93192 12.47585 
1 1 1   19    1   37 o  157.515   11.648   19.231   2.7885   18.402   4.2551   19.854   3.6917  152.570   18.607  159.347   15.325 -6.777267 24.10519 
1 1 1   19    1   38 o  310.362   7.9483   73.994   3.7758   71.449   5.3507   76.519   5.3291  304.361   11.486  315.066   11.050 -10.70462 15.93834 
1 1 1   19    1   39 o  234.739   8.2905   42.357   2.9788   42.494   4.2411   42.224   4.1846  234.285   11.865  233.861   11.690 0.4240265 16.65698 
1 1 1   19    1   40 o   72.180   22.226   4.1383   2.6969   0.6751   3.7304   7.9303   3.9034   58.812   24.642   97.815   25.727 -39.00276 35.62464 
1 1 1   19    1   41 o  151.739   12.542   17.940   2.8868   19.045   4.3429   17.065   3.8639  154.757   18.715  146.719   17.554 8.037720 25.65898 
1 1 1   19    1   42 o  232.086   9.0864   41.487   3.2278   46.037   4.6421   37.227   4.4913  243.485   12.498  218.617   13.488 24.86876 18.38808 
1 1 1   19    1   43 o  173.260   17.385   23.760   4.5484   18.863   7.3534   26.794   5.7886  147.918   33.284  182.734   21.083 -34.81682 39.39880 
1 1 1   19    1   44 o   43.455   19.884  -1.8512   2.9695  -5.9812   4.4681   1.4161   3.9741   45.894   22.021   63.009   25.823 -17.11529 33.93754 
1 1 1   19    1   45 o   97.443   21.545   7.8516   3.1281   7.4699   4.3303   8.2682   4.5235   94.364   27.978   98.877   28.394 -4.513260 39.86191 
1 1 1   19    1   46 o  146.618   16.888   17.119   3.7206   20.114   5.0482   13.558   5.5051  157.288   21.534  125.674   29.179 31.61393 36.26459 
1 1 1   19    1   47 o  128.026   18.432   13.227   3.5078   10.572   4.8651   16.102   5.0625  110.824   28.515  138.937   24.711 -28.11231 37.73273 
1 1 1   19    1   48 o   79.439   24.007   5.2237   3.1661   6.5550   4.6506   4.0737   4.3225   89.015   29.386   75.848   28.074 13.16720 40.64124 
1 1 1   19    1   49 o   87.475   25.047   6.4853   3.5246   10.544   4.7838   1.6662   5.2129  110.089   28.249   69.776   29.174 40.31322 40.60960 
1 1 1   19    1   50 o   70.319   25.134   3.7105   3.4231   3.8567   4.9817   3.5797   4.7115   76.592   29.715   74.435   28.893 2.156738 41.44618 
1 1 1   19    1   51 o  104.864   22.169   9.3114   3.4470   8.1301   4.8512   10.516   4.8987   95.983   29.851  108.678   28.935 -12.69492 41.57338 
1 1 1   19    1   52 o   58.885   24.306   1.3696   3.5523  -0.5559   4.8675   3.5639   5.1961   59.990   26.612   75.284   29.999 -15.29410 40.10202 
1 1 1   19    1   53 o  171.417   14.686   23.489   3.8161   24.110   5.7670   23.005   5.0898  168.776   22.917  166.436   20.407 2.339325 30.68581 
1 1 1   19    1   54 o   71.239   27.336   3.6935   4.1816   4.1919   6.0817   3.2467   5.7589   79.002   32.111   74.834   30.923 4.168526 44.57981 
1 1 1   19    1   55 f  221.519   10.700   38.518   3.6281   35.492   5.1482   41.504   5.1138  208.751   16.240  226.959   14.802 -18.20850 21.97340 
1 1 1   19    1   56 o  147.877   15.301   17.857   3.4131   17.555   4.8664   18.150   4.7883  141.081   23.352  144.216   22.420 -3.135056 32.37283 
1 1 1   19    2    1 o  453.812   10.201  157.738   7.0858   0.0000   0.0000  157.738   7.0858  ?   ?   453.812   10.201 0.000000 10.20103 
1 1 1   19    2    2 f  1292.94   12.325  1280.87   24.391  1307.27   35.549  1257.39   33.528  1305.38   17.792  1280.35   17.108 25.03003 24.68318 
1 1 1   19    2    3 o  549.122   6.2569  230.838   5.2590  230.960   9.4375  230.783   6.3334  549.083   11.229  549.019   7.5367 0.6372070E-01 13.52395 
1 1 1   19    2    4 o  212.608   6.9396   34.607   2.2583   38.889   4.6104   33.255   2.5903  224.860   13.457  208.400   8.1206 16.45961 15.71758 
1 1 1   19    2    5 o  220.813   5.5638   37.325   1.8805   32.743   4.8129   38.150   2.0429  206.081   15.369  223.237   5.9787 -17.15587 16.49057 
1 1 1   19    2    6 o  461.483   5.2955  163.023   3.7405  166.120   5.5378  160.425   5.0726  465.786   7.7674  457.747   7.2400 8.039307 10.61843 
1 1 1   19    2    7 o  395.030   5.3331  119.453   3.2246  119.772   4.7904  119.189   4.3605  395.502   7.9133  394.555   7.2203 0.9474182 10.71229 
1 1 1   19    2    8 o  387.165   7.3403  114.769   4.3499   0.0000   0.0000  114.769   4.3499  ?   ?   387.165   7.3403 0.000000 7.340314 
1 1 1   19    2    9 o  351.167   8.3444   94.432   4.4852   94.432   4.4852   0.0000   0.0000  351.167   8.3444  ?   ?  0.000000 8.344416 
1 1 1   19    2   10 o  359.506   5.2103   98.936   2.8671  100.945   4.6965   97.742   3.6198  363.069   8.4512  357.305   6.6188 5.764648 10.73458 
1 1 1   19    2   11 o  415.191   5.7657  131.966   3.6641  134.489   5.4107  129.830   4.9798  419.070   8.4352  411.763   7.9013 7.306763 11.55782 
1 1 1   19    2   12 o  700.263   6.2112  375.417   6.6575  376.852   9.6143  374.094   9.2277  701.468   8.9545  698.915   8.6258 2.552979 12.43332 
1 1 1   19    2   13 o  1030.35   6.8587  812.837   10.817  827.618   17.486  803.676   13.767  1039.32   10.992  1024.39   8.7800 14.93469 14.06824 
1 1 1   19    2   14 o  417.931   6.1869  133.724   3.9577  145.786   8.1362  129.986   4.5297  436.140   12.188  412.022   7.1826 24.11829 14.14684 
1 1 1   19    2   15 o  964.755   6.6696  712.635   9.8488  716.749   15.794  710.018   12.599  967.200   10.668  962.844   8.5486 4.356140 13.67077 
1 1 1   19    2   16 o  486.490   5.1071  181.178   3.8029  175.519   6.9409  183.605   4.5460  478.674   9.4735  489.710   6.0648 -11.03680 11.24852 
1 1 1   19    2   17 o  422.332   5.0521  136.543   3.2658  141.610   5.5432  133.849   4.0418  429.990   8.4223  418.112   6.3155 11.87744 10.52715 
1 1 1   19    2   18 o  739.824   5.3855  419.026   6.0985  415.710   10.510  420.710   7.4881  736.644   9.3211  741.247   6.5999 -4.601990 11.42108 
1 1 1   19    2   19 o  227.336   6.9501   39.576   2.4184   40.176   3.5191   39.039   3.3291  228.980   10.041  225.726   9.6354 3.253769 13.91607 
1 1 1   19    2   20 o  323.792   5.5652   80.269   2.7581   81.225   3.7325   79.120   4.0937  325.660   7.4879  321.385   8.3219 4.275635 11.19481 
1 1 1   19    2   21 o  454.910   5.0637  158.434   3.5259  153.115   5.4626  162.233   4.6163  447.088   7.9824  460.275   6.5524 -13.18768 10.32730 
1 1 1   19    2   22 o  390.597   5.3364  116.812   3.1904  121.164   4.3985  111.980   4.6346  397.734   7.2250  382.332   7.9196 15.40222 10.72015 
1 1 1   19    2   23 o  454.763   4.8848  158.338   3.4002  162.720   5.0046  154.581   4.6339  460.910   7.0938  449.254   6.7388 11.65585 9.784392 
1 1 1   19    2   24 o  997.847   5.5702  762.457   8.5076  775.101   12.338  750.995   11.747  1005.78   8.0142  990.053   7.7518 15.72589 11.14979 
1 1 1   19    2   25 o  218.640   7.6955   36.628   2.5754   35.393   3.5867   37.944   3.7002  214.511   10.960  222.399   10.870 -7.888184 15.43644 
1 1 1   19    2   26 o  470.254   5.8263  169.367   4.1936  165.094   5.9316  173.636   5.9298  464.103   8.3500  475.976   8.1393 -11.87311 11.66067 
1 1 1   19    2   27 o  135.878   11.163   14.267   2.3012   19.405   3.5002   10.355   3.0541  158.164   14.624  114.523   18.018 43.64166 23.20558 
1 1 1   19    2   28 o  914.248   5.4911  640.192   7.6842  642.800   11.020  637.724   10.720  915.730   7.8622  912.141   7.6785 3.588562 10.98970 
1 1 1   19    2   29 o   51.479   20.243   1.1845   2.3369   4.8116   3.7261  -1.1674   3.0004   80.074   26.297   46.603   20.771 33.47177 33.51083 
1 1 1   19    2   30 o  208.338   8.1013   33.286   2.5834   37.570   3.8328   29.719   3.4972  220.833   11.378  196.298   11.692 24.53497 16.31467 
1 1 1   19    2   31 o  328.409   6.6298   82.662   3.3326   82.552   5.6910   82.720   4.1113  327.725   11.345  328.397   8.1792 -0.6724243 13.98610 
1 1 1   19    2   32 o  129.237   14.201   13.027   2.7628   15.546   3.7837   10.150   4.0435  140.601   17.995  111.899   24.304 28.70232 30.24039 
1 1 1   19    2   33 o  138.956   12.612   14.989   2.6533   11.558   3.7314   18.499   3.7736  120.183   21.052  153.842   16.273 -33.65894 26.60762 
1 1 1   19    2   34 f  269.920   7.0203   55.875   2.9004   56.711   4.2149   55.124   3.9973  271.623   10.138  267.837   9.7505 3.785706 14.06598 
1 1 1   19    2   35 o  342.929   6.6464   90.185   3.4887   89.194   4.7544   91.341   5.1351  340.734   9.1161  344.719   9.7322 -3.984833 13.33490 
1 1 1   19    2   36 o  174.645   10.061   23.538   2.6781   23.370   3.8959   23.689   3.6876  173.176   14.841  174.548   13.918 -1.371445 20.34621 
1 1 1   19    2   37 o   76.685   21.797   4.7382   2.6793   3.8721   3.5843   5.8350   4.0335   73.583   25.774   85.985   27.288 -12.40133 37.53598 
1 1 1   19    2   38 o  409.772   7.3401  128.919   4.6038  123.075   6.9137  133.574   6.1709  399.502   11.306  416.614   9.6771 -17.11255 14.88211 
1 1 1   19    2   39 o  187.424   11.142   27.193   3.1820   21.798   4.4644   32.764   4.5365  166.173   17.831  205.014   14.551 -38.84113 23.01459 
1 1 1   19    2   40 f  219.808   9.0859   37.188   3.0569   32.721   4.4610   41.142   4.1973  204.848   14.318  230.425   11.942 -25.57739 18.64393 
1 1 1   19    2   41 o   63.949   22.640   2.8796   2.7713   10.938   4.2679  -2.9949   3.6440  114.930   24.975   46.151   21.439 68.77954 32.91447 
1 1 1   19    2   42 o   86.869   21.722   6.2140   2.8807  -0.3877   4.2588   11.781   3.9111   58.423   25.436  120.112   22.087 -61.68906 33.68747 
1 1 1   19    2   43 o   44.488   21.127  -4.5149   3.8954 -10.8783   6.2622  -0.4985   4.9751   50.385   24.614   62.633   27.374 -12.24801 36.81330 
1 1 1   19    2   44 o  240.034   9.1562   44.419   3.3640   45.485   4.9334   43.492   4.5991  241.540   13.396  236.377   12.759 5.163666 18.50002 
1 1 1   19    2   45 o  180.962   13.122   25.592   3.6099   27.536   5.2265   23.818   4.9920  185.859   18.623  172.502   19.234 13.35669 26.77205 
1 1 1   19    2   46 f  115.107   20.710   10.854   3.5146   10.452   4.8627   11.293   5.0857  110.426   28.557  114.651   28.969 -4.225113 40.67793 
1 1 1   19    2   47 o  228.787   11.624   40.732   4.0572   42.794   5.1885   37.485   6.5090  233.428   14.595  216.031   19.909 17.39647 24.68551 
1 1 1   19    2   48 o  180.999   12.670   25.645   3.4880   28.437   5.0730   23.142   4.8035  188.673   17.776  169.611   18.820 19.06221 25.88805 
1 1 1   19    2   49 o   56.664   23.794   0.7717   3.4904   3.4017   4.7973  -2.1864   5.0877   74.375   29.075   57.809   26.287 16.56650 39.19625 
1 1 1   19    2   50 o  181.892   13.796   26.106   3.8124   26.811   5.7884   25.566   5.0665  180.690   21.341  177.679   18.921 3.010651 28.52105 
1 1 1   19    2   51 o  164.531   14.963   21.564   3.7270   18.901   4.9726   24.979   5.6298  150.444   22.267  173.654   21.651 -23.20959 31.05767 
1 1 1   19    2   52 o  165.610   14.582   21.862   3.6586   22.888   5.1949   20.852   5.1533  166.139   20.890  157.891   21.914 8.247757 30.27627 
1 1 1   19    2   53 o   76.880   26.028   4.9453   3.6453   0.7279   5.2872   8.7664   5.0327   65.608   28.452   98.032   30.391 -32.42442 41.63089 
1 1 1   19    2   54 o  163.432   17.640   21.910   4.3426   30.709   6.1405   13.106   6.1423  190.934   21.378  116.478   32.967 74.45529 39.29146 
1 1 1   19    2   55 o   46.324   21.039  -1.2363   3.2466   8.7515   4.6538 -10.7049   4.5313   96.438   29.098   38.091   19.017 58.34673 34.76096 
1 1 1   19    2   56 o   54.803   22.936   1.1834   3.2262   6.1429   4.5614  -3.7812   4.5638   82.115   29.049   48.747   23.068 33.36760 37.09382 
1 1 1   19    3    0 o  311.363   10.919   74.502   5.1891   74.502   5.1891   74.502   5.1891  311.363   10.919  311.363   10.919 0.000000 0.000000 
1 1 1   19    3    1 o  502.870   10.326  193.691   7.9481   0.0000   0.0000  193.691   7.9481  ?   ?   502.870   10.326 0.000000 10.32618 
1 1 1   19    3    2 o  652.958   8.0450  326.458   8.0405  319.335   11.544  333.170   11.206  645.616   11.682  659.487   11.101 -13.87103 16.11502 
1 1 1   19    3    3 o  517.043   7.4253  204.682   5.8764  226.913   9.4334  190.585   7.5120  544.243   11.324  498.839   9.8384 45.40451 15.00096 
1 1 1   19    3    4 o  239.365   7.9936   43.871   2.9287   41.684   5.0665   44.969   3.5890  232.757   14.290  242.312   9.6768 -9.555206 17.25853 
1 1 1   19    3    5 o  1124.69   7.8456  968.533   13.506  980.688   27.967  964.836   15.424  1130.83   16.158  1122.45   8.9775 8.374146 18.48441 
1 1 1   19    3    6 o  355.015   4.5007   96.473   2.4457  101.800   4.5699   94.334   2.8952  364.617   8.1885  351.046   5.3881 13.57065 9.802190 
1 1 1   19    3    7 o  1168.10   7.2508  1044.69   12.964  1107.88   22.117  1011.62   16.001  1202.46   12.017  1149.32   9.0957 53.13965 15.07092 
1 1 1   19    3    8 o  682.544   5.3585  356.619   5.5982  361.329   9.1441  353.796   7.0801  686.902   8.6971  679.787   6.8045 7.115173 11.04271 
1 1 1   19    3    9 o  867.662   6.0426  576.336   8.0249  623.188   13.811  552.457   9.8601  901.998   10.004  849.422   7.5839 52.57611 12.55346 
1 1 1   19    3   10 o  1036.03   7.5420  821.867   11.960  856.469   17.879  793.840   16.090  1057.32   11.047  1017.99   10.326 39.32391 15.12205 
1 1 1   19    3   11 o  365.397   5.8591  102.212   3.2769  102.184   5.0297  102.233   4.3195  365.270   8.9962  365.394   7.7233 -0.1236267 11.85670 
1 1 1   19    3   12 o  1008.78   6.7068  779.136   10.356  818.257   17.396  757.662   12.888  1033.44   10.997  994.662   8.4655 38.77625 13.87825 
1 1 1   19    3   13 o  504.402   5.2915  194.763   4.0853  182.843   6.5759  202.256   5.2135  488.608   8.7927  513.974   6.6270 -25.36517 11.01040 
1 1 1   19    3   14 o  447.829   5.5225  153.530   3.7854  150.397   6.5194  155.123   4.6495  443.102   9.6124  450.114   6.7486 -7.011230 11.74488 
1 1 1   19    3   15 f  594.187   5.3683  270.279   4.8823  259.201   7.4113  278.773   6.4895  581.764   8.3229  603.388   7.0266 -21.62433 10.89238 
1 1 1   19    3   16 o  694.256   5.8968  369.010   6.2662  370.048   10.345  368.408   7.8753  695.013   9.7246  693.615   7.4179 1.397766 12.23079 
1 1 1   19    3   17 o  354.708   6.3435   96.333   3.4441   89.451   6.0293   99.666   4.1960  341.628   11.530  360.758   7.5989 -19.12970 13.80912 
1 1 1   19    3   18 o  956.891   5.6147  701.011   8.2235  709.570   12.781  694.963   10.743  962.470   8.6755  952.628   7.3675 9.841614 11.38173 
1 1 1   19    3   19 o  340.105   5.2954   88.556   2.7566   91.510   4.4142   86.667   3.5295  345.642   8.3436  336.419   6.8544 9.223328 10.79801 
1 1 1   19    3   20 o  312.438   5.9550   74.744   2.8479   77.901   4.2947   72.266   3.8047  318.879   8.7990  307.154   8.0926 11.72495 11.95460 
1 1 1   19    3   21 o  221.870   7.0091   37.701   2.3803   40.519   3.9193   36.053   2.9962  229.890   11.138  216.919   9.0239 12.97057 14.33512 
1 1 1   19    3   22 o  537.484   5.0560  221.180   4.1595  225.856   6.7704  218.345   5.2717  542.963   8.1466  533.961   6.4502 9.001404 10.39097 
1 1 1   19    3   23 o  468.569   5.2019  168.108   3.7308  164.632   5.0568  172.260   5.5268  463.605   7.1263  474.195   7.6147 -10.59012 10.42914 
1 1 1   19    3   24 o  500.779   5.2332  192.023   4.0113  194.740   5.4290  188.757   5.9528  504.204   7.0346  496.344   7.8355 7.860321 10.53006 
1 1 1   19    3   25 o  227.956   8.2167   39.824   2.8669   38.424   3.6632   42.037   4.6056  223.807   10.693  233.613   12.931 -9.805893 16.77941 
1 1 1   19    3   26 o  402.592   5.2537  124.118   3.2375  126.440   4.8659  122.274   4.3366  406.187   7.8265  399.489   7.0921 6.698059 10.56178 
1 1 1   19    3   27 o  380.615   5.6736  110.956   3.3053  109.867   5.2400  111.676   4.2597  378.514   9.0444  381.750   7.2900 -3.236420 11.61653 
1 1 1   19    3   28 o  332.847   5.7818   84.862   2.9456   91.520   4.4485   79.663   3.9309  345.487   8.4122  322.361   7.9667 23.12582 11.58589 
1 1 1   19    3   29 o  469.963   5.2649  169.167   3.7872  169.714   5.5540  168.691   5.1776  470.507   7.7121  469.138   7.2104 1.368652 10.55778 
1 1 1   19    3   30 o  350.075   6.9618   93.934   3.7304   98.399   7.7468   92.586   4.2563  357.449   14.159  347.469   8.0030 9.980042 16.26442 
1 1 1   19    3   31 o  186.130   9.4522   26.662   2.6841   27.022   3.7855   26.298   3.8063  186.879   13.321  184.305   13.588 2.574600 19.02884 
1 1 1   19    3   32 o  154.554   12.913   18.518   3.0267   20.475   4.0607   16.073   4.5401  161.924   16.620  142.199   21.533 19.72537 27.20078 
1 1 1   19    3   33 o  188.613   8.8408   27.311   2.5523   26.936   3.7629   27.630   3.4735  186.493   13.269  189.084   12.065 -2.590149 17.93368 
1 1 1   19    3   34 o  125.158   12.863   12.198   2.4291   12.877   3.6928   11.681   3.2249  127.262   19.586  121.466   17.881 5.796295 26.52050 
1 1 1   19    3   35 o  205.329   9.2716   32.395   2.9139   35.355   4.1251   29.447   4.1167  213.770   12.664  194.798   13.898 18.97133 18.80221 
1 1 1   19    3   36 o  177.556   10.550   24.348   2.8544   26.271   4.0113   22.375   4.0626  183.771   14.375  169.191   15.873 14.57999 21.41503 
1 1 1   19    3   37 o  139.923   13.668   15.278   2.8900   13.233   4.0050   17.499   4.1744  128.363   21.119  148.669   18.762 -20.30646 28.24900 
1 1 1   19    3   38 o   71.816   21.863   4.0903   2.6187   2.2135   3.9440   5.5701   3.5020   66.852   26.294   83.295   25.266 -16.44244 36.46598 
1 1 1   19    3   39 o  183.355   11.175   26.032   3.1212   31.257   4.7537   22.074   4.1381  199.918   15.660  167.626   16.336 32.29227 22.62979 
1 1 1   19    3   40 o  212.834   9.7792   34.898   3.1858   36.506   5.2898   33.983   3.9906  215.893   16.124  209.222   12.519 6.670792 20.41348 
1 1 1   19    3   41 o  159.406   12.413   19.781   3.0048   19.009   4.8237   20.270   3.8411  153.847   21.035  160.542   15.838 -6.694672 26.33100 
1 1 1   19    3   42 o  217.280   11.316   36.589   3.7506   43.197   8.6858   35.075   4.1582  230.855   24.979  212.336   12.855 18.51904 28.09279 
1 1 1   19    3   43 o   49.172   21.480  -0.4488   3.0600   4.2777   3.9376  -7.6552   4.8620   76.366   26.992   45.898   22.256 30.46757 34.98434 
1 1 1   19    3   44 o  144.673   14.663   16.479   3.2021   16.872   4.3704   16.023   4.7051  144.622   20.302  139.987   22.739 4.635406 30.48352 
1 1 1   19    3   45 o  281.089   9.4344   60.974   4.0591   63.626   5.8710   58.545   5.6181  285.927   13.415  274.284   13.382 11.64313 18.94822 
1 1 1   19    3   46 o  167.307   13.797   21.969   3.5016   30.101   4.9222   13.637   4.9823  194.986   16.652  127.095   26.471 67.89072 31.27326 
1 1 1   19    3   47 o  200.352   12.159   31.312   3.7112   31.853   4.9897   30.641   5.5521  200.555   16.398  195.668   18.768 4.887466 24.92272 
1 1 1   19    3   48 o  157.641   14.864   19.656   3.5443   25.116   5.0521   14.364   4.9735  176.678   18.979  130.243   25.860 46.43494 32.07758 
1 1 1   19    3   49 o   92.378   24.586   7.2653   3.5376   4.6350   4.6689   10.811   5.4206   79.273   29.208  110.590   30.854 -31.31716 42.48632 
1 1 1   19    3   50 o   73.584   25.631   4.2331   3.5420   2.7773   5.3246   5.3886   4.7439   73.738   30.017   82.591   29.581 -8.853783 42.14337 
1 1 1   19    3   51 o   58.338   24.184   1.2110   3.5387   5.1576   4.8219  -3.3953   5.2094   81.206   29.719   55.196   25.639 26.01012 39.24986 
1 1 1   19    3   52 o  111.887   21.365   10.565   3.5254   17.309   5.0062   3.9310   4.9654  142.554   23.781   75.883   29.603 66.67149 37.97233 
1 1 1   19    3   53 o   82.664   27.888   5.8705   4.1848   11.968   8.2239   3.7398   4.8613  110.281   39.006   74.276   29.200 36.00491 48.72448 
1 1 1   19    3   54 o  157.854   16.119   20.241   3.8401   18.614   5.0423   22.488   5.9253  146.981   23.181  160.461   24.935 -13.47995 34.04544 
1 1 1   19    3   55 o   75.315   24.344   4.9575   3.1990   4.7671   4.5176   5.1490   4.5306   76.233   28.604   78.016   28.768 -1.782753 40.56871 
1 1 1   19    3   56 o   53.718   23.068   0.6547   3.4088   1.4554   5.0296  -0.0256   4.6360   64.696   27.904   58.364   25.928 6.331390 38.08993 
1 1 1   19    4    0 o  567.502   10.947  246.866   9.5012  246.866   9.5012  246.866   9.5012  567.502   10.947  567.502   10.947 0.000000 0.000000 
1 1 1   19    4    1 o  647.849   8.0547  321.372   7.9871  323.382   11.541  319.523   11.065  649.695   11.606  645.830   11.193 3.864136 16.12395 
1 1 1   19    4    2 o  460.932   10.042  162.726   7.0846   0.0000   0.0000  162.726   7.0846  ?   ?   460.932   10.042 0.000000 10.04174 
1 1 1   19    4    3 o  876.722   9.3490  588.658   12.546  593.024   18.362  584.836   17.181  879.625   13.638  873.603   12.849 6.021790 18.73764 
1 1 1   19    4    4 o  346.469   7.4175   91.909   3.9336  101.080   6.7047   87.095   4.8575  363.214   12.060  337.228   9.4106 25.98615 15.29713 
1 1 1   19    4    5 o  999.874   8.4149  765.558   12.878  831.890   24.621  740.574   15.110  1041.59   15.443  983.305   10.040 58.28485 18.41990 
1 1 1   19    4    6 o  329.199   8.3051   82.985   4.1848   91.029   6.8736   78.248   5.2751  344.643   13.030  319.603   10.783 25.03992 16.91337 
1 1 1   19    4    7 o  476.088   8.4675  173.569   6.1704  185.220   9.3584  164.609   8.2070  491.639   12.436  463.517   11.568 28.12143 16.98442 
1 1 1   19    4    8 o  518.478   8.5103  205.857   6.7537  206.208   9.8834  205.549   9.2505  518.739   12.448  517.951   11.668 0.7882690 17.06141 
1 1 1   19    4    9 o  575.583   8.5057  253.703   7.4935  267.289   11.496  243.666   9.8811  590.566   12.718  563.940   11.447 26.62622 17.11103 
1 1 1   19    4   10 o  207.550   11.956   33.118   3.7821   30.541   6.3159   34.559   4.7224  198.263   21.138  211.798   14.657 -13.53452 25.72293 
1 1 1   19    4   11 o  642.703   7.2953  316.278   7.1766  332.323   13.454  309.898   8.4845  658.432   13.350  636.122   8.7139 22.30994 15.94215 
1 1 1   19    4   12 o  386.299   7.4890  114.265   4.4281  114.351   8.8220  114.237   5.1198  386.145   14.926  386.217   8.6606 -0.7162476E-01 17.25679 
1 1 1   19    4   13 o  842.937   6.0898  543.982   7.8571  585.831   13.683  523.394   9.5972  874.478   10.223  826.751   7.5840 47.72723 12.72864 
1 1 1   19    4   14 o  618.197   5.1917  292.557   4.9126  291.520   7.5524  293.317   6.4679  616.988   7.9972  618.940   6.8272 -1.951843 10.51500 
1 1 1   19    4   15 o  430.867   5.0430  142.115   3.3258  151.624   5.1962  135.516   4.3286  444.974   7.6292  420.701   6.7221 24.27292 10.16817 
1 1 1   19    4   16 o  375.305   4.5965  107.822   2.6405  105.966   4.1031  109.134   3.4498  372.000   7.2061  377.552   5.9696 -5.552094 9.357520 
1 1 1   19    4   17 o  513.187   5.0846  201.613   3.9940  207.290   7.8017  199.596   4.6495  520.157   9.7990  510.586   5.9493 9.570923 11.46363 
1 1 1   19    4   18 o  728.137   5.4638  405.901   6.0894  402.362   11.161  407.401   7.2663  724.647   10.062  729.427   6.5082 -4.779358 11.98367 
1 1 1   19    4   19 o  362.628   5.0717  100.671   2.8150  101.682   4.4861  100.014   3.6154  364.355   8.0441  361.404   6.5358 2.950989 10.36450 
1 1 1   19    4   20 o  659.861   5.3372  333.360   5.3906  332.645   7.8080  334.011   7.4513  659.011   7.7407  660.388   7.3716 -1.377136 10.68919 
1 1 1   19    4   21 o  159.045   9.1513   19.447   2.2184   17.640   3.8163   20.369   2.7263  150.577   16.847  162.624   11.018 -12.04709 20.12984 
1 1 1   19    4   22 o  278.576   6.2293   59.429   2.6562   53.019   4.4353   63.014   3.3167  262.948   11.020  286.812   7.5551 -23.86401 13.36105 
1 1 1   19    4   23 o  286.082   7.0106   62.690   3.0698   62.032   4.8779   63.121   3.9502  284.387   11.206  286.984   8.9927 -2.596741 14.36822 
1 1 1   19    4   24 o  333.848   8.4751   85.415   4.3307   83.964   5.2150   88.638   7.7734  330.892   10.297  339.596   14.955 -8.704224 18.15677 
1 1 1   19    4   25 o  411.293   5.5294  129.544   3.4809  133.464   6.0140  127.570   4.2686  417.215   9.4175  408.078   6.8340 9.137299 11.63588 
1 1 1   19    4   26 o  442.199   5.1016  149.738   3.4530  155.298   5.3043  145.650   4.5488  450.163   7.6982  436.018   6.8158 14.14444 10.28195 
1 1 1   19    4   27 o  431.554   5.4132  142.635   3.5757  144.067   5.8224  141.768   4.5307  433.460   8.7757  430.144   6.8815 3.315613 11.15204 
1 1 1   19    4   28 o  245.018   6.8730   46.003   2.5776   49.581   4.0310   43.529   3.3526  254.161   10.362  238.217   9.1947 15.94435 13.85317 
1 1 1   19    4   29 o  385.231   5.4445  113.674   3.2103  123.261   5.0053  106.974   4.1844  400.930   8.1563  373.574   7.3179 27.35620 10.95796 
1 1 1   19    4   30 o  400.876   7.1251  123.186   4.3719  125.376   8.4066  122.374   5.1186  403.562   13.609  399.430   8.3722 4.131805 15.97837 
1 1 1   19    4   31 o  389.255   6.4070  116.124   3.8173  120.681   5.7075  112.435   5.1349  396.499   9.4045  382.788   8.7640 13.71063 12.85502 
1 1 1   19    4   32 o   65.359   21.552   3.1839   2.5016   7.6033   3.5391  -1.2292   3.5365   96.770   24.009   50.903   22.628 45.86653 32.99134 
1 1 1   19    4   33 o  202.324   8.3542   31.416   2.5872   33.807   3.9183   29.568   3.4448  209.185   12.292  195.697   11.552 13.48840 16.86786 
1 1 1   19    4   34 o  137.911   11.557   14.742   2.4171   16.417   3.6331   13.411   3.2377  144.656   16.716  130.592   16.570 14.06436 23.53745 
1 1 1   19    4   35 f  140.678   11.584   15.343   2.4722   14.148   3.7221   16.287   3.3071  133.633   18.710  144.322   15.199 -10.68900 24.10557 
1 1 1   19    4   36 o  366.275   6.6525  102.907   3.7296  106.545   5.2472   99.192   5.3022  372.306   9.2078  359.152   9.6452 13.15427 13.33462 
1 1 1   19    4   37 o  218.311   9.3638   36.653   3.1289   39.901   4.4137   33.372   4.4364  226.956   12.757  207.212   14.071 19.74339 18.99317 
1 1 1   19    4   38 o  167.345   11.944   21.725   3.0392   20.562   4.6061   22.622   4.0445  161.096   19.049  169.960   15.725 -8.863571 24.70107 
1 1 1   19    4   39 o  145.929   12.629   16.588   2.7931   19.557   4.4679   14.683   3.5785  156.943   18.985  136.072   17.594 20.87071 25.88376 
1 1 1   19    4   40 o   85.182   21.242   5.9468   2.7602   2.9185   4.4832   7.7954   3.5027   72.517   28.174   97.161   23.752 -24.64429 36.85029 
1 1 1   19    4   41 o  256.499   8.3474   50.610   3.2772   51.043   5.2686   50.337   4.1855  256.202   13.483  255.384   10.707 0.8180542 17.21723 
1 1 1   19    4   42 o   65.403   25.602   2.2547   3.7236  -8.3432   8.0481   5.1412   4.2002   64.186   30.448   81.838   27.938 -17.65198 41.32333 
1 1 1   19    4   43 o   81.155   24.669   5.3580   3.3359   3.8992   3.9398   9.0532   6.2705   74.386   26.918  104.328   34.107 -29.94141 43.44955 
1 1 1   19    4   44 o  110.603   20.125   9.9677   3.2815   9.0431   4.6271   10.903   4.6547  103.323   28.385  113.596   27.142 -10.27330 39.27323 
1 1 1   19    4   45 o  142.211   16.156   16.047   3.4544   13.271   4.8337   18.945   4.9386  125.732   25.976  152.635   21.754 -26.90305 33.88222 
1 1 1   19    4   46 o  123.137   18.912   12.266   3.4505   6.6944   4.8685   17.890   4.8911   90.508   30.076  147.838   22.309 -57.33008 37.44663 
1 1 1   19    4   47 o   36.699   17.962  -6.2265   3.3809  -6.4034   4.6992  -6.0366   4.8680   46.556   22.402   48.392   23.157 -1.835751 32.21935 
1 1 1   19    4   48 f  106.827   22.984   9.5724   3.6467   7.1904   5.0186   12.237   5.3079   92.613   30.525  118.517   29.402 -25.90409 42.38168 
1 1 1   19    4   49 o  119.209   20.820   11.741   3.6606   15.115   5.1262   8.2311   5.2290  133.152   26.085   97.541   31.082 35.61100 40.57735 
1 1 1   19    4   50 o  193.744   12.855   29.499   3.7906   33.042   5.8359   26.913   4.9855  202.024   19.099  182.706   18.064 19.31749 26.28846 
1 1 1   19    4   51 o   54.216   23.043   0.5311   3.3387  -1.1205   4.6013   2.3675   4.8519   56.995   25.539   69.699   28.545 -12.70370 38.30219 
1 1 1   19    4   52 o   64.058   24.490   2.7129   3.3487   2.3745   4.7098   3.0588   4.7621   68.739   28.135   71.594   28.655 -2.855072 40.15825 
1 1 1   19    4   53 o  147.652   17.440   17.796   3.8653   15.101   6.2658   19.452   4.9111  126.851   32.211  151.967   21.732 -25.11593 38.85707 
1 1 1   19    4   54 o  154.268   17.370   19.530   4.0301   11.212   5.7074   27.802   5.6916  108.049   32.139  181.840   20.825 -73.79105 38.29552 
1 1 1   19    4   55 o   79.678   24.375   5.6501   3.2497   8.6456   4.4597   2.2589   4.7451   96.035   28.372   66.728   27.862 29.30678 39.76479 
1 1 1   19    4   56 o  106.616   21.883   10.003   3.4515   5.1405   5.0020   14.422   4.7687   77.978   29.903  125.757   25.643 -47.77869 39.39274 
1 1 1   19    5    0 o  819.229   12.821  514.343   16.067  514.343   16.067  514.343   16.067  819.229   12.821  819.229   12.821 0.000000 0.000000 
1 1 1   19    5    1 o  696.383   8.4061  371.348   8.9601  379.569   13.106  364.134   12.277  703.833   12.166  689.409   11.634 14.42438 16.83364 
1 1 1   19    5    2 o  712.544   11.579  388.981   12.629   0.0000   0.0000  388.981   12.629  ?   ?   712.544   11.579 0.000000 11.57923 
1 1 1   19    5    3 o  812.367   13.291  505.779   16.526  505.779   16.526   0.0000   0.0000  812.367   13.291  ?   ?  0.000000 13.29068 
1 1 1   19    5    4 o  952.699   10.022  695.193   14.614  721.210   21.801  673.964   19.693  969.910   14.685  937.707   13.721 32.20319 20.09774 
1 1 1   19    5    5 o  753.472   8.8983  434.767   10.262  460.509   15.690  415.522   13.567  775.154   13.224  736.409   12.036 38.74475 17.88138 
1 1 1   19    5    6 o  724.008   8.8338  401.429   9.7895  420.510   14.865  386.816   13.009  740.727   13.111  710.517   11.962 30.20996 17.74780 
1 1 1   19    5    7 o  735.003   7.3256  413.632   8.2414  440.940   10.770  375.052   12.802  758.774   9.2735  699.623   11.954 59.15131 15.12959 
1 1 1   19    5    8 o  495.892   8.5857  188.317   6.5167  188.317   6.5167   0.0000   0.0000  495.892   8.5857  ?   ?  0.000000 8.585665 
1 1 1   19    5    9 o  138.670   10.956   14.824   2.3065   12.432   3.5507   16.570   3.0337  125.853   19.026  146.385   13.699 -20.53195 23.44457 
1 1 1   19    5   10 o  792.037   6.6967  480.292   8.1185  519.286   12.381  450.879   10.753  823.370   9.8240  767.267   9.1561 56.10352 13.42926 
1 1 1   19    5   11 o  403.270   6.3268  124.506   3.9053  128.512   5.8805  121.346   5.2234  409.615   9.3793  398.057   8.5731 11.55811 12.70711 
1 1 1   19    5   12 o  1151.45   8.3444  1015.35   14.706  1063.20   21.866  975.821   19.873  1177.84   12.129  1128.48   11.505 49.36060 16.71747 
1 1 1   19    5   13 o  614.736   6.4146  289.329   6.0357  301.475   8.9221  279.081   8.1956  627.368   9.2912  603.640   8.8702 23.72845 12.84549 
1 1 1   19    5   14 o  453.596   4.5953  157.497   3.1905  158.293   4.6769  156.804   4.3634  454.686   6.7202  452.555   6.2992 2.130951 9.210861 
1 1 1   19    5   15 o  536.595   5.0319  220.419   4.1328  220.598   6.4285  220.293   5.3956  536.712   7.8253  536.391   6.5718 0.3208008 10.21883 
1 1 1   19    5   16 o  228.936   5.8117   40.126   2.0365   39.325   3.0202   40.795   2.7577  226.585   8.7083  230.801   7.8063 -4.216003 11.69504 
1 1 1   19    5   17 o  889.369   5.3645  605.548   7.3026  608.693   11.299  603.292   9.5697  891.471   8.2809  887.604   7.0438 3.866943 10.87148 
1 1 1   19    5   18 o  559.771   5.1730  239.885   4.4322  241.854   8.5652  239.165   5.1796  561.813   9.9603  558.897   6.0548 2.916687 11.65628 
1 1 1   19    5   19 o  820.550   5.2338  515.473   6.5734  516.670   10.244  514.636   8.5708  821.292   8.1488  819.780   6.8305 1.512512 10.63288 
1 1 1   19    5   20 o  699.945   5.3824  375.099   5.7665  380.574   8.4954  370.421   7.8525  704.871   7.8742  695.442   7.3770 9.429016 10.78993 
1 1 1   19    5   21 o  757.593   5.6472  439.464   6.5484  459.480   9.7251  422.860   8.8574  774.444   8.2041  742.980   7.7886 31.46417 11.31240 
1 1 1   19    5   22 o  372.797   5.9642  106.424   3.4032  110.356   5.3359  103.728   4.4186  379.467   9.1868  367.964   7.8453 11.50269 12.08082 
1 1 1   19    5   23 o  392.967   5.8490  118.256   3.5181  120.066   5.6167  117.087   4.5131  395.778   9.2718  390.940   7.5421 4.837982 11.95197 
1 1 1   19    5   24 o  411.286   6.7605  129.574   4.2559  135.782   6.0380  123.444   5.9997  420.848   9.3734  401.243   9.7690 19.60544 13.53862 
1 1 1   19    5   25 o  239.482   7.2085   43.941   2.6423   47.026   5.0783   42.796   3.0941  247.039   13.481  236.286   8.5553 10.75296 15.96671 
1 1 1   19    5   26 o  210.788   8.0183   34.055   2.5870   42.027   4.9984   31.139   3.0235  233.383   14.058  201.484   9.8038 31.89822 17.13887 
1 1 1   19    5   27 o  657.498   5.6864  331.120   5.7227  333.958   10.527  329.930   6.8181  659.670   10.426  656.201   6.7882 3.469604 12.44100 
1 1 1   19    5   28 o  185.469   10.505   26.490   2.9699   27.829   4.9957   25.759   3.6935  189.109   17.456  182.534   13.312 6.575409 21.95233 
1 1 1   19    5   29 o  296.848   7.9271   67.566   3.6018   76.974   6.6683   63.691   4.2798  316.241   13.776  288.074   9.7062 28.16675 16.85207 
1 1 1   19    5   30 o  369.863   6.1631  104.823   3.4890  110.590   6.5490  102.537   4.1229  379.352   11.279  365.712   7.3653 13.64038 13.47067 
1 1 1   19    5   31 o  197.070   8.3125   29.794   2.5074   29.685   3.9139   29.870   3.2655  195.924   13.127  196.855   10.880 -0.9304199 17.04962 
1 1 1   19    5   32 o  431.085   5.8702  142.408   3.8734  140.783   5.4690  144.043   5.4865  428.334   8.3418  433.275   8.2730 -4.940765 11.74852 
1 1 1   19    5   33 o  223.547   7.6584   38.338   2.6205   36.206   3.9721   39.980   3.4869  216.532   12.032  228.095   9.9875 -11.56319 15.63733 
1 1 1   19    5   34 o   43.504   18.781  -0.2202   2.2829   0.8594   3.4540  -1.0577   3.0422   58.072   23.968   47.196   20.983 10.87576 31.85532 
1 1 1   19    5   35 o   56.202   20.646   1.9893   2.3303  -1.3935   3.5119   4.6501   3.1147   50.019   22.369   76.963   23.917 -26.94334 32.74755 
1 1 1   19    5   36 o  315.502   7.9311   76.432   3.8300   74.912   4.8182   79.042   6.3127  312.031   10.088  319.979   12.889 -7.947693 16.36777 
1 1 1   19    5   37 o  277.564   7.8106   59.166   3.3183   59.562   4.7375   58.785   4.6494  277.996   11.134  276.200   10.998 1.795929 15.64964 
1 1 1   19    5   38 o  112.544   16.305   10.047   2.7269   7.2023   4.4486   11.759   3.4514   94.054   28.465  121.180   19.251 -27.12612 34.36338 
1 1 1   19    5   39 o   42.863   19.221  -1.1045   2.6119  -1.7970   4.1584  -0.6533   3.3566   53.562   24.117   51.033   22.390 2.528702 32.90791 
1 1 1   19    5   40 o   98.906   18.311   7.8916   2.6700   7.8309   4.0015   7.9403   3.5847   97.146   26.277   97.998   24.072 -0.8516541 35.63611 
1 1 1   19    5   41 o  113.204   16.083   10.184   2.7084   1.3314   3.8897   18.515   3.7735   62.409   25.559  153.202   16.344 -90.79245 30.33816 
1 1 1   19    5   42 o  100.155   26.473   8.3922   4.1198   4.5279   11.195   8.9975   4.4307  102.315   42.764  103.503   27.500 -1.188271 50.84325 
1 1 1   19    5   43 o   80.617   25.421   5.2331   3.5049   0.3844   4.3563   14.133   5.9018   61.550   26.245  128.614   30.451 -67.06449 40.19997 
1 1 1   19    5   44 o   68.412   24.388   3.3465   3.2209  -1.6690   4.3662   9.3343   4.7707   55.041   24.754  104.829   28.832 -49.78855 38.00032 
1 1 1   19    5   45 o   99.637   22.662   8.2598   3.3782   3.3358   4.6125   13.957   4.9615   74.156   28.642  128.951   26.034 -54.79523 38.70619 
1 1 1   19    5   46 o  158.958   15.300   19.965   3.6765   19.791   5.0582   20.161   5.3531  155.809   21.807  156.767   22.993 -0.9578552 31.68936 
1 1 1   19    5   47 o   51.158   22.608  -0.7391   3.4809   0.0119   4.8887  -1.5113   4.9575   63.044   27.350   59.055   26.482 3.988880 38.06963 
1 1 1   19    5   48 o  260.727   11.633   52.847   4.6424   52.132   5.9642   53.945   7.3946  257.127   15.222  259.638   18.733 -2.510986 24.13777 
1 1 1   19    5   49 o  232.681   10.347   41.997   3.6850   37.154   5.6961   45.482   4.8325  215.612   17.408  240.817   13.160 -25.20430 21.82277 
1 1 1   19    5   50 o  199.434   13.077   31.287   3.9699   29.541   6.0097   32.639   5.2878  189.762   21.045  201.709   17.294 -11.94608 27.23932 
1 1 1   19    5   51 o  172.759   13.683   23.633   3.5886   18.579   4.8347   29.833   5.3553  149.223   21.811  191.715   18.478 -42.49231 28.58646 
1 1 1   19    5   52 o   95.073   23.356   7.8126   3.3743   12.030   4.6951   3.3078   4.8527  116.644   26.853   72.879   29.007 43.76430 39.52837 
1 1 1   19    5   53 o   95.897   24.788   8.1048   3.6650   3.2936   5.7342   11.427   4.7653   75.475   30.986  112.499   27.828 -37.02425 41.64730 
1 1 1   19    5   54 o   64.546   25.393   2.6957   3.6791   0.7769   5.0697   4.8307   5.3476   63.863   27.778   79.012   30.750 -15.14942 41.43899 
1 1 1   19    5   55 o  108.369   21.677   10.224   3.4701   14.039   5.0293   6.7579   4.7941  123.413   27.344   85.781   29.822 37.63208 40.46019 
1 1 1   19    5   56 o   47.158   21.155  -0.6959   3.1667  -2.6832   4.3030   1.6521   4.6772   49.408   23.067   63.708   27.180 -14.29978 35.64903 
1 1 1   19    6    0 o  703.575   11.835  379.381   12.737  379.381   12.737  379.381   12.737  703.575   11.835  703.575   11.835 0.000000 0.000000 
1 1 1   19    6    1 o  566.240   11.427  245.642   9.9036  245.642   9.9036   0.0000   0.0000  566.240   11.427  ?   ?  0.000000 11.42675 
1 1 1   19    6    2 o  478.092   5.9739  174.980   4.3716  169.973   8.5826  176.735   5.0799  470.997   11.905  480.459   6.9077 -9.461304 13.76394 
1 1 1   19    6    4 o  322.533   8.2589   79.659   4.0773   89.815   7.2070   74.879   4.9446  342.305   13.755  312.656   10.332 29.64908 17.20368 
1 1 1   19    6    5 o  546.943   8.1747  229.070   6.8435  250.442   11.012  215.620   8.7354  571.670   12.584  530.534   10.757 41.13605 16.55557 
1 1 1   19    6    6 o  911.142   9.9533  635.884   13.881  666.341   20.993  612.224   18.503  932.242   14.712  893.712   13.526 38.53021 19.98530 
1 1 1   19    6    7 o  638.015   7.0946  311.667   6.9284  313.768   8.7502  308.135   11.343  640.081   8.9313  634.154   11.686 5.926697 14.70846 
1 1 1   19    6    8 f  592.789   8.9128  269.119   8.0870  269.119   8.0870   0.0000   0.0000  592.789   8.9128  ?   ?  0.000000 8.912829 
1 1 1   19    6    9 o  428.646   7.2022  140.682   4.7254  147.656   6.0618  129.880   7.5443  439.084   9.0195  411.691   11.972 27.39261 14.98949 
1 1 1   19    6   10 o  132.890   12.490   13.654   2.5107   18.201   3.9498   10.571   3.2523  153.059   17.155  115.835   19.002 37.22406 25.60026 
1 1 1   19    6   11 o  340.370   6.7944   88.701   3.5398   93.003   5.4192   85.500   4.6748  348.431   10.161  334.113   9.1412 14.31860 13.66798 
1 1 1   19    6   12 o  689.041   6.5983  363.507   6.9590  382.625   10.460  348.327   9.3209  706.756   9.6696  674.376   9.0300 32.38055 13.23032 
1 1 1   19    6   13 o  325.555   7.0833   81.153   3.5297   85.611   5.4209   77.872   4.6506  334.273   10.595  318.841   9.5294 15.43274 14.24993 
1 1 1   19    6   14 o   85.031   20.639   5.7802   2.6591   6.9550   4.2588   5.0295   3.4043   94.196   27.696   80.929   24.980 13.26730 37.29725 
1 1 1   19    6   15 o  300.880   6.2997   69.313   2.9012   73.335   3.7178   63.048   4.6396  309.451   7.8491  286.849   10.567 22.60233 13.16330 
1 1 1   19    6   16 o  500.514   4.8181  191.773   3.6911  184.686   5.2862  198.516   5.1563  491.106   7.0323  509.178   6.6161 -18.07239 9.655331 
1 1 1   19    6   17 o  252.188   5.3637   48.690   2.0704   48.691   3.4206   48.689   2.6010  252.115   8.8642  252.162   6.7389 -0.4644775E-01 11.13490 
1 1 1   19    6   18 o  566.384   4.6878  245.574   4.0640  237.191   6.3089  251.521   5.3132  556.516   7.4063  573.146   6.0565 -16.63086 9.567405 
1 1 1   19    6   19 o  434.927   5.8947  144.836   3.9242  140.186   7.1979  146.803   4.6811  427.638   10.997  437.828   6.9851 -10.18967 13.02751 
1 1 1   19    6   20 o  676.389   5.8767  350.310   6.0841  358.855   8.2828  340.297   8.9663  684.448   7.9062  666.443   8.7898 18.00513 11.82237 
1 1 1   19    6   21 o  306.804   5.7240   72.076   2.6880   74.954   4.7954   70.757   3.2459  312.703   10.019  303.946   6.9771 8.757507 12.20897 
1 1 1   19    6   22 o  109.252   12.612   9.2810   2.0702   14.941   4.1361   7.3889   2.3913  137.810   20.209   96.653   16.772 41.15690 26.26231 
1 1 1   19    6   23 o  365.187   6.0569  102.134   3.3856  113.887   5.6649   95.603   4.2227  385.426   9.6024  353.238   7.8101 32.18738 12.37752 
1 1 1   19    6   24 o  418.459   6.1958  134.118   3.9684  141.061   6.1999  129.298   5.1652  428.931   9.4433  410.750   8.2156 18.18158 12.51689 
1 1 1   19    6   25 o  607.320   5.2403  282.449   4.8713  302.051   8.3593  272.370   5.9943  627.704   8.7005  596.282   6.5678 31.42206 10.90113 
1 1 1   19    6   26 o  211.919   7.9842   34.423   2.5898   38.311   5.1381   33.099   2.9986  222.613   15.170  207.740   9.4304 14.87360 17.86194 
1 1 1   19    6   27 o  791.142   6.6032  479.562   7.9961  515.525   13.609  460.600   9.8818  819.475   10.849  775.081   8.3295 44.39349 13.67818 
1 1 1   19    6   28 f  146.148   13.456   16.568   2.9762   9.0858   5.6908   19.385   3.4918  106.789   32.167  158.010   14.603 -51.22105 35.32621 
1 1 1   19    6   29 o  409.992   6.0294  128.789   3.7837  136.161   7.8192  126.535   4.3236  420.842   12.139  406.313   6.9521 14.52866 13.98861 
1 1 1   19    6   30 o  454.200   5.7075  158.054   3.9679  154.849   7.1908  159.457   4.7578  448.999   10.463  456.107   6.8151 -7.107635 12.48685 
1 1 1   19    6   31 o  434.095   6.3474  144.423   4.2175  140.189   9.1708  145.559   4.7495  426.486   14.049  435.717   7.1215 -9.231049 15.75053 
1 1 1   19    6   32 o   96.727   17.059   7.4487   2.4334   7.4599   3.5407   7.4386   3.3499   95.818   24.150   95.730   23.122 0.8728790E-01 33.43442 
1 1 1   19    6   33 o  205.185   8.3147   32.314   2.6113   33.676   4.1263   31.404   3.3726  208.635   12.986  201.767   10.962 6.867767 16.99375 
1 1 1   19    6   34 o  283.149   6.7656   61.486   2.9322   61.517   4.5501   61.463   3.8345  282.807   10.511  282.888   8.8558 -0.8071899E-01 13.74467 
1 1 1   19    6   35 o  241.163   7.5450   44.635   2.7851   44.193   4.3149   44.951   3.6464  239.486   11.771  241.775   9.8533 -2.289841 15.35093 
1 1 1   19    6   36 o  260.653   10.976   52.331   4.3791   48.442   5.1100   63.086   8.4971  250.038   13.401  283.532   19.702 -33.49380 23.82720 
1 1 1   19    6   37 o   98.953   17.791   7.8519   2.5956   12.351   4.2654   5.2059   3.2710  123.199   23.477   80.662   24.407 42.53781 33.86545 
1 1 1   19    6   38 o   67.925   21.473   3.5980   2.4995   4.1326   3.9294   3.2347   3.2393   76.095   26.957   68.364   24.448 7.730591 36.39235 
1 1 1   19    6   39 f  210.214   8.9705   34.003   2.8863   36.570   4.5115   32.225   3.7555  216.816   13.664  203.844   12.090 12.97191 18.24535 
1 1 1   19    6   40 o  185.054   10.110   26.476   2.8527   23.741   4.3344   28.567   3.7891  173.713   16.500  191.623   12.995 -17.91046 21.00280 
1 1 1   19    6   41 o  194.233   11.504   29.261   3.4049   17.903   7.0142   32.763   3.8945  144.791   32.452  205.337   12.450 -60.54587 34.75860 
1 1 1   19    6   42 o   77.719   22.236   4.9311   2.7789   0.3105   4.2997   8.2458   3.6417   61.016   26.047   99.598   24.140 -38.58139 35.51312 
1 1 1   19    6   43 o  137.771   18.366   15.182   3.7765   19.507   4.9360   9.0769   5.8648  155.393   21.314  103.938   32.896 51.45517 39.19732 
1 1 1   19    6   44 o   44.540   20.366  -1.8885   3.1083  -3.7504   4.2372   0.2807   4.5735   48.745   22.801   62.413   26.759 -13.66770 35.15539 
1 1 1   19    6   45 o   84.130   23.958   5.8772   3.2338   8.1957   4.3612   3.0455   4.8196   98.350   27.759   73.818   29.057 24.53227 40.18481 
1 1 1   19    6   46 f  251.066   10.039   48.740   3.8578   45.788   5.3372   51.970   5.5827  241.599   14.500  257.561   14.216 -15.96187 20.30617 
1 1 1   19    6   47 f   54.869   23.355   0.3595   3.4386  -1.8773   4.6598   3.0337   5.0950   56.122   25.375   74.591   29.711 -18.46912 39.07257 
1 1 1   19    6   48 o  130.733   21.113   14.058   4.0809   7.6310   5.0989   25.511   6.8065   94.747   30.746  174.083   26.370 -79.33620 40.50539 
1 1 1   19    6   49 o   80.259   24.656   5.3844   3.3210   4.1230   4.9061   6.4513   4.5119   77.611   29.650   87.715   28.944 -10.10340 41.43557 
1 1 1   19    6   50 o  132.400   17.626   14.215   3.4832   11.596   5.5808   15.886   4.4582  113.455   31.176  138.156   21.806 -24.70099 38.04482 
1 1 1   19    6   51 f  122.130   18.613   12.256   3.3695   13.243   4.8945   11.367   4.6456  122.956   26.766  113.552   27.105 9.404610 38.09327 
1 1 1   19    6   52 o   73.132   25.303   4.3245   3.4493  -2.3140   4.6549   12.409   5.1368   53.892   24.746  117.336   28.813 -63.44329 37.98048 
1 1 1   19    6   53 o   68.209   25.657   3.3905   3.6390   1.5928   5.8184   4.5455   4.6636   70.255   30.153   76.807   29.011 -6.551826 41.84333 
1 1 1   19    6   54 o  159.155   16.344   20.661   3.9249   19.434   5.4244   22.008   5.6860  148.758   24.689  158.887   24.140 -10.12894 34.52939 
1 1 1   19    6   55 o  181.577   15.214   26.766   4.1893   18.736   6.9682   31.311   5.2425  137.203   33.477  194.475   17.810 -57.27161 37.91963 
1 1 1   19    6   56 f   55.687   23.210   1.3431   3.2847   0.1867   4.5094   2.6503   4.7942   58.182   25.722   67.565   28.090 -9.382240 38.08793 
1 1 1   19    7    0 o   75.069   18.710   5.0422   1.8601   5.0422   1.8601   5.0422   1.8601   75.069   18.710   75.069   18.710 0.000000 0.000000 
1 1 1   19    7    1 o  982.348   8.1078  738.940   12.191  749.539   21.736  734.076   14.725  988.786   14.362  978.983   9.8268 9.803040 17.40177 
1 1 1   19    7    2 o  268.968   6.0369   55.383   2.4853   63.472   6.0853   53.763   2.7227  287.754   13.816  264.997   6.7127 22.75766 15.36069 
1 1 1   19    7    4 o   96.326   19.797   7.3859   2.8213   0.3779   5.6340   9.7316   3.2595   71.461   30.130  110.903   19.934 -39.44179 36.12732 
1 1 1   19    7    5 o  209.482   11.318   33.719   3.6155   40.216   6.6906   31.039   4.2969  228.053   19.350  200.727   14.075 27.32553 23.92733 
1 1 1   19    7    6 o  802.396   9.3966  493.120   11.541  499.755   17.058  487.520   15.672  807.416   13.803  797.560   12.837 9.855286 18.84997 
1 1 1   19    7    7 o  895.463   8.1822  614.035   11.215  635.544   14.353  580.318   17.970  910.853   10.295  870.086   13.493 40.76685 16.97195 
1 1 1   19    7    8 o  379.665   9.4283  110.406   5.4790  110.406   5.4790   0.0000   0.0000  379.665   9.4283  ?   ?  0.000000 9.428276 
1 1 1   19    7    9 o  214.263   15.542   35.397   5.0625   0.0000   0.0000   35.397   5.0625  ?   ?   214.263   15.542 0.000000 15.54226 
1 1 1   19    7   10 o  616.830   7.4487  291.339   7.0326  288.625   8.7542  296.277   11.809  613.860   9.3171  621.746   12.409 -7.886658 15.51747 
1 1 1   19    7   11 o  677.357   7.6027  351.332   7.8823  347.856   9.7419  357.923   13.413  673.895   9.4446  683.327   12.825 -9.432068 15.92696 
1 1 1   19    7   12 o  794.251   6.9705  483.021   8.4740  522.630   12.965  453.478   11.197  825.942   10.255  769.418   9.5074 56.52405 13.98433 
1 1 1   19    7   13 o  342.226   7.1958   89.680   3.7693   88.541   5.7406   90.544   4.9975  339.922   11.033  343.801   9.4968 -3.878723 14.55753 
1 1 1   19    7   14 o  567.096   6.5657  246.237   5.6991  271.373   8.8446  228.391   7.4526  595.174   9.7087  546.053   8.9166 49.12122 13.18205 
1 1 1   19    7   15 o  698.274   6.2921  373.323   6.7249  385.550   9.3096  359.980   9.7250  709.483   8.5727  685.505   9.2685 23.97754 12.62524 
1 1 1   19    7   16 o  263.591   6.8425   53.204   2.7607   53.721   3.4269   52.247   4.6596  264.831   8.4541  261.075   11.660 3.756134 14.40258 
1 1 1   19    7   17 o  295.308   6.7526   66.779   3.0522   64.973   3.8785   69.715   4.9469  291.235   8.7006  301.602   10.716 -10.36716 13.80338 
1 1 1   19    7   18 o  106.850   15.936   8.9580   2.5265   10.822   3.2857   6.2619   3.9519  117.160   18.971   89.544   26.768 27.61667 32.80893 
1 1 1   19    7   19 o  271.733   6.7812   56.547   2.8205   46.195   5.8411   59.694   3.2208  244.761   15.674  279.171   7.5375 -34.41051 17.39199 
1 1 1   19    7   20 o  432.038   5.2309  142.911   3.4592  144.001   5.4980  142.197   4.4504  433.545   8.2852  430.897   6.7477 2.647339 10.68533 
1 1 1   19    7   21 o  490.336   4.9743  184.080   3.7333  196.482   6.3984  177.678   4.5970  506.402   8.2548  481.678   6.2351 24.72412 10.34498 
1 1 1   19    7   22 o  542.310   5.4229  225.199   4.5014  226.215   6.9602  224.467   5.9018  543.333   8.3692  541.324   7.1229 2.008972 10.99000 
1 1 1   19    7   23 o  247.766   6.6177   47.021   2.5097   42.701   4.8372   48.613   2.9357  235.410   13.481  251.888   7.6144 -16.47801 15.48249 
1 1 1   19    7   24 o  406.099   5.4198  126.292   3.3689  124.804   5.9536  126.992   4.0859  403.427   9.6414  407.165   6.5562 -3.737305 11.65936 
1 1 1   19    7   25 o  141.219   12.581   15.438   2.6909   14.241   4.7428   16.007   3.2678  133.548   24.088  143.463   15.109 -9.915390 28.43464 
1 1 1   19    7   26 o  492.197   5.9989  185.570   4.5194  193.003   7.0255  180.323   5.9029  501.658   9.1495  485.023   7.9513 16.63519 12.12172 
1 1 1   19    7   27 o  131.330   12.558   13.376   2.4936   11.125   7.3858   13.666   2.6492  118.411   36.834  132.664   13.222 -14.25216 39.13533 
1 1 1   19    7   28 o  449.461   5.5450  154.745   3.8147  161.825   6.9340  151.672   4.5682  459.178   9.8658  444.883   6.7086 14.29562 11.93055 
1 1 1   19    7   29 o  299.585   6.6346   68.784   3.0423   64.279   5.8957   70.419   3.5517  288.997   13.328  303.053   7.6568 -14.05670 15.37105 
1 1 1   19    7   30 o   40.575   18.134  -0.9671   2.3040  -5.0710   5.1941   0.0383   2.5707   53.717   25.164   47.491   20.203 6.225521 32.27078 
1 1 1   19    7   31 o  260.827   7.8047   52.182   3.1158   59.268   7.6634   50.778   3.4105  276.013   18.242  257.228   8.6622 18.78464 20.19433 
1 1 1   19    7   32 o  258.942   8.3558   51.458   3.3118   43.282   5.9015   55.216   4.0012  235.989   16.441  268.097   9.7505 -32.10782 19.11468 
1 1 1   19    7   33 f  220.084   8.7487   37.192   2.9471   37.495   5.8876   37.090   3.4043  219.182   17.700  219.660   10.125 -0.4783630 20.39188 
1 1 1   19    7   34 o   79.917   21.008   5.1683   2.6036   6.7784   5.6983   4.7435   2.9271   94.980   32.540   77.234   23.025 17.74658 39.86289 
1 1 1   19    7   35 o  135.922   18.293   14.623   3.7092   16.450   7.6731   14.065   4.2372  139.559   35.759  132.405   21.656 7.154327 41.80542 
1 1 1   19    7   36 o  198.320   9.9982   30.341   3.0252   33.038   4.2807   27.650   4.2760  206.285   13.634  188.352   14.955 17.93236 20.23705 
1 1 1   19    7   37 o  194.249   10.093   29.130   2.9905   32.678   4.3317   25.899   4.1338  205.005   13.886  182.157   14.958 22.84891 20.41038 
1 1 1   19    7   38 o   94.104   18.631   7.1582   2.5886   13.088   4.1991   3.5228   3.2877  127.024   22.417   70.200   24.680 56.82320 33.34061 
1 1 1   19    7   39 o  353.850   6.5109   96.104   3.5264   95.242   5.4320   96.732   4.6362  351.544   10.095  354.634   8.5411 -3.089569 13.22349 
1 1 1   19    7   40 o  233.185   8.4253   41.828   3.0072   42.725   4.6307   41.173   3.9545  234.514   12.951  230.903   11.189 3.611572 17.11465 
1 1 1   19    7   41 o  111.047   19.359   9.9669   3.1708   10.679   6.9175   9.7774   3.5677  112.444   35.741  109.189   22.106 3.254761 42.02494 
1 1 1   19    7   42 o  182.034   10.738   25.684   2.9786   20.120   4.5748   29.779   3.9243  158.720   19.223  195.450   13.195 -36.72990 23.31600 
1 1 1   19    7   43 o   87.672   25.232   6.3685   3.5685   5.9989   4.5127   6.9854   5.8299   86.818   28.961   94.278   32.880 -7.459801 43.81597 
1 1 1   19    7   44 o  282.477   9.1373   61.537   3.9507   68.721   5.7002   54.897   5.4804  297.515   12.517  265.264   13.543 32.25113 18.44180 
1 1 1   19    7   45 o  199.099   12.183   30.889   3.6948   27.798   5.2838   33.847   5.1686  186.549   18.759  206.968   16.451 -20.41924 24.95092 
1 1 1   19    7   46 o  192.081   12.291   28.792   3.5945   31.517   4.9877   25.847   5.1850  199.507   16.481  179.470   19.171 20.03664 25.28165 
1 1 1   19    7   47 o  316.666   9.9988   77.597   4.8464   81.026   6.0589   71.506   8.0753  322.693   12.267  300.042   17.661 22.65048 21.50348 
1 1 1   19    7   48 o  146.200   18.210   17.238   3.9866   18.088   5.1116   15.917   6.3693  147.484   23.427  134.102   31.556 13.38152 39.30172 
1 1 1   19    7   49 o   32.724   16.206  -6.7522   3.0358  -4.8680   4.3907  -8.4780   4.2021   46.925   22.327   39.410   19.434 7.515472 29.60000 
1 1 1   19    7   50 o  109.249   20.491   9.9504   3.3006   6.8338   4.9543   12.437   4.4258   89.580   30.343  120.417   24.837 -30.83685 39.21209 
1 1 1   19    7   51 o   79.739   23.822   5.4204   3.1307   5.4257   4.4869   5.4154   4.3703   81.457   28.811   81.179   28.459 0.2780609 40.49703 
1 1 1   19    7   52 o   78.031   25.884   5.1332   3.6066   4.3963   5.9698   5.5568   4.5260   80.486   32.129   81.748   28.934 -1.261734 43.23738 
1 1 1   19    7   53 o  124.933   18.186   12.914   3.3756   12.401   4.4504   13.608   5.1797  118.473   25.311  122.356   28.232 -3.883514 37.91667 
1 1 1   19    7   54 o   92.866   26.085   7.8386   3.8608   12.657   5.4125   2.8473   5.5086  115.442   30.262   71.975   30.033 43.46702 42.63548 
1 1 1   19    7   55 o   56.232   23.073   1.5428   3.1773   4.4280   4.2344  -2.1746   4.8064   73.644   27.681   53.869   24.883 19.77547 37.22115 
1 1 1   19    7   56 o  162.654   13.755   21.374   3.3924   15.604   4.5095   28.897   5.1492  132.714   23.035  185.652   18.361 -52.93822 29.45732 
1 1 1   19    8    0 o  766.928   8.4427  450.444   9.9081  450.444   9.9081  450.444   9.9081  766.928   8.4427  766.928   8.4427 0.000000 0.000000 
1 1 1   19    8    1 o  522.947   5.0578  209.340   4.0484  207.098   5.7245  211.583   5.7262  520.081   7.1911  525.684   7.1166 -5.603516 10.11723 
1 1 1   19    8    2 o  450.768   4.8918  155.538   3.3751  152.723   4.8226  158.240   4.7252  446.621   7.0546  454.623   6.7905 -8.001709 9.791704 
1 1 1   19    8    3 o  413.100   10.450  130.727   6.6074   0.0000   0.0000  130.727   6.6074  ?   ?   413.100   10.450 0.000000 10.44980 
1 1 1   19    8    4 o  854.432   9.4816  559.164   12.400  553.213   17.639  564.978   17.436  849.522   13.565  858.537   13.268 -9.015442 18.97545 
1 1 1   19    8    5 o  905.911   9.9001  628.623   13.728  677.258   21.133  593.118   18.056  939.810   14.691  879.637   13.411 60.17371 19.89126 
1 1 1   19    8    6 o  982.769   10.429  739.892   15.688  750.857   22.814  730.057   21.607  989.497   15.063  975.773   14.467 13.72400 20.88529 
1 1 1   19    8    7 o  433.201   7.1159  143.688   4.7183  152.624   6.1513  130.915   7.3540  446.406   9.0026  413.339   11.624 33.06714 14.70238 
1 1 1   19    8    8 o  923.674   10.380  653.602   14.676  653.602   14.676   0.0000   0.0000  923.674   10.380  ?   ?  0.000000 10.38033 
1 1 1   19    8    9 o  196.827   10.761   29.770   3.2296   31.487   4.2297   27.369   5.0014  202.190   13.749  188.016   17.583 14.17395 22.32049 
1 1 1   19    8   10 o  353.571   8.1012   95.735   4.3843  106.731   5.7156   80.017   6.8337  373.261   10.004  323.048   13.820 50.21274 17.06122 
1 1 1   19    8   11 o  330.069   8.4059   83.437   4.2468   79.126   5.2896   91.255   7.1234  321.357   10.754  344.994   13.490 -23.63699 17.25166 
1 1 1   19    8   12 o  468.542   7.7473  168.115   5.5561  170.505   6.9702  163.950   9.2017  471.780   9.6524  462.441   13.000 9.338684 16.19154 
1 1 1   19    8   13 o  206.914   11.761   32.920   3.7096   32.810   4.7096   33.101   6.0208  206.260   15.021  206.673   19.254 -0.4132233 24.42051 
1 1 1   19    8   14 o  1026.11   9.0448  806.531   14.206  760.080   23.187  834.442   17.974  995.289   15.220  1043.45   11.254 -48.16089 18.92904 
1 1 1   19    8   15 o  291.489   6.6484   65.059   2.9662   63.359   3.7843   67.768   4.7766  287.605   8.5965  297.380   10.494 -9.774628 13.56557 
1 1 1   19    8   16 o  417.839   5.8901  133.673   3.7670  137.731   4.8367  127.415   6.0060  424.079   7.4513  407.796   9.6222 16.28384 12.17000 
1 1 1   19    8   17 o  603.248   5.8825  278.630   5.4316  276.625   6.8801  281.947   8.8492  600.990   7.4792  606.604   9.5308 -5.614746 12.11505 
1 1 1   19    8   18 o  143.334   11.138   15.845   2.4244   13.669   3.6559   17.553   3.2390  132.046   18.604  150.568   14.223 -18.52187 23.41782 
1 1 1   19    8   19 o  582.593   6.2051  259.909   5.5333  260.668   9.3902  259.506   6.8485  583.126   10.521  582.051   7.6872 1.075317 13.02988 
1 1 1   19    8   20 o  198.045   13.888   30.257   4.1834   30.257   4.1834   0.0000   0.0000  198.045   13.888  ?   ?  0.000000 13.88846 
1 1 1   19    8   21 o  254.585   8.5892   49.667   3.3470   48.678   4.5593   50.824   4.9289  251.891   11.826  257.345   12.513 -5.454147 17.21696 
1 1 1   19    8   22 o  385.197   5.2880  113.615   3.1178  121.067   5.5628  110.202   3.7646  397.420   9.1449  379.317   6.4840 18.10263 11.21031 
1 1 1   19    8   23 o  126.196   10.770   12.306   2.0605   23.503   4.4566   9.2613   2.3238  173.918   16.957  108.856   14.292 65.06260 22.17662 
1 1 1   19    8   24 f  170.992   10.671   22.520   2.7790   24.111   4.7580   21.696   3.4237  175.977   17.914  167.499   13.468 8.477463 22.41208 
1 1 1   19    8   25 o  334.456   7.2742   85.718   3.7238   76.527   6.5869   90.035   4.5145  315.512   13.639  342.688   8.6069 -27.17633 16.12797 
1 1 1   19    8   26 o   79.281   18.341   5.0451   2.1814   2.4917   5.6803   5.4869   2.3626   78.270   31.307   82.655   19.064 -4.384308 36.65445 
1 1 1   19    8   27 o  101.123   15.344   8.0532   2.3004   8.4598   5.6743   7.9733   2.5165  103.729   32.289  100.308   16.997 3.421371 36.48927 
1 1 1   19    8   28 o  291.927   6.5227   65.306   2.9146   60.818   5.5493   67.016   3.4250  281.186   12.894  295.657   7.5684 -14.47125 14.95074 
1 1 1   19    8   29 o  414.397   5.7481  131.566   3.6460  134.569   6.6511  130.276   4.3593  418.586   10.381  412.261   6.9084 6.325378 12.46962 
1 1 1   19    8   30 o  166.273   9.9304   21.307   2.5158   15.877   5.3721   22.832   2.8473  140.281   25.976  172.027   10.869 -31.74635 28.15858 
1 1 1   19    8   31 o  319.824   7.0467   78.430   3.4496   93.717   8.6673   75.553   3.7603  348.184   16.263  313.833   7.8280 34.35117 18.04895 
1 1 1   19    8   32 o  209.663   9.3943   33.764   3.0148   37.337   5.8343   32.463   3.5213  218.812   17.568  205.116   11.259 13.69661 20.86623 
1 1 1   19    8   33 f  194.288   9.9338   29.091   2.9443   27.250   7.5807   29.418   3.1951  183.708   27.831  195.268   10.731 -11.55980 29.82852 
1 1 1   19    8   34 o  190.250   12.564   28.030   3.6380   21.521   7.6860   29.909   4.1299  161.165   32.283  196.313   13.833 -35.14789 35.12143 
1 1 1   19    8   35 o  363.769   7.3738  101.560   4.1057  108.488   7.0396   97.989   5.0543  375.033   12.263  357.025   9.2489 18.00757 15.36012 
1 1 1   19    8   36 f  351.892   6.8843   95.021   3.7080  104.411   7.0329   91.406   4.3638  367.745   12.495  344.930   8.2654 22.81534 14.98097 
1 1 1   19    8   37 o  138.950   16.153   15.204   3.3713   12.351   6.0629   16.481   4.0561  121.070   32.169  144.043   18.849 -22.97284 37.28481 
1 1 1   19    8   38 o  198.764   10.694   30.550   3.2416   28.759   7.8025   30.924   3.5637  187.292   28.083  199.777   11.705 -12.48553 30.42479 
1 1 1   19    8   39 o  298.805   7.9709   68.633   3.6456   54.394   7.1867   73.567   4.2302  263.083   17.954  309.183   8.9388 -46.09967 20.05632 
1 1 1   19    8   40 o  110.133   18.389   9.7495   2.9906   9.7471   6.6899   9.7501   3.3433  108.431   35.219  109.501   20.706 -1.069633 40.85468 
1 1 1   19    8   41 o  244.228   8.5659   45.912   3.2021   45.148   5.2561   46.362   4.0380  240.544   14.341  245.018   10.767 -4.473679 17.93300 
1 1 1   19    8   42 o   37.033   17.519  -2.9522   2.6289  -1.8564   4.0510  -3.7494   3.4552   52.338   23.662   42.585   20.127 9.752876 31.06429 
1 1 1   19    8   43 o  278.596   10.488   59.976   4.4725   59.423   6.0331   60.649   6.6641  275.811   14.340  278.086   15.721 -2.274933 21.27879 
1 1 1   19    8   44 o   62.819   24.038   2.3393   3.2280   1.8655   4.4387   2.8713   4.7030   67.303   27.403   72.669   28.672 -5.365959 39.66110 
1 1 1   19    8   45 o  226.615   11.026   39.777   3.8245   35.648   5.3458   44.107   5.4739  212.349   16.579  236.917   15.175 -24.56769 22.47499 
1 1 1   19    8   46 o  297.692   9.2804   68.440   4.2287   70.799   6.0267   66.152   5.9348  301.449   13.062  291.286   13.311 10.16263 18.64921 
1 1 1   19    8   47 o   74.558   26.576   4.1575   3.8247   5.1258   4.6084   2.0141   6.8564   81.755   29.169   78.596   33.194 3.159203 44.18835 
1 1 1   19    8   48 o  166.668   15.351   22.042   3.8721   22.553   5.0467   21.311   6.0376  166.500   20.217  159.020   25.680 7.480713 32.68367 
1 1 1   19    8   49 o  179.171   12.700   25.219   3.4603   17.597   5.2557   31.052   4.5973  144.270   24.688  197.793   15.304 -53.52328 29.04666 
1 1 1   19    8   50 o   72.733   23.804   4.3290   3.0540   5.5655   4.4066   3.1861   4.2366   82.312   28.593   70.447   27.383 11.86508 39.59006 
1 1 1   19    8   51 o   68.618   23.931   3.6929   3.0883   5.5092   4.5483   2.1392   4.2067   81.892   29.003   65.566   26.685 16.32648 39.41124 
1 1 1   19    8   52 o  163.823   14.756   21.476   3.6603   12.075   5.9082   27.333   4.6630  113.404   32.415  183.852   16.754 -70.44786 36.48863 
1 1 1   19    8   53 o  123.745   19.705   12.857   3.6071   7.1038   5.4138   17.450   4.8373   89.072   31.632  142.469   22.963 -53.39691 39.08855 
1 1 1   19    8   54 o  207.021   13.533   34.266   4.2645   33.170   5.5533   35.841   6.6576  200.166   18.329  205.294   21.506 -5.128311 28.25750 
1 1 1   19    8   55 o   52.538   22.047   0.9761   2.9936   2.9780   4.0365  -1.4707   4.4626   66.391   26.445   53.508   24.442 12.88295 36.01073 
1 1 1   19    9    0 o  323.933   7.0078   80.437   3.4710   80.437   3.4710   80.437   3.4710  323.933   7.0078  323.933   7.0078 0.000000 0.000000 
1 1 1   19    9    1 o  380.258   4.9283  110.685   2.8684  109.808   4.0863  111.538   4.0275  378.704   7.0496  381.679   6.8939 -2.975250 9.860189 
1 1 1   19    9    2 o  442.590   5.5559  149.956   3.7638  148.609   6.3185  150.697   4.6859  440.485   9.3716  443.648   6.9005 -3.163330 11.63803 
1 1 1   19    9    3 o  375.838   5.9758  108.139   3.4377  109.352   4.1106  105.316   6.2700  377.915   7.1063  370.755   11.049 7.160278 13.13665 
1 1 1   19    9    4 o  285.145   9.2710   62.275   4.0464   60.225   6.0898   63.895   5.4144  279.901   14.262  288.747   12.251 -8.846100 18.80093 
1 1 1   19    9    5 o  312.413   9.3763   74.757   4.4836   69.655   6.9062   78.474   5.8949  301.376   14.971  320.002   12.035 -18.62622 19.20897 
1 1 1   19    9    6 o  472.212   8.5786  170.770   6.2004  192.749   9.7520  155.856   8.0333  501.474   12.705  450.990   11.637 50.48465 17.22922 
1 1 1   19    9    7 o  470.922   8.9923  169.852   6.4817  169.852   6.4817   0.0000   0.0000  470.922   8.9923  ?   ?  0.000000 8.992333 
1 1 1   19    9    8 o  1093.27   11.446  915.901   19.154  915.901   19.154   0.0000   0.0000  1093.27   11.446  ?   ?  0.000000 11.44617 
1 1 1   19    9    9 o  707.100   7.6248  382.870   8.2524  379.150   10.199  389.922   14.044  703.547   9.4710  713.204   12.865 -9.656982 15.97504 
1 1 1   19    9   10 o  779.310   7.9393  465.091   9.4703  456.839   11.525  482.250   16.618  772.240   9.7503  793.056   13.690 -20.81598 16.80729 
1 1 1   19    9   11 o  699.465   7.7821  374.668   8.3316  387.707   10.539  352.935   13.606  711.409   9.6783  678.482   13.101 32.92761 16.28842 
1 1 1   19    9   12 o  605.418   7.7639  280.694   7.1945  294.841   9.1645  257.972   11.615  620.377   9.6512  580.049   13.082 40.32800 16.25677 
1 1 1   19    9   13 o  653.334   7.9334  326.901   7.9335  330.668   9.9619  320.371   13.118  656.957   9.9068  646.366   13.259 10.59100 16.55145 
1 1 1   19    9   14 o   86.164   27.390   5.6245   4.0625   4.1731   5.4694   7.4107   6.0677   84.377   31.510  100.577   33.583 -16.19994 46.05103 
1 1 1   19    9   15 f   67.600   20.331   3.5429   2.2748   2.2890   2.8693   5.6646   3.7324   61.846   22.877   85.560   26.113 -23.71316 34.71626 
1 1 1   19    9   16 o  491.908   7.5412  185.323   5.6780  185.323   5.6780   0.0000   0.0000  491.908   7.5412  ?   ?  0.000000 7.541208 
1 1 1   19    9   17 f  682.256   6.0905  356.417   6.3602  381.590   8.5236  324.790   9.5538  705.816   7.8897  651.035   9.5874 54.78046 12.41634 
1 1 1   19    9   18 o  506.096   5.4640  196.109   4.2327  195.079   6.0794  197.079   5.8967  504.645   7.8705  507.240   7.5949 -2.595673 10.93743 
1 1 1   19    9   19 o  317.294   7.2737   77.113   3.5325   75.696   6.3839   77.739   4.2410  314.055   13.280  318.520   8.6988 -4.465179 15.87568 
1 1 1   19    9   20 o  525.746   6.8397  211.711   5.5040  217.231   6.5397  198.302   10.192  532.476   8.0239  508.278   13.100 24.19818 15.36239 
1 1 1   19    9   21 o  126.649   13.361   12.452   2.5510   17.648   4.0522   9.0408   3.2832  150.356   17.963  106.449   20.896 43.90725 27.55609 
1 1 1   19    9   22 o  278.875   7.1828   59.581   3.0660   65.386   4.8888   55.818   3.9363  291.944   10.940  269.819   9.5312 22.12527 14.50986 
1 1 1   19    9   23 o  398.319   6.6259  121.539   4.0396  132.734   6.9878  115.919   4.9507  415.915   10.977  388.895   8.3170 27.01978 13.77165 
1 1 1   19    9   24 o  324.643   7.3789   80.762   3.6666   97.166   6.7288   73.833   4.3729  355.683   12.360  310.296   9.2071 45.38681 15.41204 
1 1 1   19    9   25 o  236.917   8.4115   43.034   3.0503   41.429   4.9722   44.002   3.8625  231.664   14.089  239.446   10.539 -7.781647 17.59475 
1 1 1   19    9   26 o  161.057   9.3824   19.967   2.3029   24.273   5.4086   19.013   2.5451  175.939   20.467  157.016   10.653 18.92265 23.07326 
1 1 1   19    9   27 o  500.689   5.3674  192.019   4.1134  188.255   7.0926  193.927   5.0494  495.328   9.3550  503.065   6.5576 -7.736450 11.42446 
1 1 1   19    9   28 o  211.218   7.7549   34.208   2.5071   40.769   5.3312   32.345   2.8409  229.462   15.266  205.316   9.0398 24.14659 17.74184 
1 1 1   19    9   29 o  248.110   7.1588   47.194   2.7186   56.349   5.5477   44.301   3.1188  270.520   13.398  240.300   8.4794 30.21965 15.85598 
1 1 1   19    9   30 o  273.416   6.9387   57.313   2.9039   55.022   5.7678   58.091   3.3609  266.781   14.176  275.186   7.9791 -8.405212 16.26713 
1 1 1   19    9   31 o  289.491   7.2354   64.270   3.2060   63.426   8.1503   64.425   3.4872  285.309   18.768  289.785   7.8619 -4.475769 20.34820 
1 1 1   19    9   32 o  392.690   8.0330  118.340   4.8284  113.266   8.9798  120.404   5.7266  382.793   15.326  395.890   9.4505 -13.09671 18.00562 
1 1 1   19    9   33 o  249.837   8.9442   47.946   3.4203   56.654   8.2045   46.114   3.7629  268.888   20.080  244.901   10.038 23.98672 22.44915 
1 1 1   19    9   34 o  251.870   8.5698   48.728   3.3038   53.773   6.2270   46.752   3.8976  263.049   15.535  246.505   10.330 16.54353 18.65582 
1 1 1   19    9   35 f  190.174   9.5904   27.885   2.7826   27.424   6.0528   28.009   3.1334  185.790   21.693  190.409   10.796 -4.618225 24.23058 
1 1 1   19    9   36 o  185.522   10.132   26.577   2.8664   28.959   6.0651   25.891   3.2525  190.985   21.100  182.840   11.683 8.144623 24.11850 
1 1 1   19    9   37 o  235.159   10.248   42.603   3.6886   39.964   6.4347   43.894   4.5017  225.268   18.835  238.020   12.399 -12.75215 22.54981 
1 1 1   19    9   38 o  182.902   10.812   25.892   3.0134   29.541   7.7020   25.232   3.2744  190.138   27.243  180.329   11.931 9.809250 29.74111 
1 1 1   19    9   39 o  286.824   8.1037   63.254   3.5577   57.236   7.2570   65.158   4.0819  269.966   17.659  290.921   9.1668 -20.95526 19.89688 
1 1 1   19    9   40 f  249.672   9.2765   48.016   3.5451   53.610   8.5338   46.850   3.8972  259.296   21.702  246.430   10.332 12.86673 24.03565 
1 1 1   19    9   41 o  213.028   10.843   35.144   3.5237   41.008   7.6153   33.546   3.9748  226.085   22.296  207.697   12.562 18.38757 25.59185 
1 1 1   19    9   42 o  500.014   6.8040  192.089   5.2073  194.503   9.6649  191.102   6.1813  500.772   12.609  498.320   8.1040 2.451660 14.98882 
1 1 1   19    9   43 o  163.732   20.306   21.559   4.9798   32.240   10.224   18.236   5.7019  192.126   36.091  148.092   26.109 44.03400 44.54459 
1 1 1   19    9   44 o  174.600   16.313   24.115   4.3092   10.675   7.4217   30.949   5.2927  111.492   37.138  197.442   17.701 -85.95056 41.14088 
1 1 1   19    9   45 o  448.399   7.3493  154.717   5.0440  152.133   6.9965  157.513   7.2785  443.474   10.307  451.138   10.541 -7.663605 14.74261 
1 1 1   19    9   46 o  106.612   22.807   9.4906   3.6092   12.388   4.9201   6.1155   5.3107  120.394   27.325   88.337   31.334 32.05689 41.57491 
1 1 1   19    9   47 o   99.169   24.562   8.3484   3.7089   8.6493   5.2170   8.0409   5.2738  100.021   30.932   97.008   31.247 3.012772 43.96727 
1 1 1   19    9   48 o   97.309   23.613   8.0384   3.4813   5.8345   4.6736   10.785   5.2177   84.932   29.450  110.582   30.045 -25.65057 42.07095 
1 1 1   19    9   49 o   98.941   22.296   8.2826   3.2956   15.489   5.1569   3.3079   4.2848  134.339   26.019   71.459   27.605 62.87988 37.93448 
1 1 1   19    9   50 o   63.032   23.318   2.7849   2.9813  -1.3848   4.2896   6.6810   4.1465   54.238   24.451   87.879   27.642 -33.64090 36.90423 
1 1 1   19    9   51 o   84.129   24.716   6.1187   3.3928   8.5557   5.6886   4.7732   4.2268   97.392   32.517   77.463   27.903 19.92918 42.84785 
1 1 1   19    9   52 o   67.063   23.771   3.5115   3.0558  -3.2740   4.2137   11.038   4.4380   48.458   22.689  111.348   26.435 -62.88906 34.83672 
1 1 1   19    9   53 f  279.099   10.044   60.852   4.2907   51.689   7.1313   66.051   5.3719  250.444   18.739  289.434   12.126 -38.99016 22.32013 
1 1 1   19    9   54 o  146.995   16.382   17.725   3.6232   19.609   5.0255   15.686   5.2286  150.495   22.508  131.096   26.957 19.39944 35.11834 
1 1 1   19    9   55 o  151.377   14.461   18.595   3.3099   14.774   4.3138   24.065   5.1611  129.704   22.547  167.845   20.516 -38.14098 30.48440 
1 1 1   19   10    0 o   29.380   19.218  -0.2973   2.1361  -0.2973   2.1361  -0.2973   2.1361   29.380   19.218   29.380   19.218 0.000000 0.000000 
1 1 1   19   10    1 o  468.309   5.1153  167.885   3.6667  168.854   5.2179  166.939   5.1536  469.601   7.2593  466.933   7.2109 2.668304 10.23205 
1 1 1   19   10    2 o  548.266   6.0385  230.128   5.0675  221.831   8.4778  234.741   6.3210  538.116   10.293  553.683   7.4585 -15.56732 12.71114 
1 1 1   19   10    3 o  861.973   7.5979  568.936   10.024  566.918   12.141  573.260   17.769  860.333   9.2196  864.743   13.425 -4.410767 16.28596 
1 1 1   19   10    4 o  633.854   6.6282  307.609   6.4306  313.932   7.8193  294.395   11.304  640.276   7.9787  619.801   11.915 20.47485 14.33981 
1 1 1   19   10    5 o  329.102   9.3467   82.959   4.7082   91.763   6.9472   75.481   6.4029  345.983   13.119  313.782   13.332 32.20108 18.70366 
1 1 1   19   10    6 o  157.030   16.486   19.128   3.9034   19.520   5.8011   18.804   5.2766  157.335   24.919  154.695   22.983 2.639786 33.89981 
1 1 1   19   10    7 o  927.846   10.380  659.562   14.741  659.562   14.741   0.0000   0.0000  927.846   10.380  ?   ?  0.000000 10.37981 
1 1 1   19   10    8 o  412.762   7.6322  130.465   4.8219  128.764   6.0059  133.550   8.0882  409.992   9.5704  417.399   12.660 -7.406403 15.87030 
1 1 1   19   10    9 o  692.360   7.6849  367.087   8.1440  365.187   10.006  370.817   14.018  690.456   9.4677  695.457   13.169 -5.000488 16.21905 
1 1 1   19   10   10 o  607.946   7.6025  283.033   7.0744  280.266   8.6662  288.559   12.248  604.871   9.3604  613.486   13.044 -8.615051 16.05462 
1 1 1   19   10   11 o  245.300   10.682   46.108   4.0106   49.901   4.9715   39.039   6.7868  255.123   12.731  224.490   19.960 30.63359 23.67432 
1 1 1   19   10   12 o  433.753   5.9645  144.046   3.9599  144.249   4.3868  143.150   9.2026  434.039   6.6032  432.014   13.917 2.024994 15.40403 
1 1 1   19   10   13 o  493.333   7.9819  186.401   6.0272  183.222   7.4410  192.467   10.278  489.006   9.9413  500.952   13.404 -11.94547 16.68829 
1 1 1   19   10   14 o  848.102   8.0569  550.918   10.459  577.177   13.006  502.861   17.595  867.912   9.7905  809.580   14.199 58.33197 17.24730 
1 1 1   19   10   15 o  182.033   10.827   25.488   3.0030   26.580   3.3089   20.385   7.1509  185.831   11.693  159.678   30.368 26.15323 32.54127 
1 1 1   19   10   16 o  235.996   9.3068   42.675   3.3618   40.808   3.7228   50.926   7.8266  230.737   10.541  256.464   20.099 -25.72694 22.69506 
1 1 1   19   10   17 o  586.228   6.0137  263.152   5.3961  271.538   6.9976  250.850   8.4753  595.395   7.6785  572.117   9.6783 23.27814 12.35433 
1 1 1   19   10   18 o  209.404   8.1840   33.595   2.6231   34.992   3.9520   32.494   3.5070  213.233   12.159  205.548   11.189 7.685287 16.52384 
1 1 1   19   10   19 o  433.326   8.5517  143.884   5.6720  150.628   7.5509  135.150   8.5925  443.173   11.131  419.589   13.379 23.58405 17.40427 
1 1 1   19   10   20 o  409.829   5.8872  128.624   3.6930  132.315   5.4080  125.398   5.0552  415.524   8.5029  404.539   8.1641 10.98471 11.78783 
1 1 1   19   10   21 o  303.488   7.2838   70.563   3.3835   83.055   5.9480   64.587   4.1140  328.977   11.812  290.259   9.2600 38.71854 15.00936 
1 1 1   19   10   22 o  425.675   6.4290  138.796   4.1888  144.914   7.1184  135.555   5.1808  434.617   10.701  420.571   8.0480 14.04593 13.38920 
1 1 1   19   10   23 o  414.880   6.1120  131.843   3.8813  136.292   5.8403  128.324   5.1942  421.606   9.0503  409.159   8.2938 12.44727 12.27579 
1 1 1   19   10   24 o  369.046   6.4173  104.338   3.6249  107.475   5.5257  101.968   4.8028  374.314   9.6446  364.683   8.6043 9.631622 12.92482 
1 1 1   19   10   25 f  335.801   6.8026   86.405   3.4965   86.294   5.3731   86.487   4.6048  335.302   10.469  335.808   8.9589 -0.5054016 13.77921 
1 1 1   19   10   26 o  416.901   6.6603  133.186   4.2501  131.790   7.1631  133.945   5.2799  414.215   11.298  417.945   8.2534 -3.729553 13.99168 
1 1 1   19   10   27 o  258.558   8.1243   51.268   3.2152   47.703   5.1042   53.613   4.1399  248.607   13.464  264.248   10.235 -15.64047 16.91250 
1 1 1   19   10   28 o  104.121   14.010   8.4980   2.1760   8.5890   4.8570   8.4751   2.4340  103.127   29.360  103.644   15.846 -0.5170746 33.36315 
1 1 1   19   10   29 o  130.702   11.166   13.226   2.2124   16.441   4.9897   12.440   2.4683  143.397   23.551  126.470   12.933 16.92686 26.86881 
1 1 1   19   10   30 o  249.240   7.6105   47.647   2.9034   60.991   7.9850   45.614   3.1167  279.824   18.752  243.810   8.3517 36.01382 20.52740 
1 1 1   19   10   31 o  102.113   17.689   8.3060   2.6645   10.519   7.0396   7.9358   2.8787  114.347   36.024   99.377   19.622 14.96992 41.02153 
1 1 1   19   10   32 o  173.207   10.549   23.157   2.7834   30.221   5.6375   20.881   3.2007  196.280   19.003  164.087   12.846 32.19353 22.93750 
1 1 1   19   10   33 o   55.177   21.491   1.5062   2.6137  -2.8902   5.3682   2.8722   2.9923   59.530   27.043   65.371   23.485 -5.841564 35.81713 
1 1 1   19   10   34 o  107.289   18.390   9.2030   2.9114   3.3380   5.7368   11.238   3.3788   80.645   31.715  118.604   19.274 -37.95840 37.11210 
1 1 1   19   10   35 o  284.844   7.4593   62.288   3.2522   56.419   6.3867   64.342   3.7788  269.266   15.562  289.365   8.5318 -20.09885 17.74771 
1 1 1   19   10   36 o  295.836   8.6202   67.282   3.9033   66.171   6.5371   67.897   4.8660  291.787   14.684  296.823   10.710 -5.035126 18.17500 
1 1 1   19   10   37 o  297.988   8.6747   68.291   3.9566   68.124   6.7125   68.380   4.8979  296.242   14.804  297.794   10.745 -1.552155 18.29242 
1 1 1   19   10   38 o  298.710   7.7970   68.573   3.5649   73.636   8.3796   67.454   3.9392  306.319   17.951  296.114   8.6911 10.20563 19.94392 
1 1 1   19   10   39 o  363.328   7.3556  101.423   4.0906  112.442   9.0332   98.580   4.5879  380.003   15.531  357.993   8.3729 22.00946 17.64375 
1 1 1   19   10   40 o  160.900   12.716   20.180   3.1062   25.170   7.0242   18.967   3.4633  174.752   27.141  155.472   14.729 19.27977 30.88025 
1 1 1   19   10   41 o   57.595   22.627   1.6566   2.9173   1.8785   6.9668   1.6094   3.2125   80.123   33.628   59.258   23.596 20.86522 41.08085 
1 1 1   19   10   42 o   52.075   22.107   0.2720   3.0667   6.2005   7.1112  -1.0825   3.3991   94.391   35.783   49.632   22.115 44.75907 42.06584 
1 1 1   19   10   43 o  169.615   19.618   23.062   4.9993   30.525   10.584   20.919   5.6720  184.954   38.631  159.704   23.941 25.25018 45.44820 
1 1 1   19   10   44 o  149.587   17.871   17.881   4.0108   20.368   7.0537   16.693   4.8758  153.913   31.013  142.476   23.153 11.43671 38.70221 
1 1 1   19   10   45 o  137.093   20.620   15.299   4.1928   23.825   7.6428   11.628   5.0148  166.283   31.174  116.366   28.404 49.91714 42.17350 
1 1 1   19   10   46 o   82.299   27.843   5.4200   4.1713   8.0728   8.0039   4.4309   4.8875  101.468   38.074   79.512   29.769 21.95572 48.33000 
1 1 1   19   10   47 o  131.502   18.674   14.020   3.6531 -10.9137   8.8051   19.204   4.0149   63.104   30.440  154.838   17.233 -91.73386 34.97921 
1 1 1   19   10   48 o  143.838   20.446   16.968   4.3747   21.026   7.5129   14.885   5.3811  153.043   33.040  131.086   27.687 21.95682 43.10673 
1 1 1   19   10   49 o   71.161   25.750   3.7896   3.6054   2.3887   7.0449   4.2867   4.1967   79.069   33.534   75.590   27.716 3.479286 43.50502 
1 1 1   19   10   50 o   48.124   20.998  -0.2044   2.9162  -0.4116   4.2013  -0.0118   4.0511   56.501   24.911   56.845   24.777 -0.3444824 35.13455 
1 1 1   19   10   51 o   78.472   25.177   5.2298   3.4264   4.0054   5.8343   5.8745   4.2334   78.810   31.656   83.029   28.049 -4.219078 42.29496 
1 1 1   19   10   52 o  175.620   12.602   24.425   3.3651   24.329   4.9262   24.508   4.6078  171.665   19.070  173.207   17.626 -1.541718 25.96824 
1 1 1   19   10   53 o   62.008   23.191   2.7926   2.9647   5.1901   4.0317  -0.0300   4.3747   77.827   27.332   57.659   25.420 20.16800 37.32586 
1 1 1   19   10   54 o  157.741   17.902   20.677   4.2457   16.530   7.0358   23.051   5.3243  127.008   35.048  163.686   21.793 -36.67746 41.27065 
1 1 1   19   10   55 o  116.946   17.879   11.510   3.0987   9.7329   4.2399   13.548   4.5400  101.891   26.820  122.075   25.135 -20.18465 36.75678 
1 1 1   19   11    0 o  781.557   8.7992  467.832   10.523  467.832   10.523  467.832   10.523  781.557   8.7992  781.557   8.7992 0.000000 0.000000 
1 1 1   19   11    1 o  1045.69   8.5998  837.445   13.765  818.620   23.296  847.541   17.061  1033.15   14.732  1051.77   10.598 -18.62915 18.14758 
1 1 1   19   11    2 o  580.800   6.5483  258.271   5.8214  253.462   6.8873  270.301   10.893  575.316   7.8212  593.879   11.984 -18.56317 14.31027 
1 1 1   19   11    3 o  806.909   7.4275  498.569   9.1735  496.405   11.030  503.426   16.521  805.057   8.9512  810.341   13.320 -5.284485 16.04838 
1 1 1   19   11    4 o  656.726   6.8723  330.227   6.9081  336.855   8.3948  316.323   12.158  663.214   8.2697  642.415   12.364 20.79956 14.87510 
1 1 1   19   11    5 f  1027.82   8.6415  809.102   13.595  822.246   16.758  783.797   23.252  1035.94   10.568  1010.85   15.028 25.09143 18.37205 
1 1 1   19   11    6 o  481.533   6.7130  177.538   4.9478  185.400   5.8767  158.397   9.1696  492.040   7.8031  454.536   13.180 37.50412 15.31655 
1 1 1   19   11    7 o  175.525   15.095   23.808   4.0159   23.808   4.0159   0.0000   0.0000  175.525   15.095  ?   ?  0.000000 15.09469 
1 1 1   19   11    8 o  176.779   12.880   24.086   3.4612   24.359   4.1923   23.501   6.1344  177.499   15.589  173.125   23.777 4.373352 28.43172 
1 1 1   19   11    9 o  499.482   5.9733  191.007   4.5667  188.112   5.0620  203.667   10.585  495.658   6.6722  515.363   13.419 -19.70432 14.98607 
1 1 1   19   11   10 o   53.442   23.085  -0.4203   3.4531  -1.4724   4.0892   2.1948   6.4468   54.933   24.379   81.800   33.128 -26.86640 41.13171 
1 1 1   19   11   11 o  602.614   7.9482  278.124   7.3312  277.946   8.9405  278.489   12.809  602.313   9.6977  602.554   13.888 -0.2404785 16.93895 
1 1 1   19   11   12 o  142.957   9.2419   15.722   2.0114   16.803   2.1062   4.5213   6.7808  147.799   9.3587   91.396   34.872 56.40254 36.10575 
1 1 1   19   11   13 o  490.568   6.3155  184.272   4.7422  186.867   5.3186  174.208   10.473  493.981   7.0343  476.482   14.360 17.49878 15.99042 
1 1 1   19   11   14 o  345.577   7.3496   91.462   3.8876   94.612   4.3529   79.048   8.6414  351.450   8.0918  320.232   17.699 31.21823 19.46061 
1 1 1   19   11   15 o  438.044   6.6664  146.942   4.4697  151.497   5.0085  129.127   9.9061  444.750   7.3574  410.039   15.784 34.71057 17.41417 
1 1 1   19   11   16 o  493.889   7.5560  186.840   5.7120  195.830   6.7815  164.891   10.597  505.556   8.7637  463.396   14.940 42.15994 17.32088 
1 1 1   19   11   17 f  183.830   10.882   26.002   3.0482   25.262   3.3322   29.797   7.5463  181.070   12.093  194.606   25.983 -13.53558 28.65952 
1 1 1   19   11   18 o  221.426   18.056   37.979   6.0662   43.359   9.1840   33.816   8.0795  235.294   25.931  207.436   26.019 27.85870 36.73467 
1 1 1   19   11   19 o  214.786   13.315   35.556   4.3558   35.556   4.3558   0.0000   0.0000  214.786   13.315  ?   ?  0.000000 13.31478 
1 1 1   19   11   20 o   54.890   20.995   1.5845   2.4617   2.0137   3.9508   1.3122   3.1473   66.920   26.319   58.360   23.318 8.560200 35.16222 
1 1 1   19   11   21 o  676.822   5.7026  350.822   5.9077  367.038   8.6929  336.904   8.0531  692.034   8.2067  663.048   7.9350 28.98602 11.41553 
1 1 1   19   11   22 o  382.939   6.1717  112.324   3.6175  121.125   5.3675  105.000   4.8966  397.478   8.8224  370.089   8.6442 27.38928 12.35135 
1 1 1   19   11   23 o  387.314   6.1709  114.913   3.6583  121.207   5.4470  109.741   4.9377  397.576   8.9510  378.338   8.5266 19.23782 12.36214 
1 1 1   19   11   24 o  459.997   5.9233  162.087   4.1705  168.797   6.2165  156.596   5.6238  469.177   8.6565  451.955   8.1295 17.22189 11.87534 
1 1 1   19   11   25 o  272.495   7.6107   56.920   3.1743   56.645   4.9802   57.108   4.1196  271.509   11.984  272.793   9.8662 -1.284180 15.52270 
1 1 1   19   11   26 o  161.084   11.742   20.046   2.8751   23.623   5.2055   18.476   3.4489  173.545   19.960  154.171   14.797 19.37483 24.84658 
1 1 1   19   11   27 o  192.072   9.9230   28.399   2.9073   28.235   4.8079   28.493   3.6503  190.516   16.655  192.069   12.484 -1.553085 20.81458 
1 1 1   19   11   28 o  475.478   6.1786  173.251   4.4967  174.411   6.7939  172.346   5.9987  476.669   9.3118  473.988   8.2683 2.681335 12.45285 
1 1 1   19   11   29 o   54.896   22.312   0.9727   2.9358   3.5574   6.6304   0.3423   3.2743   86.049   34.014   54.661   23.004 31.38799 41.06241 
1 1 1   19   11   30 o  354.941   9.2542   96.747   5.0277   95.589   8.3975   97.394   6.2770  351.706   15.599  355.792   11.526 -4.085602 19.39558 
1 1 1   19   11   31 o  316.684   9.3408   77.041   4.5277   87.897   8.6382   72.928   5.3166  336.867   16.753  307.851   11.283 29.01544 20.19822 
1 1 1   19   11   32 o  768.837   6.2721  453.209   7.3811  475.647   11.513  437.551   9.6177  786.694   9.5612  754.917   8.3234 31.77722 12.67658 
1 1 1   19   11   33 o  217.712   9.1666   36.427   3.0546   36.648   5.5739   36.332   3.6518  216.645   16.944  216.949   11.034 -0.3040466 20.21965 
1 1 1   19   11   34 o  360.810   6.3807   99.850   3.5239  104.923   6.7928   97.983   4.1219  368.830   12.033  357.265   7.5376 11.56509 14.19850 
1 1 1   19   11   35 o  273.104   7.5522   57.272   3.1570   55.072   6.3053   58.007   3.6470  265.945   15.558  274.707   8.6736 -8.762085 17.81207 
1 1 1   19   11   36 o  160.973   13.527   20.195   3.3021   29.854   5.7274   15.387   4.0413  194.286   19.524  138.872   19.554 55.41373 27.63224 
1 1 1   19   11   37 o  187.814   10.157   27.260   2.9089   30.543   6.6353   26.478   3.2365  195.297   22.616  184.843   11.496 10.45357 25.36986 
1 1 1   19   11   38 o   37.968   17.799  -2.5702   2.6067 -13.2609   7.6172  -1.1522   2.7742   55.480   27.113   44.185   19.812 11.29509 33.58021 
1 1 1   19   11   39 o  143.486   13.295   16.094   2.8867   16.518   6.6173   15.995   3.2080  139.320   31.740  142.654   14.912 -3.333710 35.06815 
1 1 1   19   11   40 o   82.046   22.781   5.5268   2.9625   14.341   6.9002   3.5350   3.2802  128.713   34.375   69.956   24.646 58.75760 42.29754 
1 1 1   19   11   41 o  262.505   9.0610   53.098   3.6407   63.593   7.8188   50.193   4.1139  283.884   18.088  254.915   10.544 28.96915 20.93693 
1 1 1   19   11   42 f  208.318   12.253   33.763   3.8897   48.435   8.0152   29.244   4.4486  245.772   21.524  192.963   15.185 52.80908 26.34074 
1 1 1   19   11   43 o  238.714   15.126   44.714   5.4982   54.655   11.658   41.870   6.2352  255.025   30.469  229.851   17.863 25.17387 35.31911 
1 1 1   19   11   44 o   91.902   22.989   7.0566   3.2257   11.413   7.6780   6.1229   3.5546  114.341   37.759   85.798   25.325 28.54275 45.46539 
1 1 1   19   11   45 o  102.270   25.946   8.8842   4.0680   12.674   7.7149   7.4248   4.7876  119.004   37.736   93.964   29.720 25.03952 48.03435 
1 1 1   19   11   46 o  302.280   10.375   70.785   4.8003   75.120   9.0058   69.065   5.6734  306.344   19.305  297.795   12.447 8.548187 22.96969 
1 1 1   19   11   47 o  183.663   13.129   26.488   3.6664   22.670   7.4371   27.713   4.2141  160.690   31.363  187.242   14.825 -26.55183 34.69032 
1 1 1   19   11   48 o  113.676   24.987   11.066   4.2291   1.3703   6.8763   16.964   5.3635   75.985   32.700  141.016   25.800 -65.03152 41.65211 
1 1 1   19   11   49 o  136.421   18.755   15.217   3.8126   21.345   8.6281   13.730   4.2501  149.330   37.733  127.699   22.569 21.63095 43.96774 
1 1 1   19   11   50 o  177.170   13.295   24.828   3.5790   13.921   6.2176   30.233   4.3768  122.559   32.583  194.874   14.784 -72.31495 35.77993 
1 1 1   19   11   51 o  121.835   19.855   12.384   3.5752   4.5652   6.7955   15.377   4.2040   83.278   33.907  135.433   20.957 -52.15536 39.86073 
1 1 1   19   11   52 o   46.360   21.165  -1.5564   3.3404 -13.7335   5.4724   5.6753   4.2173   40.935   20.505   81.076   27.983 -40.14135 34.69137 
1 1 1   19   11   53 o   68.822   25.249   3.7407   3.4837   5.7708   5.2041   2.0923   4.6894   82.114   30.722   66.123   27.661 15.99104 41.33990 
1 1 1   19   11   54 f   58.069   24.256   1.4492   3.5984   3.8041   6.7885   0.5289   4.2437   77.881   32.968   58.153   25.353 19.72751 41.58869 
1 1 1   19   12    0 o  182.283   20.948   26.475   5.6444   26.475   5.6444   26.475   5.6444  182.283   20.948  182.283   20.948 0.000000 0.000000 
1 1 1   19   12    1 o  689.711   8.4947  364.333   8.9678   0.0000   0.0000  364.333   8.9678  ?   ?   689.711   8.4947 0.000000 8.494733 
1 1 1   19   12    2 o  587.071   6.8006  263.894   6.1109  263.737   7.2540  264.277   11.341  586.839   8.0758  587.154   12.619 -0.3147583 14.98227 
1 1 1   19   12    3 o  317.593   7.4642   77.239   3.6285   74.920   4.1399   84.921   7.5363  312.759   8.6479  332.729   14.798 -19.96954 17.13943 
1 1 1   19   12    4 o  298.069   7.7498   68.038   3.5357   67.624   4.0460   69.373   7.2731  297.133   8.8962  300.258   15.882 -3.125580 18.20375 
1 1 1   19   12    5 o  336.302   7.4702   86.608   3.8453   84.091   4.3980   94.775   7.9229  331.345   8.6718  351.498   14.726 -20.15268 17.08979 
1 1 1   19   12    6 o  411.174   8.1132  129.480   5.1060  129.480   5.1060   0.0000   0.0000  411.174   8.1132  ?   ?  0.000000 8.113153 
1 1 1   19   12    7 o  284.353   7.0729   61.915   3.0784   60.842   3.3904   66.954   7.3469  281.859   7.8586  294.894   16.341 -13.03476 18.13216 
1 1 1   19   12    8 o  393.094   6.2291  118.310   3.7479  121.571   4.1771  104.845   8.4885  398.455   6.8490  369.658   15.002 28.79767 16.49190 
1 1 1   19   12    9 o  341.761   6.4186   89.432   3.3576   89.823   3.6339   87.151   8.7797  342.493   6.9318  336.450   17.105 6.042755 18.45621 
1 1 1   19   12   10 o  520.422   5.1558  207.344   4.1070  207.996   4.4052  203.008   11.356  521.228   5.5216  514.388   14.424 6.839478 15.44438 
1 1 1   19   12   11 o  411.425   5.1181  129.588   3.2231  129.489   3.4042  130.445   10.015  411.260   5.4079  412.199   15.873 -0.9390869 16.76919 
1 1 1   19   12   12 o  407.198   5.1892  126.942   3.2343  127.734   3.4291  120.562   9.7334  408.458   5.4848  396.236   16.049 12.22137 16.96004 
1 1 1   19   12   13 o  470.627   6.9717  169.622   5.0221  166.036   5.6530  183.055   10.940  465.578   7.9326  488.352   14.635 -22.77313 16.64668 
1 1 1   19   12   14 o  209.812   9.6017   33.735   3.0835   36.032   3.3870   22.616   7.4526  216.817   10.206  168.374   30.019 48.44333 31.70606 
1 1 1   19   12   15 o  320.512   7.8541   78.693   3.8531   76.361   4.2836   88.582   8.8188  315.684   8.8651  339.466   16.973 -23.78116 19.14827 
1 1 1   19   12   16 o  195.415   10.784   29.369   3.2131   30.202   3.5320   25.374   7.7370  198.089   11.701  178.599   29.320 19.49001 31.56879 
1 1 1   19   12   17 o  115.923   24.897   10.786   4.2858   10.301   5.2175   11.793   7.5148  113.113   29.741  122.172   37.001 -9.058609 47.47200 
1 1 1   19   12   18 o  369.663   7.2892  104.684   4.1243  108.187   4.6024   90.398   9.2931  375.761   8.0021  342.228   17.802 33.53296 19.51815 
1 1 1   19   12   19 o   48.146   20.584  -0.0947   2.6928   1.5837   3.2711  -3.6235   4.7429   60.552   23.905   53.917   24.839 6.635265 34.47338 
1 1 1   19   12   20 o  650.127   5.6535  323.690   5.6258  341.556   8.1729  307.601   7.7557  667.602   7.9981  633.550   7.9978 34.05231 11.31086 
1 1 1   19   12   21 o  441.608   5.7745  149.362   3.9032  151.962   5.5359  146.792   5.5042  445.271   8.1225  437.623   8.2172 7.648224 11.55411 
1 1 1   19   12   22 o  476.466   5.7630  173.881   4.2029  183.264   6.1402  165.609   5.7650  488.951   8.2045  464.812   8.1032 24.13974 11.53146 
1 1 1   19   12   23 o  384.881   6.0996  113.478   3.5934  119.466   5.2576  108.229   4.9225  394.708   8.7025  375.698   8.5601 19.01035 12.20685 
1 1 1   19   12   24 o  108.786   15.477   9.2965   2.5044   4.6101   3.8276   12.805   3.3116   79.274   26.672  127.665   17.400 -48.39145 31.84569 
1 1 1   19   12   25 o  475.382   6.0109  173.139   4.3738  177.516   6.4752  169.466   5.9314  481.058   8.7940  470.090   8.2434 10.96848 12.05354 
1 1 1   19   12   26 o  413.405   6.5865  130.975   4.1677  135.114   6.6636  128.316   5.3414  419.457   10.379  408.995   8.5324 10.46237 13.43588 
1 1 1   19   12   27 o  587.366   7.7153  264.566   6.9364  283.369   10.920  251.848   8.9809  607.071   11.752  572.633   10.246 34.43823 15.59169 
1 1 1   19   12   28 o  307.888   9.8131   72.803   4.6245   87.431   8.2003   65.980   5.6000  336.446   15.924  292.789   12.496 43.65701 20.24126 
1 1 1   19   12   29 o  206.097   10.878   32.748   3.4195   32.324   4.9238   33.142   4.7526  203.909   15.902  206.638   15.132 -2.729477 21.95050 
1 1 1   19   12   30 o  174.029   12.625   23.453   3.3402   21.154   7.1121   24.104   3.7834  160.916   29.979  176.179   14.149 -15.26283 33.14986 
1 1 1   19   12   31 o  101.197   20.210   8.2517   3.0209   12.628   4.7560   5.2920   3.9112  124.448   25.814   82.897   26.929 41.55092 37.30352 
1 1 1   19   12   32 o  309.474   9.1819   73.597   4.3494   75.821   6.1158   71.321   6.1867  313.524   12.744  303.972   13.297 9.551544 18.41805 
1 1 1   19   12   33 o  100.433   19.634   8.1330   2.9100   9.0726   5.3254   7.7329   3.4746  105.168   30.985   97.231   23.588 7.936638 38.94210 
1 1 1   19   12   34 o  112.433   18.263   10.094   3.0350   11.163   5.5018   9.6263   3.6387  115.676   30.601  108.704   22.606 6.972527 38.04547 
1 1 1   19   12   35 o  316.858   8.0971   77.144   3.9270   84.560   6.3826   72.626   4.9815  330.802   12.605  307.004   10.601 23.79825 16.47054 
1 1 1   19   12   36 o  282.915   9.1609   61.591   3.9670   65.822   7.1545   59.713   4.7669  290.383   16.161  278.195   11.195 12.18747 19.65939 
1 1 1   19   12   37 o  281.875   7.8342   61.062   3.3800   65.696   7.6462   59.937   3.7682  289.541   17.333  279.109   8.8204 10.43216 19.44803 
1 1 1   19   12   38 o   33.775   16.256  -3.6526   2.4779   0.4074   6.0090  -4.4844   2.7200   71.548   30.673   34.291   16.632 37.25700 34.89225 
1 1 1   19   12   39 o  188.266   10.575   27.442   3.0351   34.140   6.6147   25.656   3.4160  206.713   21.206  181.629   12.361 25.08401 24.54584 
1 1 1   19   12   40 o  346.680   7.2651   92.372   3.8551   99.209   7.9106   90.243   4.4149  357.038   14.475  342.411   8.4237 14.62738 16.74783 
1 1 1   19   12   41 o   69.725   23.712   3.6738   3.0256   0.4878   6.6491   4.5058   3.3978   74.554   32.119   75.944   25.121 -1.389755 40.77617 
1 1 1   19   12   42 o   79.636   24.233   5.1718   3.2179 -11.2703   10.724   6.7986   3.3733   72.379   34.563   90.309   23.995 -17.92974 42.07573 
1 1 1   19   12   43 o  111.026   19.059   10.008   3.1221   1.0449   7.2026   12.082   3.4646   78.190   33.553  122.201   19.152 -44.01060 38.63441 
1 1 1   19   12   44 o  105.106   21.136   9.1180   3.2824   8.7686   7.1354   9.2118   3.6968  103.124   36.348  104.895   23.596 -1.770744 43.33559 
1 1 1   19   12   45 o  337.919   9.2625   88.204   4.7908   76.557   8.6132   93.422   5.7649  310.265   18.217  347.176   10.849 -36.91092 21.20246 
1 1 1   19   12   46 o  105.298   21.045   9.1993   3.2732   7.6938   7.6091   9.5411   3.6259   98.923   37.122  106.630   22.899 -7.706200 43.61695 
1 1 1   19   12   47 o   75.970   25.314   4.6525   3.4480   4.9952   6.6529   4.5267   4.0318   86.588   34.121   76.746   27.293 9.841759 43.69396 
1 1 1   19   12   48 o  187.171   14.769   27.784   4.1966   26.838   6.2742   28.549   5.6454  179.356   23.413  187.081   20.026 -7.725281 30.80921 
1 1 1   19   12   49 o  217.343   11.881   37.033   3.9376   30.592   7.6887   39.323   4.5845  188.071   27.524  223.226   13.481 -35.15509 30.64808 
1 1 1   19   12   50 o   45.305   20.930  -2.2121   3.4024  -0.7319   6.7241  -2.7216   3.9446   68.935   30.882   48.085   22.327 20.84987 38.10755 
1 1 1   19   12   51 o  122.288   18.430   12.369   3.3425   9.1976   5.6443   14.082   4.1481   99.500   32.351  128.825   21.815 -29.32562 39.01927 
1 1 1   19   12   52 o   67.799   24.617   3.5962   3.2992   7.2304   5.5366   1.5953   4.1082   89.394   31.963   61.942   25.899 27.45239 41.13872 
1 1 1   19   12   53 o  108.209   22.897   10.311   3.6741   6.9463   5.3877   13.237   5.0233   87.097   31.484  119.400   27.976 -32.30278 42.11729 
1 1 1   19   12   54 o   98.540   24.539   8.8304   3.6871   2.1677   7.4527   10.990   4.2427   75.205   33.166  109.378   25.766 -34.17315 41.99883 
1 1 1   19   13    0 o  402.210   8.1998  124.007   5.0434  124.007   5.0434  124.007   5.0434  402.210   8.1998  402.210   8.1998 0.000000 0.000000 
1 1 1   19   13    1 o  748.908   7.3752  429.495   8.4542  420.219   10.002  452.697   15.820  740.682   8.8227  768.335   13.452 -27.65381 16.08686 
1 1 1   19   13    2 o  333.002   7.5033   84.919   3.8244   80.715   4.3645   98.822   7.9373  324.617   8.7840  358.925   14.448 -34.30786 16.90834 
1 1 1   19   13    3 o  890.488   8.0150  607.307   10.925  595.321   12.921  637.353   20.458  881.522   9.5762  911.483   14.664 -29.96063 17.51375 
1 1 1   19   13    4 o  526.255   6.9488  212.065   5.5972  212.563   6.5543  210.725   10.757  526.819   8.1283  524.201   13.407 2.618103 15.67867 
1 1 1   19   13    5 o  387.987   8.3697  115.298   4.9704  115.298   4.9704   0.0000   0.0000  387.987   8.3697  ?   ?  0.000000 8.369660 
1 1 1   19   13    6 o  250.186   8.8620   47.947   3.3936   49.294   3.7807   42.362   7.6990  253.652   9.7380  233.625   21.781 20.02742 23.85907 
1 1 1   19   13    7 o  238.979   8.9590   43.750   3.2771   42.077   3.6111   51.557   7.8016  234.337   10.068  258.184   19.895 -23.84679 22.29740 
1 1 1   19   13    8 o  132.369   13.779   13.585   2.7507   14.296   2.9587   9.0549   7.4689  135.738   14.463  111.117   37.258 24.62155 39.96723 
1 1 1   19   13    9 o  415.238   7.1412  132.043   4.5388  127.522   5.0472  151.150   10.376  408.030   8.0814  443.754   15.277 -35.72333 17.28280 
1 1 1   19   13   10 o  451.967   7.0625  156.437   4.8858  157.757   5.5152  151.621   10.532  453.832   7.9396  444.402   15.483 9.429962 17.40014 
1 1 1   19   13   11 o  233.585   8.5124   41.798   3.0434   42.570   3.2803   37.025   8.1576  235.715   9.0919  217.642   24.938 18.07280 26.54358 
1 1 1   19   13   12 o  290.284   6.0294   64.523   2.6790   64.719   2.8109   62.578   8.8485  290.718   6.3169  284.375   20.466 6.343628 21.41824 
1 1 1   19   13   13 o  329.838   7.2381   83.326   3.6542   82.435   3.9915   87.942   9.0831  328.042   7.9494  337.740   17.632 -9.697998 19.34075 
1 1 1   19   13   14 o  138.046   11.117   14.707   2.3291   14.806   2.4306   13.600   8.1461  138.462   11.575  130.566   38.281 7.895920 39.99256 
1 1 1   19   13   15 o   43.187   18.660  -0.2801   2.2572  -1.1710   2.3620   9.1001   7.6639   40.495   18.210  111.439   37.740 -70.94426 41.90335 
1 1 1   19   13   16 o   79.856   27.580   4.4861   4.0970   6.6207   4.8312  -0.9797   7.7308   93.300   29.892   79.248   34.386 14.05209 45.56220 
1 1 1   19   13   17 o  427.710   6.9409  140.130   4.5440  143.166   5.0439  127.056   10.469  432.276   7.6232  406.370   16.831 25.90619 18.47651 
1 1 1   19   13   18 o  226.327   9.7158   39.277   3.3658   39.277   3.3658   0.0000   0.0000  226.327   9.7158  ?   ?  0.000000 9.715792 
1 1 1   19   13   19 o  267.596   8.5007   54.887   3.4818   55.026   3.7692   54.079   9.0911  267.899   9.1919  263.419   22.771 4.479462 24.55659 
1 1 1   19   13   20 o  633.254   6.2477  307.171   6.0557  310.734   7.6773  301.305   9.8521  636.749   7.8772  626.704   10.271 10.04431 12.94350 
1 1 1   19   13   21 o  357.034   6.1407   97.647   3.3558  102.643   4.6857   92.385   4.8085  365.912   8.3661  347.095   9.0508 18.81647 12.32515 
1 1 1   19   13   22 o  256.889   7.1830   50.572   2.8244   53.238   3.9547   47.797   4.0350  263.420   9.8084  249.547   10.564 13.87253 14.41525 
1 1 1   19   13   23 o  321.706   6.5473   79.300   3.2240   77.973   4.5844   80.599   4.5348  318.802   9.3948  324.147   9.1401 -5.344574 13.10741 
1 1 1   19   13   24 o  322.147   6.6643   79.528   3.2861   79.309   4.7726   79.725   4.5313  321.467   9.6994  322.355   9.1837 -0.8879395 13.35734 
1 1 1   19   13   25 o  140.674   12.466   15.337   2.6563   15.697   4.2774   15.111   3.3891  140.885   20.432  139.019   16.233 1.866501 26.09511 
1 1 1   19   13   26 o  481.573   7.9745  177.865   5.8780  187.702   9.3420  171.418   7.5627  493.974   12.356  472.403   10.459 21.57092 16.18816 
1 1 1   19   13   27 o  170.598   12.061   22.500   3.1291   20.404   4.2639   24.946   4.6063  161.474   17.533  178.829   17.034 -17.35460 24.44557 
1 1 1   19   13   28 o  262.163   7.9124   52.726   3.1750   55.795   4.7056   50.161   4.3019  269.336   11.414  255.420   11.004 13.91577 15.85447 
1 1 1   19   13   29 o   91.815   19.609   6.7958   2.6720   8.1336   4.2568   5.9260   3.4324   99.922   27.133   85.912   24.752 14.00974 36.72701 
1 1 1   19   13   30 o  196.809   12.046   29.943   3.6112   36.450   7.4705   27.958   4.1252  214.574   23.110  189.754   14.308 24.82076 27.18117 
1 1 1   19   13   31 o  258.300   10.800   51.343   4.2700   55.100   5.3193   44.536   7.1603  267.253   13.004  238.248   19.815 29.00482 23.70068 
1 1 1   19   13   32 o  204.445   10.064   32.154   3.1493   39.692   5.2585   27.938   3.9325  225.890   15.299  189.689   13.635 36.20074 20.49337 
1 1 1   19   13   33 o  127.809   15.568   12.847   2.9825   13.626   5.0732   12.435   3.6870  128.784   26.617  124.651   20.001 4.132675 33.29378 
1 1 1   19   13   34 o  241.084   9.2494   44.707   3.4131   44.090   5.4693   45.100   4.3680  237.962   15.094  241.758   11.804 -3.796417 19.16182 
1 1 1   19   13   35 o  209.904   10.660   34.048   3.4137   27.478   5.7693   37.588   4.2345  185.947   20.618  220.156   12.619 -34.20992 24.17261 
1 1 1   19   13   36 o   60.833   23.034   2.1835   2.9444  -1.3518   5.0145   4.0438   3.6375   60.774   26.983   74.451   25.971 -13.67702 37.45140 
1 1 1   19   13   37 o  210.900   11.530   34.457   3.7079   39.773   6.7291   32.140   4.4433  224.097   19.822  202.969   14.396 21.12750 24.49834 
1 1 1   19   13   38 o  326.858   8.6317   82.218   4.3184   78.956   7.0796   84.151   5.4497  318.703   14.513  330.166   10.784 -11.46335 18.08075 
1 1 1   19   13   39 o  288.981   9.4675   64.360   4.1877   70.146   7.1667   61.361   5.1603  299.486   15.689  281.579   11.973 17.90714 19.73542 
1 1 1   19   13   40 o   60.518   22.454   2.3452   2.7685  -2.1643   6.6498   3.2907   3.0449   67.988   30.565   67.484   23.749 0.5037842 38.70724 
1 1 1   19   13   41 o  248.652   9.1175   47.663   3.4701   44.874   7.4228   48.443   3.9254  236.941   20.674  250.442   10.240 -13.50026 23.07141 
1 1 1   19   13   42 o   91.891   23.306   7.0413   3.2830   18.407   10.245   5.7405   3.4658  141.084   43.298   83.493   25.092 57.59100 50.04296 
1 1 1   19   13   43 o   95.886   22.192   7.6486   3.1926   14.692   6.8371   5.6847   3.6103  128.984   34.109   83.177   25.733 45.80691 42.72711 
1 1 1   19   13   44 o   79.259   25.262   5.1035   3.4539   8.0216   7.4452   4.3033   3.8988  100.650   36.914   75.807   26.852 24.84302 45.64738 
1 1 1   19   13   45 o  261.476   9.5189   52.857   3.8097   54.048   8.1021   52.519   4.3166  258.933   20.613  260.250   10.836 -1.317291 23.28825 
1 1 1   19   13   46 o   38.259   18.357  -4.1691   3.1048  -3.5330   6.9405  -4.3282   3.4716   65.364   30.088   41.060   19.623 24.30384 35.92141 
1 1 1   19   13   47 o  166.241   13.451   21.788   3.3934   18.734   6.2199   23.083   4.0491  146.753   28.719  170.250   15.715 -23.49751 32.73742 
1 1 1   19   13   48 o  236.716   13.241   44.109   4.7784   40.362   8.0044   46.184   5.9561  219.433   24.236  240.554   16.272 -21.12100 29.19204 
1 1 1   19   13   49 o   98.283   23.303   8.3044   3.4523  -3.5651   7.0408   12.061   3.9612   64.693   29.964  119.310   22.517 -54.61748 37.48153 
1 1 1   19   13   50 o  214.471   11.309   36.066   3.6993   22.651   6.4636   42.602   4.5113  160.697   27.252  232.414   12.730 -71.71634 30.07857 
1 1 1   19   13   51 o  277.195   9.8070   59.896   4.1609   38.873   7.3909   69.650   5.0346  213.939   22.928  298.198   11.030 -84.25861 25.44288 
1 1 1   19   13   52 o  159.680   14.108   20.487   3.4126   17.103   5.5739   22.516   4.3162  137.157   27.508  165.548   17.289 -28.39072 32.48961 
1 1 1   19   13   53 o   68.763   25.139   3.8091   3.4491   5.4494   5.3829   2.6665   4.4926   80.471   30.981   67.050   27.465 13.42092 41.40253 
1 1 1   19   14    0 o  351.784   8.6757   94.924   4.6650   94.924   4.6650   94.924   4.6650  351.784   8.6757  351.784   8.6757 0.000000 0.000000 
1 1 1   19   14    1 o  516.670   6.9783  204.418   5.5186  204.493   6.5373  204.232   10.295  516.704   8.2658  516.059   13.033 0.6446533 15.43309 
1 1 1   19   14    2 o  427.220   7.0851  139.767   4.6330  136.774   5.3460  148.797   9.2857  422.575   8.2653  440.434   13.774 -17.85934 16.06360 
1 1 1   19   14    3 o  228.383   9.7234   39.964   3.3990   40.846   3.8180   36.592   7.4625  230.859   10.805  216.799   22.832 14.06044 25.25929 
1 1 1   19   14    4 o  626.680   8.4253  300.824   8.0816  300.824   8.0816   0.0000   0.0000  626.680   8.4253  ?   ?  0.000000 8.425250 
1 1 1   19   14    5 o  537.002   7.0734  220.833   5.8140  225.621   6.7860  207.620   11.274  542.735   8.1688  520.199   14.159 22.53656 16.34630 
1 1 1   19   14    6 o  910.056   8.2250  634.383   11.457  636.149   13.759  630.388   20.691  911.149   9.8655  906.290   14.916 4.859375 17.88341 
1 1 1   19   14    7 o  1131.17   9.3895  980.386   16.257  978.980   19.575  983.511   29.186  1130.06   11.317  1131.52   16.851 -1.458130 20.29885 
1 1 1   19   14    8 o  511.668   6.3221  200.471   4.9513  196.406   5.4259  220.702   12.105  506.424   6.9999  536.224   14.749 -29.80038 16.32541 
1 1 1   19   14    9 o  368.869   6.7213  104.198   3.7949  102.087   4.0898  117.268   10.178  365.093   7.3186  390.656   17.021 -25.56345 18.52744 
1 1 1   19   14   10 o  589.673   6.4184  266.269   5.7931  265.644   6.4475  268.889   13.197  588.938   7.1524  591.834   14.568 -2.896851 16.22907 
1 1 1   19   14   11 o  352.358   6.7487   95.084   3.6398   93.333   3.9124  106.351   9.9243  349.077   7.3223  371.928   17.433 -22.85071 18.90837 
1 1 1   19   14   12 o  224.651   8.9414   38.673   3.0746   38.418   3.2919   40.413   8.6041  223.888   9.6061  227.318   25.150 -3.429916 26.92210 
1 1 1   19   14   13 f  189.152   14.572   27.639   4.1864   28.112   4.7650   26.042   8.7650  190.522   16.503  180.158   33.002 10.36348 36.89787 
1 1 1   19   14   14 o  394.841   9.2383  119.489   5.5832  123.419   6.5695  109.269   10.595  401.179   10.698  376.751   18.372 24.42834 21.26015 
1 1 1   19   14   15 o  404.638   9.3250  125.506   5.7755  131.386   6.8702  111.339   10.664  413.891   10.845  380.251   18.323 33.63995 21.29137 
1 1 1   19   14   16 o  239.642   8.2133   44.008   3.0127   46.007   3.2196   29.938   8.5416  245.009   8.5851  194.015   29.709 50.99484 30.92445 
1 1 1   19   14   17 o  222.595   8.8742   37.982   3.0235   39.027   3.2364   30.814   8.4763  225.616   9.3719  196.975   28.980 28.64063 30.45811 
1 1 1   19   14   18 o  499.624   7.5653  191.279   5.7855  191.279   5.7855   0.0000   0.0000  499.624   7.5653  ?   ?  0.000000 7.565306 
1 1 1   19   14   19 o  494.664   6.9432  187.475   5.2570  192.152   5.8488  167.809   11.994  500.738   7.6310  466.743   16.788 33.99466 18.44137 
1 1 1   19   14   20 o  455.986   6.3726  159.286   4.4477  161.126   5.5206  155.881   7.5082  458.494   7.8665  450.656   10.885 7.837372 13.42992 
1 1 1   19   14   21 o  305.280   7.2421   71.422   3.3840   70.574   4.1130   73.198   5.9537  303.360   8.8578  308.623   12.604 -5.263458 15.40486 
1 1 1   19   14   22 o  179.009   10.227   24.675   2.7905   24.638   3.2810   24.772   5.3054  178.660   12.069  177.877   19.823 0.7828369 23.20831 
1 1 1   19   14   23 o  160.250   10.224   19.794   2.4947   19.473   3.4821   20.132   3.5757  158.364   14.527  161.022   14.669 -2.658661 20.64524 
1 1 1   19   14   24 o  295.070   9.3664   66.817   4.2302   74.874   6.9733   62.126   5.3212  311.739   14.614  284.247   12.230 27.49142 19.05680 
1 1 1   19   14   25 o  207.514   13.107   33.275   4.1416   28.884   8.3613   34.702   4.7676  189.388   29.831  211.661   14.809 -22.27235 33.30446 
1 1 1   19   14   26 f  488.914   5.9741  183.171   4.4707  187.240   6.4232  179.348   6.2263  493.993   8.4950  483.482   8.4136 10.51117 11.95632 
1 1 1   19   14   27 o  352.544   6.6549   95.279   3.5911  103.831   5.3209   88.125   4.8667  367.710   9.4538  338.770   9.3855 28.94061 13.32147 
1 1 1   19   14   28 o  170.085   10.713   22.330   2.7747   23.799   4.2157   21.208   3.6856  174.739   15.937  165.099   14.739 9.639877 21.70829 
1 1 1   19   14   29 o   80.803   22.918   5.2456   2.9653   9.4977   6.6814   4.2027   3.3090  109.258   35.168   74.780   24.793 34.47803 43.02871 
1 1 1   19   14   30 o   92.798   28.420   6.8840   4.4164   7.6149   6.9679   6.3933   5.7097  101.774   35.914   93.292   32.539 8.481827 48.46240 
1 1 1   19   14   31 o  332.153   7.3594   84.663   3.7415   87.715   5.8033   82.493   4.8947  337.478   11.235  327.530   9.7634 9.947754 14.88429 
1 1 1   19   14   32 o  139.406   13.673   15.162   2.8801   18.913   4.7796   13.024   3.6089  154.133   20.790  127.907   19.012 26.22618 28.17188 
1 1 1   19   14   33 o  282.583   8.6602   61.378   3.7458   60.593   6.1451   61.843   4.7251  279.341   14.421  283.293   10.897 -3.952271 18.07546 
1 1 1   19   14   34 o  263.250   9.0322   53.305   3.6394   49.765   6.1236   55.239   4.5253  252.545   15.923  267.647   11.046 -15.10196 19.37960 
1 1 1   19   14   35 o   95.890   21.035   7.5071   3.0025   0.4762   4.9266   11.662   3.7871   65.824   27.985  120.001   21.403 -54.17743 35.23130 
1 1 1   19   14   36 o  211.940   10.498   34.637   3.4056   39.002   5.5202   31.955   4.3272  223.166   16.273  202.504   14.047 20.66185 21.49725 
1 1 1   19   14   37 o  135.773   16.509   14.585   3.3602   21.444   6.2630   11.812   3.9818  161.651   26.210  120.299   22.450 41.35157 34.51043 
1 1 1   19   14   38 o   71.312   24.402   3.8043   3.2045   4.6164   5.5927   3.4074   3.9100   84.027   31.762   71.953   26.687 12.07306 41.48563 
1 1 1   19   14   39 o  165.774   14.875   21.570   3.7341   16.907   6.1914   24.236   4.6813  141.467   29.547  174.916   17.730 -33.44911 34.45816 
1 1 1   19   14   40 o  310.363   9.2017   74.252   4.3713   68.984   7.2072   77.317   5.4980  296.632   15.932  316.110   11.363 -19.47827 19.56913 
1 1 1   19   14   41 o  192.458   15.081   29.097   4.4071   28.916   6.8283   29.227   5.7698  188.117   24.281  191.048   20.029 -2.931671 31.47594 
1 1 1   19   14   42 o  179.675   22.132   26.191   5.9580   32.671   10.579   23.181   7.2103  191.950   37.350  165.328   29.579 26.62251 47.64372 
1 1 1   19   14   43 o   90.369   26.611   6.8525   3.9290  -0.9262   6.7884   10.771   4.8179   71.012   31.468  112.142   28.120 -41.12988 42.20177 
1 1 1   19   14   44 o  240.126   14.849   45.340   5.4308   53.456   7.7610   37.553   7.6022  258.215   19.787  214.108   23.589 44.10649 30.78886 
1 1 1   19   14   45 o  219.610   10.680   37.401   3.5899   40.061   7.6426   36.647   4.0664  221.167   22.908  216.589   12.317 4.578064 26.00961 
1 1 1   19   14   46 o   70.453   24.415   3.8261   3.2120   3.7090   6.5638   3.8630   3.6831   82.022   33.352   72.189   26.041 9.833328 42.31397 
1 1 1   19   14   47 o  171.972   13.138   23.301   3.4320   13.694   6.0548   27.849   4.1659  123.085   31.883  187.469   14.634 -64.38403 35.08097 
1 1 1   19   14   48 o  110.723   27.609   10.826   4.6630   6.7622   9.5096   12.112   5.3504   97.447   39.942  116.069   29.925 -18.62205 49.90870 
1 1 1   19   14   49 o  179.221   12.745   25.346   3.4735   14.931   6.1982   30.115   4.1939  127.316   31.878  194.755   14.166 -67.43880 34.88378 
1 1 1   19   14   50 o  232.858   10.405   42.309   3.7086   28.008   6.1714   50.392   4.6398  182.069   22.634  253.350   11.965 -71.28099 25.60152 
1 1 1   19   14   51 o   58.445   23.483   1.8522   3.2116  -4.6165   5.5127   5.1759   3.9515   53.529   25.337   77.919   27.076 -24.38964 37.08141 
1 1 1   19   14   52 o  159.921   15.121   20.730   3.6574   11.106   6.3522   25.502   4.4732  105.265   34.325  176.413   16.768 -71.14730 38.20131 
1 1 1   19   14   53 o  183.472   12.952   26.933   3.6140   23.214   5.4571   29.839   4.8233  163.478   22.398  190.481   16.712 -27.00331 27.94577 
1 1 1   19   15    0 o  720.679   9.0358  397.889   9.9638  397.889   9.9638  397.889   9.9638  720.679   9.0358  720.679   9.0358 0.000000 0.000000 
1 1 1   19   15    1 o  906.738   8.2351  629.786   11.429  620.047   13.653  652.599   20.896  899.518   9.9160  922.092   14.805 -22.57397 17.81906 
1 1 1   19   15    2 o  225.461   9.6497   38.951   3.3301   40.717   3.7912   32.988   6.9667  230.481   10.747  205.722   22.491 24.75926 24.92664 
1 1 1   19   15    3 o  323.379   9.2351   80.124   4.5711   80.124   4.5711   0.0000   0.0000  323.379   9.2351  ?   ?  0.000000 9.235091 
1 1 1   19   15    4 o  212.613   10.472   34.647   3.4080   36.565   3.8123   27.021   7.6036  218.085   11.461  184.957   27.712 33.12775 29.98808 
1 1 1   19   15    5 o  1192.15   9.7460  1089.12   17.784  1084.14   21.408  1100.21   31.945  1189.06   11.763  1196.48   17.443 -7.410522 21.03859 
1 1 1   19   15    6 o  467.889   7.1885  167.665   5.1481  167.237   5.9003  169.032   10.537  467.236   8.2502  469.249   14.670 -2.012787 16.83108 
1 1 1   19   15    7 o  1077.05   9.1592  888.882   15.100  889.495   18.165  887.513   27.161  1077.13   11.018  1074.75   16.511 2.378784 19.84931 
1 1 1   19   15    8 o  332.117   6.9913   84.477   3.5540   84.934   3.8308   81.655   9.5219  332.995   7.5160  325.185   19.216 7.809601 20.63334 
1 1 1   19   15    9 o  389.423   6.6733  116.140   3.9777  116.530   4.3354  114.068   10.000  390.051   7.2617  385.211   16.960 4.839661 18.44965 
1 1 1   19   15   10 o  310.218   7.2338   73.712   3.4348   74.729   3.6984   67.330   9.2635  312.332   7.7362  294.893   20.653 17.43857 22.05478 
1 1 1   19   15   11 o  163.965   11.467   20.721   2.8597   20.362   3.0353   23.557   8.5299  162.445   12.299  170.968   33.793 -8.523300 35.96185 
1 1 1   19   15   12 o  467.384   6.5857  167.307   4.7113  165.836   5.1248  175.338   11.972  465.289   7.1959  477.534   16.379 -12.24438 17.89026 
1 1 1   19   15   13 o  863.039   8.8045  570.840   11.631  577.334   14.240  557.825   20.159  867.639   10.722  851.892   15.460 15.74689 18.81472 
1 1 1   19   15   14 o  267.892   11.870   55.072   4.8671   56.557   5.6878   51.011   9.4059  271.009   13.757  255.611   24.335 15.39891 27.95397 
1 1 1   19   15   15 o  357.693   6.9700   98.013   3.8161   98.919   4.1229   92.601   10.080  359.314   7.4965  346.061   19.105 13.25262 20.52286 
1 1 1   19   15   16 o  269.890   7.7847   55.818   3.2159   52.951   3.4173   78.003   9.5074  262.837   8.4943  317.359   19.669 -54.52179 21.42505 
1 1 1   19   15   17 o  398.510   7.5070  121.693   4.5791  121.693   4.5791   0.0000   0.0000  398.510   7.5070  ?   ?  0.000000 7.507034 
1 1 1   19   15   18 o  283.509   7.9755   61.607   3.4609   62.989   3.7050   52.140   9.6966  286.645   8.4444  257.995   24.863 28.64999 26.25764 
1 1 1   19   15   19 o  138.731   13.014   14.920   2.7311   14.581   2.8784   17.986   8.6495  137.002   13.919  147.883   38.006 -10.88098 40.47465 
1 1 1   19   15   20 o  105.309   17.409   8.7771   2.7081   9.4328   2.8471   2.5487   8.7750  109.220   17.631   92.937   38.263 16.28282 42.12980 
1 1 1   19   15   21 o  131.078   14.287   13.379   2.8201   13.808   2.9812   9.7316   8.6954  133.090   14.890  115.328   40.159 17.76231 42.83067 
1 1 1   19   15   22 o  412.459   10.057  130.591   6.3491  138.155   7.6867  114.351   11.264  423.988   11.845  384.445   19.141 39.54358 22.50963 
1 1 1   19   15   23 o  184.085   14.091   26.247   3.9402   26.264   5.7958   26.232   5.3728  182.811   21.101  183.048   19.476 -0.2378845 28.71465 
1 1 1   19   15   24 o  362.528   6.7528  100.736   3.7471   99.455   5.5249  101.827   5.0991  359.885   10.030  364.255   9.1457 -4.369873 13.57347 
1 1 1   19   15   25 o  374.149   6.2853  107.285   3.5995  107.090   5.0262  107.491   5.1572  373.558   8.7905  374.230   9.0033 -0.6726685 12.58305 
1 1 1   19   15   26 o  277.016   7.3786   58.850   3.1286   60.590   4.4529   57.153   4.3966  280.801   10.360  272.701   10.533 8.099457 14.77456 
1 1 1   19   15   27 o   79.360   19.934   5.0864   2.4182   6.6332   3.5439   3.7387   3.3080   90.530   24.830   72.052   24.788 18.47815 35.08488 
1 1 1   19   15   28 o  256.879   7.7974   50.633   3.0658   52.143   4.4781   49.300   4.2061  260.315   11.239  253.165   10.854 7.149902 15.62478 
1 1 1   19   15   29 o  100.226   26.262   8.2192   4.0774   10.340   6.4672   6.8203   5.2529  112.585   34.376   94.119   31.239 18.46559 46.44965 
1 1 1   19   15   30 o  144.671   13.234   16.288   2.8980   14.183   4.1959   18.208   4.0073  133.094   21.316  152.133   17.530 -19.03847 27.59844 
1 1 1   19   15   31 o  141.258   13.857   15.569   2.9574   18.168   5.0034   14.174   3.6665  150.587   22.389  133.713   18.402 16.87399 28.98099 
1 1 1   19   15   32 o  412.557   7.1920  130.643   4.5415  147.113   7.5467  121.291   5.6865  436.854   11.286  397.114   9.3553 39.74008 14.65950 
1 1 1   19   15   33 o  388.317   6.9853  115.745   4.1518  123.977   6.3686  109.660   5.4753  401.173   10.371  377.503   9.4758 23.67053 14.04844 
1 1 1   19   15   34 o  119.454   15.995   11.287   2.8512   14.097   4.5648   9.4897   3.6509  131.604   23.525  107.652   22.863 23.95189 32.80432 
1 1 1   19   15   35 o  341.240   7.5881   89.463   3.9634   92.307   6.0691   87.348   5.2334  345.763   11.468  336.667   10.156 9.095886 15.31820 
1 1 1   19   15   36 o  120.160   18.230   11.547   3.2476   8.3991   5.7194   13.044   3.9453  101.332   32.530  127.047   21.023 -25.71493 38.73198 
1 1 1   19   15   37 o  100.964   21.577   8.3579   3.2334   10.682   5.5158   7.1412   3.9911  112.283   31.051   92.903   26.668 19.37948 40.93138 
1 1 1   19   15   38 o  203.230   11.873   32.067   3.6772   26.269   5.8921   35.766   4.7063  180.776   21.730  213.956   14.456 -33.17906 26.09865 
1 1 1   19   15   39 o   42.940   20.093  -3.0547   3.2959  -6.1276   5.8168  -1.6016   4.0000   54.900   25.997   52.689   23.695 2.210346 35.17542 
1 1 1   19   15   40 o   81.267   26.684   5.2486   3.8365   19.348   6.3650  -2.7965   4.8081  151.646   28.467   55.152   25.260 96.49353 38.05840 
1 1 1   19   15   41 o  345.980   11.034   92.651   5.8435   86.817   7.6369  100.892   9.0761  333.339   14.968  358.535   16.539 -25.19611 22.30611 
1 1 1   19   15   42 o  132.149   21.856   14.308   4.2663   15.911   10.419   13.985   4.6763  131.551   44.006  129.600   24.471 1.951569 50.35241 
1 1 1   19   15   43 o  187.423   17.221   27.926   4.8850   25.809   6.6015   30.488   7.2625  176.490   25.149  191.942   25.339 -15.45207 35.70050 
1 1 1   19   15   44 o  131.454   20.354   14.115   3.9629   5.1346   6.3745   19.773   5.0595   86.992   33.652  155.333   21.887 -68.34113 40.14316 
1 1 1   19   15   45 o  148.988   18.386   17.917   4.1040   31.092   6.5848   9.5487   5.2479  194.584   22.526  104.348   30.763 90.23546 38.12817 
1 1 1   19   15   46 o   64.942   25.941   2.2083   3.8942   4.5785   5.8351   0.3049   5.2290   82.361   32.102   65.226   28.291 17.13470 42.78951 
1 1 1   19   15   47 o  279.557   14.902   61.902   6.3536   0.0000   0.0000   61.902   6.3536  ?   ?   279.557   14.902 0.000000 14.90226 
1 1 1   19   15   48 o   51.436   23.620  -2.2801   4.2421   3.3006   7.0970  -5.3826   5.2915   81.236   34.010   51.617   24.545 29.61864 41.94168 
1 1 1   19   15   49 o   88.521   27.449   6.8945   4.1053  -1.6460   6.2212   13.482   5.4638   64.245   29.157  121.849   29.591 -57.60371 41.54217 
1 1 1   19   15   50 o   79.166   27.109   5.3485   3.9548   6.5282   5.8113   4.3308   5.3975   87.377   32.510   77.803   30.710 9.573456 44.72117 
1 1 1   19   15   51 o   67.805   24.452   3.6501   3.2469   3.4721   5.6099   3.7397   3.9815   74.560   30.633   70.437   26.758 4.122620 40.67409 
1 1 1   19   15   52 o  180.019   13.598   26.000   3.7192   18.806   5.5481   31.872   5.0121  144.407   26.060  197.115   16.772 -52.70813 30.99028 
1 1 1   19   16    0 o  1019.89   15.466  798.008   24.130  798.008   24.130  798.008   24.130  1019.89   15.466  1019.89   15.466 0.000000 0.000000 
1 1 1   19   16    1 o  301.971   9.4954   69.879   4.3888   69.879   4.3888   0.0000   0.0000  301.971   9.4954  ?   ?  0.000000 9.495375 
1 1 1   19   16    2 o  360.050   9.1119   99.335   5.0216   99.335   5.0216   0.0000   0.0000  360.050   9.1119  ?   ?  0.000000 9.111870 
1 1 1   19   16    3 o  767.326   7.7023  451.010   9.0462  435.332   10.525  495.332   17.697  753.737   9.1231  803.257   14.394 -49.51990 17.04165 
1 1 1   19   16    4 o  505.058   7.1818  195.372   5.5519  191.465   6.4199  206.961   11.057  499.911   8.3901  519.261   13.911 -19.34985 16.24560 
1 1 1   19   16    5 o  433.270   7.4492  143.791   4.9402  143.570   5.6865  144.468   9.9753  432.878   8.5824  433.718   15.026 -0.8402405 17.30439 
1 1 1   19   16    6 o  579.888   7.2989  257.569   6.4785  250.445   7.4041  280.842   13.381  571.729   8.4608  604.775   14.456 -33.04614 16.74960 
1 1 1   19   16    7 o  254.708   9.1433   49.718   3.5646   50.867   3.9057   43.990   8.7223  257.603   9.9056  237.399   24.348 20.20399 26.28625 
1 1 1   19   16    8 o  299.125   7.5769   68.543   3.4691   69.660   3.7486   61.881   9.1551  301.531   8.1222  282.496   21.330 19.03534 22.82424 
1 1 1   19   16    9 o  412.059   6.6826  130.045   4.2148  133.766   4.6462  112.751   10.016  417.884   7.2639  382.868   17.091 35.01569 18.57078 
1 1 1   19   16   10 o  252.044   9.2435   48.691   3.5660   49.454   3.8902   44.677   8.9226  253.978   10.007  239.077   24.741 14.90121 26.68813 
1 1 1   19   16   11 o  937.295   8.7551  673.300   12.560  668.157   14.886  686.011   23.403  933.433   10.419  944.482   16.189 -11.04913 19.25163 
1 1 1   19   16   12 o  422.780   6.8146  136.917   4.4099  135.912   4.7789  142.680   11.445  421.192   7.4127  430.528   17.368 -9.336517 18.88351 
1 1 1   19   16   13 o  703.982   8.4239  379.825   9.0770  375.679   10.795  389.828   16.769  699.915   10.077  712.007   15.387 -12.09186 18.39305 
1 1 1   19   16   14 o  334.541   10.213   85.840   5.2297   84.815   6.0374   88.921   10.467  332.410   11.866  338.808   20.276 -6.398163 23.49288 
1 1 1   19   16   15 o  379.123   9.4532  110.219   5.4857  109.509   6.4425  112.092   10.461  377.755   11.142  381.358   17.922 -3.602905 21.10325 
1 1 1   19   16   16 o  354.610   7.6488   96.367   4.1516   96.367   4.1516   0.0000   0.0000  354.610   7.6488  ?   ?  0.000000 7.648766 
1 1 1   19   16   17 o  180.593   10.352   25.107   2.8497   26.783   2.9842   7.7523   9.6006  186.529   10.495  111.451   41.723 75.07852 43.02236 
1 1 1   19   16   18 o  428.160   6.9364  140.472   4.5458  138.887   4.9120  149.927   11.997  425.690   7.5388  440.816   17.781 -15.12625 19.31293 
1 1 1   19   16   19 o  484.165   6.8966  179.634   5.1109  177.909   5.5417  189.455   13.221  481.776   7.5150  495.501   17.432 -13.72522 18.98277 
1 1 1   19   16   20 o   79.221   20.152   5.0449   2.4494   5.2845   2.5345   1.6574   9.5310   81.052   20.435   93.713   39.333 -12.66072 44.32441 
1 1 1   19   16   21 f  309.284   9.5156   73.408   4.5047   79.432   6.4572   67.697   6.2874  321.327   13.129  296.557   13.851 24.77051 19.08472 
1 1 1   19   16   22 o  228.597   16.704   40.558   5.8042   0.0000   0.0000   40.558   5.8042  ?   ?   228.597   16.704 0.000000 16.70393 
1 1 1   19   16   23 o  537.461   6.4966  221.387   5.3445  222.987   6.5960  218.329   9.1192  539.202   7.9921  532.992   11.178 6.209595 13.74128 
1 1 1   19   16   24 o  284.705   8.3317   62.188   3.6308   67.252   4.5755   53.579   5.9663  295.896   10.103  263.139   14.874 32.75687 17.98068 
1 1 1   19   16   25 o  201.751   8.7384   31.242   2.6985   35.009   3.7785   27.321   3.8551  213.017   11.633  187.814   13.500 25.20291 17.82067 
1 1 1   19   16   26 o   93.462   16.778   6.9607   2.3120   7.9610   3.2002   5.8685   3.3440   99.192   21.683   85.456   24.372 13.73610 32.62165 
1 1 1   19   16   27 o  262.265   7.5232   52.769   3.0200   57.541   4.3530   48.340   4.1935  273.565   10.396  250.680   10.929 22.88498 15.08366 
1 1 1   19   16   28 o  278.060   11.458   59.529   4.8767   59.443   7.5364   59.591   6.3963  276.106   17.930  277.188   15.133 -1.082184 23.46258 
1 1 1   19   16   29 o  285.781   8.3439   62.718   3.6498   57.624   5.3297   67.217   5.0085  273.309   12.740  295.469   11.075 -22.16013 16.88092 
1 1 1   19   16   30 o  161.451   11.977   20.207   2.9387   18.078   4.5857   21.691   3.8281  150.783   20.393  166.684   15.171 -15.90176 25.41661 
1 1 1   19   16   31 o  181.741   10.528   25.520   2.9162   22.275   4.3843   28.094   3.9054  168.361   17.257  190.158   13.505 -21.79805 21.91357 
1 1 1   19   16   32 o  193.434   10.256   28.896   3.0257   32.482   4.6513   26.266   3.9838  204.112   14.993  183.597   14.289 20.51530 20.71115 
1 1 1   19   16   33 o  306.516   7.7258   72.176   3.6246   72.101   5.3784   72.239   4.9061  305.654   11.496  306.165   10.469 -0.5103149 15.54878 
1 1 1   19   16   34 o  245.051   9.0918   46.210   3.4102   49.557   5.2125   43.706   4.5090  252.583   13.532  237.436   12.450 15.14748 18.38806 
1 1 1   19   16   35 o  212.805   10.209   34.910   3.3252   33.488   5.2296   35.876   4.3082  206.548   16.684  214.824   13.166 -8.275864 21.25325 
1 1 1   19   16   36 o   76.356   23.952   4.6384   3.1157   3.6656   5.3847   5.1280   3.8201   79.524   30.882   80.938   26.629 -1.413795 40.77794 
1 1 1   19   16   37 o  136.128   16.067   14.653   3.2832   20.872   5.5046   11.219   4.0905  160.431   23.081  116.651   23.718 43.77993 33.09452 
1 1 1   19   16   38 o  159.813   14.348   20.027   3.4722   19.410   5.6814   20.394   4.3868  153.697   25.010  160.133   18.222 -6.436462 30.94454 
1 1 1   19   16   39 f  178.442   15.110   25.016   4.0882   27.574   5.9306   22.699   5.6432  185.140   21.317  167.254   22.624 17.88597 31.08513 
1 1 1   19   16   40 o  187.053   13.157   27.328   3.7430   21.695   6.0319   30.856   4.7732  162.192   25.108  197.928   15.889 -35.73569 29.71377 
1 1 1   19   16   41 o  312.406   11.572   75.656   5.5332   85.176   11.528   72.807   6.3073  324.474   23.368  305.772   13.476 18.70132 26.97526 
1 1 1   19   16   42 o  118.826   26.616   11.977   4.7206   14.895   6.3822   8.4514   7.0143  130.448   32.167  101.708   36.018 28.73998 48.29083 
1 1 1   19   16   43 o  197.462   13.898   30.611   4.1738   22.740   6.7540   35.473   5.3088  163.796   27.942  211.573   16.524 -47.77773 32.46250 
1 1 1   19   16   44 o   68.382   26.193   2.9464   3.8350  -0.5883   6.5059   4.8285   4.7475   69.853   30.888   80.609   29.490 -10.75683 42.70509 
1 1 1   19   16   45 o  213.329   13.012   35.707   4.2286   30.211   6.4638   39.818   5.5910  191.538   22.475  223.718   16.443 -32.18053 27.84743 
1 1 1   19   16   46 o  154.089   18.196   19.236   4.2089   13.852   6.6136   22.901   5.4564  122.650   34.031  166.310   21.973 -43.65970 40.50840 
1 1 1   19   16   47 o   61.930   25.961   1.2345   4.1437   0.0507   6.5142   2.0389   5.3703   70.330   31.013   70.884   29.622 -0.5538788 42.88648 
1 1 1   19   16   48 o   97.419   26.101   8.3514   3.9705   9.3239   5.7500   7.4650   5.4893  101.053   32.635   92.347   31.922 8.705559 45.65154 
1 1 1   19   16   49 o   46.955   21.974  -3.0928   3.9437  -2.9027   5.8410  -3.2520   5.3463   59.225   27.383   55.708   25.909 3.517124 37.69722 
1 1 1   19   16   50 o  171.835   16.043   23.953   4.1709   20.273   5.7997   27.895   6.0025  151.371   25.967  181.177   22.103 -29.80598 34.10031 
1 1 1   19   16   51 o   94.718   26.735   8.2409   4.0455   3.8771   5.5922   13.032   5.8595   75.542   30.758  115.553   32.022 -40.01120 44.40117 
1 1 1   19   16   52 o   82.488   28.097   6.2028   4.2481   2.1000   5.4567   12.515   6.7685   68.632   29.321  109.579   35.410 -40.94650 45.97392 
1 1 1   19   17    1 o  506.452   8.9464  196.559   6.9351  191.055   9.1859  203.855   10.576  499.043   12.026  515.339   13.408 -16.29553 18.01068 
1 1 1   19   17    2 o  774.177   7.7945  459.157   9.2363  448.931   10.936  484.603   17.251  765.339   9.3354  794.408   14.187 -29.06915 16.98311 
1 1 1   19   17    3 o  216.124   10.713   35.817   3.5441   35.279   4.0291   37.656   7.4507  214.073   12.349  219.768   22.465 -5.694031 25.63550 
1 1 1   19   17    4 o  128.224   16.787   12.856   3.2156   12.644   3.5916   13.713   7.2189  126.753   19.106  130.309   35.313 -3.556236 40.14997 
1 1 1   19   17    5 o   54.825   22.490   0.7670   3.0177   0.5160   3.3046   2.0273   7.4047   55.929   23.293   85.763   35.210 -29.83478 42.21762 
1 1 1   19   17    6 o  274.456   8.9553   57.730   3.7620   58.279   4.1865   55.425   8.5742  275.714   9.9203  267.242   21.134 8.472076 23.34638 
1 1 1   19   17    7 o  356.841   7.9617   97.564   4.3486   99.531   4.9143   90.464   9.3359  360.369   8.9093  342.361   17.878 18.00824 19.97476 
1 1 1   19   17    8 o  164.855   11.591   20.953   2.9061   22.850   3.1098   7.8803   8.1637  172.161   11.874  108.053   38.794 64.10759 40.57022 
1 1 1   19   17    9 o  505.375   7.6154  195.682   5.8908  196.970   6.7799  191.714   11.899  506.947   8.7376  499.344   15.569 7.602722 17.85316 
1 1 1   19   17   10 o  171.563   12.244   22.707   3.1943   22.178   3.4354   26.080   8.6788  169.413   13.357  180.077   32.691 -10.66379 35.31421 
1 1 1   19   17   11 o  375.266   7.0380  107.885   4.0426  108.190   4.4053  106.257   10.173  375.761   7.6595  371.394   17.896 4.367126 19.46601 
1 1 1   19   17   12 o  366.611   7.1278  102.972   3.9997  105.011   4.3471   91.725   10.211  370.190   7.6719  344.273   19.457 25.91672 20.91466 
1 1 1   19   17   13 o  195.313   14.295   29.482   4.2437   31.933   4.8970   22.089   8.5038  203.092   15.880  164.751   34.812 38.34030 38.26318 
1 1 1   19   17   14 o  270.833   11.596   56.311   4.8069   64.270   5.5426   32.159   9.6550  289.266   12.518  200.141   32.643 89.12543 34.96064 
1 1 1   19   17   15 o  323.829   11.926   80.532   5.9114   80.532   5.9114   0.0000   0.0000  323.829   11.926  ?   ?  0.000000 11.92623 
1 1 1   19   17   16 o  196.745   17.187   30.069   5.1238   30.069   5.1238   0.0000   0.0000  196.745   17.187  ?   ?  0.000000 17.18711 
1 1 1   19   17   17 o  454.010   9.2233  158.109   6.4095  158.241   7.4637  157.738   12.509  454.016   10.740  452.024   18.079 1.992676 21.02896 
1 1 1   19   17   18 o  166.078   10.644   21.262   2.6916   21.444   2.8035   19.115   9.6239  166.745   11.047  151.891   40.611 14.85376 42.08619 
1 1 1   19   17   19 o  218.923   14.717   37.077   4.9027   34.911   5.5638   44.602   10.370  211.961   17.300  236.795   29.232 -24.83441 33.96807 
1 1 1   19   17   20 o  406.994   10.010  127.162   6.2358  128.729   7.2746  122.821   12.109  409.275   11.612  398.184   19.868 11.09131 23.01263 
1 1 1   19   17   21 o  279.766   8.1806   60.031   3.5031   60.001   3.7281   60.253   10.238  279.657   8.7095  276.908   24.404 2.748993 25.91197 
1 1 1   19   17   22 o  245.135   8.0968   46.092   3.0380   45.283   3.5555   48.281   5.8475  242.866   9.5646  249.697   15.375 -6.831238 18.10701 
1 1 1   19   17   23 o  275.728   8.2672   58.328   3.4891   58.800   4.2746   57.386   6.0393  276.672   10.094  272.409   14.537 4.263092 17.69756 
1 1 1   19   17   24 o   45.130   19.481  -0.2396   2.4554   1.6100   2.8334  -5.8182   4.9208   57.406   22.371   50.188   23.808 7.218578 32.66962 
1 1 1   19   17   25 o  371.254   7.2183  105.707   4.1018  109.198   5.0342   98.813   7.0749  377.150   8.7206  358.110   12.907 19.03992 15.57713 
1 1 1   19   17   26 o  292.656   7.9944   65.729   3.5811   64.473   4.3481   68.377   6.3138  289.646   9.8077  297.672   13.857 -8.026093 16.97703 
1 1 1   19   17   27 o  562.526   9.4468  243.169   8.1339  259.666   15.315  236.688   9.5997  578.512   17.296  554.486   11.311 24.02594 20.66591 
1 1 1   19   17   28 o  248.646   8.6813   47.491   3.3040   45.791   4.6985   49.154   4.6470  243.329   12.659  252.533   12.022 -9.203949 17.45800 
1 1 1   19   17   29 o  367.750   7.1048  103.774   3.9992  119.245   5.7371   89.152   5.5777  393.798   9.5181  340.287   10.709 53.51132 14.32726 
1 1 1   19   17   30 o   40.049   18.208  -1.4343   2.4402  -2.8767   3.6494  -0.2679   3.2817   46.703   21.611   52.007   22.485 -5.303837 31.18674 
1 1 1   19   17   31 o  326.094   7.1761   81.632   3.5818   82.695   5.2161   80.684   4.9271  327.658   10.401  323.738   9.9433 3.919830 14.38893 
1 1 1   19   17   32 o  178.046   10.702   24.522   2.9029   25.572   4.3493   23.679   3.8983  180.699   15.887  174.105   14.768 6.594040 21.69024 
1 1 1   19   17   33 o  172.245   11.251   22.990   2.9500   22.125   4.3221   23.744   4.0363  167.607   17.086  174.166   15.296 -6.558334 22.93257 
1 1 1   19   17   34 o   87.693   21.115   6.2996   2.8002   6.6545   4.4354   6.0645   3.6108   90.781   28.594   86.273   25.540 4.508041 38.33983 
1 1 1   19   17   35 o  167.257   12.971   21.797   3.2947   17.909   5.2707   24.291   4.2211  148.223   24.056  175.878   15.850 -27.65540 28.80874 
1 1 1   19   17   36 o  170.641   12.740   22.682   3.3037   20.960   5.1367   23.896   4.3144  161.472   21.303  174.208   16.372 -12.73564 26.86785 
1 1 1   19   17   37 o   93.412   23.856   7.2427   3.4229   7.5892   4.9856   6.9338   4.7079   96.013   30.324   92.263   29.502 3.750526 42.30737 
1 1 1   19   17   38 o  123.933   20.187   12.439   3.6975   17.180   5.5591   8.6776   4.9515  143.803   26.223  101.481   29.872 42.32211 39.74843 
1 1 1   19   17   39 o   62.033   24.131   2.1014   3.2922   5.5021   5.5248   0.2289   4.0996   86.942   31.812   59.235   25.364 27.70728 40.68558 
1 1 1   19   17   40 o  295.392   10.000   67.409   4.5215   68.464   6.6882   66.522   6.1362  296.066   14.759  292.238   13.718 3.827576 20.14957 
1 1 1   19   17   41 o  203.712   19.610   33.240   6.0391   22.328   10.033   39.441   7.5627  155.130   41.459  220.423   22.742 -65.29309 47.28672 
1 1 1   19   17   42 o  252.535   10.900   49.424   4.2131   44.680   6.6587   52.591   5.4407  236.693   18.527  259.200   13.763 -22.50633 23.07972 
1 1 1   19   17   43 o  241.625   11.528   45.359   4.2635   37.122   6.7091   50.938   5.5217  214.202   20.722  254.697   14.221 -40.49500 25.13240 
1 1 1   19   17   44 o  212.095   12.796   35.246   4.1345   29.049   6.3498   39.806   5.4475  187.922   22.524  224.021   15.992 -36.09975 27.62415 
1 1 1   19   17   45 f   89.483   26.337   6.8740   3.8493   5.0255   5.9703   8.1891   5.0358   84.343   32.584   96.817   30.464 -12.47447 44.60663 
1 1 1   19   17   46 o  166.952   16.017   22.310   4.0426   31.031   6.1071   15.509   5.3935  194.368   20.853  133.376   27.338 60.99188 34.38348 
1 1 1   19   17   47 o  128.609   22.124   13.923   4.1980   22.501   6.8412   8.7419   5.3168  159.581   29.079   98.642   31.332 60.93884 42.74706 
1 1 1   19   17   48 o   96.530   27.069   8.3039   4.1613   0.3663   5.9623   15.843   5.8105   67.891   29.812  132.332   29.446 -64.44067 41.90240 
1 1 1   19   17   49 o   69.745   26.663   3.5027   3.9689   5.3114   5.5934   1.6686   5.6326   81.992   31.577   69.479   29.739 12.51257 43.37688 
1 1 1   19   17   50 f  164.218   16.273   21.985   4.0365   10.812   5.4846   35.188   5.9622  106.013   31.499  205.798   19.147 -99.78523 36.86174 
1 1 1   19   17   51 f   44.831   21.175  -3.3456   3.8140  -7.2568   5.2914   0.8838   5.5025   47.323   23.008   65.468   28.696 -18.14522 36.78138 
1 1 1   19   18    0 o  268.474   16.411   55.914   6.6859   55.914   6.6859   55.914   6.6859  268.474   16.411  268.474   16.411 0.000000 0.000000 
1 1 1   19   18    1 o  320.418   10.892   78.747   5.3420   77.260   7.3892   80.375   7.7320  317.044   15.227  323.336   15.623 -6.291992 21.81597 
1 1 1   19   18    2 o  751.291   9.5919  432.717   11.030  408.181   14.668  464.650   16.733  729.129   13.143  777.751   14.056 -48.62189 19.24375 
1 1 1   19   18    3 o  302.996   11.020   70.422   5.1109   68.187   6.5470   73.909   8.1779  297.911   14.358  309.408   17.338 -11.49658 22.51108 
1 1 1   19   18    4 o  711.711   7.7062  388.097   8.3949  375.130   9.8118  423.522   16.217  699.556   9.1634  742.461   14.270 -42.90479 16.95901 
1 1 1   19   18    5 o  454.386   7.4839  158.184   5.2050  159.614   6.0245  153.974   10.337  456.354   8.6248  447.554   15.089 8.800385 17.38028 
1 1 1   19   18    6 o  256.720   9.4588   50.528   3.7168   47.685   4.1469   62.135   8.3806  249.325   10.866  283.226   19.450 -33.90060 22.27938 
1 1 1   19   18    7 o  201.461   11.149   31.234   3.4245   32.241   3.7687   26.465   8.2024  204.593   12.088  181.917   30.540 22.67578 32.84515 
1 1 1   19   18    8 f  444.248   7.8363  151.232   5.3285  150.585   6.1711  153.126   10.564  443.199   9.0969  446.200   15.468 -3.001221 17.94437 
1 1 1   19   18    9 o  117.369   15.732   10.784   2.7550   10.236   2.9345   14.861   8.0020  114.011   17.364  135.240   37.400 -21.22955 41.23461 
1 1 1   19   18   10 o  201.290   9.6926   31.073   2.9863   29.524   3.1879   42.173   8.5335  195.876   10.673  232.006   24.396 -36.12964 26.62835 
1 1 1   19   18   11 o  231.980   8.7721   41.257   3.1147   39.960   3.3123   51.171   9.1558  228.270   9.4801  255.909   23.642 -27.63971 25.47158 
1 1 1   19   18   12 o  268.622   8.1278   55.309   3.3418   56.954   3.5866   44.479   9.2041  272.561   8.5970  237.919   25.682 34.64192 27.08238 
1 1 1   19   18   13 o  390.579   9.1720  116.991   5.4833  115.221   6.4159  121.786   10.561  387.458   10.818  397.450   17.360 -9.991516 20.45472 
1 1 1   19   18   14 o  322.223   10.548   79.687   5.2025   91.506   6.0273   45.147   10.303  345.211   11.407  238.763   28.773 106.4486 30.95126 
1 1 1   19   18   15 o   86.157   29.240   5.4170   4.6007   5.4170   4.6007   0.0000   0.0000   86.157   29.240  ?   ?  0.000000 29.24040 
1 1 1   19   18   16 o  616.349   8.7232  291.348   8.2295  300.443   9.8892  270.866   14.841  625.630   10.327  592.715   16.358 32.91547 19.34539 
1 1 1   19   18   17 o  224.585   13.769   38.958   4.7103   43.294   5.3381   23.708   10.011  236.635   14.813  169.050   39.415 67.58459 42.10670 
1 1 1   19   18   18 o  368.654   10.141  104.335   5.7221  101.535   6.5967  112.845   11.499  363.466   11.858  381.241   19.774 -17.77576 23.05703 
1 1 1   19   18   19 f  484.031   9.3592  179.802   6.9339  186.271   8.3031  164.891   12.605  492.399   11.017  461.845   17.831 30.55466 20.96001 
1 1 1   19   18   20 o  358.597   7.4808   98.597   4.1060   99.063   4.3825   95.245   11.747  359.399   7.9666  349.283   22.086 10.11667 23.47865 
1 1 1   19   18   21 o  231.512   9.2535   41.143   3.2791   41.806   3.4660   35.491   10.120  233.335   9.7047  209.254   32.664 24.08083 34.07564 
1 1 1   19   18   22 o  132.229   13.006   13.592   2.5983   13.601   2.9916   13.565   5.2422  131.918   15.087  129.048   27.387 2.870453 31.26807 
1 1 1   19   18   23 o  224.194   8.5992   38.578   2.9509   36.853   3.4272   43.522   5.8021  218.993   10.225  236.740   16.108 -17.74716 19.07866 
1 1 1   19   18   24 o  190.058   10.415   27.851   3.0183   29.065   3.6180   25.072   5.4740  193.898   12.254  178.367   20.418 15.53078 23.81274 
1 1 1   19   18   25 o   81.139   21.227   5.3248   2.6665   4.4769   3.1235   7.6028   5.1197   75.948   24.004   97.834   30.706 -21.88622 38.97458 
1 1 1   19   18   26 f  293.674   12.312   66.469   5.5341   76.817   10.454   62.440   6.5232  312.601   21.988  283.751   15.073 28.85025 26.65833 
1 1 1   19   18   27 o  287.225   8.4362   63.359   3.7088   67.148   4.5524   55.882   6.3958  295.468   10.066  268.158   15.650 27.30954 18.60818 
1 1 1   19   18   28 o  568.035   6.4862  247.485   5.6394  254.667   7.5662  238.509   8.4588  575.740   8.5859  556.816   9.9249 18.92468 13.12330 
1 1 1   19   18   29 o  171.325   10.321   22.679   2.6939   24.419   3.7964   20.914   3.8231  177.092   14.123  163.516   15.459 13.57585 20.93881 
1 1 1   19   18   30 o  145.198   11.711   16.369   2.5805   14.028   3.7776   18.418   3.5334  132.669   19.158  153.347   15.257 -20.67802 24.49048 
1 1 1   19   18   31 o  203.327   9.3486   31.813   2.9095   32.055   4.1815   31.587   4.0508  203.058   13.531  201.641   13.198 1.417435 18.90169 
1 1 1   19   18   32 o   50.504   20.480   0.8930   2.4671  -2.0462   3.7471   3.1422   3.2780   49.696   22.583   67.967   24.559 -18.27134 33.36382 
1 1 1   19   18   33 o  202.033   9.6816   31.438   2.9939   28.576   4.3600   33.992   4.1184  191.199   15.019  209.172   12.927 -17.97267 19.81583 
1 1 1   19   18   34 o  184.341   11.367   26.346   3.1916   30.452   4.8479   23.205   4.2400  196.982   16.223  171.755   16.325 25.22684 23.01484 
1 1 1   19   18   35 o   64.484   24.025   2.6394   3.1759   1.4046   5.0048   3.4719   4.1093   69.177   28.726   73.167   27.315 -3.990654 39.63950 
1 1 1   19   18   36 o  232.971   11.046   41.941   3.9388   46.111   5.5255   37.633   5.6162  242.881   14.935  218.668   16.911 24.21333 22.56236 
1 1 1   19   18   37 o  307.159   8.7392   72.666   4.1087   77.671   6.4389   69.228   5.3363  316.244   13.302  299.067   11.657 17.17758 17.68725 
1 1 1   19   18   38 o   87.172   23.493   6.3071   3.2054   4.3904   5.1999   7.4818   4.0710   81.211   30.644   94.522   26.868 -13.31033 40.75494 
1 1 1   19   18   39 o  257.104   10.244   51.082   4.0312   47.237   6.1639   53.956   5.3287  244.831   16.545  263.059   13.277 -18.22783 21.21397 
1 1 1   19   18   40 o  301.288   16.588   71.539   7.6201   64.122   10.767   78.982   10.786  279.813   25.417  312.773   22.685 -32.95963 34.06740 
1 1 1   19   18   41 o  254.328   10.710   50.093   4.1691   55.989   6.5455   46.069   5.4081  266.448   16.125  242.243   14.655 24.20486 21.78949 
1 1 1   19   18   42 o  235.156   11.468   42.941   4.1278   48.884   6.6306   39.181   5.2746  247.933   17.586  222.774   15.567 25.15953 23.48612 
1 1 1   19   18   43 o  251.829   11.390   49.295   4.3902   38.865   6.8492   56.568   5.7196  218.947   20.683  268.389   13.971 -49.44215 24.95949 
1 1 1   19   18   44 o   63.342   25.055   2.1834   3.5996   3.5724   5.7993   1.3129   4.5911   78.624   31.568   65.121   27.314 13.50291 41.74421 
1 1 1   19   18   45 o  294.511   10.021   67.332   4.5174   61.879   6.5631   72.241   6.2272  279.272   15.413  303.367   13.411 -24.09518 20.43083 
1 1 1   19   18   46 o  161.428   17.208   21.045   4.1864   28.513   6.8192   16.528   5.3034  183.307   24.953  138.318   26.005 44.98917 36.03990 
1 1 1   19   18   47 o  222.307   13.387   39.076   4.5339   30.214   6.6751   46.665   6.1775  189.109   23.573  240.798   16.867 -51.68912 28.98561 
1 1 1   19   18   48 o  155.939   20.106   20.257   4.6872   7.3099   8.4690   25.975   5.6278   94.514   38.077  175.967   21.331 -81.45324 43.64495 
1 1 1   19   18   49 o  185.722   14.789   27.740   4.1692   22.784   5.8385   32.898   5.9556  161.785   24.330  198.644   19.853 -36.85858 31.40248 
1 1 1   19   18   50 o  106.212   24.917   10.152   3.9809   8.3632   5.5294   12.077   5.7360   93.611   32.054  111.118   31.993 -17.50713 45.28822 
1 1 1   19   18   51 o   66.648   27.530   2.5263   4.5622   2.1999   5.5873   3.1792   7.9025   69.432   29.667   79.153   34.550 -9.721436 45.53917 
1 1 1   19   19    0 o  371.846   14.576  106.539   8.2668  106.539   8.2668  106.539   8.2668  371.846   14.576  371.846   14.576 0.000000 0.000000 
1 1 1   19   19    1 o  744.178   9.5062  424.631   10.828  423.898   15.119  425.404   15.515  742.865   13.297  744.116   13.622 -1.250488 19.03598 
1 1 1   19   19    2 o  199.292   11.523   30.582   3.5001   28.990   4.0557   35.228   6.9282  193.760   13.765  212.443   21.607 -18.68269 25.61884 
1 1 1   19   19    3 o  566.252   7.3675  245.673   6.3856  242.222   7.5214  254.583   12.084  562.129   8.7417  575.615   13.716 -13.48682 16.26479 
1 1 1   19   19    4 o  708.491   7.6680  384.640   8.3155  377.261   9.8824  402.534   15.389  701.468   9.2042  723.747   13.892 -22.27899 16.66427 
1 1 1   19   19    5 o  641.490   9.5526  315.557   9.3795  320.371   12.874  310.112   13.693  645.817   13.024  635.195   14.084 10.62109 19.18261 
1 1 1   19   19    6 o  516.073   9.5594  204.238   7.5511  202.726   10.149  206.114   11.301  513.733   12.907  517.799   14.259 -4.066162 19.23317 
1 1 1   19   19    7 o  853.226   15.053  559.990   19.659   0.0000   0.0000  559.990   19.659  ?   ?   853.226   15.053 0.000000 15.05349 
1 1 1   19   19    8 o  522.565   8.2372  209.315   6.5886  210.220   7.8977  207.243   11.949  523.518   9.8559  519.027   15.041 4.490479 17.98214 
1 1 1   19   19    9 o  153.326   16.718   18.321   3.8598   17.337   4.3898   21.675   8.1036  148.550   19.799  163.315   33.540 -14.76538 38.94828 
1 1 1   19   19   10 o  196.179   13.583   29.726   4.0535   27.264   4.6207   37.948   8.4437  187.449   16.266  219.512   25.612 -32.06236 30.34087 
1 1 1   19   19   11 o  331.549   9.9471   84.336   5.0479   85.326   5.9008   81.636   9.7475  333.342   11.565  324.437   19.722 8.905365 22.86319 
1 1 1   19   19   12 o  122.411   21.891   11.950   3.9510   11.997   4.5439   11.802   7.9999  122.041   25.161  122.145   38.390 -0.1034470 45.90096 
1 1 1   19   19   13 o  123.675   22.090   12.204   4.0281   11.564   4.4653   15.002   9.3349  119.737   25.163  136.100   41.243 -16.36268 48.31349 
1 1 1   19   19   14 o  179.808   18.197   25.221   4.9391   25.221   4.9391   0.0000   0.0000  179.808   18.197  ?   ?  0.000000 18.19675 
1 1 1   19   19   15 o  218.773   13.609   36.966   4.5344   35.679   5.1019   41.806   9.8926  214.596   15.640  229.303   28.823 -14.70732 32.79264 
1 1 1   19   19   16 o  159.744   18.086   19.967   4.3443   18.072   4.8481   27.689   9.7871  151.153   21.567  183.746   36.087 -32.59315 42.04014 
1 1 1   19   19   17 o  255.715   12.712   50.299   4.9757   48.837   5.6586   55.284   10.448  251.323   14.775  264.738   26.125 -13.41519 30.01328 
1 1 1   19   19   18 f  287.765   11.929   63.671   5.2542   65.951   6.0868   57.006   10.407  292.668   13.588  268.904   25.595 23.76431 28.97768 
1 1 1   19   19   19 o  203.307   15.800   32.093   4.8781   33.649   5.5704   26.974   10.103  207.840   17.678  180.314   37.814 27.52623 41.74179 
1 1 1   19   19   20 o   82.770   18.875   5.5184   2.3383   4.8018   2.4074   17.458   9.8266   77.232   20.152  144.636   41.941 -67.40375 46.53165 
1 1 1   19   19   21 o  290.086   8.9401   64.597   3.9695   64.584   4.2720   64.676   10.741  289.987   9.6246  286.399   24.744 3.588379 26.55001 
1 1 1   19   19   22 o  326.679   9.8400   81.990   4.9202   80.996   5.3624   87.283   12.374  324.565   10.794  332.916   24.453 -8.351227 26.72978 
1 1 1   19   19   23 o  162.895   11.416   20.517   2.8283   21.581   3.3012   17.581   5.4838  166.834   13.031  147.713   25.156 19.12134 28.33113 
1 1 1   19   19   24 o  229.605   8.7682   40.484   3.0815   39.560   3.5532   43.288   6.1892  226.829   10.234  235.659   17.279 -8.830444 20.08241 
1 1 1   19   19   25 o  196.395   14.308   29.958   4.2716   31.009   6.1933   29.004   5.8993  198.280   20.712  191.777   20.411 6.503433 29.07925 
1 1 1   19   19   26 o  179.204   10.608   24.801   2.8967   23.917   3.3544   27.392   5.7445  175.651   12.559  186.187   20.497 -10.53572 24.03866 
1 1 1   19   19   27 o   77.740   22.525   4.8547   2.8354   7.2040   3.1808  -4.2333   6.2562   93.951   22.429   62.049   28.563 31.90205 36.31733 
1 1 1   19   19   28 o  133.653   14.448   13.987   2.9086   14.240   3.3862   13.276   5.6803  134.337   16.838  126.188   29.872 8.149124 34.29127 
1 1 1   19   19   29 o  457.638   6.3943  160.674   4.4790  162.723   6.3311  158.620   6.3375  459.999   8.9920  454.133   9.1172 5.866699 12.80546 
1 1 1   19   19   30 o  272.347   7.8013   56.982   3.2521   58.917   4.5262   54.916   4.6757  276.473   10.696  266.782   11.450 9.690186 15.66874 
1 1 1   19   19   31 o  252.522   8.1692   49.014   3.1575   52.248   4.5042   45.890   4.4277  260.203   11.309  243.757   11.867 16.44704 16.39302 
1 1 1   19   19   32 o  159.647   11.529   19.782   2.7984   19.125   4.0725   20.370   3.8518  155.575   17.400  161.039   15.831 -5.463654 23.52412 
1 1 1   19   19   33 f  209.025   9.7365   33.665   3.1151   29.002   4.3254   38.689   4.4900  192.624   14.783  223.074   13.209 -30.45001 19.82473 
1 1 1   19   19   34 o  194.784   12.241   29.474   3.6310   27.805   5.1019   31.187   5.1688  187.550   17.993  199.004   17.136 -11.45436 24.84754 
1 1 1   19   19   35 o  172.484   18.217   23.601   4.7368   23.601   4.7368   0.0000   0.0000  172.484   18.217  ?   ?  0.000000 18.21742 
1 1 1   19   19   36 o  243.970   9.7295   45.909   3.6333   45.171   5.3625   46.536   4.9399  240.401   14.643  244.477   13.251 -4.075974 19.74851 
1 1 1   19   19   37 o  197.887   11.470   30.411   3.4593   31.870   5.2888   29.320   4.5733  200.746   17.384  193.102   15.606 7.644180 23.36145 
1 1 1   19   19   38 o   59.507   23.368   1.8220   3.1101   1.7262   4.8297   1.8900   4.0652   68.926   28.383   65.411   26.371 3.514351 38.74327 
1 1 1   19   19   39 o  110.775   34.015   10.633   6.3218   10.091   9.2570   11.106   8.6543  111.455   41.118  114.166   40.047 -2.710197 57.39679 
1 1 1   19   19   40 o  217.230   14.368   37.027   4.7505   33.932   10.406   37.841   5.3394  195.935   36.024  218.960   16.043 -23.02594 39.43499 
1 1 1   19   19   41 o  219.797   12.044   37.667   4.0365   31.322   6.2435   42.223   5.2910  196.623   21.074  231.598   15.006 -34.97569 25.87094 
1 1 1   19   19   42 o  175.278   14.520   24.249   3.8605   31.132   6.2276   19.953   4.9197  195.645   21.132  156.227   21.115 39.41827 29.87298 
1 1 1   19   19   43 o   75.714   26.197   4.5050   3.6972   5.7494   5.5803   3.5313   4.9361   86.504   31.922   75.296   29.477 11.20863 43.44983 
1 1 1   19   19   44 o  300.303   10.242   70.028   4.7076   65.913   6.4746   74.643   6.8569  288.811   14.695  307.785   14.555 -18.97446 20.68291 
1 1 1   19   19   45 o  335.016   12.028   87.749   6.1677   61.568   10.950   99.916   7.4645  268.482   27.012  356.381   13.684 -87.89911 30.28055 
1 1 1   19   19   46 o  159.005   17.943   20.566   4.2906   21.454   7.2600   20.089   5.3189  153.367   31.963  154.166   23.264 -0.7984314 39.53316 
1 1 1   19   19   47 o  175.620   16.454   24.934   4.3714   26.858   7.1302   23.776   5.5333  174.471   27.620  168.020   22.048 6.451065 35.34055 
1 1 1   19   19   48 o   68.590   26.144   3.4038   3.8090   6.7312   5.4462   0.2177   5.3293   87.407   31.645   63.705   28.073 23.70172 42.30279 
1 1 1   19   19   49 o  125.051   21.398   13.421   3.9484   19.497   5.6998   7.8144   5.4749  147.605   26.187   91.436   31.865 56.16951 41.24469 
1 1 1   19   19   50 o  130.772   22.324   14.884   4.3080   16.121   5.8061   13.369   6.4257  130.357   29.755  114.740   34.095 15.61698 45.25249 
1 1 1   19   20    0 o  688.150   13.317  363.570   14.015  363.570   14.015  363.570   14.015  688.150   13.317  688.150   13.317 0.000000 0.000000 
1 1 1   19   20    1 o  237.705   12.866   43.536   4.6636   35.613   6.2919   53.194   6.9473  213.921   19.428  262.150   17.413 -48.22829 26.08934 
1 1 1   19   20    2 o  293.645   10.961   66.177   4.9265   60.884   6.5423   73.109   7.4872  280.876   15.275  307.755   15.949 -26.87833 22.08409 
1 1 1   19   20    3 o  278.377   9.1184   59.423   3.8853   57.417   4.5300   65.006   7.5561  273.527   10.820  289.950   17.101 -16.42322 20.23681 
1 1 1   19   20    4 o  247.931   9.6758   47.149   3.6719   48.703   4.3026   42.983   7.0444  251.892   11.160  235.088   19.760 16.80392 22.69357 
1 1 1   19   20    5 o  312.951   10.380   75.149   4.9721   75.189   6.3570   75.086   7.9797  312.776   13.278  311.723   16.786 1.053558 21.40307 
1 1 1   19   20    6 o  460.499   9.2337  162.632   6.5084  162.820   8.4002  162.350   10.295  460.444   11.919  459.371   14.641 1.072815 18.87929 
1 1 1   19   20    7 o  417.451   7.8369  133.573   5.0075  133.320   5.7237  134.398   10.338  416.956   8.9685  417.691   16.170 -0.7353210 18.49046 
1 1 1   19   20    8 o  219.979   9.4603   37.119   3.1853   36.955   3.4714   37.995   8.0134  219.443   10.335  219.898   24.209 -0.4548798 26.32288 
1 1 1   19   20    9 o  130.216   14.698   13.214   2.8782   15.874   3.1033  -3.1501   7.6974  142.920   14.382   73.659   33.017 69.26088 36.01316 
1 1 1   19   20   10 o   89.256   20.610   6.4100   2.7588   6.0277   2.9530   9.0332   7.7351   86.544   22.188  110.568   37.912 -24.02405 43.92761 
1 1 1   19   20   11 o  208.470   9.8990   33.351   3.1587   34.604   3.3727   24.414   9.0094  212.320   10.378  172.743   35.267 39.57695 36.76251 
1 1 1   19   20   12 o  176.543   12.067   24.063   3.2411   24.063   3.2411   0.0000   0.0000  176.543   12.067  ?   ?  0.000000 12.06651 
1 1 1   19   20   13 o  198.546   16.916   30.639   5.0917   30.639   5.0917   0.0000   0.0000  198.546   16.916  ?   ?  0.000000 16.91566 
1 1 1   19   20   14 o  294.506   10.925   66.620   4.9246   64.471   5.6486   73.429   10.054  289.527   12.746  306.864   21.542 -17.33685 25.03084 
1 1 1   19   20   15 o  381.759   9.7951  111.875   5.7236  111.776   6.5738  112.186   11.636  381.404   11.261  379.942   20.081 1.462463 23.02251 
1 1 1   19   20   16 o  146.061   19.672   16.820   4.2861   18.540   4.8261   10.400   9.3253  153.141   21.154  118.649   41.573 34.49257 46.64553 
1 1 1   19   20   17 o  466.090   9.3847  166.759   6.6952  163.220   7.7113  177.597   13.494  460.870   10.931  478.948   18.407 -18.07785 21.40830 
1 1 1   19   20   18 o  205.278   19.404   32.962   6.0246   36.376   7.4848   26.682   10.153  214.799   23.130  179.044   38.211 35.75497 44.66645 
1 1 1   19   20   19 o  271.568   15.912   57.166   6.5851   60.347   8.4849   52.347   10.443  278.026   20.073  256.763   26.974 21.26273 33.62352 
1 1 1   19   20   20 o  102.558   33.374   8.2065   6.0065   10.202   7.6700   5.0418   9.6587  114.118   37.742  102.273   40.854 11.84510 55.61910 
1 1 1   19   20   21 o   67.587   20.967   3.5486   2.3951   4.1230   2.4649  -6.1665   10.136   72.049   21.038   79.670   36.558 -7.620689 42.17890 
1 1 1   19   20   22 o  150.634   12.000   17.582   2.7439   18.218   2.8429   8.9297   10.491  153.314   12.216  115.615   43.550 37.69942 45.23060 
1 1 1   19   20   23 f  161.141   21.418   20.620   5.1518   21.601   5.8935   17.440   10.608  164.218   24.170  143.601   44.057 20.61702 50.25155 
1 1 1   19   20   24 o  290.125   10.933   64.790   4.8549   68.732   6.9259   60.982   6.8074  297.637   15.254  280.130   15.942 17.50644 22.06446 
1 1 1   19   20   25 o  159.115   11.523   19.607   2.7875   17.577   3.1516   26.899   5.9739  150.196   13.865  184.137   21.606 -33.94136 25.67259 
1 1 1   19   20   26 o  133.014   13.917   13.826   2.7914   14.830   3.0685   9.0097   6.7220  137.626   14.799  106.543   35.337 31.08311 38.31083 
1 1 1   19   20   27 o   58.974   22.363   2.0052   2.7780   1.7542   3.0529   3.2141   6.6990   59.349   23.196   84.219   33.888 -24.87046 41.06655 
1 1 1   19   20   28 o  124.974   15.323   12.295   2.8698   10.629   3.2584   18.057   6.0594  115.145   19.161  148.096   27.751 -32.95026 33.72307 
1 1 1   19   20   29 o  306.445   8.3695   72.185   3.9257   70.428   4.6330   76.658   7.3924  302.408   10.009  314.171   15.373 -11.76315 18.34400 
1 1 1   19   20   30 o  277.711   7.7571   59.255   3.2973   57.951   4.4885   60.783   4.8598  274.158   10.696  280.653   11.313 -6.495605 15.56912 
1 1 1   19   20   31 o  118.867   14.590   11.127   2.5987   9.8400   3.7242   12.348   3.6280  109.546   22.946  123.964   19.786 -14.41788 30.29843 
1 1 1   19   20   32 o  178.715   11.586   24.778   3.1521   20.858   4.0962   30.470   4.9359  162.677   16.687  196.972   16.524 -34.29498 23.48417 
1 1 1   19   20   33 o  182.010   11.870   25.725   3.2886   24.316   4.2659   27.789   5.1632  175.886   16.021  187.424   18.229 -11.53812 24.26860 
1 1 1   19   20   34 o  389.774   7.6629  116.804   4.5717  118.135   6.9841  115.806   6.0473  390.809   11.676  387.422   10.198 3.386993 15.50207 
1 1 1   19   20   35 o  195.387   10.803   29.584   3.2183   31.776   4.8526   27.863   4.3000  201.101   15.894  188.500   15.029 12.60179 21.87443 
1 1 1   19   20   36 o  187.873   12.049   27.460   3.4467   28.433   5.0557   26.615   4.7113  189.465   17.636  183.489   16.967 5.975983 24.47250 
1 1 1   19   20   37 o  143.766   15.134   16.312   3.2803   13.305   4.9207   18.718   4.4009  125.892   26.381  152.766   19.248 -26.87383 32.65642 
1 1 1   19   20   38 o   61.479   25.416   1.2017   3.8930   6.6938   4.8226  -9.0715   6.5957   90.638   29.925   54.634   26.352 36.00416 39.87367 
1 1 1   19   20   39 f  188.801   15.819   28.149   4.5294   33.897   9.9748   26.655   5.0837  197.165   34.298  182.691   18.432 14.47432 38.93716 
1 1 1   19   20   40 o  216.278   12.136   36.476   4.0012   48.667   6.6257   29.478   5.0199  247.506   17.604  192.510   17.218 54.99680 24.62440 
1 1 1   19   20   41 o  113.863   22.325   10.802   3.7517   9.7190   5.8866   11.543   4.8687  105.357   32.902  115.625   27.843 -10.26826 43.10183 
1 1 1   19   20   42 o  217.020   11.943   36.794   3.9520   40.229   6.0491   34.235   5.2199  224.258   17.768  207.363   16.585 16.89459 24.30568 
1 1 1   19   20   43 o  164.061   15.315   21.426   3.8013   24.973   5.9031   18.912   4.9687  173.419   22.791  150.932   22.168 22.48792 31.79371 
1 1 1   19   20   44 f  304.147   10.350   71.905   4.8181   64.261   6.6530   80.335   6.9869  284.551   15.332  319.254   14.298 -34.70300 20.96421 
1 1 1   19   20   45 f  142.556   18.679   16.632   3.9777   17.714   6.3705   15.941   5.0924  140.190   30.552  135.965   25.404 4.224670 39.73330 
1 1 1   19   20   46 o  139.216   18.540   15.941   3.8525   17.265   5.7619   14.870   5.1808  139.246   28.005  129.624   26.989 9.622101 38.89349 
1 1 1   19   20   47 o  132.730   20.711   14.857   4.0703   24.778   5.9404   6.0779   5.5883  170.007   23.453   85.081   31.836 84.92641 39.54181 
1 1 1   19   20   48 o  192.952   15.226   30.052   4.4603   23.260   5.9249   38.935   6.7761  163.141   24.483  215.116   20.841 -51.97452 32.15214 
1 1 1   19   20   49 o   81.933   27.667   6.0334   4.1187   8.1582   5.5500   3.4290   6.1446   92.507   32.091   75.487   31.627 17.01985 45.05682 
1 1 1   19   21    0 o   41.817   28.112  -2.0705   5.1148  -2.0705   5.1148  -2.0705   5.1148   41.817   28.112   41.817   28.112 0.000000 0.000000 
1 1 1   19   21    1 o  176.115   15.810   24.080   4.2163   22.804   5.9531   25.364   5.9726  169.857   23.530  179.593   22.200 -9.735168 32.34921 
1 1 1   19   21    2 o  262.674   12.097   53.007   4.8635   54.333   6.6690   51.500   7.1079  265.000   16.524  257.682   18.137 7.318481 24.53565 
1 1 1   19   21    3 o  305.341   11.029   71.581   5.1545   74.521   6.9843   68.065   7.6387  311.168   14.664  296.640   16.894 14.52737 22.37033 
1 1 1   19   21    4 o  303.764   10.895   70.840   5.0654   73.156   6.5726   67.453   7.9493  308.383   13.924  295.141   17.678 13.24234 22.50345 
1 1 1   19   21    5 f  322.332   8.6878   79.676   4.2863   80.745   5.0023   76.723   8.3143  324.373   10.075  314.890   17.317 9.482910 20.03452 
1 1 1   19   21    6 o  189.597   12.130   27.733   3.5018   28.111   4.0076   26.512   7.2009  190.663   13.827  182.584   26.544 8.078247 29.92910 
1 1 1   19   21    7 o  102.920   18.699   8.4331   2.8373   8.8278   3.1031   6.4215   7.0056  105.120   20.017   98.410   35.851 6.709366 41.06066 
1 1 1   19   21    8 o  351.254   7.6765   94.582   4.1272   96.110   4.5727   87.867   9.5865  354.018   8.4387  336.675   18.676 17.34320 20.49411 
1 1 1   19   21    9 o  542.138   6.9275  225.249   5.7486  222.748   6.4186  235.384   12.923  539.023   7.7797  552.724   15.275 -13.70105 17.14188 
1 1 1   19   21   10 o  227.071   9.6545   39.569   3.3555   41.319   3.6798   30.936   8.1749  231.988   10.363  196.988   27.892 35.00020 29.75537 
1 1 1   19   21   11 o  512.740   10.647  201.896   8.3557  201.896   8.3557   0.0000   0.0000  512.740   10.647  ?   ?  0.000000 10.64672 
1 1 1   19   21   12 o  506.762   13.970  197.738   10.836  197.738   10.836   0.0000   0.0000  506.762   13.970  ?   ?  0.000000 13.96952 
1 1 1   19   21   13 o  346.496   12.388   92.338   6.5703   91.791   8.2061   93.316   10.967  344.980   15.541  346.182   20.793 -1.201355 25.95875 
1 1 1   19   21   14 o  135.497   26.607   14.852   5.3212   17.778   6.5829   9.3335   9.0387  147.687   30.141  114.268   40.841 33.41876 50.75929 
1 1 1   19   21   15 o  744.575   10.788  425.993   12.295  428.415   16.603  423.051   18.294  745.466   14.551  740.161   16.148 5.304993 21.73689 
1 1 1   19   21   16 o  437.293   11.710  147.069   7.8380  146.633   10.009  147.762   12.603  435.958   15.000  436.617   18.858 -0.6591492 24.09591 
1 1 1   19   21   17 o  216.066   14.538   36.169   4.7799   39.387   5.4437   25.336   9.9883  225.254   15.891  174.106   38.503 51.14803 41.65302 
1 1 1   19   21   18 o   99.110   28.143   7.9567   4.4689   4.9463   5.0837   18.193   9.3740   85.092   30.607  147.101   40.398 -62.00901 50.68270 
1 1 1   19   21   19 o  473.922   9.6747  172.546   7.0180  168.855   8.1392  183.244   13.856  468.492   11.350  485.901   18.631 -17.40912 21.81614 
1 1 1   19   21   20 o  378.103   14.118  110.340   8.1708  117.080   11.050  102.210   12.137  388.280   18.593  361.087   22.065 27.19250 28.85453 
1 1 1   19   21   21 o  256.169   14.206   50.827   5.5485   51.481   6.3496   48.714   11.411  257.361   16.201  245.354   31.083 12.00693 35.05212 
1 1 1   19   21   22 o  412.168   10.793  130.727   6.8089  139.892   7.9502  105.504   13.189  426.051   12.191  365.783   23.684 60.26797 26.63775 
1 1 1   19   21   23 o   88.515   19.775   6.3450   2.6117   5.9869   2.6902   12.216   10.892   85.864   20.709  125.837   44.849 -39.97302 49.39943 
1 1 1   19   21   24 o  395.611   7.0954  120.093   4.2965  121.104   5.1341  117.731   7.8486  397.055   8.4478  390.461   13.132 6.594635 15.61497 
1 1 1   19   21   25 o  205.151   10.013   32.388   3.1440   34.730   3.6037   24.924   6.4336  212.012   11.144  176.043   24.544 35.96895 26.95514 
1 1 1   19   21   26 o  242.023   9.4065   45.059   3.4846   46.622   3.8868   38.653   7.8663  246.059   10.320  220.018   23.734 26.04034 25.88065 
1 1 1   19   21   27 o  184.627   10.608   26.350   2.9853   26.070   3.3889   27.319   6.3077  183.358   12.144  184.793   22.783 -1.435104 25.81733 
1 1 1   19   21   28 o  170.643   11.551   22.572   2.9993   23.936   3.4686   18.532   5.9709  175.452   13.009  150.228   26.957 25.22382 29.93180 
1 1 1   19   21   29 o  194.541   11.085   29.289   3.2872   30.220   3.7753   26.368   6.6844  197.314   12.566  180.540   24.847 16.77351 27.84404 
1 1 1   19   21   30 o  365.776   8.9712  102.958   5.0227  103.481   5.3610   99.198   14.366  366.569   9.5548  350.495   26.986 16.07431 28.62736 
1 1 1   19   21   31 o  202.910   10.014   31.735   3.1103   30.239   3.9152   34.295   5.1209  197.166   13.047  209.172   16.119 -12.00639 20.73744 
1 1 1   19   21   32 o   80.484   20.540   5.3052   2.5388   10.284   3.6387   0.5823   3.5439  112.145   21.984   57.053   23.967 55.09209 32.52244 
1 1 1   19   21   33 o   50.171   20.983   0.4807   2.6977  -0.8267   4.2396   1.3702   3.4970   56.875   25.052   60.021   24.367 -3.146198 34.94805 
1 1 1   19   21   34 o   88.939   20.537   6.4989   2.7393   4.5381   4.0121   8.2111   3.7491   78.009   27.272   99.238   24.762 -21.22897 36.83676 
1 1 1   19   21   35 o  220.518   9.8133   37.524   3.3123   41.127   4.8743   34.434   4.5149  229.501   13.942  209.867   14.137 19.63356 19.85559 
1 1 1   19   21   36 o  133.917   15.435   14.192   3.1058   11.696   4.5947   16.292   4.2145  117.978   26.133  142.156   19.916 -24.17797 32.85654 
1 1 1   19   21   37 o   63.049   25.277   1.8229   3.7124   0.0502   4.3727   6.3992   7.0258   60.295   26.011   94.383   35.619 -34.08827 44.10546 
1 1 1   19   21   38 o  119.519   24.139   11.923   4.2639   4.1337   9.6394   13.818   4.7543   94.943   39.682  128.519   25.069 -33.57553 46.93758 
1 1 1   19   21   39 o  112.603   21.039   10.446   3.4929   17.707   5.5420   5.6612   4.4988  145.256   25.875   84.365   28.913 60.89098 38.80092 
1 1 1   19   21   40 o   98.089   22.685   8.0780   3.3380   5.6794   4.8149   10.298   4.6318   84.886   29.865  109.276   27.665 -24.38959 40.70966 
1 1 1   19   21   41 o   74.139   25.161   4.3437   3.4067   6.5272   5.0999   2.5845   4.5778   89.158   30.772   70.073   28.078 19.08534 41.65669 
1 1 1   19   21   42 o   83.641   24.711   5.9314   3.3829   3.2755   4.9764   8.2130   4.6125   74.214   29.426   96.990   28.902 -22.77592 41.24551 
1 1 1   19   21   43 f  130.235   18.550   13.849   3.5932   13.368   5.3392   14.247   4.8579  122.907   28.872  128.766   25.549 -5.858963 38.55342 
1 1 1   19   21   44 o   88.840   25.256   6.8382   3.5968   8.4489   5.3291   5.4905   4.8745   97.328   31.417   82.713   29.939 14.61568 43.39780 
1 1 1   19   21   45 o   41.056   19.900  -5.7414   3.8774 -10.7973   6.1245  -2.3594   5.0091   48.281   23.741   55.948   25.682 -7.667133 34.97432 
1 1 1   19   21   46 o  162.485   17.376   21.556   4.2544   9.5590   5.4799   39.759   6.7500  101.045   31.776  218.750   20.395 -117.7053 37.75822 
1 1 1   19   21   47 o  144.986   19.221   17.542   4.1603   10.876   5.5731   25.933   6.2523  106.518   31.775  172.733   24.322 -66.21463 40.01525 
1 1 1   19   21   48 o  130.577   19.833   14.427   3.8392   12.648   5.3290   16.347   5.5358  115.368   29.924  133.236   28.033 -17.86741 41.00335 
1 1 1   19   22    0 o  906.185   14.869  630.953   20.611  630.953   20.611  630.953   20.611  906.185   14.869  906.185   14.869 0.000000 0.000000 
1 1 1   19   22    1 o  155.708   17.767   18.959   4.1587   10.692   5.5405   29.628   6.2938  114.678   30.878  194.327   21.521 -79.64895 37.63768 
1 1 1   19   22    2 o  533.338   9.2156  218.227   7.5231  213.643   10.233  223.619   11.099  527.132   12.682  539.144   13.449 -12.01184 18.48565 
1 1 1   19   22    3 o   62.765   25.616   1.1902   3.8903   1.1736   4.9221   1.2179   6.3501   69.204   28.592   77.414   32.269 -8.210060 43.11365 
1 1 1   19   22    4 o  279.438   9.5320   59.919   4.0770   56.728   4.7573   68.742   7.9114  271.738   11.438  297.886   17.427 -26.14789 20.84551 
1 1 1   19   22    5 o  506.342   7.6954  196.557   5.9641  194.765   7.0579  201.031   11.154  503.846   9.1519  510.986   14.260 -7.139954 16.94459 
1 1 1   19   22    6 f  269.633   9.7449   55.798   4.0218   57.061   4.6299   51.914   8.1181  272.553   11.098  257.991   20.733 14.56183 23.51653 
1 1 1   19   22    7 o  304.766   9.0625   71.262   4.2275   68.967   4.8084   79.076   8.8729  299.692   10.482  319.323   18.229 -19.63074 21.02812 
1 1 1   19   22    8 o  386.488   8.3698  114.566   4.9513  111.695   5.7081  123.292   9.9509  381.464   9.7762  399.733   16.264 -18.26901 18.97595 
1 1 1   19   22    9 o  213.238   13.602   35.143   4.4165   39.624   5.1019   21.750   8.8212  226.278   14.812  162.218   36.419 64.05981 39.31650 
1 1 1   19   22   10 o  135.002   23.101   14.568   4.6019   14.568   4.6019   0.0000   0.0000  135.002   23.101  ?   ?  0.000000 23.10081 
1 1 1   19   22   11 o  439.788   7.2408  148.281   4.8742  150.602   5.4445  138.915   10.939  443.127   8.0271  424.037   16.854 19.08954 18.66798 
1 1 1   19   22   12 o  141.008   14.374   15.480   3.0590   15.048   3.2665   18.560   8.7212  138.784   15.651  149.260   38.057 -10.47530 41.14959 
1 1 1   19   22   13 o  372.983   9.7223  106.824   5.5504  108.524   6.5109  102.304   10.617  375.715   11.322  362.769   19.190 12.94653 22.28059 
1 1 1   19   22   14 o  256.895   12.322   50.788   4.8451   48.234   5.5520   58.945   9.9223  249.659   14.592  273.694   23.926 -24.03532 28.02448 
1 1 1   19   22   15 o  289.337   11.684   64.401   5.1743   64.399   5.9888   64.404   10.277  289.081   13.535  286.152   23.675 2.928864 27.27116 
1 1 1   19   22   16 f  179.725   16.972   25.214   4.6136   26.923   5.2584   19.501   9.6163  185.367   18.793  152.074   40.565 33.29358 44.70658 
1 1 1   19   22   17 o  508.168   9.3762  198.340   7.2929  202.044   8.6413  189.173   13.596  512.542   11.015  493.926   17.984 18.61664 21.08897 
1 1 1   19   22   18 o  219.057   15.031   37.246   5.0093   39.258   5.8180   31.482   9.8491  224.477   17.061  195.584   34.142 28.89250 38.16741 
1 1 1   19   22   19 o  164.644   26.380   21.868   6.4234   23.435   8.0411   19.106   10.678  168.616   32.333  149.745   43.806 18.87064 54.44608 
1 1 1   19   22   20 o  298.516   12.696   68.711   5.8010   70.786   6.6859   62.389   11.668  302.661   14.432  279.370   27.649 23.29120 31.18906 
1 1 1   19   22   21 o  243.966   14.710   46.192   5.4672   44.513   6.1151   52.884   12.204  238.960   16.826  254.914   31.983 -15.95389 36.13926 
1 1 1   19   22   22 o  365.082   11.654  102.714   6.5121  106.708   7.6236   91.932   12.525  371.701   13.400  340.754   24.171 30.94684 27.63637 
1 1 1   19   22   23 o  405.781   11.251  126.875   6.9882  125.028   8.1034  132.233   13.803  402.316   13.159  409.770   22.089 -7.454193 25.71174 
1 1 1   19   22   24 o  211.751   10.391   34.525   3.3680   35.430   3.5166   24.489   11.708  214.468   10.713  166.618   44.896 47.85052 46.15668 
1 1 1   19   22   25 o  169.167   11.281   22.162   2.9042   24.363   3.1714   10.720   7.2295  177.321   11.751  114.163   36.565 63.15790 38.40679 
1 1 1   19   22   26 o  184.110   10.503   26.200   2.9476   26.704   3.3230   24.337   6.3835  185.652   11.755  173.572   24.727 12.07996 27.37843 
1 1 1   19   22   27 o   78.855   22.536   5.0372   2.8560   5.9095   2.9326 -10.9927   12.572   85.003   22.272   81.938   38.623 3.065399 44.58485 
1 1 1   19   22   28 o   60.654   22.610   2.2819   2.8134   2.0302   2.8902   6.8281   12.284   59.674   22.767  112.162   45.618 -52.48845 50.98400 
1 1 1   19   22   29 o  265.837   9.1353   54.395   3.7171   56.793   4.3205   47.565   7.2926  271.403   10.401  245.358   19.581 26.04420 22.17213 
1 1 1   19   22   30 o  115.632   17.665   10.683   3.0273   10.372   3.4018   11.868   6.6370  113.157   20.391  118.026   34.539 -4.868408 40.10890 
1 1 1   19   22   31 o   94.203   22.173   7.3085   3.1440   7.7945   3.5570   5.5726   6.7224   96.988   24.073   91.604   34.776 5.384308 42.29521 
1 1 1   19   22   32 o  359.065   7.6969   99.127   4.2302  101.976   6.2612   96.734   5.7377  363.235   11.262  353.978   10.590 9.257263 15.45866 
1 1 1   19   22   33 o  549.826   6.7475  232.225   5.6785  235.287   7.9997  229.116   8.0619  552.448   9.4605  545.068   9.6632 7.379639 13.52325 
1 1 1   19   22   34 f   62.197   22.761   2.5817   2.8283   5.9286   4.1436  -0.3382   3.8702   85.761   27.705   55.739   24.258 30.02180 36.82352 
1 1 1   19   22   35 o  220.868   10.031   37.672   3.3911   36.219   4.9168   38.989   4.6831  214.878   15.044  223.416   13.761 -8.538361 20.38901 
1 1 1   19   22   36 o  192.157   14.328   28.954   4.1840   32.272   5.0028   21.233   7.6317  202.231   16.301  156.449   32.913 45.78250 36.72818 
1 1 1   19   22   37 o  143.675   19.890   16.690   4.2567   22.776   11.846   15.787   4.5613  153.804   46.427  138.776   22.224 15.02748 51.47182 
1 1 1   19   22   38 o  113.984   19.492   10.597   3.2786   15.550   4.8267   6.3545   4.4673  136.795   23.924   87.934   28.790 48.86041 37.43279 
1 1 1   19   22   39 o  126.266   17.873   12.864   3.3577   9.0779   4.9343   16.130   4.5823  102.374   29.730  139.903   22.135 -37.52877 37.06542 
1 1 1   19   22   40 o   49.011   21.710  -0.7352   3.2276  -3.7093   4.7308   1.8547   4.4147   51.895   24.214   66.419   27.219 -14.52385 36.43041 
1 1 1   19   22   41 o   48.411   21.555  -0.8573   3.2226   0.6871   4.7101  -2.2166   4.4187   63.568   27.202   53.168   24.300 10.40009 36.47522 
1 1 1   19   22   42 o  252.257   12.779   49.947   4.9179   51.877   6.0597   46.223   8.4176  255.572   15.565  235.678   23.654 19.89349 28.31530 
1 1 1   19   22   43 o  146.517   17.302   17.377   3.8053   28.474   6.1061   10.331   4.8657  185.215   21.967  107.574   28.924 77.64131 36.32040 
1 1 1   19   22   44 o   95.224   25.189   7.9462   3.7279   7.1926   5.9995   8.4202   4.7580   91.517   33.202   96.783   29.471 -5.265442 44.39456 
1 1 1   19   22   45 o  177.772   14.676   25.302   3.9576   26.383   5.7932   24.355   5.4193  177.021   21.844  170.424   21.236 6.596878 30.46529 
1 1 1   19   22   46 o  103.084   25.496   9.5188   4.0004   4.5243   5.4227   15.483   5.9256   78.194   30.808  128.513   30.569 -50.31910 43.40021 
1 1 1   19   22   47 o   84.948   25.560   6.4892   3.5947   10.454   5.0136   2.2945   5.1566  105.019   29.805   68.763   28.900 36.25602 41.51567 
1 1 1   19   23    0 o   42.452   28.718  -2.6004   5.4974  -2.6004   5.4974  -2.6004   5.4974   42.452   28.718   42.452   28.718 0.000000 0.000000 
1 1 1   19   23    1 o  253.287   12.375   49.337   4.7976   46.070   6.5573   53.100   7.0379  243.518   17.714  261.534   17.685 -18.01601 25.03074 
1 1 1   19   23    2 o  687.039   9.7072  362.328   10.208  347.570   13.724  380.605   15.273  672.008   13.343  702.958   14.194 -30.94983 19.48082 
1 1 1   19   23    3 o  427.713   9.6623  140.424   6.3256  140.044   8.5189  140.891   9.4441  426.611   13.046  427.640   14.428 -1.029480 19.45179 
1 1 1   19   23    4 o  132.044   21.542   13.878   4.2036   10.353   5.3515   19.557   6.7926  112.713   30.346  155.261   29.664 -42.54800 42.43599 
1 1 1   19   23    5 o  386.679   8.3224  114.689   4.9257  107.920   5.7419  133.550   9.5849  374.906   10.006  416.200   15.046 -41.29379 18.06925 
1 1 1   19   23    6 o  244.233   10.402   45.814   3.8887   43.504   4.4721   52.978   7.8744  237.506   12.344  260.673   19.886 -23.16693 23.40575 
1 1 1   19   23    7 o  418.532   9.0028  134.425   5.7674  132.357   6.9256  139.103   10.418  415.038   10.902  424.501   16.033 -9.463196 19.38833 
1 1 1   19   23    8 o  117.151   26.588   11.168   4.6584   11.168   4.6584   0.0000   0.0000  117.151   26.588  ?   ?  0.000000 26.58802 
1 1 1   19   23    9 o  443.711   8.1996  151.029   5.5688  151.029   5.5688   0.0000   0.0000  443.711   8.1996  ?   ?  0.000000 8.199620 
1 1 1   19   23   10 o  285.293   8.7619   62.462   3.8261   65.142   4.2014   49.439   9.2617  291.286   9.4233  250.374   24.481 40.91229 26.23174 
1 1 1   19   23   11 o  738.283   7.3563  417.973   8.3129  414.727   9.3823  429.827   17.930  735.203   8.3374  746.052   15.701 -10.84875 17.77753 
1 1 1   19   23   12 o  281.716   8.7352   60.913   3.7666   61.195   4.0960   59.368   9.5866  282.295   9.4796  274.885   22.996 7.410065 24.87319 
1 1 1   19   23   13 o  302.431   10.905   70.322   5.0479   70.412   5.8999   70.079   9.7518  302.368   12.748  299.218   21.435 3.149628 24.93892 
1 1 1   19   23   14 o  257.704   12.606   51.149   4.9725   51.261   5.8026   50.841   9.6480  257.263   14.798  253.381   25.211 3.881226 29.23359 
1 1 1   19   23   15 o  147.469   20.080   17.216   4.4146   19.430   5.0335   9.8351   9.1896  156.445   21.596  115.586   41.195 40.85941 46.51242 
1 1 1   19   23   16 o  176.649   17.524   24.425   4.6757   24.018   5.3595   25.722   9.5666  174.459   20.459  175.389   36.809 -0.9301605 42.11269 
1 1 1   19   23   17 o  125.581   31.526   13.079   6.0508   19.115   7.7165   3.4437   9.7501  151.395   34.117   97.868   40.318 53.52697 52.81553 
1 1 1   19   23   18 o  345.060   14.767   92.050   7.7991   96.751   10.339   85.843   11.880  352.025   19.262  329.843   23.688 22.18210 30.53085 
1 1 1   19   23   19 o  166.012   19.883   21.784   4.9517   23.652   5.5530   14.531   10.941  172.639   21.479  133.489   45.093 39.14983 49.94708 
1 1 1   19   23   20 o  525.788   9.7989  212.605   7.8860  212.639   9.2240  212.514   15.203  525.357   11.471  522.177   19.021 3.180359 22.21231 
1 1 1   19   23   21 o  328.083   12.052   83.014   6.0520   77.300   6.8074  104.563   13.219  316.150   14.067  363.435   23.895 -47.28503 27.72876 
1 1 1   19   23   22 o  253.637   14.848   50.001   5.7392   51.724   6.5646   44.413   11.822  257.452   16.750  231.387   34.430 26.06499 38.28787 
1 1 1   19   23   23 o  296.071   13.740   67.820   6.2264   67.903   7.1742   67.566   12.534  295.293   15.932  289.092   28.706 6.201843 32.83070 
1 1 1   19   23   24 o  149.387   27.503   18.341   6.0570   18.341   6.0570   0.0000   0.0000  149.387   27.503  ?   ?  0.000000 27.50303 
1 1 1   19   23   25 o  302.187   8.9143   70.230   4.1232   70.890   4.3531   64.469   12.859  303.527   9.3697  280.980   30.382 22.54636 31.79415 
1 1 1   19   23   26 o  211.443   10.530   34.459   3.4080   34.543   3.5393   33.383   12.629  211.360   10.978  194.298   43.544 17.06111 44.90658 
1 1 1   19   23   27 o  164.408   11.602   20.974   2.9008   19.517   3.2121   27.413   6.7544  158.202   13.391  184.152   24.576 -25.94986 27.98764 
1 1 1   19   23   28 o  298.619   8.6436   68.600   3.9508   66.413   4.5410   75.409   8.0132  293.543   10.107  310.393   16.931 -16.84961 19.71777 
1 1 1   19   23   29 o  419.432   7.7969  135.228   5.0056  140.286   6.0114  123.793   9.0392  426.837   9.2012  399.042   14.799 27.79572 17.42652 
1 1 1   19   23   30 o  164.750   12.910   21.157   3.2295   23.050   3.6674   14.621   6.8147  171.719   14.077  130.302   33.860 41.41718 36.66919 
1 1 1   19   23   31 o  139.369   16.468   15.378   3.4452   12.643   4.0000   23.235   6.7804  124.614   21.763  167.585   27.379 -42.97056 34.97473 
1 1 1   19   23   32 o  270.882   9.9997   56.619   4.1461   55.990   4.8574   58.308   7.9582  268.943   11.800  271.272   19.292 -2.329620 22.61460 
1 1 1   19   23   33 o   73.352   24.740   4.1263   3.2933   4.2194   3.7359   3.8017   6.9749   75.294   26.317   85.813   34.562 -10.51904 43.44077 
1 1 1   19   23   34 o  178.250   13.856   24.876   3.7506   26.359   4.3827   20.821   7.2492  182.906   15.810  155.916   31.461 26.98955 35.20988 
1 1 1   19   23   35 o   61.184   24.566   1.6687   3.5123   3.5463   4.1915  -2.7572   6.4355   73.374   27.549   65.131   29.596 8.242584 40.43336 
1 1 1   19   23   36 o   40.268   19.546  -6.0778   3.7761 -11.8727   8.7816  -4.7634   4.1825   62.413   30.178   45.998   21.858 16.41488 37.26189 
1 1 1   19   23   37 o  123.568   18.013   12.311   3.3068   15.493   4.7792   9.3879   4.5803  136.638   23.711  104.609   28.036 32.02876 36.71853 
1 1 1   19   23   38 o  284.711   9.0879   62.620   3.9604   66.709   5.7088   58.826   5.4988  292.544   12.749  274.585   13.084 17.95941 18.26801 
1 1 1   19   23   39 o   57.813   23.045   1.6328   3.0672   4.6494   4.6410  -0.7066   4.0870   79.304   29.136   55.419   24.495 23.88445 38.06398 
1 1 1   19   23   40 o  179.628   13.398   25.411   3.6573   23.606   5.2374   27.128   5.1094  169.912   20.556  183.382   18.454 -13.47050 27.62416 
1 1 1   19   23   41 o  143.850   16.333   16.615   3.5325   13.334   5.0993   19.642   4.8982  123.501   27.663  154.175   21.328 -30.67486 34.93009 
1 1 1   19   23   42 o   81.620   24.496   5.6758   3.3048   4.9201   4.5186   6.5448   4.8457   79.329   28.809   87.820   30.008 -8.491348 41.59835 
1 1 1   19   23   43 o  214.683   12.392   36.279   4.0546   38.345   6.2638   34.789   5.3194  216.720   19.078  207.782   16.872 8.937851 25.46766 
1 1 1   19   23   44 o   57.573   24.519   0.7773   3.7936   1.7613   5.3448  -0.2217   5.3854   68.873   29.209   63.210   28.019 5.663078 40.47503 
1 1 1   19   23   45 o   81.549   25.605   5.8497   3.5597   4.7935   4.8523   7.0805   5.2382   77.953   29.557   88.780   31.155 -10.82680 42.94501 
1 1 1   19   23   46 o  146.185   16.630   17.511   3.6549   19.126   5.1306   15.847   5.2078  148.400   23.359  132.551   26.593 15.84958 35.39584 
1 1 1   19   24    0 o  307.730   15.928   73.373   7.4567   73.373   7.4567   73.373   7.4567  307.730   15.928  307.730   15.928 0.000000 0.000000 
1 1 1   19   24    1 o  220.590   13.546   37.618   4.5515   38.973   6.2458   36.084   6.6465  223.607   18.412  214.632   20.480 8.975693 27.53988 
1 1 1   19   24    2 o  357.889   10.457   98.403   5.7284   97.128   7.6348  100.045   8.6649  355.015   14.050  359.994   15.725 -4.978699 21.08778 
1 1 1   19   24    3 o  113.057   24.130   10.348   4.0486   11.482   5.1886   8.5824   6.4732  118.458   28.878  105.381   34.664 13.07719 45.11691 
1 1 1   19   24    4 o   76.490   28.040   3.7627   4.2952   4.1326   5.6483   3.2555   6.6139   83.997   31.879   85.013   33.855 -1.016472 46.50242 
1 1 1   19   24    5 o  174.266   28.435   24.480   7.3231   0.0000   0.0000   24.480   7.3231  ?   ?   174.266   28.435 0.000000 28.43515 
1 1 1   19   24    7 o  171.268   16.161   22.862   4.1866   22.862   4.1866   0.0000   0.0000  171.268   16.161  ?   ?  0.000000 16.16129 
1 1 1   19   24    8 o  452.086   7.3821  156.739   5.1083  154.438   5.7365  165.550   11.227  448.626   8.3539  462.904   15.845 -14.27789 17.91242 
1 1 1   19   24    9 o  378.225   7.7235  109.733   4.4713  107.950   4.9907  116.986   10.066  375.025   8.6942  388.836   16.913 -13.81149 19.01653 
1 1 1   19   24   10 o  545.030   7.2530  227.814   6.0507  223.218   6.7714  246.019   13.478  539.349   8.2024  564.274   15.605 -24.92511 17.62910 
1 1 1   19   24   11 o  177.522   12.409   24.384   3.3505   25.014   3.6454   20.960   8.5041  179.657   13.352  158.531   35.883 21.12611 38.28626 
1 1 1   19   24   12 o  313.974   8.5691   75.674   4.1181   76.373   4.5188   72.253   10.004  315.326   9.3625  303.587   21.671 11.73914 23.60707 
1 1 1   19   24   13 o  261.705   12.574   52.771   5.0366   50.640   5.8623   58.775   9.8425  255.566   15.053  272.875   23.804 -17.30902 28.16381 
1 1 1   19   24   14 o  494.697   9.4099  188.025   7.1251  194.492   8.6144  174.020   12.678  502.725   11.195  473.656   17.486 29.06845 20.76305 
1 1 1   19   24   15 o  463.650   9.7086  165.229   6.8899  165.792   8.1815  163.856   12.777  464.034   11.519  459.259   18.175 4.774597 21.51820 
1 1 1   19   24   16 o  417.442   13.020  134.431   8.3193  143.997   11.457  123.762   12.100  430.704   17.380  398.447   19.839 32.25620 26.37513 
1 1 1   19   24   17 o  414.392   13.718  132.633   8.7008  125.551   11.655  141.550   13.077  401.507   18.965  425.885   20.061 -24.37747 27.60611 
1 1 1   19   24   18 o  256.952   13.721   51.156   5.3771   49.880   6.0708   55.801   11.583  253.228   15.741  262.922   29.281 -9.693405 33.24352 
1 1 1   19   24   19 o  281.538   13.234   61.227   5.7028   62.145   6.5034   58.173   11.864  282.865   15.075  268.235   29.378 14.63049 33.02003 
1 1 1   19   24   20 o  245.846   14.810   46.980   5.5471   51.618   6.2983   30.945   11.712  257.393   16.067  189.171   41.581 68.22234 44.57726 
1 1 1   19   24   21 o  152.055   22.647   18.574   5.1101   13.253   5.7055   40.150   11.489  126.006   30.012  219.083   35.475 -93.07661 46.46721 
1 1 1   19   24   22 o   91.558   30.783   6.4787   5.0986   6.0175   5.6487   8.5062   11.845   90.882   32.307  116.025   45.590 -25.14319 55.87645 
1 1 1   19   24   23 o  329.270   14.660   84.060   7.3885   84.060   7.3885   0.0000   0.0000  329.270   14.660  ?   ?  0.000000 14.66004 
1 1 1   19   24   24 o  277.444   14.430   59.835   6.1065   61.301   6.9223   54.691   12.966  280.270   16.205  256.530   33.848 23.74066 37.52779 
1 1 1   19   24   25 o  489.120   10.902  184.517   8.1616  185.485   9.4370  181.644   16.257  489.771   12.588  479.542   22.149 10.22922 25.47638 
1 1 1   19   24   26 o  287.645   8.5512   63.636   3.7649   60.479   4.2850   74.323   7.8843  280.167   9.9922  308.276   16.772 -28.10843 19.52318 
1 1 1   19   24   27 o  317.710   8.3454   77.628   4.0583   81.777   4.6807   65.067   8.1450  325.878   9.3840  287.548   18.606 38.32959 20.83814 
1 1 1   19   24   28 o  169.904   12.126   22.440   3.1327   24.110   3.4958   15.628   7.0590  175.928   13.075  134.757   34.174 41.17194 36.58968 
1 1 1   19   24   29 o  107.360   18.394   9.2820   2.9139   8.9001   3.2245   10.983   6.8040  104.407   20.907  113.789   35.347 -9.381844 41.06659 
1 1 1   19   24   30 o  194.476   14.629   29.594   4.3228   29.594   4.3228   0.0000   0.0000  194.476   14.629  ?   ?  0.000000 14.62921 
1 1 1   19   24   31 o  119.327   19.389   11.496   3.4198   15.173   3.9644   0.8026   6.7605  137.460   19.380   76.066   32.571 61.39430 37.90042 
1 1 1   19   24   32 o   98.773   21.927   8.0564   3.2286   5.0392   3.6270   19.573   7.0861   79.649   25.935  151.201   31.635 -71.55168 40.90697 
1 1 1   19   24   33 o  208.588   12.637   33.895   4.0154   37.428   4.7163   24.587   7.6553  218.745   14.162  170.253   30.497 48.49149 33.62446 
1 1 1   19   24   34 o  128.298   18.153   13.219   3.4653   17.526   4.0010   0.2875   6.9329  148.085   18.023   75.030   32.560 73.05564 37.21510 
1 1 1   19   24   35 o   86.594   26.187   6.2315   3.7662   12.036   9.1837   5.0579   4.1294  117.577   41.253   80.570   27.696 37.00717 49.68789 
1 1 1   19   24   36 f  189.546   11.966   28.021   3.4539   26.861   4.6628   29.431   5.1414  183.927   16.746  192.202   17.674 -8.275681 24.34781 
1 1 1   19   24   37 o   54.480   22.148   1.1634   2.8938  -1.7952   4.0510   4.2461   4.1351   52.032   23.580   76.010   27.566 -23.97843 36.27566 
1 1 1   19   24   38 o  177.925   12.650   24.820   3.4226   23.229   4.8853   26.353   4.7964  169.511   19.166  181.451   17.486 -11.93951 25.94393 
1 1 1   19   24   39 o  172.133   13.643   23.367   3.5651   26.081   5.3356   21.177   4.7919  179.116   19.792  161.195   19.840 17.92175 28.02448 
1 1 1   19   24   40 o  152.135   15.442   18.472   3.5460   19.346   5.2734   17.750   4.7910  151.899   23.435  146.068   22.121 5.830338 32.22666 
1 1 1   19   24   41 o  134.394   17.377   14.651   3.4908   18.334   5.2280   11.688   4.6894  147.107   24.050  115.436   27.018 31.67153 36.17153 
1 1 1   19   24   42 o  164.213   15.677   21.642   3.8925   23.471   5.3614   19.602   5.6605  167.903   21.344  150.770   25.434 17.13358 33.20291 
1 1 1   19   24   43 o  222.814   17.800   40.394   6.0201   40.394   6.0201   0.0000   0.0000  222.814   17.800  ?   ?  0.000000 17.80037 
1 1 1   19   24   44 o   93.838   23.938   7.7687   3.4494   9.8709   5.0355   5.9103   4.7346  102.836   30.082   82.877   29.566 19.95951 42.17901 
1 1 1   19   24   45 o   49.614   22.059  -0.5299   3.3627  -2.3371   4.8531   1.1390   4.6637   54.247   25.038   62.911   26.998 -8.664616 36.82150 
1 1 1   19   25    0 o  878.791   15.082  594.154   20.274  594.154   20.274  594.154   20.274  878.791   15.082  878.791   15.082 0.000000 0.000000 
1 1 1   19   25    1 o  323.061   11.028   80.251   5.4530   77.316   7.5549   83.443   7.8786  316.356   15.602  328.640   15.662 -12.28397 22.10742 
1 1 1   19   25    2 f  208.969   22.301   34.428   7.0230   0.0000   0.0000   34.428   7.0230  ?   ?   208.969   22.301 0.000000 22.30121 
1 1 1   19   25    5 f  439.229   9.8971  148.223   6.6538  148.223   6.6538   0.0000   0.0000  439.229   9.8971  ?   ?  0.000000 9.897136 
1 1 1   19   25    6 o  126.924   18.879   12.767   3.5560   12.476   4.0845   13.675   7.2275  124.678   22.218  128.379   35.560 -3.700562 41.92999 
1 1 1   19   25    7 o  504.076   7.2916  194.885   5.6259  192.038   6.4109  204.420   11.733  500.207   8.3733  514.484   14.899 -14.27628 17.09105 
1 1 1   19   25    8 o  496.498   8.4071  189.215   6.3890  193.304   7.7461  180.514   11.299  501.509   10.091  483.312   15.274 18.19629 18.30661 
1 1 1   19   25    9 o  329.432   9.8945   83.403   4.9892   77.942   5.7080  101.080   10.270  318.199   11.720  360.287   18.688 -42.08850 22.05845 
1 1 1   19   25   10 o  219.298   11.150   37.099   3.7302   36.906   4.1356   37.938   8.6388  218.520   12.416  217.902   26.443 0.6170807 29.21289 
1 1 1   19   25   11 o  444.358   7.7492  151.521   5.2706  150.042   5.8906  157.456   11.802  442.030   8.7064  450.645   17.110 -8.615265 19.19802 
1 1 1   19   25   12 o  272.071   9.5220   56.886   3.9653   57.075   4.3721   56.008   9.4140  272.403   10.486  266.280   23.333 6.123169 25.58087 
1 1 1   19   25   13 o  619.041   9.1348  294.429   8.6554  294.486   10.379  294.300   15.684  618.567   10.962  616.120   16.631 2.447021 19.91865 
1 1 1   19   25   14 o  499.265   9.6273  191.625   7.3571  190.696   8.7990  193.785   13.412  497.562   11.554  499.480   17.543 -1.917480 21.00600 
1 1 1   19   25   15 o  177.478   23.813   25.192   6.3057   21.562   8.3347   30.051   9.6430  160.241   34.964  190.130   34.402 -29.88879 49.05092 
1 1 1   19   25   16 o  284.340   12.589   62.385   5.4790   59.753   6.2476   71.152   11.402  277.472   14.764  299.080   25.140 -21.60733 29.15421 
1 1 1   19   25   17 f  468.746   9.9104  169.046   7.1105  169.257   8.3086  168.467   13.745  468.588   11.584  464.532   19.331 4.055634 22.53654 
1 1 1   19   25   18 o  476.032   10.141  174.419   7.3892  171.227   8.5014  184.279   14.943  471.186   11.788  485.265   20.118 -14.07843 23.31687 
1 1 1   19   25   19 o  459.106   10.358  162.302   7.2786  153.912   8.3142  189.832   15.060  446.565   12.164  492.446   19.980 -45.88104 23.39133 
1 1 1   19   25   20 o  466.130   10.566  167.378   7.5386  166.865   8.6897  168.938   15.156  464.907   12.211  463.655   21.357 1.252136 24.60134 
1 1 1   19   25   21 o  435.035   12.404  146.184   8.2595  146.184   8.2595   0.0000   0.0000  435.035   12.404  ?   ?  0.000000 12.40394 
1 1 1   19   25   22 o  359.900   13.860  100.314   7.6350  100.314   7.6350   0.0000   0.0000  359.900   13.860  ?   ?  0.000000 13.85984 
1 1 1   19   25   23 o  148.196   24.903   17.895   5.4484   18.571   6.0908   15.190   12.189  150.096   27.526  134.693   47.503 15.40294 54.90189 
1 1 1   19   25   24 o  180.678   21.436   26.072   5.8124   25.990   6.4411   26.428   13.489  179.449   24.056  169.663   49.121 9.786301 54.69536 
1 1 1   19   25   25 o  358.797   12.979   99.666   7.1279   94.067   7.9826  121.692   15.833  347.908   14.990  388.483   26.790 -40.57486 30.69902 
1 1 1   19   25   26 o   70.625   29.851   0.9074   5.5523  -1.4594   6.0992   12.357   13.415   66.983   29.748  127.424   48.947 -60.44114 57.27762 
1 1 1   19   25   27 o  268.814   9.1035   55.642   3.7457   58.771   4.2649   45.092   7.8327  276.073   10.093  237.700   21.770 38.37323 23.99613 
1 1 1   19   25   28 o   84.111   21.968   5.8198   2.8590   7.6109   3.1432  -2.7653   6.8813   96.166   21.850   68.102   30.810 28.06389 37.77158 
1 1 1   19   25   29 f  232.828   10.939   41.886   3.8985   44.748   4.5338   33.769   7.6367  240.020   12.383  203.703   25.019 36.31718 27.91556 
1 1 1   19   25   30 o  224.839   12.098   39.271   4.1481   35.068   4.8993   49.912   7.7953  211.500   15.236  250.255   20.532 -38.75510 25.56734 
1 1 1   19   25   31 o  148.837   15.861   17.506   3.5577   19.247   4.0995   12.195   7.1609  155.620   17.515  118.407   36.176 37.21329 40.19332 
1 1 1   19   25   32 o  288.447   9.8670   64.238   4.3563   67.387   5.1319   56.114   8.2415  295.013   11.365  265.089   20.470 29.92358 23.41345 
1 1 1   19   25   33 o  229.822   12.038   41.090   4.2200   40.515   4.8626   42.842   8.4936  227.546   14.030  228.974   24.621 -1.428040 28.33811 
1 1 1   19   25   34 o  272.125   15.674   58.258   6.5010   52.894   9.3999   63.175   9.0007  254.367   24.444  280.365   21.129 -25.99841 32.31045 
1 1 1   19   25   35 o  231.542   12.668   41.855   4.4725   41.786   5.0302   42.117   9.7721  230.723   14.314  223.139   29.322 7.584000 32.62904 
1 1 1   19   25   36 o   69.292   23.390   3.7329   2.9437   0.8520   4.0998   6.7985   4.2292   60.995   25.709   89.791   27.863 -28.79567 37.91192 
1 1 1   19   25   37 o  193.866   11.589   29.340   3.4231   29.791   4.7482   28.853   4.9395  193.579   16.173  190.043   17.166 3.535767 23.58512 
1 1 1   19   25   38 o  298.441   9.5653   68.988   4.3695   68.128   5.7794   70.136   6.6758  295.188   12.791  298.547   14.609 -3.358429 19.41752 
1 1 1   19   25   39 o   98.870   22.493   8.2878   3.3272   8.4487   4.7737   8.1358   4.6399   98.012   29.447   96.369   29.049 1.642181 41.36374 
1 1 1   19   25   40 o  128.809   18.243   13.551   3.4962   5.1502   5.0380   21.356   4.8559   81.707   30.295  161.206   20.118 -79.49950 36.36661 
1 1 1   19   25   41 f  118.127   20.629   11.690   3.5941   9.4180   4.8944   14.349   5.2949  102.055   29.602  127.018   27.990 -24.96260 40.73931 
1 1 1   19   25   42 o   59.204   24.158   1.6464   3.4591   0.1045   5.1864   2.8819   4.6424   63.132   27.761   69.929   28.185 -6.797787 39.56135 
1 1 1   19   25   43 o  175.841   19.937   25.758   5.2712   16.504   7.8967   33.195   7.0793  127.036   37.807  196.414   24.050 -69.37707 44.80861 
1 1 1   19   25   44 o  116.684   20.577   11.598   3.5407   12.643   5.1479   10.660   4.8775  116.552   28.979  106.809   29.061 9.742744 41.04081 
1 1 1   19   26    2 o  105.837   34.315   8.8431   6.3524   8.8431   6.3524   0.0000   0.0000  105.837   34.315  ?   ?  0.000000 34.31499 
1 1 1   19   26    3 o  293.164   11.892   66.180   5.3361   65.514   7.3209   66.935   7.7941  290.403   16.538  293.304   17.440 -2.901123 24.03456 
1 1 1   19   26    4 o  205.633   15.031   32.851   4.6982   30.079   6.2902   36.348   7.0656  195.203   21.404  214.668   21.806 -19.46497 30.55557 
1 1 1   19   26    5 o  170.051   17.889   22.680   4.5864   23.717   6.0500   21.280   7.0328  172.469   23.532  161.389   29.559 11.08002 37.78230 
1 1 1   19   26    6 o  479.473   8.4345  176.502   6.1901  177.460   7.3708  174.208   11.402  480.458   10.023  474.493   15.700 5.965363 18.62626 
1 1 1   19   26    7 o  241.807   10.367   44.967   3.8369   44.096   4.2818   48.517   8.6439  239.296   11.690  247.816   23.053 -8.520203 25.84723 
1 1 1   19   26    8 o  378.722   8.0916  110.101   4.6906  112.067   5.2972  102.963   10.094  381.941   9.0611  364.043   18.116 17.89789 20.25531 
1 1 1   19   26    9 o  115.618   19.775   10.694   3.3738   10.115   3.7317   13.289   7.8948  111.728   22.597  126.383   37.846 -14.65449 44.07905 
1 1 1   19   26   10 f  675.906   8.8554  350.952   9.1614  350.740   11.009  351.429   16.521  675.134   10.654  673.489   16.027 1.644653 19.24438 
1 1 1   19   26   11 o  116.244   23.065   10.960   3.9590   7.6205   4.4438   23.811   8.7166   96.832   28.241  168.680   34.912 -71.84792 44.90379 
1 1 1   19   26   12 o  264.405   11.590   53.867   4.6907   52.632   5.3657   57.872   9.6603  260.704   13.493  270.264   23.589 -9.560181 27.17510 
1 1 1   19   26   13 o  129.360   21.002   13.411   4.0158   11.298   4.5022   21.637   8.8823  117.346   25.772  159.657   37.060 -42.31131 45.14016 
1 1 1   19   26   14 o  355.678   14.334   97.880   7.8034   89.899   10.491  107.763   11.675  338.443   20.346  370.503   20.669 -32.05981 29.00348 
1 1 1   19   26   15 o   51.901   23.882  -3.0633   4.3671  -2.7821   4.9212  -4.1053   9.4733   56.611   25.785   79.406   36.015 -22.79478 44.29416 
1 1 1   19   26   16 o  267.006   13.197   55.095   5.3936   53.148   6.1939   61.204   10.971  261.311   15.556  276.393   26.247 -15.08249 30.51104 
1 1 1   19   26   17 o   97.135   29.432   7.6754   4.7539   10.092   5.3634  -1.1802   10.268  110.154   30.676   88.416   38.964 21.73814 49.59064 
1 1 1   19   26   18 o  330.631   11.821   84.349   5.9821   82.796   6.8877   89.118   12.069  327.101   13.757  335.003   23.690 -7.901947 27.39474 
1 1 1   19   26   19 o  241.525   15.469   45.464   5.6887   46.278   6.5138   42.851   11.678  243.035   17.630  226.464   34.804 16.57123 39.01465 
1 1 1   19   26   20 o  119.288   31.212   11.964   5.7647   11.964   5.7647   0.0000   0.0000  119.288   31.212  ?   ?  0.000000 31.21236 
1 1 1   19   26   21 o  511.942   12.244  202.512   9.5942  202.512   9.5942   0.0000   0.0000  511.942   12.244  ?   ?  0.000000 12.24386 
1 1 1   19   26   22 o  158.276   22.808   20.190   5.3661   19.865   5.9114   21.713   12.791  155.974   25.653  155.027   48.514 0.9476929 54.87920 
1 1 1   19   26   23 o  295.164   13.871   67.550   6.2669   60.665   7.0027   95.245   14.045  278.513   16.500  343.494   26.930 -64.98141 31.58271 
1 1 1   19   26   24 o  409.370   11.742  129.503   7.3577  129.907   8.3445  128.092   15.597  409.444   13.315  399.224   25.660 10.22015 28.90913 
1 1 1   19   26   25 o   61.444   27.700  -2.2316   5.5055  -6.1100   6.0205   17.571   13.604   56.437   26.641  141.464   50.154 -85.02682 56.79037 
1 1 1   19   26   26 o  308.556   14.664   74.048   6.9257   77.432   7.7505   60.639   15.428  314.607   16.150  264.612   39.285 49.99451 42.47489 
1 1 1   19   26   27 o  195.683   27.035   31.459   7.8812   41.985   9.7036   11.059   13.509  225.544   28.763  123.324   48.614 102.2192 56.48562 
1 1 1   19   26   28 o  147.887   14.995   17.209   3.3474   14.936   3.7951   25.175   7.1045  136.630   18.633  174.324   27.541 -37.69328 33.25172 
1 1 1   19   26   29 o  138.599   17.176   15.279   3.5656   15.633   4.0729   14.119   7.3777  139.438   19.626  126.895   36.205 12.54256 41.18266 
1 1 1   19   26   30 o  143.010   15.112   16.133   3.2579   16.830   3.6132   13.103   7.5341  145.695   16.493  122.192   37.057 23.50269 40.56184 
1 1 1   19   26   31 o  186.948   12.772   27.269   3.6327   29.695   4.1033   18.473   7.8126  194.804   13.852  144.583   35.551 50.22069 38.15429 
1 1 1   19   26   32 o   74.474   30.586   2.2745   5.5899  -0.6480   8.2284   4.7793   7.6176   78.569   34.739   90.536   36.240 -11.96752 50.20134 
1 1 1   19   26   33 o  275.239   15.084   59.493   6.3306   67.663   9.5258   53.031   8.4721  289.786   21.632  256.276   21.805 33.50998 30.71518 
1 1 1   19   26   34 o  125.232   20.579   12.837   3.8077   13.026   4.1462   11.821   9.6215  125.458   22.414  116.329   42.070 9.129539 47.66824 
1 1 1   19   26   35 o  130.772   19.265   13.903   3.7406   13.609   4.3272   14.772   7.4404  127.865   22.953  127.191   36.383 0.6738968 43.01819 
1 1 1   19   26   36 o   51.895   22.367   0.0530   3.2273  -2.0069   3.6052   8.3605   7.2401   47.920   21.920  100.177   36.453 -52.25761 42.53623 
1 1 1   19   26   37 o   70.550   23.677   3.9506   3.0162   2.7551   4.2835   5.1263   4.2480   69.191   27.343   80.247   28.062 -11.05556 39.18053 
1 1 1   19   26   38 o   80.651   23.648   5.5005   3.1086   5.1678   4.3901   5.8351   4.4025   80.551   28.498   83.967   28.603 -3.415703 40.37652 
1 1 1   19   26   39 o  118.977   18.726   11.635   3.2975   12.326   4.4225   10.770   4.9483  119.599   24.965  109.818   29.007 9.781609 38.27049 
1 1 1   19   26   40 o  171.091   16.656   23.626   4.3064   9.8689   8.7180   28.066   4.9529  104.106   39.583  186.053   17.601 -81.94796 43.32024 
1 1 1   19   26   41 o   71.643   25.028   4.1488   3.3787   3.2805   5.0433   4.8558   4.5509   72.980   29.390   78.086   28.825 -5.105804 41.16656 
1 1 1   19   26   42 o  117.601   19.663   11.623   3.4145   14.438   5.0758   9.2955   4.6147  126.813   26.979  100.554   28.615 26.25918 39.32789 
1 1 1   19   26   43 o   62.935   24.334   2.6756   3.3320  -3.5104   4.8452   8.2258   4.5894   51.634   24.225   94.220   28.991 -42.58610 37.77988 
1 1 1   19   27    0 o   58.148   35.665   2.3482   6.1042   2.3482   6.1042   2.3482   6.1042   58.148   35.665   58.148   35.665 0.000000 0.000000 
1 1 1   19   27    3 o  164.443   29.215   22.108   7.0840   0.0000   0.0000   22.108   7.0840  ?   ?   164.443   29.215 0.000000 29.21479 
1 1 1   19   27    4 o  304.197   18.347   72.225   8.5025   0.0000   0.0000   72.225   8.5025  ?   ?   304.197   18.347 0.000000 18.34667 
1 1 1   19   27    5 o  387.871   11.177  115.843   6.6355  114.257   8.8946  117.833   9.9643  384.235   15.124  389.727   16.704 -5.492004 22.53321 
1 1 1   19   27    6 o  167.067   18.643   21.984   4.6861   20.423   6.0775   24.272   7.3591  158.892   25.880  172.497   28.894 -13.60483 38.79005 
1 1 1   19   27    7 o  295.012   9.2396   66.894   4.1722   70.103   4.7434   55.924   8.7694  301.855   10.267  266.357   21.698 35.49802 24.00458 
1 1 1   19   27    8 o  137.237   17.173   14.848   3.5283   15.884   3.9556   10.814   7.8047  141.645   18.702  115.839   38.060 25.80692 42.40725 
1 1 1   19   27    9 o  256.730   10.047   50.707   3.9480   48.730   4.3999   58.879   8.9441  251.480   11.431  273.295   21.556 -21.81470 24.39954 
1 1 1   19   27   10 o  218.179   11.394   36.779   3.7918   37.235   4.1901   34.719   8.9109  219.313   12.534  206.716   28.958 12.59659 31.55387 
1 1 1   19   27   11 o  280.614   11.236   60.676   4.8260   59.426   5.4952   64.893   10.091  277.400   12.942  286.177   23.238 -8.776978 26.59861 
1 1 1   19   27   12 o  279.549   11.718   60.260   5.0141   57.348   5.7069   70.116   10.500  271.991   13.753  297.464   23.246 -25.47284 27.00917 
1 1 1   19   27   13 o  147.969   19.815   17.407   4.3752   16.933   4.9251   19.181   9.5282  145.004   22.955  148.945   40.656 -3.941071 46.68888 
1 1 1   19   27   14 o  334.035   14.973   86.486   7.6554   84.460   10.345   88.940   11.381  327.597   20.739  335.497   22.290 -7.900391 30.44595 
1 1 1   19   27   15 o  266.913   13.552   55.242   5.5183   49.460   6.3375   73.373   11.222  251.706   16.542  303.565   24.357 -51.85840 29.44295 
1 1 1   19   27   16 o  324.073   12.208   81.087   6.0554   74.660   6.8461  104.186   12.980  310.432   14.408  362.373   23.528 -51.94141 27.58940 
1 1 1   19   27   17 o  232.691   15.613   42.233   5.5286   37.904   6.2355   58.145   11.954  219.462   18.742  267.159   29.737 -47.69603 35.15100 
1 1 1   19   27   18 f  157.193   21.904   19.815   5.1270   19.910   5.7033   19.416   11.705  156.682   24.591  148.214   46.414 8.467911 52.52563 
1 1 1   19   27   19 o  257.939   16.702   52.036   6.5587   52.036   6.5587   0.0000   0.0000  257.939   16.702  ?   ?  0.000000 16.70212 
1 1 1   19   27   20 o  197.682   19.213   30.900   5.7400   27.773   6.5067   41.872   12.189  185.878   23.388  221.777   37.225 -35.89912 43.96227 
1 1 1   19   27   21 o  126.344   28.270   13.334   5.3305   16.603   5.9447  -0.0774   12.041  141.234   28.482   96.526   42.377 44.70737 51.05899 
1 1 1   19   27   22 o  193.129   19.614   29.589   5.7177   29.462   6.3287   30.155   13.338  191.875   21.944  181.314   47.494 10.56023 52.31789 
1 1 1   19   27   23 o  364.039   12.400  102.549   6.9095   99.658   7.7893  113.221   14.966  358.257   14.205  374.624   26.267 -16.36728 29.86183 
1 1 1   19   27   24 o  180.986   26.189   26.802   7.0439   22.945   8.3065   36.677   13.291  163.612   34.267  201.709   44.263 -38.09668 55.97746 
1 1 1   19   27   25 o  285.781   19.337   64.581   8.4089   66.229   10.393   61.458   14.308  287.043   23.872  268.810   35.655 18.23312 42.90831 
1 1 1   19   27   26 o  214.661   24.479   37.360   7.8991   47.086   9.6079   17.073   13.876  240.115   26.588  139.016   50.484 101.0989 57.05767 
1 1 1   19   27   27 o  231.406   26.192   43.760   9.1137   48.921   11.635   35.566   14.660  241.000   32.360  193.439   49.353 47.56122 59.01563 
1 1 1   19   27   28 o  252.363   24.918   51.755   9.4994   46.352   12.126   60.338   15.284  232.238   35.218  262.155   39.300 -29.91632 52.77121 
1 1 1   19   27   29 o  145.819   15.055   16.767   3.3118   17.412   3.6495   13.760   7.8825  148.240   16.357  124.759   37.920 23.48055 41.29715 
1 1 1   19   27   30 o  126.305   28.807   13.612   5.4457   20.543   7.8813   7.2791   7.5331  153.007   34.479   98.828   36.966 54.17918 50.54956 
1 1 1   19   27   31 o  255.432   15.999   51.382   6.2237   57.951   8.7534   44.667   8.8506  268.368   21.490  233.277   25.187 35.09073 33.10899 
1 1 1   19   27   32 o  153.148   15.165   18.547   3.5082   18.617   3.9057   18.259   7.9821  152.820   16.985  142.258   36.483 10.56235 40.24278 
1 1 1   19   27   33 o   93.359   25.364   7.3907   3.7188   9.7803   4.1156  -3.2395   8.6805  107.272   25.449   74.600   34.082 32.67188 42.53502 
1 1 1   19   27   34 o   56.004   23.566   0.6856   3.4356   3.9770   3.9940  -8.6794   6.7370   74.048   27.055   55.511   26.739 18.53645 38.03862 
1 1 1   19   27   35 o   72.577   25.450   4.0434   3.4951   7.9084   4.0277  -7.7399   7.0325   95.832   26.546   58.357   27.901 37.47561 38.51153 
1 1 1   19   27   36 o  218.513   12.257   37.387   4.0830   42.006   4.9069   26.988   7.3618  230.904   13.949  177.176   28.083 53.72748 31.35633 
1 1 1   19   27   37 o  171.884   16.572   23.681   4.3058   21.580   4.7198   34.108   10.514  162.702   19.331  191.300   37.246 -28.59753 41.96319 
1 1 1   19   27   38 o  244.496   10.318   46.501   3.8614   46.727   5.5458   46.288   5.3796  242.495   15.015  241.581   14.617 0.9141083 20.95528 
1 1 1   19   27   39 o  312.630   11.897   76.592   5.6928   55.235   9.5087   88.524   7.1074  255.010   24.669  334.694   13.874 -79.68431 28.30272 
1 1 1   19   27   40 o   84.192   23.690   6.1764   3.1814   3.1025   4.4631   9.3517   4.5362   70.060   27.839  101.514   28.190 -31.45457 39.61955 
1 1 1   19   27   41 o   88.184   24.395   6.8768   3.4038   2.9766   5.3420   9.5425   4.4163   72.473   29.848  102.327   27.574 -29.85454 40.63557 
1 1 1   19   27   42 o  189.515   12.422   28.488   3.5833   38.034   5.3828   20.890   4.8020  216.395   16.373  157.512   20.397 58.88347 26.15503 
1 1 1   19   28    0 o   39.053   27.308  -5.8361   6.0457  -5.8361   6.0457  -5.8361   6.0457   39.053   27.308   39.053   27.308 0.000000 0.000000 
1 1 1   19   28    1 o   69.195   27.169   2.3791   4.2037   9.0643   5.7963  -5.0380   6.1054  105.548   32.598   59.476   27.670 46.07148 42.75773 
1 1 1   19   28    2 o  375.872   11.296  108.853   6.4985  103.622   8.8381  115.010   9.5884  365.560   15.795  384.971   16.272 -19.41052 22.67770 
1 1 1   19   28    3 o  149.136   28.129   18.249   6.1856   18.249   6.1856   0.0000   0.0000  149.136   28.129  ?   ?  0.000000 28.12912 
1 1 1   19   28    4 o   75.199   30.915   1.8475   5.7179   1.8475   5.7179   0.0000   0.0000   75.199   30.915  ?   ?  0.000000 30.91499 
1 1 1   19   28    5 o  445.484   11.139  152.895   7.5956  155.668   9.7062  148.515   12.200  448.598   14.136  436.623   18.255 11.97522 23.08839 
1 1 1   19   28    6 o  259.841   13.307   52.301   5.2747   50.173   6.7301   55.688   8.4929  253.387   17.459  265.805   21.047 -12.41789 27.34589 
1 1 1   19   28    7 o  326.547   10.640   82.113   5.3180   73.879   6.3361  101.739   9.7821  309.187   13.389  361.527   17.678 -52.33981 22.17545 
1 1 1   19   28    8 o  110.035   26.740   9.9985   4.4594   3.2815   5.2404   27.632   8.4908   78.048   30.422  182.893   31.465 -104.8452 43.76722 
1 1 1   19   28    9 o  191.268   21.960   29.096   6.3123   33.995   9.1614   24.668   8.7097  203.721   30.303  171.355   34.403 32.36581 45.84576 
1 1 1   19   28   10 f  213.520   19.970   35.967   6.4509   27.011   8.8373   46.183   9.4382  179.904   33.320  239.806   26.137 -59.90158 42.34787 
1 1 1   19   28   11 o   69.298   27.761   2.0796   4.4741   3.7791   5.1814  -2.9016   8.8707   79.727   30.468   78.747   35.361 0.9799728 46.67604 
1 1 1   19   28   12 o  383.720   10.890  113.464   6.3959  111.387   7.4258  119.433   12.589  379.701   12.777  389.443   21.198 -9.741760 24.75115 
1 1 1   19   28   13 o  217.854   15.730   37.038   5.2099   36.238   5.9565   39.642   10.748  214.746   18.296  218.592   33.166 -3.845398 37.87807 
1 1 1   19   28   14 o   91.789   29.815   6.6687   4.7945   7.1165   5.4160   5.0465   10.308   95.241   31.726  102.590   41.765 -7.348289 52.44790 
1 1 1   19   28   15 o  384.842   14.877  114.907   8.7633  108.233   11.804  123.104   13.081  370.518   20.898  394.757   21.733 -24.23941 30.15073 
1 1 1   19   28   16 o  153.531   30.338   19.657   6.8766   7.4822   8.7365   39.482   11.149  104.732   39.672  216.878   34.758 -112.1458 52.74488 
1 1 1   19   28   17 f  261.599   25.813   55.086   10.201   55.086   10.201   0.0000   0.0000  261.599   25.813  ?   ?  0.000000 25.81343 
1 1 1   19   28   18 o  162.023   24.808   21.327   5.9564   21.327   5.9564   0.0000   0.0000  162.023   24.808  ?   ?  0.000000 24.80773 
1 1 1   19   28   19 o  268.213   14.720   56.031   6.0201   54.975   6.8110   59.801   12.872  264.943   16.883  268.862   31.900 -3.919189 36.09260 
1 1 1   19   28   20 o  174.074   26.602   24.806   6.8628   30.324   8.3005   12.884   12.200  191.609   29.227  127.194   47.148 64.41515 55.47240 
1 1 1   19   28   21 o   89.254   33.789   5.2413   6.3352   7.0323   7.5016   0.7870   11.830   99.319   36.940   97.081   42.327 2.238441 56.17902 
1 1 1   19   28   22 o  133.060   33.150   15.188   6.7267   19.473   8.0644   5.3881   12.195  149.887   35.668  107.647   44.783 42.23929 57.25095 
1 1 1   19   28   23 o  133.876   28.205   15.025   5.5972   18.279   6.2337   1.4889   12.715  147.849   28.580  100.871   43.933 46.97729 52.41101 
1 1 1   19   28   24 o  110.679   31.764   10.413   5.6625   14.289   6.4323  -2.9345   11.936  128.924   32.582   90.097   40.686 38.82724 52.12381 
1 1 1   19   28   25 o  187.150   22.356   28.243   6.2772   26.155   7.1508   35.256   13.105  177.932   27.113  196.247   44.637 -18.31493 52.22620 
1 1 1   19   28   26 o  165.047   33.774   23.497   8.2446   21.355   10.531   26.889   13.251  152.634   43.155  168.028   48.698 -15.39441 65.06805 
1 1 1   19   28   27 o  177.225   33.373   27.010   8.7207   16.517   11.128   43.707   14.038  135.018   45.478  219.170   43.383 -84.15186 62.85155 
1 1 1   19   28   28 o  255.382   18.876   51.801   7.3264   43.566   8.3661   78.897   15.175  231.516   23.955  304.875   33.048 -73.35860 40.81670 
1 1 1   19   28   29 o  209.645   18.395   34.972   5.8431   32.119   8.3339   37.729   8.1947  195.683   28.675  214.201   25.495 -18.51790 38.37018 
1 1 1   19   28   30 o  258.431   10.849   51.724   4.2914   52.789   4.9647   48.577   8.5342  260.591   12.447  244.501   23.077 16.09013 26.21973 
1 1 1   19   28   31 o   97.898   23.002   8.0357   3.3883   9.0289   3.8122   4.3006   7.3932  103.422   24.465   87.709   35.492 15.71362 43.10716 
1 1 1   19   28   32 o  174.346   14.947   24.018   3.9503   21.356   4.2902   38.842   10.125  163.408   17.422  211.450   32.310 -48.04225 36.70783 
1 1 1   19   28   33 o  171.302   13.896   23.128   3.6121   22.326   4.2155   25.344   7.0067  167.224   16.692  172.656   27.431 -5.431412 32.11040 
1 1 1   19   28   34 o  162.669   15.014   20.998   3.6961   22.702   4.3505   16.577   7.0075  168.316   17.125  135.086   33.935 33.23000 38.01110 
1 1 1   19   28   35 o  111.130   23.762   10.495   3.9196   13.059   4.2683  -3.3016   9.9001  124.523   23.249   78.291   36.000 46.23296 42.85479 
1 1 1   19   28   36 o   47.931   21.826  -1.7039   3.5229  -2.1476   4.1352  -0.5299   6.7272   51.206   23.442   70.095   31.181 -18.88911 39.01037 
1 1 1   19   28   37 o  105.331   23.393   9.5257   3.6733   9.4596   4.2604   9.7173   7.2511  103.573   26.703  103.210   36.613 0.3635941 45.31664 
1 1 1   19   28   38 o  276.018   11.834   59.717   4.9995   82.415   6.5586   28.234   7.7242  323.289   13.254  177.905   29.392 145.3839 32.24234 
1 1 1   19   28   39 o  130.871   17.758   14.078   3.4653   18.298   4.8981   9.8497   4.9032  146.636   22.545  103.484   29.512 43.15163 37.13818 
1 1 1   19   28   40 o   94.859   23.649   7.9201   3.4217   9.6653   5.3369   6.7020   4.4588  101.278   31.279   86.570   28.783 14.70731 42.50704 
1 1 1   19   28   41 o  108.795   21.350   10.183   3.4284   9.5060   5.0054   10.781   4.7055  100.457   30.147  108.020   28.168 -7.563286 41.25868 
1 1 1   19   29    0 o   90.781   41.613   9.5434   6.3168   9.5434   6.3168   9.5434   6.3168   90.781   41.613   90.781   41.613 0.000000 0.000000 
1 1 1   19   29    1 o   44.758   21.554  -6.4075   4.3722  -3.0625   6.0475 -10.0704   6.3284   63.253   28.722   52.351   25.386 10.90148 38.33309 
1 1 1   19   29    2 o  603.578   10.505  280.541   9.7052  271.242   13.282  291.194   14.216  591.759   14.664  612.889   15.154 -21.12946 21.08723 
1 1 1   19   29    3 o   98.979   29.034   8.0218   4.6850   6.0517   6.1447   10.757   7.2406   92.629   33.602  114.518   36.584 -21.88864 49.67356 
1 1 1   19   29    4 f  284.822   12.915   62.672   5.6302   62.408   7.4679   63.020   8.5699  282.656   17.345  283.146   19.901 -0.4893188 26.39852 
1 1 1   19   29    5 o  270.461   17.430   57.175   7.1773   57.175   7.1773   0.0000   0.0000  270.461   17.430  ?   ?  0.000000 17.43038 
1 1 1   19   29    6 o  252.219   18.274   49.863   7.0068   49.863   7.0068   0.0000   0.0000  252.219   18.274  ?   ?  0.000000 18.27379 
1 1 1   19   29    7 o   89.797   29.832   6.2593   4.7900   6.2593   4.7900   0.0000   0.0000   89.797   29.832  ?   ?  0.000000 29.83192 
1 1 1   19   29    8 o   75.248   27.546   3.7767   4.1430   4.5323   4.7568   1.4023   8.4321   81.278   29.552   86.396   36.667 -5.118141 47.09315 
1 1 1   19   29    9 o  512.933   7.9927  202.121   6.2752  196.353   6.9645  227.008   14.466  505.303   9.0047  539.718   17.512 -34.41431 19.69110 
1 1 1   19   29   10 o   73.404   25.666   3.8852   3.5535   5.3923   3.8616  -4.4470   9.0799   82.914   26.741   76.634   34.951 6.280571 44.00739 
1 1 1   19   29   11 o   53.515   23.211  -0.3429   3.5195   0.5504   3.8089  -5.5604   9.2051   59.000   24.819   75.202   34.629 -16.20170 42.60493 
1 1 1   19   29   12 o   84.990   25.922   5.8117   3.6790   5.6968   3.9858   6.4733   9.5625   84.871   27.146  104.044   40.937 -19.17348 49.11971 
1 1 1   19   29   13 o  422.970   8.6846  137.572   5.6225  132.139   6.1202  166.962   14.234  414.302   9.6511  461.167   20.166 -46.86505 22.35615 
1 1 1   19   29   14 o  168.010   25.530   22.949   6.3587   22.230   7.7988   24.376   10.983  162.558   32.480  165.815   42.934 -3.256668 53.83568 
1 1 1   19   29   15 o  192.189   23.052   29.628   6.6459   29.289   8.2622   30.249   11.186  188.365   29.636  186.132   40.420 2.232361 50.12064 
1 1 1   19   29   16 o  401.260   18.020  125.927   11.067  125.927   11.067   0.0000   0.0000  401.260   18.020  ?   ?  0.000000 18.01987 
1 1 1   19   29   17 o  269.880   18.252   57.266   7.4954   58.079   9.2760   55.735   12.723  269.881   22.665  258.792   32.861 11.08902 39.91895 
1 1 1   19   29   18 o  453.453   21.764  162.632   15.105   0.0000   0.0000  162.632   15.105  ?   ?   453.453   21.764 0.000000 21.76353 
1 1 1   19   29   19 o  128.444   36.607   14.278   7.5467   13.628   9.7019   15.275   12.009  126.367   42.464  133.610   47.147 -7.242989 63.45117 
1 1 1   19   29   20 o   69.717   31.564  -2.9418   7.2377  -9.4210   9.2258   7.4276   11.671   68.687   32.588  111.056   44.715 -42.36979 55.33003 
1 1 1   19   29   21 o   73.995   29.959   2.3767   5.2706   0.3440   5.9345   9.9669   11.468   70.795   30.420  116.982   45.169 -46.18707 54.45748 
1 1 1   19   29   22 o  177.459   21.924   25.346   5.8286   21.650   6.6358   37.825   12.193  161.416   27.866  207.238   39.887 -45.82190 48.65655 
1 1 1   19   29   23 o  183.255   22.264   27.077   6.1166   26.594   6.9331   28.771   12.992  180.026   25.907  175.222   47.326 4.804199 53.95336 
1 1 1   19   29   24 o  129.462   30.977   14.353   6.0562   18.232   6.9135   1.5539   12.557  145.855   31.859   99.806   43.559 46.04817 53.96646 
1 1 1   19   29   25 o  103.212   38.188   8.0932   7.9965   16.734   10.197  -5.7062   12.887  135.874   43.416   88.609   40.864 47.26520 59.62288 
1 1 1   19   29   26 o  184.179   24.124   27.714   6.6373   25.918   7.5194   34.051   14.123  175.650   28.979  188.212   48.665 -12.56268 56.63950 
1 1 1   19   29   27 o  114.481   34.330   11.421   6.4926   9.0639   7.3780   19.510   13.669  105.090   36.969  143.184   50.324 -38.09446 62.44355 
1 1 1   19   29   28 o  192.137   23.763   30.208   6.8394   27.744   7.9758   37.053   13.295  180.763   29.870  198.292   44.853 -17.52901 53.88863 
1 1 1   19   29   29 o  166.015   27.466   23.216   6.7351   25.108   8.3329   19.651   11.438  169.349   33.334  142.872   46.017 26.47714 56.82216 
1 1 1   19   29   30 o   50.915   24.263  -5.9534   5.2283 -11.0742   8.1615  -2.3892   6.8089   60.010   29.034   67.394   30.554 -7.384621 42.14915 
1 1 1   19   29   31 o  272.885   11.282   57.850   4.7123   58.098   5.2336   56.790   10.831  272.997   12.525  259.809   27.662 13.18814 30.36515 
1 1 1   19   29   32 o  216.523   12.988   36.757   4.2845   39.412   4.7168   24.235   10.244  223.877   13.833  158.638   41.655 65.23906 43.89178 
1 1 1   19   29   33 o  290.737   16.952   67.325   7.5112   76.695   10.394   57.081   10.867  306.064   22.341  259.248   27.821 46.81610 35.68064 
1 1 1   19   29   34 o  324.880   21.365   86.184   10.565   86.184   10.565   0.0000   0.0000  324.880   21.365  ?   ?  0.000000 21.36507 
1 1 1   19   29   35 o  145.057   17.023   16.998   3.7077   22.154   4.4478   5.2539   6.7128  165.417   17.850   86.535   34.219 78.88180 38.59445 
1 1 1   19   29   36 o  154.100   17.180   19.246   3.9833   24.118   4.8832   9.5582   6.8862  171.740   18.889  102.121   35.728 69.61955 40.41367 
1 1 1   19   29   37 o  214.005   13.813   36.363   4.5003   46.752   5.7029   19.215   7.3268  241.661   15.499  142.297   34.088 99.36436 37.44596 
1 1 1   19   29   38 o   50.609   22.617  -0.8009   3.5831   1.7442   4.2656  -6.9007   6.6036   63.676   26.487   55.933   26.820 7.743015 37.69469 
1 1 1   19   29   39 o  166.001   21.498   23.309   5.3341   23.309   5.3341   0.0000   0.0000  166.001   21.498  ?   ?  0.000000 21.49830 
1 1 1   19   30    0 o  300.435   18.180   70.512   8.2902   70.512   8.2902   70.512   8.2902  300.435   18.180  300.435   18.180 0.000000 0.000000 
1 1 1   19   30    1 o  284.979   13.434   62.831   5.8598   66.851   8.4268   59.067   8.1538  291.822   18.969  274.014   19.570 17.80771 27.25423 
1 1 1   19   30    2 o  395.458   11.639  120.666   7.0452  116.892   9.6933  124.892   10.258  387.700   16.335  400.592   16.729 -12.89172 23.38118 
1 1 1   19   30    3 o  126.565   26.234   13.196   4.9153   16.084   6.6043   9.6092   7.3592  138.262   31.862  109.633   36.983 28.62910 48.81487 
1 1 1   19   30    4 o  372.360   11.768  107.008   6.7073  104.751   9.0654  109.739   9.9702  367.062   16.135  375.239   17.359 -8.176636 23.69993 
1 1 1   19   30    5 o  137.579   23.926   15.379   4.8555   19.924   6.2197   8.2869   7.7696  155.943   27.037  105.278   37.841 50.66490 46.50732 
1 1 1   19   30    6 o  297.948   13.473   68.700   6.1445   62.719   7.6406   79.650   10.338  283.018   17.727  317.493   21.398 -34.47534 27.78696 
1 1 1   19   30    7 o   95.874   30.175   7.4263   4.9405   3.9406   6.0385   14.484   8.5927   83.743   32.653  130.106   39.602 -46.36240 51.32725 
1 1 1   19   30    8 o  410.543   15.034  130.821   9.4472  130.821   9.4472   0.0000   0.0000  410.543   15.034  ?   ?  0.000000 15.03398 
1 1 1   19   30    9 o  221.506   15.705   38.320   5.2903   38.320   5.2903   0.0000   0.0000  221.506   15.705  ?   ?  0.000000 15.70545 
1 1 1   19   30   10 o  407.033   10.114  127.631   6.3012  133.320   7.0904  106.257   13.743  415.715   11.143  364.728   24.764 50.98685 27.15578 
1 1 1   19   30   11 o  438.375   9.6404  147.969   6.4686  147.075   7.4276  150.774   13.161  436.615   11.114  438.363   19.615 -1.747955 22.54509 
1 1 1   19   30   12 o  329.652   9.6766   83.686   4.8826   81.036   5.3391   97.222   12.067  324.154   10.761  349.829   22.658 -25.67535 25.08321 
1 1 1   19   30   13 o  160.636   16.459   20.308   3.9897   19.367   4.3035   26.061   10.643  156.315   18.335  171.987   41.006 -15.67233 44.91869 
1 1 1   19   30   14 o   64.942   28.883  -1.5319   5.7697  -1.5319   5.7697   0.0000   0.0000   64.942   28.883  ?   ?  0.000000 28.88342 
1 1 1   19   30   15 o  364.068   14.005  102.839   7.8042  102.839   7.8042   0.0000   0.0000  364.068   14.005  ?   ?  0.000000 14.00478 
1 1 1   19   30   16 o  301.360   13.329   70.395   6.1482   65.780   7.0349   85.316   12.650  290.129   15.902  325.414   25.605 -35.28445 30.14087 
1 1 1   19   30   17 o  177.696   20.955   25.256   5.5899   21.555   6.4679   36.178   11.111  161.654   27.099  205.175   36.730 -43.52083 45.64517 
1 1 1   19   30   18 o   63.862   27.880  -0.4973   5.1475  -0.7657   5.8200   0.4670   11.031   67.080   29.455   93.346   40.781 -26.26536 50.30582 
1 1 1   19   30   19 o   63.357   28.062  -1.1854   5.3916  -2.1130   6.0651   2.3087   11.772   64.991   29.207   99.456   42.793 -34.46487 51.80995 
1 1 1   19   30   20 o  160.098   24.375   20.934   5.7845   17.316   6.4793   35.143   12.840  142.886   30.551  196.958   43.730 -54.07210 53.34457 
1 1 1   19   30   21 o   75.602   33.299  -0.7709   7.4894   1.7995   9.7535  -4.4639   11.691   91.110   39.070   86.495   39.530 4.615013 55.57979 
1 1 1   19   30   22 o  143.320   35.575   17.997   7.7677   9.3372   10.377   29.035   11.715  112.318   43.070  178.180   43.365 -65.86235 61.11950 
1 1 1   19   30   23 o  134.690   37.953   16.140   8.1597   13.732   10.495   19.821   12.975  125.700   44.099  145.531   49.106 -19.83170 66.00138 
1 1 1   19   30   24 o  124.390   38.635   13.708   8.1294   5.6667   10.455   26.004   12.929  101.926   41.841  164.543   48.221 -62.61671 63.84338 
1 1 1   19   30   25 o  114.936   33.632   11.499   6.2933   12.231   7.0549   8.6464   13.926  118.053   35.872  116.401   48.092 1.651604 59.99685 
1 1 1   19   30   26 o  167.324   27.689   23.510   6.8435   25.614   7.9434   17.449   13.479  172.877   31.166  136.751   49.742 36.12575 58.69904 
1 1 1   19   30   27 o   84.335   33.329   4.2852   6.3650   3.5719   7.7379   5.7778   11.193   86.925   35.876  102.899   42.863 -15.97417 55.89564 
1 1 1   19   30   28 o  184.213   23.934   27.960   6.5889   34.154   8.4728   18.484   10.480  201.185   28.296  139.133   43.969 62.05219 52.28692 
1 1 1   19   30   29 o  185.053   24.609   28.424   6.7977   34.992   8.6556   17.854   10.981  202.953   28.661  135.713   45.172 67.24026 53.49737 
1 1 1   19   30   30 o  176.678   34.611   27.966   9.0251   27.966   9.0251   0.0000   0.0000  176.678   34.611  ?   ?  0.000000 34.61135 
1 1 1   19   30   31 o  216.345   17.836   37.493   5.8537   37.236   8.9533   37.685   7.7362  208.470   28.830  213.065   24.148 -4.595245 37.60755 
1 1 1   19   30   32 o  145.643   16.577   17.022   3.6296   17.312   4.2298   16.212   7.0689  145.664   19.458  132.887   34.463 12.77676 39.57636 
1 1 1   19   30   33 o  147.824   16.823   17.597   3.7386   24.012   4.4183   1.4220   7.0156  172.891   16.912   76.314   32.935 96.57685 37.02327 
1 1 1   19   30   34 o  254.217   11.302   50.446   4.3979   58.619   5.3890   34.149   7.6099  273.238   12.885  200.290   25.393 72.94824 28.47525 
1 1 1   19   30   35 o  112.416   22.373   10.776   3.7142   13.360   4.3423   3.7324   7.1698  124.825   23.592   82.123   34.265 42.70119 41.60151 
1 1 1   19   30   36 o  292.806   12.677   67.518   5.6814   67.518   5.6814   0.0000   0.0000  292.806   12.677  ?   ?  0.000000 12.67656 
1 1 1   19   30   37 o  178.429   21.906   26.887   5.8571   30.637   9.1147   24.249   7.6444  179.230   34.477  161.137   32.121 18.09348 47.12120 
1 1 1   19   30   38 o  122.360   23.570   13.045   4.2543   18.305   5.4147   4.5606   6.8771  144.099   25.482   82.151   33.854 61.94788 42.37235 
1 1 1   19   31    0 o  120.228   43.209   15.200   7.2762   15.200   7.2762   15.200   7.2762  120.228   43.209  120.228   43.209 0.000000 0.000000 
1 1 1   19   31    1 o  318.417   12.639   78.393   6.1602   79.829   8.5787   76.864   8.8513  319.333   17.619  312.947   18.561 6.386536 25.59243 
1 1 1   19   31    2 o   69.329   28.419   1.6518   4.8143  -3.6235   6.6225   7.5641   7.0110   65.197   29.779  100.558   35.967 -35.36036 46.69491 
1 1 1   19   31    3 o  282.839   14.026   62.004   6.0722   69.570   8.3204   53.383   8.8818  297.745   18.346  258.954   22.636 38.79156 29.13695 
1 1 1   19   31    4 o   64.196   27.438   0.2466   4.7816  -1.3082   6.2554   2.4320   7.4163   68.466   30.280   84.486   35.016 -16.01959 46.29281 
1 1 1   19   31    5 o  299.573   13.365   69.486   6.1282   68.667   8.0649   70.606   9.4266  295.946   17.888  298.901   20.733 -2.955200 27.38290 
1 1 1   19   31    6 o  333.059   10.860   85.556   5.5365   80.388   6.4889   99.386   10.615  322.263   13.155  355.391   19.590 -33.12863 23.59715 
1 1 1   19   31    7 o  530.939   9.4416  217.020   7.6729  206.245   9.0568  244.419   14.442  516.874   11.448  559.858   16.854 -42.98419 20.37387 
1 1 1   19   31    8 o  433.286   9.8444  144.614   6.5288  142.977   7.7261  148.703   12.210  430.241   11.732  435.918   18.299 -5.676697 21.73709 
1 1 1   19   31    9 o  451.849   8.4398  157.009   5.8371  155.475   6.5736  162.726   12.692  449.331   9.5580  456.016   18.183 -6.685120 20.54240 
1 1 1   19   31   10 o  158.032   17.984   19.772   4.2725   19.772   4.2725   0.0000   0.0000  158.032   17.984  ?   ?  0.000000 17.98361 
1 1 1   19   31   11 o  634.745   9.1537  310.156   8.8934  310.156   8.8934   0.0000   0.0000  634.745   9.1537  ?   ?  0.000000 9.153740 
1 1 1   19   31   12 o  187.481   16.070   27.584   4.5670   27.584   4.5670   0.0000   0.0000  187.481   16.070  ?   ?  0.000000 16.07010 
1 1 1   19   31   13 o  426.370   12.993  140.832   8.4797  140.832   8.4797   0.0000   0.0000  426.370   12.993  ?   ?  0.000000 12.99338 
1 1 1   19   31   14 o  169.000   16.509   22.496   4.2160   22.625   4.5526   21.722   11.172  169.084   17.861  154.769   44.674 14.31464 48.11238 
1 1 1   19   31   15 o  230.664   16.597   41.764   5.8207   43.469   6.6787   36.376   11.871  234.547   18.760  203.896   39.463 30.65112 43.69574 
1 1 1   19   31   16 o  174.499   21.391   24.439   5.5937   35.999   6.5003  -8.5504   10.981  212.707   20.208   77.797   36.490 134.9100 41.71239 
1 1 1   19   31   17 o  261.757   15.737   53.637   6.2760   54.870   7.1944   49.712   12.837  263.892   17.918  241.153   35.869 22.73889 40.09491 
1 1 1   19   31   18 o  249.426   16.604   48.867   6.3029   54.352   7.4051   34.446   12.007  262.282   18.566  196.468   41.243 65.81471 45.22892 
1 1 1   19   31   19 o   55.222   25.923  -5.1036   5.5616  -3.0766   6.4090 -11.2845   11.191   64.624   29.431   74.761   35.591 -10.13665 46.18373 
1 1 1   19   31   20 o   69.908   29.903   0.5761   5.6879  -3.9970   6.4756   16.019   11.900   62.971   29.015  134.070   46.963 -71.09941 55.20279 
1 1 1   19   31   21 o  173.432   23.618   24.517   6.1065   24.397   6.9923   24.903   12.535  171.160   27.631  161.933   47.490 9.226501 54.94311 
1 1 1   19   31   22 o   97.855   37.672   6.6309   7.9588   8.3547   10.253   4.0178   12.624  108.531   42.484  104.120   44.543 4.411423 61.55517 
1 1 1   19   31   23 o  102.107   38.624   7.7602   8.2739   6.7114   10.689   9.3278   13.068  104.795   42.580  116.248   47.136 -11.45307 63.52073 
1 1 1   19   31   24 o  174.002   33.750   26.397   8.6642   23.538   11.534   30.098   13.126  156.983   45.416  176.113   47.571 -19.13031 65.76920 
1 1 1   19   31   25 o  151.565   36.860   20.718   8.4689   29.261   12.192   12.753   11.773  174.669   45.240  121.871   46.080 52.79797 64.57576 
1 1 1   19   31   26 o   72.780   32.967  -2.4307   7.9070   1.9491   11.518  -6.3349   10.874   95.144   41.615   78.742   36.731 16.40253 55.50677 
1 1 1   19   31   27 o  146.525   29.598   18.572   6.4096   34.566   8.0249  -9.6092   10.652  203.234   26.422   73.024   34.753 130.2098 43.65692 
1 1 1   19   31   28 o  191.713   23.406   30.324   6.7257   38.645   8.4877   16.282   11.026  214.719   26.380  130.037   45.225 84.68234 52.35683 
1 1 1   19   31   29 o  137.777   37.987   17.769   8.2694   17.769   8.2694   0.0000   0.0000  137.777   37.987  ?   ?  0.000000 37.98657 
1 1 1   19   31   30 o   96.213   34.744   7.6941   6.5591   11.487   8.5355   2.2249   10.250  112.412   39.740   90.127   39.344 22.28436 55.92174 
1 1 1   19   31   31 o   85.963   33.951   5.0335   6.6008  -2.9758   8.7887   15.397   9.9974   74.249   34.059  125.139   43.090 -50.88974 54.92549 
1 1 1   19   31   32 o  240.610   16.664   46.360   6.0995   63.044   9.7221   35.530   7.8328  275.176   23.301  204.457   25.590 70.71919 34.60878 
1 1 1   19   31   33 o  164.115   14.897   21.513   3.7013   21.076   4.3064   22.749   7.2409  161.031   17.768  158.751   30.911 2.279907 35.65396 
1 1 1   19   31   34 o  215.535   12.755   36.677   4.1891   41.108   5.0645   27.075   7.4544  227.138   14.645  174.440   28.933 52.69814 32.42823 
1 1 1   19   31   35 o   40.701   19.526  -4.3872   3.5094  -4.0870   4.0263  -5.3362   7.1595   45.272   21.493   61.301   28.973 -16.02917 36.07458 
1 1 1   19   31   36 o   88.091   25.809   6.9115   3.7040   8.2677   4.3966   3.5952   6.8752   95.239   28.180   79.584   33.405 15.65519 43.70359 
1 1 1   19   32    0 o  140.682   41.015   19.200   7.6682   19.200   7.6682   19.200   7.6682  140.682   41.015  140.682   41.015 0.000000 0.000000 
1 1 1   19   32    1 o  102.619   30.348   8.7537   5.1003   8.2831   6.9680   9.2968   7.4855  103.027   35.946  107.997   37.280 -4.969231 51.78705 
1 1 1   19   32    2 o   89.308   30.582   6.1316   5.0329   6.1307   7.0029   6.1326   7.2381   94.831   35.608   95.542   36.130 -0.7112198 50.72718 
1 1 1   19   32    3 o  208.898   17.926   34.375   5.6761   29.308   7.7059   40.385   8.3925  189.174   27.412  223.737   24.931 -34.56297 37.05320 
1 1 1   19   32    4 o  201.276   18.598   32.002   5.6649   26.202   7.6015   39.246   8.4958  178.038   28.884  220.157   25.695 -42.11870 38.65911 
1 1 1   19   32    5 o   63.902   27.675  -0.2075   4.9890  -1.8578   6.4662   2.2202   7.8425   68.124   30.418   85.404   35.753 -17.28054 46.94148 
1 1 1   19   32    6 o   63.157   26.371   0.9295   4.2512  -0.5776   5.0516   4.5872   7.8700   63.153   27.593   92.380   36.886 -29.22742 46.06457 
1 1 1   19   32    7 o  150.871   20.399   18.230   4.5898   12.737   5.3661   33.204   8.8595  123.089   28.965  200.274   29.810 -77.18472 41.56424 
1 1 1   19   32    8 o  229.913   14.583   41.233   5.1055   40.788   6.0356   42.352   9.5726  227.744   17.447  227.433   28.096 0.3109741 33.07199 
1 1 1   19   32    9 f  115.728   30.272   11.328   5.4236   11.328   5.4236   0.0000   0.0000  115.728   30.272  ?   ?  0.000000 30.27192 
1 1 1   19   32   10 o  304.247   11.937   71.588   5.5589   71.588   5.5589   0.0000   0.0000  304.247   11.937  ?   ?  0.000000 11.93699 
1 1 1   19   32   11 o  158.900   17.611   19.995   4.2112   20.976   4.6266   15.256   10.169  162.371   18.974  132.104   43.447 30.26755 47.40889 
1 1 1   19   32   12 o  208.602   13.661   33.913   4.3378   34.974   4.7234   28.197   10.961  211.564   14.677  177.947   41.076 33.61673 43.61945 
1 1 1   19   32   13 f  225.740   14.531   39.791   4.9940   39.791   4.9940   0.0000   0.0000  225.740   14.531  ?   ?  0.000000 14.53052 
1 1 1   19   32   14 o  308.745   11.661   73.734   5.5108   73.734   5.5108   0.0000   0.0000  308.745   11.661  ?   ?  0.000000 11.66131 
1 1 1   19   32   15 o  215.096   20.447   36.888   6.6507   36.888   6.6507   0.0000   0.0000  215.096   20.447  ?   ?  0.000000 20.44668 
1 1 1   19   32   16 o  255.326   15.960   51.118   6.2060   52.916   7.0613   45.016   13.009  258.994   17.923  226.815   38.869 32.17923 42.80210 
1 1 1   19   32   17 o   87.146   31.338   5.6271   5.3292   4.9584   6.0045   8.1081   11.566   86.481   32.858  111.464   44.642 -24.98283 55.43067 
1 1 1   19   32   18 o  237.570   17.231   44.521   6.2231   42.859   7.1815   49.533   12.469  231.663   20.463  240.291   34.924 -8.627808 40.47798 
1 1 1   19   32   19 o   78.404   31.372   3.1667   5.7062   7.2440   6.5250 -10.0892   11.765   96.698   34.686   78.228   37.024 18.46980 50.73325 
1 1 1   19   32   20 o  248.094   17.694   48.692   6.6750   45.661   7.7338   57.542   13.217  238.414   21.421  259.078   34.162 -20.66400 40.32306 
1 1 1   19   32   21 o  129.085   38.734   15.000   8.2633   8.3565   11.054   23.416   12.441  109.715   43.744  155.738   47.700 -46.02393 64.72111 
1 1 1   19   32   22 o  102.650   33.720   8.9223   6.1262   12.775   7.0605  -2.8141   12.323  120.020   35.756   90.006   40.921 30.01361 54.34182 
1 1 1   19   32   23 o   88.321   33.300   5.5714   6.1372   7.3962   7.0979   0.1662   12.216   97.625   36.007   94.325   41.985 3.300919 55.31049 
1 1 1   19   32   24 o  142.229   29.596   17.456   6.2334   25.442   7.2958  -4.1336   11.995  173.075   28.535   86.110   39.607 86.96535 48.81551 
1 1 1   19   32   25 o  259.234   17.922   53.554   7.0678   61.055   8.6344   38.324   12.304  275.115   20.655  202.843   41.039 72.27135 45.94426 
1 1 1   19   32   26 o  163.232   27.468   22.662   6.6191   22.526   8.1466   22.927   11.354  158.322   34.585  152.122   45.348 6.200058 57.03164 
1 1 1   19   32   27 o  144.290   48.818   21.411   12.823   21.411   12.823   0.0000   0.0000  144.290   48.818  ?   ?  0.000000 48.81774 
1 1 1   19   32   28 o  128.321   47.749   16.197   12.537   16.197   12.537   0.0000   0.0000  128.321   47.749  ?   ?  0.000000 47.74920 
1 1 1   19   32   29 o  101.263   38.451   8.5032   8.2197   31.839   13.282  -5.9820   10.464  174.066   48.202   76.095   35.669 97.97079 59.96455 
1 1 1   19   32   30 o  251.078   19.133   51.116   7.2975   68.519   9.7475   28.922   11.008  288.092   22.278  170.142   42.416 117.9496 47.91060 
1 1 1   19   32   31 o   87.360   33.723   5.8488   6.3909   5.2231   8.2174   6.8065   10.167   89.774   37.002   98.154   40.866 -8.379456 55.12844 
1 1 1   19   32   32 o   80.396   32.891   3.9304   6.4330   10.579   8.3491  -5.7834   10.092  105.992   39.058   73.426   34.609 32.56617 52.18538 
1 1 1   19   32   33 o   75.056   30.500   3.3997   5.4847  -5.7851   8.4905   9.9771   7.1850   66.721   31.539  102.756   36.447 -36.03506 48.19833 
1 1 1   19   32   34 o  138.556   19.103   15.935   3.9437   19.629   4.7474   7.7120   7.0840  152.931   20.822   93.651   35.664 59.27966 41.29757 
1 1 1   19   33    0 o   45.208   31.241  -5.2583   7.3173  -5.2583   7.3173  -5.2583   7.3173   45.208   31.241   45.208   31.241 0.000000 0.000000 
1 1 1   19   33    1 f  150.805   24.558   18.580   5.4735   18.880   7.6089   18.258   7.8796  148.180   34.236  145.114   35.716 3.066544 49.47506 
1 1 1   19   33    2 o  101.994   31.101   8.6515   5.2963   9.0379   7.5138   8.2700   7.4665  106.680   37.321  103.659   37.112 3.021584 52.63251 
1 1 1   19   33    3 o   64.009   28.180  -0.9018   5.3579 -13.8350   7.4865   12.677   7.6712   54.004   26.493  121.500   37.497 -67.49574 45.91177 
1 1 1   19   33    4 o  172.458   21.248   23.843   5.4902   26.625   7.3805   20.395   8.2149  179.707   27.724  153.448   35.656 26.25914 45.16549 
1 1 1   19   33    5 o  261.117   16.078   53.382   6.3946   49.317   8.4846   58.728   9.7294  248.238   22.577  270.442   23.744 -22.20413 32.76473 
1 1 1   19   33    6 o  260.114   13.606   52.643   5.3981   49.678   6.4120   59.858   10.002  251.600   16.746  272.753   24.210 -21.15303 29.43701 
1 1 1   19   33    7 o  206.740   20.136   34.009   6.2909   34.009   6.2909   0.0000   0.0000  206.740   20.136  ?   ?  0.000000 20.13567 
1 1 1   19   33    8 o  162.535   24.407   21.541   5.8843   21.541   5.8843   0.0000   0.0000  162.535   24.407  ?   ?  0.000000 24.40670 
1 1 1   19   33    9 o  310.811   12.604   74.848   5.9963   82.848   7.0884   54.719   11.244  326.469   14.185  257.780   29.000 68.68845 32.28348 
1 1 1   19   33   10 o  256.628   14.859   51.441   5.8117   48.599   6.6943   60.140   11.711  248.352   17.727  270.440   28.731 -22.08792 33.75930 
1 1 1   19   33   11 o  243.186   12.588   45.951   4.6696   45.769   5.1505   46.794   11.067  242.288   13.947  236.606   31.330 5.682159 34.29458 
1 1 1   19   33   12 o  308.840   10.991   73.717   5.1957   73.971   5.7283   72.535   12.339  309.050   12.110  297.868   27.369 11.18179 29.92830 
1 1 1   19   33   13 o  163.361   17.719   21.182   4.3595   20.039   4.7396   27.463   11.111  158.064   20.040  173.993   42.162 -15.92842 46.68222 
1 1 1   19   33   14 o  226.797   13.487   40.111   4.6607   37.820   5.0767   52.394   11.756  219.653   15.193  249.874   31.432 -30.22121 34.91164 
1 1 1   19   33   15 o  250.909   16.498   49.523   6.3008   51.355   7.1475   43.133   13.347  254.669   18.461  219.384   41.261 35.28508 45.20285 
1 1 1   19   33   16 o  307.855   16.455   74.488   7.7259   74.488   7.7259   0.0000   0.0000  307.855   16.455  ?   ?  0.000000 16.45549 
1 1 1   19   33   17 o  195.555   23.431   31.113   6.8739   31.113   6.8739   0.0000   0.0000  195.555   23.431  ?   ?  0.000000 23.43132 
1 1 1   19   33   18 o  165.466   28.324   23.039   6.9157   23.039   6.9157   0.0000   0.0000  165.466   28.324  ?   ?  0.000000 28.32444 
1 1 1   19   33   19 o  152.349   35.408   20.601   8.0997   27.999   10.781   11.012   12.273  174.487   41.052  118.454   46.450 56.03372 61.99071 
1 1 1   19   33   20 f  103.655   33.825   9.1650   6.1682   0.0301   7.0099   40.498   12.983   74.408   32.508  209.689   41.915 -135.2811 53.04379 
1 1 1   19   33   21 o   71.484   30.729   0.7130   6.0597  -1.6572   6.9431   8.2907   12.414   69.858   31.332  111.101   45.599 -41.24243 55.32613 
1 1 1   19   33   22 o  268.386   16.907   57.090   6.9097   47.580   8.0768   83.048   13.344  242.012   22.046  315.004   27.967 -72.99220 35.61147 
1 1 1   19   33   23 o   62.177   28.545  -3.2033   6.1911  -4.0371   7.2642  -0.9901   11.835   66.236   30.594   90.210   40.646 -23.97453 50.87284 
1 1 1   19   33   24 o  245.377   18.520   48.208   6.9047   52.348   8.3595   39.322   12.248  253.678   21.739  205.493   40.381 48.18503 45.86103 
1 1 1   19   33   25 o   80.631   32.705   3.5432   6.2936  -1.5447   7.3799   17.110   12.051   71.582   32.189  131.842   47.155 -60.25959 57.09364 
1 1 1   19   33   26 o  235.227   24.133   45.919   8.5659   45.919   8.5659   0.0000   0.0000  235.227   24.133  ?   ?  0.000000 24.13297 
1 1 1   19   33   27 o  283.233   16.932   64.031   7.3067   76.331   9.2565   43.698   11.901  307.046   19.802  217.694   37.044 89.35130 42.00433 
1 1 1   19   33   28 o   63.996   28.947  -1.6983   6.0716   0.7821   7.5606  -6.2032   10.189   76.691   33.626   74.226   34.922 2.464279 48.47963 
1 1 1   19   33   29 o  168.443   25.405   24.284   6.3464   23.585   8.1298   25.374   10.154  159.281   34.356  158.921   41.349 0.3599396 53.75948 
1 1 1   19   33   30 o   51.554   25.543 -14.8186   7.5717  -8.9918   11.815 -18.8797   9.8635   75.427   36.090   58.142   28.867 17.28518 46.21435 
1 1 1   19   33   31 o   73.975   34.335  -3.3326   9.3153   0.0000   0.0000  -3.3326   9.3153  ?   ?    73.975   34.335 0.000000 34.33518 
1 1 1   19   33   32 o  143.073   42.459   21.891   9.9699   0.0000   0.0000   21.891   9.9699  ?   ?   143.073   42.459 0.000000 42.45894 
1 1 1   19   33   33 o  104.950   36.877   10.777   7.3399   4.8272   11.545   14.814   9.5091   93.666   41.295  117.927   41.918 -24.26147 58.84254 
1 1 1   19   34    0 o  189.606   30.457   30.418   8.1551   30.418   8.1551   30.418   8.1551  189.606   30.457  189.606   30.457 0.000000 0.000000 
1 1 1   19   34    1 o  184.526   20.904   27.265   5.8001   27.642   8.3133   26.908   8.0961  181.238   31.087  178.980   30.656 2.258392 43.65979 
1 1 1   19   34    2 o  202.845   19.069   32.657   5.8511   36.875   8.2663   28.423   8.2833  212.580   25.943  184.140   30.453 28.44016 40.00565 
1 1 1   19   34    3 o  310.338   19.360   76.177   9.1502   76.177   9.1502   0.0000   0.0000  310.338   19.360  ?   ?  0.000000 19.35966 
1 1 1   19   34    4 o  150.222   34.582   19.557   7.7869   19.557   7.7869   0.0000   0.0000  150.222   34.582  ?   ?  0.000000 34.58197 
1 1 1   19   34    5 f   89.770   32.642   5.8883   5.8038   5.8883   5.8038   0.0000   0.0000   89.770   32.642  ?   ?  0.000000 32.64225 
1 1 1   19   34    6 o  105.258   29.798   9.3648   5.0176   9.0240   5.9714   10.183   9.2546  103.989   33.224  113.121   41.206 -9.131676 52.93161 
1 1 1   19   34    7 o   77.669   29.342   3.8994   4.7710   3.3291   5.5091   5.6102   9.5424   78.427   31.004   99.875   40.355 -21.44790 50.88933 
1 1 1   19   34    8 o   59.217   26.408  -1.4095   4.8578  -3.7221   5.5159   6.5843   10.255   57.769   26.674  104.386   41.955 -46.61693 49.71649 
1 1 1   19   34    9 o   52.377   24.563  -4.5405   4.9715  -5.9777   5.6983   0.0401   10.173   54.388   25.748   88.627   38.929 -34.23840 46.67368 
1 1 1   19   34   10 o  141.507   24.379   16.492   5.0897   21.293   5.7940   0.2693   10.652  161.263   24.222   90.764   39.852 70.49919 46.63528 
1 1 1   19   34   11 o  158.167   22.713   20.356   5.3409   20.584   6.0245   19.520   11.543  157.747   25.847  144.906   46.182 12.84094 52.92260 
1 1 1   19   34   12 o   99.270   26.815   8.3010   4.1705   8.1950   4.4644   9.0276   11.689   98.600   28.175  113.486   45.066 -14.88605 53.14839 
1 1 1   19   34   13 o  372.941   10.078  107.434   5.7530  103.484   6.2790  128.092   14.359  365.616   11.220  398.432   23.650 -32.81589 26.17686 
1 1 1   19   34   14 o   55.325   24.589  -1.0880   4.1747  -0.8795   4.5226  -2.2889   10.854   58.333   25.775   86.120   38.852 -27.78693 46.62448 
1 1 1   19   34   15 o  150.951   24.691   18.853   5.5075   18.530   6.2903   19.915   11.400  147.718   28.856  145.028   45.860 2.689804 54.18264 
1 1 1   19   34   16 o   93.454   32.383   7.0174   5.6506   11.594   6.6894  -4.3820   10.557  114.940   34.932   81.071   37.241 33.86916 51.05963 
1 1 1   19   34   17 o  243.414   22.506   48.042   8.2902   44.366   11.121   52.639   12.437  226.850   32.996  246.679   33.831 -19.82877 47.25716 
1 1 1   19   34   18 o   69.664   31.865  -3.3406   7.6175  -1.1849   9.6648  -6.8761   12.377   82.842   37.074   83.714   39.096 -0.8720016 53.87943 
1 1 1   19   34   19 o  206.900   23.314   35.077   7.2546   35.077   7.2546   0.0000   0.0000  206.900   23.314  ?   ?  0.000000 23.31419 
1 1 1   19   34   20 o  134.963   34.047   16.321   7.0328   16.321   7.0328   0.0000   0.0000  134.963   34.047  ?   ?  0.000000 34.04671 
1 1 1   19   34   21 o   79.623   32.240   3.3689   6.1042   4.7083   7.0081  -0.8421   12.426   87.236   34.815   92.161   41.575 -4.924675 54.22687 
1 1 1   19   34   22 o   82.346   32.778   4.1048   6.1971   3.1469   7.3071   6.5589   11.696   83.263   34.654  104.182   43.642 -20.91874 55.72669 
1 1 1   19   34   23 o  169.201   26.173   24.200   6.5595   26.459   7.8316   18.889   12.006  174.300   30.464  136.982   47.219 37.31790 56.19302 
1 1 1   19   34   24 o   69.774   31.315  -1.3037   6.9474  -1.3037   6.9474   0.0000   0.0000   69.774   31.315  ?   ?  0.000000 31.31471 
1 1 1   19   34   25 o  161.482   31.504   23.242   7.5072   23.242   7.5072   0.0000   0.0000  161.482   31.504  ?   ?  0.000000 31.50391 
1 1 1   19   34   26 o   87.434   33.199   5.8989   6.1272   8.7493   7.6587   0.8304   10.213  100.561   37.340   85.972   38.319 14.58893 53.50331 
1 1 1   19   34   27 o   60.543   27.830  -2.7267   5.9100   1.2265   7.3123 -10.1739   10.036   76.353   33.284   67.968   32.713 8.385674 46.66838 
1 1 1   19   34   28 f  110.794   36.714   11.757   7.2568   16.197   10.518   7.7222   10.025  124.382   44.099   99.598   40.939 24.78447 60.17256 
1 1 1   19   34   29 o  127.025   36.006   15.726   7.3214   20.903   10.793   11.313   9.9645  138.569   44.708  108.583   42.054 29.98606 61.37889 
1 1 1   19   34   30 o   62.378   29.167  -4.0861   6.9231  -0.6647   9.9364  -7.3137   9.6512   80.295   36.598   69.084   32.933 11.21156 49.23453 
1 1 1   19   35    2 o  127.093   29.961   13.801   5.7334   9.9951   7.8690   18.108   8.3707  109.902   38.207  142.564   37.760 -32.66178 53.71803 
1 1 1   19   35    3 o   90.818   32.396   6.2822   5.6844  -4.1552   7.7893   18.174   8.3142   69.655   31.993  142.876   37.532 -73.22112 49.31795 
1 1 1   19   35    4 o  121.126   30.621   12.598   5.6801   8.2361   7.3646   19.002   8.9239  102.345   36.835  145.320   39.213 -42.97485 53.80027 
1 1 1   19   35    5 o  234.697   15.022   43.168   5.3680   43.756   6.4244   41.806   9.7706  235.114   17.988  223.921   29.203 11.19301 34.29836 
1 1 1   19   35    6 o   64.996   27.665   0.5979   4.8249  -5.4587   5.5504   19.331   9.7614   54.311   25.620  145.356   41.702 -91.04518 48.94284 
1 1 1   19   35    7 o  174.677   19.814   24.460   5.2040   20.808   5.9768   35.905   10.581  158.621   25.480  203.365   35.270 -44.74419 43.51057 
1 1 1   19   35    8 o  273.086   14.192   58.286   5.9116   56.285   6.7466   64.902   12.267  267.339   16.569  279.293   29.124 -11.95483 33.50719 
1 1 1   19   35    9 o  137.182   24.922   15.634   5.0402   13.181   5.7466   23.811   10.492  123.638   30.544  160.483   42.165 -36.84415 52.06621 
1 1 1   19   35   10 o   96.106   30.185   7.7377   4.9467   6.0820   5.5550   14.080   10.872   89.265   32.006  126.036   44.819 -36.77152 55.07365 
1 1 1   19   35   11 o   77.429   29.940   3.7028   5.0444   6.1586   5.7192  -4.9006   10.705   89.916   32.448   80.918   37.292 8.997780 49.43231 
1 1 1   19   35   12 o  252.031   12.777   49.525   4.9129   48.927   5.4438   52.150   11.406  249.926   14.290  248.309   30.661 1.617096 33.82722 
1 1 1   19   35   13 o  137.742   21.580   15.520   4.4003   12.530   4.7712   32.545   11.384  121.646   26.384  188.341   40.680 -66.69444 48.48661 
1 1 1   19   35   14 o   83.949   28.788   5.5876   4.4599   6.4498   4.9104   1.5247   10.660   89.178   30.209   91.892   40.118 -2.713379 50.21971 
1 1 1   19   35   15 o  194.234   18.619   30.196   5.4677   32.625   6.3154   22.927   10.926  200.874   20.844  154.511   44.051 46.36296 48.73336 
1 1 1   19   35   16 o   78.888   33.884   1.3103   7.3576   0.2891   9.9490   2.5430   10.931   86.571   38.242   94.431   40.931 -7.860924 56.01616 
1 1 1   19   35   17 o  111.852   32.683   11.050   5.9469   11.168   6.9520   10.729   11.482  112.104   35.851  114.812   44.954 -2.708511 57.49945 
1 1 1   19   35   18 o  185.305   22.964   28.230   6.3738   24.961   7.3471   38.173   12.814  170.606   29.184  200.389   43.061 -29.78374 52.01879 
1 1 1   19   35   19 o  172.967   24.276   24.875   6.2501   27.137   7.2170   18.089   12.501  179.062   27.186  135.257   48.063 43.80574 55.21940 
1 1 1   19   35   20 o  108.190   33.288   10.422   6.0509   9.1197   7.0033   14.259   12.019  102.886   36.029  123.568   46.597 -20.68260 58.90140 
1 1 1   19   35   21 o   88.856   33.399   6.0052   6.1644   7.4281   7.1378   1.8296   12.227   96.272   35.988   95.111   42.186 1.160652 55.45116 
1 1 1   19   35   22 o   91.114   35.560   6.0656   7.1669   6.0656   7.1669   0.0000   0.0000   91.114   35.560  ?   ?  0.000000 35.56007 
1 1 1   19   35   23 o  115.281   36.977   12.477   7.3915   12.477   7.3915   0.0000   0.0000  115.281   36.977  ?   ?  0.000000 36.97746 
1 1 1   19   35   24 o  135.658   30.546   16.558   6.1899   16.391   7.4745   16.922   11.043  131.323   36.077  127.954   45.206 3.368668 57.83715 
1 1 1   19   35   25 o   98.852   35.169   8.7232   6.6948  -2.0348   9.2298   20.668   9.7255   76.696   35.079  142.269   41.861 -65.57321 54.61548 
1 1 1   19   35   26 o  249.969   20.278   51.377   7.6918   67.123   11.539   38.785   10.319  278.249   27.452  204.758   34.125 73.49081 43.79627 
1 1 1   19   35   27 o   55.321   26.181  -5.0839   5.8820  -3.6503   7.4134  -7.5199   9.6636   65.718   30.546   69.186   32.975 -3.467445 44.94850 
1 1 1   19   35   28 o  205.324   21.210   35.177   6.5698   48.839   8.5626   15.623   10.244  239.912   23.624  121.042   43.456 118.8701 49.46255 
1 1 1   19   36    0 o   59.686   38.878   0.2957   8.6051   0.2957   8.6051   0.2957   8.6051   59.686   38.878   59.686   38.878 0.000000 0.000000 
1 1 1   19   36    1 o  181.432   23.943   26.972   6.4867   19.962   8.6558   35.952   9.7970  148.702   37.914  204.821   32.322 -56.11909 49.82115 
1 1 1   19   36    2 o  205.322   21.047   33.962   6.5210   28.574   8.6048   41.232   9.9948  182.376   31.992  220.872   30.367 -38.49646 44.10948 
1 1 1   19   36    3 o  155.765   28.269   20.502   6.4916   23.802   8.7910   16.546   9.6270  163.700   36.059  134.065   42.110 29.63525 55.43943 
1 1 1   19   36    4 o  235.950   30.741   47.133   10.839   0.0000   0.0000   47.133   10.839  ?   ?   235.950   30.741 0.000000 30.74134 
1 1 1   19   36    5 o  120.087   36.504   12.811   7.3046   7.4813   10.432   17.938   10.231  105.684   42.372  138.562   43.394 -32.87781 60.65028 
1 1 1   19   36    6 o  264.741   20.782   56.278   8.3535   60.300   12.170   52.695   11.487  267.342   30.275  249.415   30.739 17.92667 43.14459 
1 1 1   19   36    7 o  251.786   20.947   50.999   7.9996   39.867   11.295   62.201   11.331  212.722   35.973  273.681   27.418 -60.95821 45.23071 
1 1 1   19   36    8 o  171.344   30.280   25.132   7.6509   19.576   10.567   31.256   11.093  143.595   43.957  184.471   40.404 -40.87628 59.70536 
1 1 1   19   36    9 o  109.505   37.586   10.329   7.6037   14.786   10.921   6.1364   10.593  127.059   44.949  102.081   42.035 24.97785 61.54165 
1 1 1   19   36   10 f  126.515   37.274   14.509   7.7066   7.3034   11.033   21.374   10.769  105.869   43.166  149.349   44.079 -43.48018 61.69484 
1 1 1   19   36   11 o  266.925   20.715   57.366   8.3969   60.328   12.246   54.738   11.536  266.303   30.599  253.802   30.294 12.50082 43.05837 
1 1 1   19   36   12 o  138.707   36.309   17.465   7.7988   17.393   11.658   17.524   10.492  134.657   46.522  135.588   44.109 -0.9317169 64.10877 
1 1 1   19   36   13 o  137.869   36.972   17.384   7.9625   26.268   11.330   8.7142   11.193  164.894   44.052  109.165   43.847 55.72932 62.15409 
1 1 1   19   36   14 o  249.489   17.293   49.487   6.5632   44.305   7.7232   62.954   12.451  233.407   21.873  271.486   30.491 -38.07907 37.52535 
1 1 1   19   36   15 o   74.661   31.166   2.0813   5.9350  -4.9638   6.9225   21.628   11.531   62.646   29.251  147.603   46.041 -84.95682 54.54714 
1 1 1   19   36   16 o  211.113   19.972   36.029   6.3770   38.521   7.7798   30.926   11.133  215.914   23.944  180.743   41.162 35.17039 47.61993 
1 1 1   19   36   17 o   65.128   29.074  -1.1293   5.9038   4.1599   7.2392 -11.6327   10.201   85.809   34.974   68.212   32.868 17.59721 47.99452 
1 1 1   19   36   18 o  172.025   24.285   24.754   6.2165   21.705   7.4952   31.472   11.127  155.891   32.466  181.300   41.052 -25.40831 52.33895 
1 1 1   19   36   19 o  148.465   28.189   19.142   6.1715   16.829   7.3925   24.461   11.210  134.639   35.402  155.204   44.737 -20.56502 57.04967 
1 1 1   19   36   20 o   84.012   34.701   3.8678   7.2473   19.896   9.8902 -14.7197   10.651  140.927   42.396   65.965   32.198 74.96208 53.23635 
1 1 1   19   36   21 o  126.586   43.481   16.207   10.176   16.207   10.176   0.0000   0.0000  126.586   43.481  ?   ?  0.000000 43.48069 
1 1 1   19   36   22 o  136.012   34.679   17.387   7.2417   26.174   10.565   9.5998   9.9461  160.643   42.360  105.392   41.660 55.25143 59.41311 
1 1 1   19   36   23 o   88.955   33.174   6.4916   6.0582   6.5470   7.5883   6.3942   10.060   92.104   36.394   96.629   40.476 -4.524406 54.43206 
1 1 1   19   36   24 o   65.829   29.247  -0.3418   5.9006  -2.7442   7.1307   4.8761   10.509   66.309   30.513   93.568   40.345 -27.25969 50.58454 
1 1 1   19   36   26 o   90.170   35.474   6.5264   7.1801   6.5264   7.1801   0.0000   0.0000   90.170   35.474  ?   ?  0.000000 35.47422 
1 1 1   19   37    0 o   40.886   29.326 -12.9974   8.6818 -12.9974   8.6818 -12.9974   8.6818   40.886   29.326   40.886   29.326 0.000000 0.000000 
1 1 1   19   37    1 o  121.571   33.278   13.107   6.3730   4.1524   8.5188   24.489   9.6042   90.892   37.588  163.232   38.978 -72.34035 54.14914 
1 1 1   19   37    2 o  399.866   13.933  124.955   8.5276  121.033   11.530  129.692   12.670  389.831   19.324  401.961   20.663 -12.12991 28.29068 
1 1 1   19   37    3 o  188.502   24.351   29.329   6.8617   27.783   9.2420   31.228   10.243  176.627   35.418  186.193   37.242 -9.565857 51.39463 
1 1 1   19   37    4 o  208.383   21.486   35.225   6.7549   33.806   8.6739   37.411   10.768  199.480   29.280  205.496   35.519 -6.016068 46.03117 
1 1 1   19   37    5 o  309.632   13.472   74.846   6.3850   74.689   7.5385   75.246   12.011  307.651   16.064  301.351   26.303 6.299896 30.82075 
1 1 1   19   37    6 o  184.908   20.982   27.744   5.8334   22.517   6.7888   42.493   11.404  162.660   28.295  219.367   35.151 -56.70676 45.12395 
1 1 1   19   37    7 o  273.434   15.235   58.881   6.3511   61.848   7.7646   52.884   11.040  278.533   18.315  249.754   29.445 28.77888 34.67612 
1 1 1   19   37    8 o  259.382   15.678   53.105   6.1950   46.009   7.3031   71.312   11.699  238.999   20.152  292.979   26.370 -53.97966 33.18796 
1 1 1   19   37    9 o  176.267   22.952   25.559   6.0454   25.371   7.2802   25.976   10.850  172.465   28.580  164.699   42.688 7.765518 51.37197 
1 1 1   19   37   10 o  230.527   17.189   42.290   6.0217   41.879   7.2014   43.246   10.979  227.329   20.932  222.164   33.314 5.165314 39.34424 
1 1 1   19   37   11 o  100.942   32.805   8.8323   5.8040   8.4696   6.8355   9.7692   10.987  100.372   35.555  110.829   43.793 -10.45667 56.40884 
1 1 1   19   37   12 o  143.562   26.682   17.563   5.6473   20.728   6.5629   8.5344   11.084  155.093   28.703  107.496   43.473 47.59629 52.09373 
1 1 1   19   37   13 o  227.641   20.317   42.007   7.0047   56.582   9.2318   22.230   10.754  262.260   23.238  149.803   44.001 112.4561 49.76065 
1 1 1   19   37   14 o   53.208   24.932  -4.1839   5.1042  -1.5161   5.8827 -12.3104   10.267   63.895   28.735   67.480   32.628 -3.585091 43.47734 
1 1 1   19   37   15 f   92.453   31.390   7.2695   5.3021   6.8493   6.1402   8.5015   10.513   91.885   33.550  105.162   42.404 -13.27773 54.07116 
1 1 1   19   37   16 o   96.352   35.945   7.6386   7.1138   10.899   10.167   4.5119   9.9570  110.849   42.604   93.677   39.804 17.17217 58.30479 
1 1 1   19   37   17 o  151.824   32.711   20.922   7.3773   31.774   10.746   11.247   10.146  181.718   39.741  111.331   42.614 70.38673 58.26906 
1 1 1   19   37   18 o   74.421   31.319   2.2133   6.0688  -0.9221   7.6195   7.6535   10.037   72.918   32.755  100.759   41.136 -27.84061 52.58449 
1 1 1   19   37   19 o   95.481   36.446   7.5306   7.4091   7.5306   7.4091   0.0000   0.0000   95.481   36.446  ?   ?  0.000000 36.44634 
1 1 1   19   37   20 o   71.961   32.153  -0.4318   7.2384  -0.4318   7.2384   0.0000   0.0000   71.961   32.153  ?   ?  0.000000 32.15340 
1 1 1   19   37   21 o  101.048   33.169   9.3839   5.9281   8.7797   7.5538   10.353   9.5650   99.339   37.044  106.211   41.184 -6.872551 55.39281 
1 1 1   19   37   22 o   68.358   29.718   0.8117   5.7966  -3.2751   7.3054   7.7580   9.5241   65.997   30.552   98.394   40.110 -32.39748 50.42113 
1 1 1   19   37   23 o   69.054   29.639   1.3702   5.6226  -1.1424   6.9791   6.0168   9.4908   68.684   31.055   93.481   39.243 -24.79717 50.04419 
1 1 1   19   38    0 o  362.035   21.139  103.998   11.623  103.998   11.623  103.998   11.623  362.035   21.139  362.035   21.139 0.000000 0.000000 
1 1 1   19   38    1 f  405.357   14.177  128.811   8.7962  138.068   12.431  119.527   12.449  415.241   19.558  384.348   21.243 30.89236 28.87555 
1 1 1   19   38    2 f  259.384   18.718   53.920   7.3814   48.310   9.9281   60.855   11.037  239.270   27.616  269.187   27.160 -29.91792 38.73342 
1 1 1   19   38    3 o  194.784   23.377   31.318   6.8306   33.025   9.0963   29.110   10.343  194.568   31.630  176.688   39.264 17.88020 50.41963 
1 1 1   19   38    4 o  245.038   19.081   48.262   7.1002   48.451   9.3093   47.999   10.978  241.016   25.628  235.368   31.245 5.647278 40.41121 
1 1 1   19   38    5 o  369.640   14.191  107.195   8.0290   95.245   10.180  126.868   13.061  344.322   19.394  395.244   21.673 -50.92264 29.08301 
1 1 1   19   38    6 o  307.815   16.259   75.123   7.6335   68.130   9.7272   86.332   12.316  288.832   22.172  322.471   25.151 -33.63885 33.52829 
1 1 1   19   38    7 o   67.192   29.911  -0.8934   6.2018   6.2126   7.8063 -13.0539   10.212   93.668   36.945   66.508   32.250 27.15995 49.04049 
1 1 1   19   38    8 o  195.603   23.433   31.725   6.8761   41.778   9.1051   18.381   10.490  221.823   27.399  136.050   44.094 85.77312 51.91376 
1 1 1   19   38    9 o   61.670   27.773  -1.5698   5.5180   3.5327   6.6391 -12.9692   9.9234   81.434   33.376   65.200   31.656 16.23381 46.00072 
1 1 1   19   38   10 o  148.936   26.306   18.971   5.7775   23.038   6.8313   8.7556   10.828  163.120   28.392  106.263   42.969 56.85632 51.50180 
1 1 1   19   38   11 o  112.564   31.369   11.407   5.6066   17.117   6.6994  -1.9388   10.242  137.560   32.359   81.614   37.183 55.94532 49.29216 
1 1 1   19   38   12 o  225.454   17.490   40.815   5.9884   41.159   7.2169   40.056   10.730  223.912   21.315  210.058   34.576 13.85371 40.61773 
1 1 1   19   38   13 o   65.831   28.707   0.2607   5.4433  -3.9164   6.4770   10.306   10.044   61.442   28.556  108.410   42.156 -46.96809 50.91730 
1 1 1   19   38   14 o   80.094   31.517   4.3103   5.6689   9.2887   6.8289  -6.7255   10.167  101.778   35.581   73.286   34.603 28.49226 49.63203 
1 1 1   19   38   15 o   56.212   25.304  -1.3235   4.5752   4.4637   5.2372 -19.9714   9.4011   79.197   30.540   55.597   27.698 23.59991 41.22951 
1 1 1   19   38   16 o   69.907   28.032   2.7978   4.5667   5.4755   5.1705  -6.6992   9.7375   83.108   30.716   71.271   33.716 11.83684 45.60974 
1 1 1   19   38   17 f  125.551   37.105   15.334   7.6263   15.334   7.6263   0.0000   0.0000  125.551   37.105  ?   ?  0.000000 37.10464 
1 1 1   19   38   18 o   85.107   32.464   5.6599   5.8760   2.3727   7.1880   12.282   10.202   78.441   33.586  112.247   42.787 -33.80639 54.39422 
1 1 1   19   38   19 o  210.291   20.039   36.432   6.3720   40.929   8.0995   29.129   10.322  219.232   24.559  170.485   40.209 48.74675 47.11610 
1 1 1   19   39    0 o   53.826   36.419  -2.6541   8.8514  -2.6541   8.8514  -2.6541   8.8514   53.826   36.419   53.826   36.419 0.000000 0.000000 
1 1 1   19   39    1 f   97.023   34.282   8.0976   6.3508  -4.2493   8.5442   23.341   9.4935   70.904   32.901  155.334   39.761 -84.43028 51.60811 
1 1 1   19   39    2 o   93.209   33.975   7.1891   6.2928   9.1707   8.5421   4.8376   9.3056  103.620   39.234   92.688   38.882 10.93166 55.23674 
1 1 1   19   39    3 o  229.819   20.138   43.023   7.0123   38.926   9.2756   48.488   10.713  211.564   29.442  235.463   30.436 -23.89883 42.34601 
1 1 1   19   39    4 o  194.339   20.761   30.968   6.0800   37.844   7.5444   18.230   10.269  213.083   23.524  134.250   43.636 78.83350 49.57298 
1 1 1   19   39    5 o  117.354   31.288   12.457   5.7227   15.381   6.8222   5.5142   10.512  128.936   34.060   97.021   41.045 31.91537 53.33631 
1 1 1   19   39    6 o  135.816   28.588   16.237   5.7549   13.796   6.7309   22.870   11.096  121.767   34.526  148.606   44.951 -26.83884 56.68036 
1 1 1   19   39    7 o  293.897   15.325   68.568   6.8701   71.294   8.1360   61.796   12.825  297.739   17.937  263.231   32.522 34.50742 37.14022 
1 1 1   19   39    8 o  290.087   15.252   66.814   6.7486   68.472   7.9506   62.540   12.765  291.713   17.893  265.029   32.123 26.68436 36.76965 
1 1 1   19   39    9 o  120.898   30.823   13.248   5.7210   14.489   6.8158   10.287   10.525  124.345   34.564  108.329   42.844 16.01608 55.04830 
1 1 1   19   39   10 o   69.976   29.997   1.2536   5.7459  -1.8268   6.9942   7.6479   10.077   68.050   30.896  100.477   41.143 -32.42683 51.45204 
1 1 1   19   39   11 o   81.229   31.931   4.5732   5.8129   1.6059   7.0907   10.654   10.151   76.494   33.061  108.467   42.323 -31.97294 53.70555 
1 1 1   19   39   12 o   72.673   30.360   2.3291   5.6384   5.0268   6.9266  -2.9694   9.7073   85.798   34.482   76.794   35.434 9.003662 49.44211 
1 1 1   19   39   13 o  134.662   28.403   16.126   5.6701   13.736   6.7805   21.684   10.340  120.220   34.833  143.958   43.358 -23.73780 55.61700 
1 1 1   19   39   14 o   88.481   34.261   6.1240   6.6123   6.1240   6.6123   0.0000   0.0000   88.481   34.261  ?   ?  0.000000 34.26068 
1 1 1   19   39   15 o  120.299   34.430   13.788   6.6614   13.788   6.6614   0.0000   0.0000  120.299   34.430  ?   ?  0.000000 34.43041 
1 1 1   19   40    0 o   65.101   41.355   3.0051   8.9819   3.0051   8.9819   3.0051   8.9819   65.101   41.355   65.101   41.355 0.000000 0.000000 
1 1 1   19   40    1 o  145.215   31.390   19.145   6.7735   16.979   9.3020   21.590   9.8828  129.483   41.477  145.480   42.025 -15.99725 59.04595 
1 1 1   19   40    2 o   80.966   33.349   3.7220   6.6691   15.087   9.0111 -10.0422   9.9169  122.832   40.922   67.621   32.539 55.21104 52.28214 
1 1 1   19   40    3 o  130.076   33.392   15.770   6.6821   16.706   9.1865   14.720   9.7374  128.555   41.222  120.872   42.474 7.682610 59.18923 
1 1 1   19   40    4 o  180.295   21.974   27.096   5.9387   27.187   7.3645   26.927   10.042  176.144   28.272  164.881   40.162 11.26309 49.11491 
1 1 1   19   40    5 o  182.571   21.527   27.700   5.9001   32.005   7.1654   18.635   10.398  194.097   24.677  133.307   43.937 60.78967 50.39225 
1 1 1   19   40    6 o   97.833   32.827   8.6251   5.7981   7.3794   6.8025   11.934   11.087   93.628   35.107  112.200   44.100 -18.57186 56.36723 
1 1 1   19   40    7 o  119.002   31.844   13.084   5.9145   12.546   6.9987   14.428   11.063  114.573   35.891  119.018   44.742 -4.444366 57.35871 
1 1 1   19   40    8 o  328.357   14.148   85.247   7.1107   83.377   8.5744   89.363   12.724  321.634   17.483  323.517   25.914 -1.883026 31.25966 
1 1 1   20    0    0 o  639.916   11.446  313.782   11.203  313.782   11.203  313.782   11.203  639.916   11.446  639.916   11.446 0.000000 0.000000 
1 1 1   20    0    1 o  516.179   7.5274  204.092   5.9444  204.092   5.9444  204.092   5.9444  516.179   7.5274  516.179   7.5274 0.000000 0.000000 
1 1 1   20    0    2 o  136.574   18.233   15.040   3.6212   15.040   3.6212   15.040   3.6212  136.574   18.233  136.574   18.233 0.000000 0.000000 
1 1 1   20    0    3 o  564.193   11.307  244.042   9.7552  244.042   9.7552  244.042   9.7552  564.193   11.307  564.193   11.307 0.000000 0.000000 
1 1 1   20    0    4 o  204.320   14.110   32.432   4.3644   32.432   4.3644   32.432   4.3644  204.320   14.110  204.320   14.110 0.000000 0.000000 
1 1 1   20    0    5 o  315.029   12.085   76.337   5.8079   76.337   5.8079   76.337   5.8079  315.029   12.085  315.029   12.085 0.000000 0.000000 
1 1 1   20    0    6 o  712.223   8.5762  388.516   9.3462  388.516   9.3462  388.516   9.3462  712.223   8.5762  712.223   8.5762 0.000000 0.000000 
1 1 1   20    0    7 o  504.424   7.8257  194.926   6.0388  194.926   6.0388  194.926   6.0388  504.424   7.8257  504.424   7.8257 0.000000 0.000000 
1 1 1   20    0    8 o  319.992   8.2647   78.547   4.0418   78.547   4.0418   78.547   4.0418  319.992   8.2647  319.992   8.2647 0.000000 0.000000 
1 1 1   20    0    9 o  540.867   8.0818  224.104   6.6873  224.104   6.6873  224.104   6.6873  540.867   8.0818  540.867   8.0818 0.000000 0.000000 
1 1 1   20    0   10 o  601.884   8.3560  277.503   7.6947  277.503   7.6947  277.503   7.6947  601.884   8.3560  601.884   8.3560 0.000000 0.000000 
1 1 1   20    0   11 o  286.646   9.3506   63.112   4.0927   63.112   4.0927   63.112   4.0927  286.646   9.3506  286.646   9.3506 0.000000 0.000000 
1 1 1   20    0   12 o  454.237   11.229  158.303   7.7962  158.303   7.7962  158.303   7.7962  454.237   11.229  454.237   11.229 0.000000 0.000000 
1 1 1   20    0   13 o   33.830   22.938  -1.8662   3.5493  -1.8662   3.5493  -1.8662   3.5493   33.830   22.938   33.830   22.938 0.000000 0.000000 
1 1 1   20    0   14 o  209.314   13.506   33.982   4.2857   33.982   4.2857   33.982   4.2857  209.314   13.506  209.314   13.506 0.000000 0.000000 
1 1 1   20    0   15 o  827.617   9.8035  524.724   12.415  524.724   12.415  524.724   12.415  827.617   9.8035  827.617   9.8035 0.000000 0.000000 
1 1 1   20    0   16 o  205.351   8.5418   32.455   2.6743   32.455   2.6743   32.455   2.6743  205.351   8.5418  205.351   8.5418 0.000000 0.000000 
1 1 1   20    0   17 o  1215.68   8.6191  1131.78   16.036  1131.78   16.036  1131.78   16.036  1215.68   8.6191  1215.68   8.6191 0.000000 0.000000 
1 1 1   20    0   18 o  388.221   7.6465  115.527   4.5397  115.527   4.5397  115.527   4.5397  388.221   7.6465  388.221   7.6465 0.000000 0.000000 
1 1 1   20    0   19 f  370.038   6.8091  104.937   3.8537  104.937   3.8537  104.937   3.8537  370.038   6.8091  370.038   6.8091 0.000000 0.000000 
1 1 1   20    0   20 o  402.522   7.5061  124.187   4.6209  124.187   4.6209  124.187   4.6209  402.522   7.5061  402.522   7.5061 0.000000 0.000000 
1 1 1   20    0   21 o  325.943   8.0413   81.502   4.0063   81.502   4.0063   81.502   4.0063  325.943   8.0413  325.943   8.0413 0.000000 0.000000 
1 1 1   20    0   22 o  509.111   6.5803  198.548   5.1258  198.548   5.1258  198.548   5.1258  509.111   6.5803  509.111   6.5803 0.000000 0.000000 
1 1 1   20    0   23 o  349.919   7.2600   93.881   3.8846   93.881   3.8846   93.881   3.8846  349.919   7.2600  349.919   7.2600 0.000000 0.000000 
1 1 1   20    0   24 o  349.997   7.4726   93.938   3.9991   93.938   3.9991   93.938   3.9991  349.997   7.4726  349.997   7.4726 0.000000 0.000000 
1 1 1   20    0   25 o   42.608   25.733   1.3538   3.0730   1.3538   3.0730   1.3538   3.0730   42.608   25.733   42.608   25.733 0.000000 0.000000 
1 1 1   20    0   26 o  163.235   12.527   20.792   3.0875   20.792   3.0875   20.792   3.0875  163.235   12.527  163.235   12.527 0.000000 0.000000 
1 1 1   20    0   27 o  587.577   6.9006  264.514   6.2042  264.514   6.2042  264.514   6.2042  587.577   6.9006  587.577   6.9006 0.000000 0.000000 
1 1 1   20    0   28 o   83.797   30.849   7.2538   3.6611   7.2538   3.6611   7.2538   3.6611   83.797   30.849   83.797   30.849 0.000000 0.000000 
1 1 1   20    0   29 o  678.875   8.0936  353.250   8.4074  353.250   8.4074  353.250   8.4074  678.875   8.0936  678.875   8.0936 0.000000 0.000000 
1 1 1   20    0   30 o  334.006   9.1759   85.702   4.6831   85.702   4.6831   85.702   4.6831  334.006   9.1759  334.006   9.1759 0.000000 0.000000 
1 1 1   20    0   31 o  558.634   8.7469  239.366   7.4750  239.366   7.4750  239.366   7.4750  558.634   8.7469  558.634   8.7469 0.000000 0.000000 
1 1 1   20    0   32 o   29.090   20.242  -2.9037   3.2120  -2.9037   3.2120  -2.9037   3.2120   29.090   20.242   29.090   20.242 0.000000 0.000000 
1 1 1   20    0   33 o  232.009   10.778   41.570   3.8085   41.570   3.8085   41.570   3.8085  232.009   10.778  232.009   10.778 0.000000 0.000000 
1 1 1   20    0   34 o  326.105   9.8800   81.806   4.9213   81.806   4.9213   81.806   4.9213  326.105   9.8800  326.105   9.8800 0.000000 0.000000 
1 1 1   20    0   35 o  238.476   10.925   43.936   3.9689   43.936   3.9689   43.936   3.9689  238.476   10.925  238.476   10.925 0.000000 0.000000 
1 1 1   20    0   36 o  401.358   8.3617  123.692   5.1318  123.692   5.1318  123.692   5.1318  401.358   8.3617  401.358   8.3617 0.000000 0.000000 
1 1 1   20    0   37 o   45.235   28.141   1.1302   3.9320   1.1302   3.9320   1.1302   3.9320   45.235   28.141   45.235   28.141 0.000000 0.000000 
1 1 1   20    0   38 f  197.021   15.820   30.523   4.7000   30.523   4.7000   30.523   4.7000  197.021   15.820  197.021   15.820 0.000000 0.000000 
1 1 1   20    0   39 o   99.439   31.956   9.8006   4.2921   9.8006   4.2921   9.8006   4.2921   99.439   31.956   99.439   31.956 0.000000 0.000000 
1 1 1   20    0   40 o  355.972   9.5904   97.524   5.2168   97.524   5.2168   97.524   5.2168  355.972   9.5904  355.972   9.5904 0.000000 0.000000 
1 1 1   20    0   41 o  271.276   13.408   57.134   5.5363   57.134   5.5363   57.134   5.5363  271.276   13.408  271.276   13.408 0.000000 0.000000 
1 1 1   20    0   42 o  213.020   22.380   36.568   7.1126   36.568   7.1126   36.568   7.1126  213.020   22.380  213.020   22.380 0.000000 0.000000 
1 1 1   20    0   43 o  161.833   20.296   21.313   4.8131   21.313   4.8131   21.313   4.8131  161.833   20.296  161.833   20.296 0.000000 0.000000 
1 1 1   20    0   44 o  178.659   18.624   25.603   4.9664   25.603   4.9664   25.603   4.9664  178.659   18.624  178.659   18.624 0.000000 0.000000 
1 1 1   20    0   45 o   41.475   27.667  -1.2418   4.7865  -1.2418   4.7865  -1.2418   4.7865   41.475   27.667   41.475   27.667 0.000000 0.000000 
1 1 1   20    0   46 o  154.562   22.745   19.883   5.0393   19.883   5.0393   19.883   5.0393  154.562   22.745  154.562   22.745 0.000000 0.000000 
1 1 1   20    0   47 o   60.397   34.342   4.0690   4.9413   4.0690   4.9413   4.0690   4.9413   60.397   34.342   60.397   34.342 0.000000 0.000000 
1 1 1   20    0   48 o   37.662   25.507  -1.8640   4.3632  -1.8640   4.3632  -1.8640   4.3632   37.662   25.507   37.662   25.507 0.000000 0.000000 
1 1 1   20    0   49 o   78.905   36.866   7.5245   4.9677   7.5245   4.9677   7.5245   4.9677   78.905   36.866   78.905   36.866 0.000000 0.000000 
1 1 1   20    0   50 o   97.276   35.588   10.253   4.8880   10.253   4.8880   10.253   4.8880   97.276   35.588   97.276   35.588 0.000000 0.000000 
1 1 1   20    0   51 o   46.619   29.662   0.9974   4.6436   0.9974   4.6436   0.9974   4.6436   46.619   29.662   46.619   29.662 0.000000 0.000000 
1 1 1   20    0   52 o   68.593   35.992   5.9430   4.9904   5.9430   4.9904   5.9430   4.9904   68.593   35.992   68.593   35.992 0.000000 0.000000 
1 1 1   20    0   53 o  194.598   26.288   32.368   7.4277   32.368   7.4277   32.368   7.4277  194.598   26.288  194.598   26.288 0.000000 0.000000 
1 1 1   20    0   54 o   49.402   30.491   2.1219   4.5246   2.1219   4.5246   2.1219   4.5246   49.402   30.491   49.402   30.491 0.000000 0.000000 
1 1 1   20    0   55 o  220.666   15.181   38.851   5.0717   38.851   5.0717   38.851   5.0717  220.666   15.181  220.666   15.181 0.000000 0.000000 
1 1 1   20    1    0 o   41.384   25.816   0.7795   3.3317   0.7795   3.3317   0.7795   3.3317   41.384   25.816   41.384   25.816 0.000000 0.000000 
1 1 1   20    1    1 o  363.042   7.5502  100.919   4.1955   95.622   5.8242  106.633   6.0489  353.293   10.770  373.087   10.592 -19.79428 15.10637 
1 1 1   20    1    2 o  356.198   7.7423   97.153   4.2212   92.874   5.9940  101.363   5.9456  348.162   11.248  363.746   10.679 -15.58447 15.50964 
1 1 1   20    1    3 o  439.364   6.0997  147.786   4.1020  148.232   7.4809  147.594   4.9052  439.857   11.112  439.047   7.2993 0.8095703 13.29455 
1 1 1   20    1    4 o  354.023   8.0073   95.974   4.3390   92.892   6.1596   99.010   6.1131  348.183   11.558  359.482   11.110 -11.29874 16.03174 
1 1 1   20    1    5 o  527.379   8.1056  212.984   6.5430  207.620   9.1738  218.537   9.3347  520.536   11.514  534.052   11.419 -13.51593 16.21660 
1 1 1   20    1    6 o  527.679   5.5017  213.158   4.4436  207.367   6.2817  218.958   6.2866  520.385   7.8865  534.738   7.6808 -14.35333 11.00871 
1 1 1   20    1    7 o  547.501   5.5797  229.476   4.6759  232.193   6.7686  226.995   6.4671  550.646   8.0307  544.459   7.7603 6.187805 11.16756 
1 1 1   20    1    8 o  272.074   6.0532   56.672   2.5208   56.575   3.6879   56.756   3.4536  271.788   8.8649  272.234   8.2881 -0.4465637 12.13588 
1 1 1   20    1    9 o  526.141   8.1891  211.997   6.5949  211.997   6.5949   0.0000   0.0000  526.141   8.1891  ?   ?  0.000000 8.189092 
1 1 1   20    1   10 o  457.313   5.7470  160.107   4.0228  162.243   5.8192  158.153   5.5672  460.272   8.2600  454.442   8.0036 5.829224 11.50159 
1 1 1   20    1   11 o  846.265   6.8186  548.354   8.8323  562.801   12.778  535.138   12.222  857.127   9.7401  835.812   9.5532 21.31476 13.64306 
1 1 1   20    1   12 o  710.271   7.2215  386.304   7.8510  390.459   9.9064  379.287   12.874  713.967   9.0650  703.452   11.956 10.51526 15.00422 
1 1 1   20    1   13 o  934.839   7.1939  669.208   10.294  657.776   19.955  673.353   12.016  926.072   14.078  937.635   8.3723 -11.56226 16.37937 
1 1 1   20    1   14 o  716.415   5.8251  392.951   6.3876  394.528   10.185  391.929   8.2007  717.637   9.2724  715.392   7.4892 2.245422 11.91915 
1 1 1   20    1   15 o  1203.83   7.6699  1109.88   14.133  1104.36   22.251  1113.62   18.297  1200.20   12.112  1205.57   9.9158 -5.371582 15.65356 
1 1 1   20    1   16 o  469.933   4.6258  169.056   3.3273  166.469   5.0117  171.095   4.4494  466.241   7.0227  472.710   6.1495 -6.468475 9.334590 
1 1 1   20    1   17 o  458.337   4.7270  160.820   3.3162  157.547   5.0103  163.372   4.4239  453.558   7.2171  461.907   6.2572 -8.349121 9.551925 
1 1 1   20    1   18 o  218.556   6.4664   36.579   2.1632   35.647   3.3992   37.212   2.8044  215.657   10.298  220.398   8.3130 -4.741348 13.23438 
1 1 1   20    1   19 o  749.717   5.4827  430.365   6.2916  422.424   8.7767  438.759   9.0239  742.599   7.7216  756.814   7.7899 -14.21552 10.96838 
1 1 1   20    1   20 f  610.995   4.6157  285.805   4.3166  287.873   6.1653  283.816   6.0458  613.089   6.5699  608.760   6.4884 4.329712 9.233775 
1 1 1   20    1   21 o  418.078   4.8330  133.825   3.0928  133.873   4.3438  133.777   4.4044  418.067   6.7882  417.911   6.8855 0.1555481 9.669047 
1 1 1   20    1   22 o  354.391   5.3584   96.172   2.9066   93.356   3.9038   99.675   4.3542  349.080   7.3063  360.669   7.8872 -11.58917 10.75128 
1 1 1   20    1   23 o  342.713   5.1700   89.939   2.7120   91.369   3.8966   88.595   3.7770  345.327   7.3719  340.050   7.2565 5.277191 10.34421 
1 1 1   20    1   24 o  502.132   4.7628  193.064   3.6606  200.892   5.3372  186.111   5.0301  512.072   6.8095  492.885   6.6675 19.18753 9.530152 
1 1 1   20    1   25 o  496.159   5.1333  188.523   3.8984  186.285   5.2388  191.301   5.8358  493.071   6.9415  499.603   7.6314 -6.531952 10.31619 
1 1 1   20    1   26 o  342.894   5.7687   90.063   3.0277   97.305   4.7626   85.152   3.9222  356.207   8.7353  333.299   7.6882 22.90784 11.63673 
1 1 1   20    1   27 o  405.156   6.0462  125.761   3.7495  127.471   4.6786  122.690   6.2688  407.785   7.4958  399.782   10.245 8.003357 12.69397 
1 1 1   20    1   28 o  407.681   5.6164  127.325   3.5047  130.063   4.8458  124.321   5.0748  411.864   7.6868  402.615   8.2349 9.249329 11.26495 
1 1 1   20    1   29 o   73.178   19.789   4.2907   2.2698   3.3160   3.5644   4.9555   2.9438   70.920   25.613   78.968   22.972 -8.047272 34.40528 
1 1 1   20    1   30 o   77.129   21.288   4.7698   2.5954  -1.3466   4.7469   7.3778   3.0997   59.672   26.385   95.525   21.695 -35.85215 34.15887 
1 1 1   20    1   31 o  569.291   5.9181  248.373   5.1569  236.721   7.0777  261.559   7.5290  555.404   8.3256  583.797   8.4257 -28.39294 11.84517 
1 1 1   20    1   32 o  106.222   14.882   8.8809   2.3532   8.3307   3.4162   9.3777   3.2463  101.322   22.602  108.059   20.375 -6.736549 30.42990 
1 1 1   20    1   33 o  191.509   9.1198   28.175   2.6733   30.600   3.9846   26.190   3.6050  198.746   13.173  183.853   12.892 14.89299 18.43189 
1 1 1   20    1   34 o  193.320   9.1879   28.721   2.7187   30.225   4.0782   27.518   3.6474  197.378   13.582  188.450   12.719 8.927963 18.60761 
1 1 1   20    1   35 o   95.935   17.477   7.3720   2.4718   5.1048   3.3949   9.9301   3.6061   80.353   24.969  110.635   22.069 -30.28168 33.32377 
1 1 1   20    1   36 o  280.033   7.0152   60.186   3.0069   57.859   4.2729   62.469   4.2322  274.134   10.183  284.924   9.7044 -10.78931 14.06677 
1 1 1   20    1   37 o   94.063   20.272   7.1997   2.8327   10.060   4.0644   4.4983   3.9501  110.514   24.654   78.115   27.075 32.39892 36.61818 
1 1 1   20    1   38 o  284.660   8.0859   62.290   3.5231   61.659   5.9163   62.636   4.3855  282.050   13.704  285.108   10.049 -3.057831 16.99389 
1 1 1   20    1   39 o  247.585   8.0871   47.132   3.0647   44.900   4.3217   49.390   4.3466  241.033   11.714  252.900   11.229 -11.86629 16.22674 
1 1 1   20    1   40 o  165.523   11.879   21.297   2.9897   28.556   4.1679   13.603   4.2908  191.170   14.349  129.200   22.516 61.96950 26.69907 
1 1 1   20    1   41 o  241.985   9.5612   45.144   3.5414   42.402   5.0498   47.797   4.9677  233.079   14.223  247.858   13.141 -14.77928 19.36431 
1 1 1   20    1   42 o  133.545   18.140   14.264   3.6120   24.523   6.0582   8.6049   4.4992  173.674   23.384  101.055   28.080 72.61932 36.54144 
1 1 1   20    1   43 o   53.320   23.615  -0.9273   3.8176  -0.8489   4.5801  -1.1059   6.9098   58.878   25.981   71.594   31.736 -12.71531 41.01485 
1 1 1   20    1   44 o  133.607   16.511   14.214   3.3046   13.951   4.5970   14.495   4.7537  129.685   24.044  132.101   24.410 -2.416183 34.26307 
1 1 1   20    1   45 o  123.224   18.514   12.262   3.3840   11.704   4.8340   12.799   4.7387  117.130   27.443  123.158   25.956 -6.027412 37.77383 
1 1 1   20    1   46 o  139.655   17.369   15.625   3.6326   18.130   5.2215   13.276   5.0570  147.876   23.883  124.708   27.254 23.16858 36.23780 
1 1 1   20    1   47 o  128.832   17.606   13.375   3.3809   18.474   4.4872   6.6787   5.1420  150.795   19.929   90.228   30.911 60.56705 36.77867 
1 1 1   20    1   48 f   41.350   19.319  -2.6263   3.0270  -3.8252   4.3505  -1.5014   4.2143   48.923   22.954   53.835   24.255 -4.912403 33.39470 
1 1 1   20    1   49 o  263.423   10.162   53.867   4.0974   57.417   5.8557   50.461   5.7355  269.800   14.230  252.520   14.905 17.28090 20.60717 
1 1 1   20    1   50 o  119.282   18.301   11.666   3.2346   10.576   4.7994   12.572   4.3783  108.984   28.462  121.008   24.479 -12.02379 37.54068 
1 1 1   20    1   51 o   58.514   23.742   1.6106   3.3178   6.1471   4.7954  -2.5549   4.5951   85.255   29.815   52.957   24.415 32.29721 38.53657 
1 1 1   20    1   52 o  216.809   12.057   37.024   3.9854   35.717   5.4161   38.566   5.8857  210.043   16.992  217.722   17.817 -7.679337 24.62088 
1 1 1   20    1   53 o  101.659   25.722   9.2885   4.0056   18.633   7.6018   5.6965   4.7130  136.492   35.904   81.613   29.455 54.87850 46.44036 
1 1 1   20    1   54 o  231.897   10.963   42.290   3.8914   38.344   5.1788   47.409   5.8976  217.324   15.674  241.419   16.051 -24.09433 22.43473 
1 1 1   20    1   55 o  117.806   19.154   11.813   3.3352   17.128   4.8019   6.8600   4.6359  139.158   23.373   85.549   29.349 53.60925 37.51901 
1 1 1   20    2    1 o  513.600   7.6123  201.983   5.9843  221.361   9.0478  186.914   7.9787  537.521   10.997  493.952   10.553 43.56863 15.24148 
1 1 1   20    2    2 o  700.143   8.3484  375.392   8.9466  380.040   13.064  371.287   12.278  704.220   12.119  696.107   11.523 8.112732 16.72323 
1 1 1   20    2    3 o  352.635   6.2089   95.201   3.3513   94.492   6.2535   95.487   3.9694  351.166   11.634  353.139   7.3435 -1.972748 13.75802 
1 1 1   20    2    4 f  906.988   7.8765  629.925   10.935  645.635   19.672  622.900   13.154  917.669   14.005  901.799   9.5296 15.86975 16.93972 
1 1 1   20    2    5 o  331.950   5.2216   84.352   2.6530   78.144   6.1793   85.754   2.9376  319.308   12.643  334.690   5.7342 -15.38196 13.88286 
1 1 1   20    2    6 o  598.313   5.6748  274.048   5.1970  291.969   7.8915  260.324   6.9060  617.457   8.3500  583.063   7.7382 34.39386 11.38428 
1 1 1   20    2    7 o  715.700   6.0787  392.152   6.6590  402.836   9.8283  383.085   9.0539  725.242   8.8537  707.268   8.3634 17.97467 12.17926 
1 1 1   20    2    8 o  179.443   7.5712   24.657   2.0795   26.604   3.3194   23.399   2.6680  185.954   11.722  174.482   10.032 11.47267 15.42894 
1 1 1   20    2    9 o  389.603   5.6874  116.205   3.3916  119.602   5.0828  113.478   4.5537  395.183   8.4029  384.953   7.7284 10.23077 11.41656 
1 1 1   20    2   10 o  532.537   5.7708  217.113   4.7039  223.646   6.9673  211.642   6.3765  540.387   8.4235  525.706   7.9244 14.68103 11.56510 
1 1 1   20    2   11 o  595.271   5.9245  271.285   5.3980  280.089   8.0702  264.157   7.2616  604.724   8.7188  587.306   8.0779 17.41803 11.88568 
1 1 1   20    2   12 o  237.038   6.8206   43.022   2.4746   49.259   4.2574   39.840   3.0411  253.539   10.971  228.066   8.7117 25.47279 14.00878 
1 1 1   20    2   13 o  344.611   6.3528   90.927   3.3509   92.318   6.6462   90.453   3.8802  347.013   12.513  343.685   7.3760 3.328613 14.52510 
1 1 1   20    2   14 o  461.616   5.5962  163.139   3.9541  165.962   6.5498  161.521   4.9598  465.448   9.1937  459.271   7.0555 6.177124 11.58894 
1 1 1   20    2   15 o  974.540   6.7145  727.238   10.016  735.459   16.135  722.085   12.775  979.613   10.761  970.911   8.5963 8.701172 13.77290 
1 1 1   20    2   16 o  382.039   6.1618  111.755   3.6032  109.932   6.1546  112.706   4.4445  378.728   10.617  383.613   7.5693 -4.884705 13.03904 
1 1 1   20    2   17 o  566.111   4.9884  245.352   4.3224  243.786   7.3647  246.176   5.3386  564.117   8.5294  567.010   6.1513 -2.893250 10.51615 
1 1 1   20    2   18 o  608.635   5.0950  283.608   4.7465  291.748   8.2773  279.620   5.7937  617.080   8.7635  604.282   6.2639 12.79749 10.77193 
1 1 1   20    2   19 o  214.634   7.2875   35.286   2.3941   38.348   3.5120   32.627   3.2723  223.662   10.259  206.039   10.410 17.62318 14.61527 
1 1 1   20    2   20 o  226.887   6.7434   39.427   2.3418   36.650   3.6123   41.441   3.0758  218.619   10.795  232.552   8.6410 -13.93312 13.82750 
1 1 1   20    2   21 o  708.318   4.7755  384.129   5.1774  383.334   7.3580  384.909   7.2866  707.434   6.7952  708.892   6.7154 -1.458557 9.553601 
1 1 1   20    2   22 o  168.646   7.9114   21.794   2.0422   20.404   2.9133   23.137   2.8636  162.635   11.783  173.334   10.848 -10.69899 16.01612 
1 1 1   20    2   23 o  477.195   5.0570  174.368   3.6937  169.795   4.9342  180.198   5.5709  470.788   6.8474  484.947   7.5052 -14.15912 10.15945 
1 1 1   20    2   24 o  535.047   5.0183  219.218   4.1098  219.659   5.6341  218.716   6.0082  535.448   6.8744  534.256   7.3472 1.191406 10.06180 
1 1 1   20    2   25 o  174.979   8.5589   23.475   2.2923   25.870   3.2515   21.108   3.2322  183.179   11.657  165.238   12.881 17.94139 17.37316 
1 1 1   20    2   26 o  324.347   7.0814   80.621   3.5156   80.796   4.5251   80.355   5.5839  324.555   9.1090  323.475   11.278 1.079712 14.49698 
1 1 1   20    2   27 o  199.115   8.1499   30.401   2.4838   30.241   3.4659   30.571   3.5615  198.070   11.481  199.120   11.737 -1.050186 16.41907 
1 1 1   20    2   28 o  243.279   6.6920   45.359   2.4919   46.590   3.6886   44.325   3.3798  246.361   9.7819  240.340   9.1874 6.020828 13.41991 
1 1 1   20    2   29 o  241.535   7.3202   44.729   2.7063   50.932   4.5419   41.314   3.3698  257.393   11.528  231.989   9.4900 25.40431 14.93197 
1 1 1   20    2   30 o  341.652   6.3611   89.464   3.3265   88.396   5.7518   90.001   4.0776  339.097   11.082  342.551   7.7769 -3.453491 13.53837 
1 1 1   20    2   31 o  240.107   7.9030   44.230   2.9045   45.247   3.9897   43.083   4.2365  242.600   10.744  236.627   11.697 5.972244 15.88270 
1 1 1   20    2   32 o  123.281   12.763   11.835   2.3734   9.9807   3.7031   13.128   3.0920  111.092   22.548  129.324   15.959 -18.23256 27.62398 
1 1 1   20    2   33 o  178.228   9.3241   24.474   2.5348   27.936   3.9276   22.002   3.3184  189.773   13.612  168.417   12.972 21.35622 18.80334 
1 1 1   20    2   34 o  358.120   6.4447   98.354   3.5327   99.169   4.8275   97.415   5.1834  359.283   8.7784  355.972   9.5132 3.310577 12.94454 
1 1 1   20    2   35 f  256.946   7.7765   50.692   3.0584   49.091   4.2027   52.495   4.4592  252.462   10.876  261.025   11.161 -8.563889 15.58381 
1 1 1   20    2   36 o  158.760   11.571   19.541   2.7924   23.477   4.3542   16.791   3.6393  172.991   16.650  146.065   16.571 26.92636 23.49114 
1 1 1   20    2   37 o  156.547   12.122   19.041   2.8820   20.262   3.9377   17.631   4.2296  160.596   16.242  148.972   18.981 11.62482 24.98141 
1 1 1   20    2   38 o  225.092   8.8487   38.983   3.0487   39.398   4.6228   38.663   4.0556  225.112   13.478  223.381   11.904 1.730774 17.98286 
1 1 1   20    2   39 o  394.202   6.6676  119.306   4.0231  120.638   5.5608  117.843   5.8276  395.833   9.1782  391.073   9.7356 4.760315 13.37984 
1 1 1   20    2   40 o  164.032   12.089   20.929   3.0137   23.682   4.0554   17.535   4.5039  173.701   15.413  147.773   20.461 25.92792 25.61717 
1 1 1   20    2   41 o   70.962   22.800   3.9519   2.8093   5.0091   3.8235   2.7117   4.1413   80.083   26.655   69.646   27.073 10.43754 37.99266 
1 1 1   20    2   42 o   61.899   25.895   0.9139   4.1102 -13.7918   7.3659   7.5632   4.9531   53.160   26.119   95.638   30.227 -42.47779 39.94833 
1 1 1   20    2   43 o   97.388   23.885   7.9189   3.5333   4.6664   4.2351   15.368   6.4091   79.125   27.991  133.313   31.846 -54.18803 42.39846 
1 1 1   20    2   44 f   88.247   23.549   6.4984   3.2399   2.5633   4.6512   10.207   4.5156   71.086   28.365  109.623   27.072 -38.53683 39.21087 
1 1 1   20    2   45 o   90.704   24.686   6.9136   3.5190   15.262   5.0967  -0.6911   4.8646  134.900   25.621   60.899   26.830 74.00038 37.09784 
1 1 1   20    2   46 o  177.239   13.536   24.654   3.6443   23.588   4.8898   25.986   5.4659  171.318   18.966  179.318   20.270 -8.000443 27.75939 
1 1 1   20    2   47 o   87.660   24.025   6.4860   3.3194   5.2676   4.5098   7.9265   4.9035   82.070   28.900   96.180   30.028 -14.11073 41.67619 
1 1 1   20    2   48 o  127.224   17.856   13.105   3.3814   11.150   4.5691   15.472   5.0277  113.644   26.717  135.094   25.242 -21.45038 36.75591 
1 1 1   20    2   49 f  147.921   15.926   17.513   3.5489   16.274   5.5753   18.357   4.6016  136.892   27.562  149.337   20.687 -12.44485 34.46169 
1 1 1   20    2   50 o  119.960   18.507   11.816   3.2888   11.418   4.8168   12.163   4.5013  113.493   27.920  118.394   25.586 -4.901726 37.87001 
1 1 1   20    2   51 o  195.553   12.111   30.085   3.6072   28.261   5.1580   31.832   5.0466  186.289   18.327  198.758   16.744 -12.46898 24.82415 
1 1 1   20    2   52 o  200.236   12.329   31.640   3.7602   32.748   5.0636   30.278   5.6145  201.314   16.580  191.682   19.404 9.631439 25.52276 
1 1 1   20    2   53 o  159.204   17.534   20.820   4.2018   14.311   7.5530   23.736   5.0564  118.061   37.328  168.433   20.004 -50.37266 42.35005 
1 1 1   20    2   54 o   70.685   25.755   4.0657   3.6159   1.3981   4.7499   7.7418   5.5760   63.776   27.305   90.599   32.110 -26.82302 42.14993 
1 1 1   20    2   55 o   57.686   23.361   1.8667   3.2057  -0.9279   4.5325   4.6638   4.5346   55.215   24.990   75.008   28.541 -19.79291 37.93530 
1 1 1   20    3    0 o  434.385   10.788  144.750   7.1630  144.750   7.1630  144.750   7.1630  434.385   10.788  434.385   10.788 0.000000 0.000000 
1 1 1   20    3    1 o  703.200   11.720  378.910   12.615   0.0000   0.0000  378.910   12.615  ?   ?   703.200   11.720 0.000000 11.71993 
1 1 1   20    3    2 o  256.758   8.5829   50.487   3.3731   57.279   5.3699   46.060   4.3350  273.371   12.833  245.178   11.552 28.19389 17.26663 
1 1 1   20    3    3 f  547.376   7.6921  229.428   6.4447  243.478   10.037  219.572   8.4065  563.692   11.633  535.378   10.259 28.31384 15.51028 
1 1 1   20    3    4 f  233.955   8.6821   41.919   3.1090   40.357   5.4965   42.653   3.7701  228.832   15.789  235.960   10.439 -7.128357 18.92810 
1 1 1   20    3    5 f  663.214   5.7363  336.729   5.8231  335.523   12.482  337.064   6.5834  661.660   12.325  663.516   6.4823 -1.856689 13.92585 
1 1 1   20    3    6 o  254.693   4.9257   49.656   1.9202   54.601   3.7857   47.944   2.2281  266.995   9.2635  250.251   5.8170 16.74416 10.93845 
1 1 1   20    3    7 o  447.058   4.6472  152.988   3.1800  157.339   5.7211  151.043   3.8254  453.270   8.2462  444.185   5.6265 9.084747 9.982910 
1 1 1   20    3    8 o  638.168   5.1226  311.761   5.0037  327.474   8.7077  304.014   6.1140  653.895   8.7001  630.147   6.3389 23.74847 10.76440 
1 1 1   20    3    9 o  801.078   5.8359  491.289   7.1558  520.457   12.146  475.780   8.8560  824.275   9.6266  788.255   7.3401 36.01990 12.10575 
1 1 1   20    3   10 o  244.988   6.7770   45.955   2.5413   49.936   4.1220   43.514   3.2277  255.295   10.549  238.352   8.8471 16.94263 13.76757 
1 1 1   20    3   11 o  508.114   5.2211  197.645   4.0606  204.421   6.8986  194.053   5.0230  516.618   8.7242  503.435   6.5185 13.18283 10.89046 
1 1 1   20    3   12 o  550.089   5.3133  231.653   4.4737  226.555   7.2850  234.740   5.6684  543.859   8.7514  553.692   6.6885 -9.832825 11.01461 
1 1 1   20    3   13 o  281.414   6.8888   60.641   2.9673   71.528   7.6002   58.683   3.2231  304.823   16.349  276.817   7.6069 28.00562 18.03224 
1 1 1   20    3   14 o  130.781   13.156   13.248   2.5978   0.0000   0.0000   13.248   2.5978  ?   ?   130.781   13.156 0.000000 13.15617 
1 1 1   20    3   15 o  915.709   6.3599  642.053   8.9140  639.777   13.965  643.619   11.580  913.751   9.9847  916.668   8.2534 -2.917114 12.95429 
1 1 1   20    3   16 o  930.967   5.9035  663.599   8.4123  652.002   11.679  676.102   12.127  922.595   8.2706  939.475   8.4332 -16.87946 11.81196 
1 1 1   20    3   17 o  168.745   8.5865   21.871   2.2105   22.861   4.8555   21.612   2.4826  171.400   18.817  167.655   9.7161 3.744492 21.17783 
1 1 1   20    3   18 o  467.520   5.1449  167.344   3.6816  171.957   5.3313  163.138   5.0904  473.823   7.3510  461.521   7.2059 12.30264 10.29377 
1 1 1   20    3   19 o  393.560   5.3308  118.593   3.2113  121.255   4.7112  116.283   4.3888  397.853   7.7364  389.629   7.3590 8.223816 10.67738 
1 1 1   20    3   20 o  593.716   4.8638  269.882   4.4200  259.427   6.7372  277.782   5.8566  581.935   7.5638  602.257   6.3532 -20.32202 9.877921 
1 1 1   20    3   21 o  486.101   4.9259  180.921   3.6651  180.483   5.7960  181.212   4.7310  485.348   7.8020  486.419   6.3544 -1.071625 10.06232 
1 1 1   20    3   22 o  316.536   5.6719   76.730   2.7480   77.396   4.5601   76.351   3.4435  317.728   9.3767  315.694   7.1263 2.034424 11.77738 
1 1 1   20    3   23 o   38.573   17.500  -1.3234   2.2388   2.6747   3.5807  -3.8895   2.8687   67.893   25.468   37.383   17.858 30.50958 31.10496 
1 1 1   20    3   24 o  385.672   6.5503  113.950   3.8668  113.637   4.3592  115.104   8.3752  385.090   7.3956  386.907   14.142 -1.817322 15.95932 
1 1 1   20    3   25 o  246.427   7.5668   46.542   2.8541   48.233   3.6215   43.771   4.6368  250.761   9.4353  238.324   12.757 12.43732 15.86738 
1 1 1   20    3   26 o   40.909   17.741  -0.3052   2.0555  -0.2775   3.2841  -0.3231   2.6355   52.375   22.569   46.556   20.139 5.818989 30.24748 
1 1 1   20    3   27 o  363.344   5.3962  101.123   3.0011  102.316   4.4728  100.147   4.0474  365.291   7.9996  361.455   7.3156 3.836273 10.84024 
1 1 1   20    3   28 o  492.670   5.0282  185.911   3.7917  188.179   5.5912  183.979   5.1594  495.436   7.3730  489.932   6.8801 5.504730 10.08449 
1 1 1   20    3   29 o  489.322   5.5102  183.434   4.1269  187.082   6.8653  181.370   5.1642  493.721   9.0846  486.413   6.9363 7.308624 11.42987 
1 1 1   20    3   30 o  225.396   8.7172   38.990   3.0074   54.244   6.9905   35.525   3.3315  264.203   17.383  215.045   10.121 49.15823 20.11533 
1 1 1   20    3   31 o  358.990   6.2137   98.781   3.4143   99.549   4.7299   97.945   4.9337  360.132   8.5807  357.163   9.0247 2.969757 12.45286 
1 1 1   20    3   32 o  464.019   5.5425  165.001   3.9365  172.541   6.2229  159.971   5.0827  474.066   8.5760  456.674   7.2714 17.39203 11.24366 
1 1 1   20    3   33 o  239.474   7.5899   44.007   2.7820   43.305   4.2788   44.520   3.6617  237.111   11.790  240.637   9.9415 -3.526169 15.42168 
1 1 1   20    3   34 o   48.089   20.054   0.4151   2.4539  -2.0619   4.0852   1.8133   3.0692   52.513   23.750   59.872   23.297 -7.358246 33.26895 
1 1 1   20    3   35 o  144.849   12.077   16.294   2.6533   18.799   4.3407   14.801   3.3524  154.181   18.782  137.156   16.287 17.02444 24.86011 
1 1 1   20    3   36 o  124.752   14.156   12.200   2.6552   18.306   3.7923   6.3297   3.7187  152.590   16.500   88.288   25.858 64.30201 30.67425 
1 1 1   20    3   37 o  175.822   10.825   23.924   2.8991   22.296   4.0012   25.724   4.2064  168.670   15.678  181.366   15.295 -12.69540 21.90282 
1 1 1   20    3   38 o  179.955   10.464   25.052   2.8698   24.688   4.5137   25.299   3.7181  177.140   16.850  180.188   13.581 -3.048599 21.64186 
1 1 1   20    3   39 o  291.213   7.7679   65.185   3.4625   62.774   4.7720   67.865   5.0316  285.171   10.933  296.474   11.088 -11.30237 15.57131 
1 1 1   20    3   40 f  324.509   7.0992   80.903   3.5262   82.362   5.2423   79.697   4.7654  326.682   10.484  321.551   9.6823 5.131409 14.27097 
1 1 1   20    3   41 o  162.986   11.632   20.654   2.8829   23.651   4.2404   18.078   3.9311  173.258   16.177  150.953   17.328 22.30522 23.70573 
1 1 1   20    3   42 o  318.113   11.422   78.316   5.5613   75.243   9.4328   79.953   6.8852  307.640   20.143  320.516   14.034 -12.87537 24.55046 
1 1 1   20    3   43 f  179.132   14.826   25.209   4.0284   24.933   4.5272   26.258   8.8279  177.474   16.869  173.817   34.399 3.657028 38.31254 
1 1 1   20    3   44 o   73.356   24.101   4.2389   3.1295   4.4289   4.2708   4.0187   4.5990   77.849   28.047   77.073   28.872 0.7750320 40.25256 
1 1 1   20    3   45 o  221.759   11.386   38.234   3.8517   40.972   5.5122   35.622   5.3844  227.917   15.900  212.111   16.720 15.80667 23.07350 
1 1 1   20    3   46 o   76.376   24.407   4.7247   3.2226   4.2780   4.2772   5.3112   4.9012   76.779   28.006   83.561   30.053 -6.782318 41.07925 
1 1 1   20    3   47 o  132.202   17.353   14.059   3.4267   12.431   4.4817   16.351   5.3166  121.183   24.992  138.963   25.950 -17.77971 36.02769 
1 1 1   20    3   48 o   68.607   25.538   3.2531   3.5868   4.9254   4.4681   0.2222   6.0150   79.937   28.700   69.184   30.172 10.75256 41.64172 
1 1 1   20    3   49 o  263.310   9.8166   53.778   3.9564   57.913   6.2349   50.991   5.1191  270.400   15.125  254.725   13.175 15.67490 20.05835 
1 1 1   20    3   50 o   92.432   23.122   7.3357   3.2630   3.7601   4.6166   10.905   4.6125   74.219   28.658  111.116   27.313 -36.89625 39.58939 
1 1 1   20    3   51 o   58.652   24.119   1.4337   3.4813  -5.0384   4.6663   9.5586   5.2282   48.048   22.904  102.335   30.833 -54.28670 38.40919 
1 1 1   20    3   52 o  103.796   21.873   9.2362   3.3655   9.9553   4.7974   8.5394   4.7224  104.372   28.993   96.827   29.333 7.544449 41.24348 
1 1 1   20    3   53 o  126.432   20.703   13.570   3.8677   13.937   6.2463   13.341   4.9254  119.661   33.024  121.220   27.213 -1.559441 42.79181 
1 1 1   20    3   54 o  121.584   21.221   12.743   3.8055   4.4239   5.3746   21.107   5.3890   76.642   30.520  155.436   23.374 -78.79393 38.44232 
1 1 1   20    3   55 o  167.156   13.583   22.514   3.4452   21.803   4.8416   23.242   4.9035  159.779   20.252  165.416   19.758 -5.636703 28.29310 
1 1 1   20    4    0 o  326.229   11.871   81.824   5.9098   81.824   5.9098   81.824   5.9098  326.229   11.871  326.229   11.871 0.000000 0.000000 
1 1 1   20    4    1 o  1061.76   15.036  864.549   24.435   0.0000   0.0000  864.549   24.435  ?   ?   1061.76   15.036 0.000000 15.03559 
1 1 1   20    4    2 o  469.598   10.440  168.938   7.5044   0.0000   0.0000  168.938   7.5044  ?   ?   469.598   10.440 0.000000 10.44043 
1 1 1   20    4    3 o  389.052   7.7547  115.904   4.6179  126.586   7.5272  109.457   5.8477  406.423   12.100  378.004   10.107 28.41946 15.76574 
1 1 1   20    4    4 o  649.466   8.1808  323.016   8.1324  320.182   12.227  325.264   10.890  646.352   12.359  651.563   10.920 -5.211426 16.49228 
1 1 1   20    4    5 o  1046.86   10.643  839.617   17.054  823.044   24.229  855.890   24.008  1035.89   15.281  1056.42   14.847 -20.53320 21.30613 
1 1 1   20    4    6 o  381.109   13.061  111.339   7.6188  111.339   7.6188   0.0000   0.0000  381.109   13.061  ?   ?  0.000000 13.06065 
1 1 1   20    4    7 o  509.109   8.5391  198.504   6.6542  196.326   9.6660  200.467   9.1740  506.104   12.478  511.460   11.719 -5.355438 17.11792 
1 1 1   20    4    8 o  657.877   8.7011  331.478   8.7617  351.711   13.536  316.888   11.494  677.340   13.056  643.042   11.678 34.29706 17.51709 
1 1 1   20    4    9 o  125.798   17.903   12.392   3.3499   12.950   6.0906   12.150   4.0111  126.968   31.493  123.880   21.958 3.088364 38.39169 
1 1 1   20    4   10 o  684.195   7.3933  358.464   7.7426  385.687   14.805  348.217   9.0837  709.216   13.639  674.265   8.8016 34.95154 16.23214 
1 1 1   20    4   11 o  548.371   7.1996  230.265   6.0430  246.866   11.834  224.410   7.0283  567.388   13.627  541.296   8.4830 26.09253 16.05147 
1 1 1   20    4   12 o  1013.77   10.782  787.541   16.730   0.0000   0.0000  787.541   16.730  ?   ?   1013.77   10.782 0.000000 10.78172 
1 1 1   20    4   13 o  320.503   5.4462   78.642   2.6717   83.495   5.2222   76.921   3.1095  330.100   10.336  316.956   6.4095 13.14365 12.16174 
1 1 1   20    4   14 o  112.421   11.639   9.7916   1.9737   16.564   5.4903   8.7864   2.1151  144.420   25.783  106.211   13.302 38.20890 29.01234 
1 1 1   20    4   15 o  616.405   4.9414  290.874   4.6621  300.473   6.7908  282.317   6.4120  626.391   7.0828  607.181   6.8993 19.20996 9.887723 
1 1 1   20    4   16 o  157.842   7.6622   19.082   1.8512   22.102   2.6370   16.148   2.5993  169.514   10.211  144.642   11.844 24.87170 15.63831 
1 1 1   20    4   17 o  595.767   4.6497  271.723   4.2400  274.850   6.6644  269.596   5.4958  599.053   7.2682  593.368   6.0511 5.684814 9.457418 
1 1 1   20    4   18 o  546.760   5.1583  228.881   4.3169  230.745   8.3423  228.199   5.0449  548.682   9.9334  545.905   6.0376 2.777527 11.62432 
1 1 1   20    4   19 o  550.416   5.0735  231.955   4.2743  238.833   6.3405  226.226   5.7869  558.383   7.4186  543.476   6.9566 14.90686 10.17004 
1 1 1   20    4   20 o  715.477   5.0555  391.947   5.5364  405.929   8.7977  382.779   7.1239  727.891   7.8965  706.949   6.5835 20.94208 10.28092 
1 1 1   20    4   21 o  189.112   7.5391   27.400   2.1823   27.599   3.7051   27.294   2.7004  189.171   12.873  188.691   9.3498 0.4789581 15.90985 
1 1 1   20    4   22 o  369.115   5.2864  104.331   2.9867  103.690   4.9304  104.702   3.7538  367.797   8.7579  369.711   6.6335 -1.913940 10.98658 
1 1 1   20    4   23 o  162.797   13.641   20.508   3.3676   19.603   4.0156   22.654   6.1827  158.678   16.788  169.227   24.589 -10.54942 29.77336 
1 1 1   20    4   24 o   63.055   23.881   2.2185   3.1653   1.6145   3.8159   3.5510   5.6678   64.203   25.667   82.272   31.758 -18.06889 40.83328 
1 1 1   20    4   25 o  499.901   5.2074  191.387   3.9845  191.826   6.5289  191.126   5.0297  500.179   8.5280  499.456   6.5793 0.7228699 10.77093 
1 1 1   20    4   26 f  250.401   7.2727   48.057   2.7874   61.169   5.7219   43.977   3.1917  282.020   13.255  239.459   8.7081 42.56033 15.85981 
1 1 1   20    4   27 o  691.912   5.0017  366.665   5.2971  375.632   7.8476  359.160   7.1793  700.019   7.3242  684.568   6.8517 15.45111 10.02938 
1 1 1   20    4   28 o   80.481   17.586   5.1987   2.1058   7.0755   3.3445   3.9659   2.7106   93.519   23.417   71.615   22.320 21.90356 32.35052 
1 1 1   20    4   29 o  552.602   5.4208  233.942   4.5851  240.372   7.7723  230.510   5.6784  559.628   9.0736  548.377   6.7651 11.25092 11.31801 
1 1 1   20    4   30 o   84.490   17.775   5.7314   2.2260   8.6300   3.9577   4.3903   2.6921  102.961   25.295   74.487   22.054 28.47401 33.55915 
1 1 1   20    4   31 o  131.589   13.071   13.472   2.5978   13.219   3.8504   13.684   3.5195  128.900   20.177  131.701   17.925 -2.801285 26.98931 
1 1 1   20    4   32 o  302.172   6.3023   70.000   2.9149   69.218   4.4786   70.575   3.8393  300.117   9.7496  303.220   8.2723 -3.102692 12.78613 
1 1 1   20    4   33 o  147.365   11.145   16.811   2.4952   13.205   4.0828   18.961   3.1524  128.324   21.550  156.198   13.313 -27.87306 25.33066 
1 1 1   20    4   34 o  372.654   6.8473  106.535   3.9057   92.760   7.8113  111.126   4.5099  346.230   14.740  380.473   7.7441 -34.24350 16.65015 
1 1 1   20    4   35 o  125.396   13.194   12.280   2.4943   12.691   3.9181   11.999   3.2344  125.646   21.122  122.966   17.694 2.680145 27.55428 
1 1 1   20    4   36 o  121.480   16.210   11.664   2.9390   14.082   3.7592   7.8611   4.7135  132.965   19.012   97.999   29.220 34.96606 34.86042 
1 1 1   20    4   37 o  138.552   11.895   14.932   2.4981   13.397   3.7246   16.187   3.3681  129.419   19.400  143.505   15.584 -14.08656 24.88415 
1 1 1   20    4   38 o  178.457   10.828   24.658   2.9438   27.417   4.4188   22.457   3.9473  187.099   15.571  169.253   15.405 17.84605 21.90420 
1 1 1   20    4   39 o  238.937   8.1572   43.904   2.9833   43.156   4.4110   44.534   4.0501  235.873   12.260  240.169   11.017 -4.295959 16.48289 
1 1 1   20    4   40 o  275.917   7.9725   58.549   3.3670   65.210   5.2274   53.826   4.4016  290.356   11.762  263.997   10.893 26.35916 16.03134 
1 1 1   20    4   41 o  460.117   6.9508  162.662   4.8952  161.211   8.7956  163.313   5.8921  456.018   12.601  460.634   8.3568 -4.616180 15.12050 
1 1 1   20    4   42 o  101.901   19.740   8.4695   2.9677   11.003   4.5818   6.6383   3.8953  114.329   26.671   89.509   26.534 24.81997 37.62164 
1 1 1   20    4   43 o  222.249   12.642   38.476   4.2828   35.535   4.8606   48.686   9.0565  212.788   15.020  244.536   24.527 -31.74788 28.76044 
1 1 1   20    4   44 o   37.688   18.383  -6.0510   3.4541  -4.8841   4.5805  -7.5891   5.2590   48.711   23.067   48.523   23.436 0.1872635 32.88372 
1 1 1   20    4   45 o  249.225   10.131   48.042   3.8646   56.285   5.4261   39.556   5.5057  268.778   13.189  223.789   16.182 44.98897 20.87640 
1 1 1   20    4   46 o   91.483   23.521   7.0426   3.3118   7.4916   4.3597   6.4299   5.0925   93.910   28.125   89.232   30.752 4.677803 41.67354 
1 1 1   20    4   47 o   45.999   21.017  -1.8565   3.3022  -0.3122   4.6037  -3.4930   4.7392   60.065   26.290   52.494   24.407 7.570435 35.87307 
1 1 1   20    4   48 o  381.565   8.6925  112.513   5.0767  109.966   6.2665  117.377   8.6598  376.190   10.883  386.304   14.646 -10.11316 18.24654 
1 1 1   20    4   49 o  119.046   19.228   11.653   3.3841   12.584   5.2142   10.976   4.4483  119.266   28.872  112.400   26.319 6.866699 39.06800 
1 1 1   20    4   50 o  105.663   22.107   9.4783   3.4606   8.9725   4.8557   10.000   4.9332  100.093   29.615  105.499   29.434 -5.406364 41.75401 
1 1 1   20    4   51 o  104.988   21.595   9.3674   3.3545   12.099   4.6667   6.4478   4.8252  117.010   26.652   86.648   29.930 30.36189 40.07692 
1 1 1   20    4   52 o   47.631   21.259  -0.7580   3.1547   2.2093   4.4958  -3.6364   4.4280   66.605   27.401   49.054   23.061 17.55168 35.81354 
1 1 1   20    4   53 o   52.758   23.236  -0.1864   3.6461  -5.7268   5.7175   3.6111   4.7335   52.590   25.147   72.345   28.694 -19.75515 38.15429 
1 1 1   20    4   54 o   62.561   24.805   2.5113   3.5364   1.2647   4.8322   3.9490   5.1892   63.609   27.393   74.286   29.849 -10.67688 40.51325 
1 1 1   20    4   55 f  102.753   21.668   9.3020   3.3005   16.533   4.6852   2.1784   4.6502  136.649   23.232   65.358   27.455 71.29109 35.96529 
1 1 1   20    5    0 o  521.962   11.497  208.937   9.1749  208.937   9.1749  208.937   9.1749  521.962   11.497  521.962   11.497 0.000000 0.000000 
1 1 1   20    5    1 o  698.015   8.5999  373.138   9.1882  383.334   13.493  364.323   12.547  707.219   12.465  689.503   11.888 17.71503 17.22511 
1 1 1   20    5    2 o  282.015   12.003   60.949   5.1810   0.0000   0.0000   60.949   5.1810  ?   ?   282.015   12.003 0.000000 12.00255 
1 1 1   20    5    3 o  240.288   9.7066   44.227   3.5700   44.912   6.3106   43.905   4.3294  241.306   17.198  239.360   11.817 1.945709 20.86674 
1 1 1   20    5    4 o  1104.05   11.059  933.950   18.688  978.805   28.238  898.995   24.927  1129.48   16.334  1082.66   15.042 46.81860 22.20501 
1 1 1   20    5    5 o  1445.17   13.665  1601.25   30.228  1644.20   44.424  1564.21   41.250  1462.97   19.838  1427.19   18.883 35.78076 27.38862 
1 1 1   20    5    6 o  349.724   8.5889   93.671   4.5976  100.327   7.7924   90.116   5.6944  361.718   14.074  342.951   10.848 18.76773 17.76991 
1 1 1   20    5    7 f  1084.82   11.225  901.782   18.639  901.782   18.639   0.0000   0.0000  1084.82   11.225  ?   ?  0.000000 11.22513 
1 1 1   20    5    8 o  458.978   6.8502  161.298   4.8124  168.355   6.3028  151.432   7.4522  468.839   8.7829  444.556   10.952 24.28342 14.03869 
1 1 1   20    5    9 o  566.961   6.0919  246.100   5.2866  243.291   7.6527  248.665   7.3117  563.594   8.8711  569.810   8.3834 -6.215149 12.20564 
1 1 1   20    5   10 o  712.640   6.4730  388.842   7.0606  394.857   10.287  383.485   9.7085  717.957   9.3611  707.569   8.9642 10.38745 12.96100 
1 1 1   20    5   11 o  483.336   6.2894  178.865   4.6529  198.660   7.2042  164.698   6.0946  509.252   9.2423  463.713   8.5866 45.53894 12.61551 
1 1 1   20    5   12 o  483.793   6.3647  179.209   4.7131  189.348   7.1378  171.371   6.2758  497.157   9.3800  473.003   8.6684 24.15424 12.77200 
1 1 1   20    5   13 o  361.179   6.7557   99.889   3.7347  102.436   5.6593   97.924   4.9709  365.633   10.112  357.532   9.0834 8.100677 13.59284 
1 1 1   20    5   14 o  550.128   7.1646  231.762   6.0329  240.937   10.644  227.420   7.3226  560.557   12.406  544.864   8.7802 15.69299 15.19876 
1 1 1   20    5   15 o  134.100   7.2493   13.812   1.4825   11.504   2.2021   15.725   2.0048  121.911   11.955  142.967   9.2104 -21.05589 15.09143 
1 1 1   20    5   16 o  691.907   5.1576  366.516   5.4622  374.175   7.9825  359.773   7.4903  698.959   7.4613  685.397   7.1398 13.56165 10.32709 
1 1 1   20    5   17 o  420.310   4.9196  135.249   3.1650  138.335   4.6696  132.626   4.3045  424.993   7.1784  416.149   6.7578 8.844147 9.858902 
1 1 1   20    5   18 o  510.813   5.1401  199.776   4.0189  212.423   8.2038  195.782   4.6099  526.415   10.182  505.646   5.9563 20.76904 11.79591 
1 1 1   20    5   19 o  273.594   6.1567   57.323   2.5782   69.896   5.8889   54.342   2.8677  301.796   12.748  266.358   7.0339 35.43787 14.55995 
1 1 1   20    5   20 o  109.238   12.050   9.2672   1.9813   9.9956   3.3784   8.8853   2.4461  112.149   20.434  106.423   15.469 5.726563 25.62908 
1 1 1   20    5   21 o  380.648   5.6527  110.958   3.2935  118.778   4.9852  104.902   4.3872  393.693   8.2729  370.013   7.7464 23.68002 11.33347 
1 1 1   20    5   22 o  530.483   6.2079  215.544   5.0406  226.080   6.6584  201.399   7.7147  543.147   8.0091  512.467   9.8351 30.67969 12.68365 
1 1 1   20    5   23 o   42.701   18.375  -0.1873   2.1709   3.5874   3.7304  -2.1204   2.6696   73.408   26.238   40.286   18.586 33.12283 32.15363 
1 1 1   20    5   24 o  216.956   7.3623   36.071   2.4449   40.800   4.4707   34.054   2.9202  230.085   12.744  210.730   9.0535 19.35551 15.63284 
1 1 1   20    5   25 o  385.914   6.2097  114.095   3.6680  117.582   5.6602  111.570   4.8161  391.504   9.4455  381.472   8.2483 10.03232 12.54001 
1 1 1   20    5   26 o  407.216   5.7734  127.030   3.5985  133.407   7.1315  124.851   4.1681  416.767   11.179  403.639   6.7464 13.12827 13.05724 
1 1 1   20    5   27 o   52.561   19.936   1.5262   2.2079   4.9609   4.5620   0.4756   2.5230   83.587   29.089   49.189   20.408 34.39835 35.53434 
1 1 1   20    5   28 o  386.217   5.7486  114.282   3.3983  115.983   6.0602  113.502   4.1043  388.625   10.188  384.797   6.9685 3.828247 12.34321 
1 1 1   20    5   29 o  276.443   6.7983   58.582   2.8766   62.380   5.5370   57.178   3.3666  284.683   12.707  273.019   8.0561 11.66348 15.04560 
1 1 1   20    5   30 o  298.992   6.2301   68.518   2.8512   72.332   4.8322   66.481   3.5314  306.808   10.290  294.387   7.8373 12.42145 12.93463 
1 1 1   20    5   31 o   51.973   20.178   1.3401   2.2985   6.4508   3.6978  -1.8776   2.9341   89.495   25.664   43.466   19.841 46.02899 32.43930 
1 1 1   20    5   32 o  261.883   7.7500   52.628   3.1065   52.964   4.8184   52.389   4.0639  262.229   12.005  261.035   10.171 1.193451 15.73443 
1 1 1   20    5   33 o  176.195   9.1802   23.919   2.4672   25.407   3.8563   22.888   3.2102  180.818   14.044  171.886   12.283 8.931763 18.65720 
1 1 1   20    5   34 o  259.997   6.9941   51.866   2.7833   52.936   4.2869   51.086   3.6596  262.222   10.681  257.787   9.2748 4.434845 14.14568 
1 1 1   20    5   35 o  425.154   5.7223  138.589   3.7238  146.990   5.8015  132.704   4.8561  437.330   8.6668  415.731   7.6315 21.59943 11.54788 
1 1 1   20    5   36 o   90.954   19.473   6.7129   2.6293   9.7235   3.7286   3.7350   3.7082  109.041   23.060   73.179   26.159 35.86204 34.87233 
1 1 1   20    5   37 o  359.227   7.2929   99.104   4.0100   96.211   5.1291  103.653   6.4311  353.519   9.4789  366.439   11.466 -12.91998 14.87682 
1 1 1   20    5   38 o   84.450   19.946   5.8258   2.5371   8.6509   4.0403   3.9865   3.2600  102.044   25.841   72.745   24.614 29.29896 35.68750 
1 1 1   20    5   39 o  210.782   8.8195   34.196   2.8454   36.765   4.3782   32.318   3.7440  217.402   13.220  204.069   12.040 13.33354 17.88059 
1 1 1   20    5   40 o  306.405   7.3868   72.157   3.4644   76.153   5.4535   69.454   4.4858  313.867   11.352  300.135   9.7646 13.73175 14.97351 
1 1 1   20    5   41 o  161.829   13.736   20.493   3.3703   20.543   7.0706   20.478   3.8339  155.661   30.767  161.222   15.737 -5.561157 34.55766 
1 1 1   20    5   42 o  244.770   8.7863   46.162   3.2918   50.870   4.9563   42.445   4.4033  256.031   12.647  233.632   12.357 22.39915 17.68195 
1 1 1   20    5   43 o   94.127   25.589   7.4347   3.7836   7.5345   4.8331   7.2766   6.0810   95.067   29.833   95.733   33.570 -0.6655045 44.91029 
1 1 1   20    5   44 o  279.397   9.5512   60.281   4.0846   66.977   5.7397   53.411   5.8140  293.472   12.778  261.054   14.609 32.41791 19.40854 
1 1 1   20    5   45 o   51.619   22.772  -0.6955   3.5162   0.5292   4.5721  -2.4686   5.5013   62.921   26.859   60.074   27.323 2.847015 38.31443 
1 1 1   20    5   46 o   51.997   22.191   0.2327   3.1197   2.3544   4.7343  -1.3957   4.1476   70.252   28.411   53.920   24.198 16.33186 37.31908 
1 1 1   20    5   47 o  181.215   12.265   25.698   3.3819   32.841   5.1628   20.329   4.4758  203.123   16.755  158.676   18.794 44.44698 25.17829 
1 1 1   20    5   48 o  169.122   15.577   22.758   3.9870   25.903   5.0608   17.611   6.4735  179.052   18.744  141.003   30.852 38.04916 36.09937 
1 1 1   20    5   49 o   90.566   23.982   7.0370   3.3771   13.519   5.2110   2.3435   4.4343  124.008   28.103   67.897   27.483 56.11094 39.30776 
1 1 1   20    5   50 o   65.333   24.323   3.0073   3.2541   2.8579   4.5433   3.1646   4.6629   70.079   28.010   71.819   28.481 -1.740616 39.94702 
1 1 1   20    5   51 o  155.857   16.132   19.590   3.7928   9.5688   6.1049   25.889   4.8402  101.706   33.674  178.333   17.977 -76.62637 38.17185 
1 1 1   20    5   52 o   81.225   25.666   5.7499   3.5711  -0.2890   5.7259   9.5943   4.5685   64.563   28.741  102.605   28.212 -38.04218 40.27344 
1 1 1   20    5   53 o  100.144   21.631   8.6990   3.2188   12.334   4.5529   5.0669   4.5513  116.943   26.098   78.068   28.825 38.87566 38.88402 
1 1 1   20    5   54 o  125.455   20.010   13.418   3.7133   8.7877   5.1320   18.505   5.3794   95.418   30.833  143.613   25.402 -48.19459 39.94906 
1 1 1   20    5   55 o  113.932   20.744   11.274   3.4842   3.0742   5.1164   18.365   4.7579   70.122   29.075  144.932   22.151 -74.80920 36.55202 
1 1 1   20    6    0 o  378.630   11.917  110.116   6.8906  110.116   6.8906  110.116   6.8906  378.630   11.917  378.630   11.917 0.000000 0.000000 
1 1 1   20    6    1 o  487.292   7.9614  181.837   5.9381  184.561   8.9192  179.667   7.9583  490.747   11.874  484.256   10.737 6.490723 16.00847 
1 1 1   20    6    2 o  760.630   11.894  443.380   13.847   0.0000   0.0000  443.380   13.847  ?   ?   760.630   11.894 0.000000 11.89395 
1 1 1   20    6    3 o  308.245   6.0937   72.742   2.8751   79.556   7.3221   71.500   3.1261  322.073   14.853  305.591   6.6834 16.48215 16.28738 
1 1 1   20    6    4 o  666.468   8.5704  340.180   8.7428  351.240   13.473  332.135   11.491  676.900   13.004  658.358   11.403 18.54193 17.29504 
1 1 1   20    6    5 o  136.137   14.805   14.382   3.0353   7.8088   6.7665   16.037   3.3962  104.340   35.461  143.737   15.692 -39.39642 38.77760 
1 1 1   20    6    6 o  493.859   8.4037  186.790   6.3525  194.443   10.381  182.208   8.0318  503.597   13.468  487.655   10.760 15.94168 17.23847 
1 1 1   20    6    7 o  226.824   11.902   39.540   4.1179   39.540   4.1179   0.0000   0.0000  226.824   11.902  ?   ?  0.000000 11.90238 
1 1 1   20    6    8 f  562.191   7.1916  242.014   6.1885  259.867   8.0359  215.996   9.7010  582.469   9.0134  530.863   11.939 51.60675 14.95926 
1 1 1   20    6    9 o  559.699   7.1032  239.873   6.0853  263.226   8.1611  210.631   9.1323  586.211   9.0955  524.256   11.381 61.95502 14.56874 
1 1 1   20    6   10 o  794.570   6.8176  483.419   8.2915  498.726   12.232  470.409   11.278  806.823   9.9052  783.625   9.4025 23.19818 13.65719 
1 1 1   20    6   11 o  378.429   6.6346  109.654   3.8430  123.092   6.0329  100.477   4.9854  400.828   9.8333  362.173   8.9931 38.65494 13.32552 
1 1 1   20    6   12 f  399.753   6.7116  122.364   4.1066  123.619   6.1952  121.380   5.4848  401.666   10.077  398.059   9.0021 3.606995 13.51210 
1 1 1   20    6   13 o  311.152   7.4527   74.144   3.5494   84.988   5.5985   66.856   4.5897  332.996   10.984  295.379   10.152 37.61725 14.95673 
1 1 1   20    6   14 o  444.362   7.2964  151.220   4.9627  147.480   8.4987  153.156   6.1132  438.533   12.661  447.121   8.9325 -8.588745 15.49518 
1 1 1   20    6   15 f  798.770   6.0648  488.538   7.4149  500.534   9.6429  471.183   11.598  808.387   7.7933  784.155   9.6633 24.23175 12.41424 
1 1 1   20    6   16 o  790.538   6.0857  478.537   7.3638  506.222   9.8236  443.027   11.126  812.938   7.8949  760.347   9.5596 52.59064 12.39818 
1 1 1   20    6   17 o  508.899   4.8735  198.271   3.7962  204.659   5.7022  193.187   5.0874  516.920   7.2069  502.255   6.6176 14.66470 9.784318 
1 1 1   20    6   18 o  333.010   5.2215   84.908   2.6615   93.626   4.2035   79.074   3.4385  349.591   7.8556  321.310   6.9917 28.28119 10.51635 
1 1 1   20    6   19 o   47.295   18.492   1.0223   1.9408   4.4548   5.1978   0.4662   2.0921   84.175   30.848   45.340   18.677 38.83522 36.06115 
1 1 1   20    6   20 o  432.450   6.8002  143.249   4.5012  143.217   5.2321  143.339   8.8298  432.336   7.9065  432.049   13.352 0.2871094 15.51747 
1 1 1   20    6   21 o  546.574   5.4209  228.769   4.5351  233.969   6.6161  224.160   6.2287  552.574   7.8224  540.891   7.5235 11.68298 10.85327 
1 1 1   20    6   22 o  400.395   5.5308  122.774   3.3896  123.492   5.4158  122.312   4.3460  401.357   8.8158  399.554   7.1063 1.803009 11.32332 
1 1 1   20    6   23 o  420.638   5.1959  135.498   3.3453  148.575   5.8724  129.215   4.0704  440.215   8.7153  410.698   6.4750 29.51675 10.85733 
1 1 1   20    6   24 o  496.741   5.1255  188.968   3.8970  187.105   6.4970  190.015   4.8704  493.989   8.5927  498.023   6.3892 -4.033966 10.70777 
1 1 1   20    6   25 o  400.013   6.1887  122.587   3.7892  123.536   5.7980  121.879   5.0061  401.280   9.4398  398.699   8.2032 2.580750 12.50612 
1 1 1   20    6   26 o  181.206   8.9839   25.189   2.4918   19.677   5.4365   26.655   2.8036  157.488   23.252  186.098   9.8778 -28.61046 25.26343 
1 1 1   20    6   27 o  636.797   5.3373  310.623   5.2022  328.070   8.8885  301.533   6.4159  653.915   8.8806  627.249   6.6826 26.66547 11.11402 
1 1 1   20    6   28 o  113.014   13.905   9.9841   2.3546   18.195   5.5612   8.1908   2.5990  150.729   24.980  101.557   17.342 49.17178 30.40947 
1 1 1   20    6   29 o  205.812   8.6062   32.505   2.7112   29.591   6.1633   33.204   3.0189  193.982   21.098  207.953   9.4846 -13.97183 23.13180 
1 1 1   20    6   30 o  418.628   6.1264  134.318   3.9256  138.917   8.8526  133.192   4.3797  424.505   13.624  416.791   6.8653 7.714203 15.25637 
1 1 1   20    6   31 o  328.760   7.4161   82.910   3.7318   96.403   8.2118   79.398   4.1894  353.198   15.190  321.604   8.5107 31.59378 17.41156 
1 1 1   20    6   32 o  248.613   8.2921   47.451   3.1554   52.611   5.8929   45.376   3.7362  260.480   14.842  242.941   10.048 17.53925 17.92289 
1 1 1   20    6   33 o  300.084   7.1106   69.088   3.2660   83.124   6.4042   64.155   3.7968  328.260   12.746  289.008   8.5831 39.25223 15.36667 
1 1 1   20    6   34 o  292.168   6.6774   65.484   2.9861   69.911   4.7028   62.493   3.8654  301.408   10.194  285.162   8.8559 16.24588 13.50330 
1 1 1   20    6   35 o  278.988   7.4384   59.757   3.1764   62.171   4.6159   57.585   4.3778  284.103   10.615  273.450   10.459 10.65265 14.90212 
1 1 1   20    6   36 o   87.029   19.255   6.1527   2.4971   2.5677   3.6490   9.3099   3.4244   66.857   25.564  106.943   21.663 -40.08601 33.50810 
1 1 1   20    6   37 o  120.414   15.449   11.449   2.7817   19.446   4.0146   4.0631   3.8579  157.036   16.972   75.365   26.709 81.67156 31.64561 
1 1 1   20    6   38 o  241.666   8.1350   44.905   3.0091   48.973   4.9825   42.569   3.7754  251.145   13.006  234.933   10.499 16.21242 16.71483 
1 1 1   20    6   39 o   92.293   18.838   6.9186   2.5711   7.4099   3.9017   6.5416   3.4182   94.509   26.107   89.041   24.371 5.468033 35.71447 
1 1 1   20    6   40 o   83.020   20.612   5.6597   2.6071   5.3605   4.0309   5.8748   3.4184   82.594   27.363   84.645   24.793 -2.051109 36.92427 
1 1 1   20    6   41 f  248.801   9.7732   47.752   3.7219   37.008   7.6500   51.084   4.2600  213.788   23.781  257.104   10.825 -43.31602 26.12889 
1 1 1   20    6   42 o  144.705   13.399   16.412   2.9341   23.607   4.4206   10.746   3.9228  172.683   16.943  113.941   23.280 58.74176 28.79254 
1 1 1   20    6   43 o  160.985   15.974   20.494   3.8843   20.574   5.0525   20.378   6.0738  159.395   21.238  156.436   26.299 2.959320 33.80363 
1 1 1   20    6   44 o  182.130   12.613   25.907   3.4944   29.008   4.8236   22.481   5.0693  191.401   16.630  166.939   20.254 24.46228 26.20636 
1 1 1   20    6   45 o  178.191   11.829   24.763   3.2080   28.862   4.9617   21.819   4.2051  190.534   17.199  165.611   16.822 24.92313 24.05797 
1 1 1   20    6   46 o   45.548   20.678  -1.5632   3.1323  -2.1705   4.6226  -1.0476   4.2592   55.026   25.035   55.696   24.791 -0.6699791 35.23264 
1 1 1   20    6   47 o  179.276   13.178   25.246   3.5908   28.795   4.9787   21.397   5.1838  189.816   17.327  161.536   21.500 28.28001 27.61274 
1 1 1   20    6   48 o   45.181   20.821  -2.1792   3.3367  -3.4127   4.3942  -0.4994   5.1277   50.065   23.352   62.287   27.488 -12.22179 36.06818 
1 1 1   20    6   49 o   96.460   23.262   7.9615   3.3947   12.471   4.8890   3.7639   4.7171  119.257   27.364   74.842   28.949 44.41506 39.83541 
1 1 1   20    6   50 o   89.977   22.758   6.9515   3.1364   14.381   4.4983  -0.0772   4.3754  129.942   23.481   58.563   25.631 71.37889 34.76091 
1 1 1   20    6   51 f  116.889   18.319   11.277   3.1698   11.824   4.4991   10.738   4.4666  115.845   26.010  109.876   26.799 5.968529 37.34576 
1 1 1   20    6   52 o  117.862   20.898   11.785   3.6320   13.611   5.8346   10.630   4.6408  120.160   31.382  108.021   27.880 12.13882 41.97725 
1 1 1   20    6   53 o  133.881   15.849   14.635   3.1847   19.089   4.4799   10.085   4.5282  150.567   19.928  104.326   27.840 46.24073 34.23740 
1 1 1   20    6   54 o  111.160   22.254   10.851   3.6544   10.850   4.9295   10.851   5.4450  106.421   29.324  104.979   31.429 1.441879 42.98439 
1 1 1   20    6   55 o   82.573   24.853   6.2424   3.3982   4.3410   4.9269   7.9678   4.6933   74.239   29.329   90.815   29.499 -16.57557 41.59727 
1 1 1   20    7    0 o  1064.55   15.036  868.784   24.490  868.784   24.490  868.784   24.490  1064.55   15.036  1064.55   15.036 0.000000 0.000000 
1 1 1   20    7    1 o  113.954   10.958   10.041   1.8878   8.2464   4.7360   10.380   2.0583  102.094   28.966  115.788   11.778 -13.69355 31.26907 
1 1 1   20    7    2 o  767.371   8.3829  450.975   9.8462   0.0000   0.0000  450.975   9.8462  ?   ?   767.371   8.3829 0.000000 8.382874 
1 1 1   20    7    3 o  182.414   6.5837   25.477   1.8382   30.070   6.5679   25.086   1.9147  196.501   22.228  181.007   6.9110 15.49437 23.27732 
1 1 1   20    7    4 o  363.797   8.4694  101.361   4.7161  105.127   8.1729   99.480   5.7744  370.242   14.422  360.338   10.470 9.903473 17.82133 
1 1 1   20    7    5 o  562.859   8.4318  242.634   7.2642  262.301   11.814  230.678   9.2114  584.920   13.196  548.679   10.968 36.24127 17.15881 
1 1 1   20    7    6 o  1172.34   11.768  1053.33   21.116  1109.63   31.992  1009.86   28.109  1202.25   17.385  1147.20   16.008 55.04688 23.63242 
1 1 1   20    7    7 o  1233.07   12.365  1165.50   23.338  1165.50   23.338   0.0000   0.0000  1233.07   12.365  ?   ?  0.000000 12.36507 
1 1 1   20    7    9 o  710.143   7.5731  386.193   8.2317  391.898   10.425  376.746   13.415  715.238   9.5228  701.022   12.502 14.21613 15.71584 
1 1 1   20    7   10 o  354.960   7.9609   96.496   4.3252   97.124   5.5537   95.528   6.8953  356.031   10.191  352.976   12.763 3.055328 16.33232 
1 1 1   20    7   11 o  915.826   8.4933  642.438   11.906  644.052   14.752  639.423   20.163  916.770   10.513  912.950   14.429 3.820129 17.85278 
1 1 1   20    7   12 o  595.749   6.5289  271.764   5.9536  279.146   8.8467  265.653   8.0489  603.607   9.5754  588.880   8.9298 14.72705 13.09311 
1 1 1   20    7   13 o  202.985   9.6484   31.570   2.9977   31.622   4.6719   31.534   3.9083  202.411   15.191  202.385   12.681 0.2507019E-01 19.78767 
1 1 1   20    7   14 o  392.094   7.5073  117.746   4.5055  123.574   8.0151  115.054   5.4476  401.376   13.046  387.514   9.1844 13.86261 15.95498 
1 1 1   20    7   15 o  565.788   6.6240  245.141   5.7365  250.983   8.5912  240.441   7.7060  572.279   9.8079  560.193   8.9871 12.08667 13.30276 
1 1 1   20    7   16 o  301.435   6.0627   69.577   2.7973   66.329   3.4343   75.979   4.8214  294.268   7.6248  314.848   10.005 -20.58017 12.57906 
1 1 1   20    7   17 o  335.652   6.1314   86.274   3.1501   90.758   4.0136   79.081   5.0832  344.208   7.6181  321.179   10.340 23.02930 12.84332 
1 1 1   20    7   18 o  546.512   5.8261  228.713   4.8736  227.627   6.2607  230.383   7.7641  545.109   7.5036  548.261   9.2520 -3.152832 11.91226 
1 1 1   20    7   19 f  355.711   5.9144   96.898   3.2201   92.210   4.6429  101.242   4.4700  346.869   8.7449  363.499   8.0340 -16.63010 11.87511 
1 1 1   20    7   20 o  386.518   5.8767  114.413   3.4768  110.090   7.1240  115.764   3.9834  378.714   12.290  388.755   6.6943 -10.04132 13.99461 
1 1 1   20    7   21 f  341.960   6.8678   89.583   3.5947   84.833   4.7893   95.710   5.4400  332.627   9.4068  353.261   10.061 -20.63312 13.77346 
1 1 1   20    7   22 o  421.531   5.0841  136.068   3.2803  140.268   5.7027  133.990   4.0102  427.746   8.7101  418.238   6.2642 9.508270 10.72880 
1 1 1   20    7   23 o  349.291   5.4107   93.438   2.8927   94.527   5.2767   92.971   3.4588  351.033   9.8207  348.362   6.4868 2.671204 11.76961 
1 1 1   20    7   24 o  411.694   5.2802  129.810   3.3273  127.959   5.7990  130.719   4.0626  408.436   9.2760  413.060   6.4257 -4.623779 11.28422 
1 1 1   20    7   25 o  287.909   7.1814   63.531   3.1647   71.850   5.2271   58.717   3.9763  305.863   11.165  276.643   9.3906 29.22034 14.58911 
1 1 1   20    7   26 o  196.835   8.3367   29.714   2.5117   25.619   5.7436   30.682   2.7929  180.547   21.186  199.975   9.1246 -19.42743 23.06767 
1 1 1   20    7   27 o  512.478   5.5699  201.200   4.3691  217.039   8.7969  196.014   5.0339  531.525   10.813  505.736   6.5029 25.78842 12.61757 
1 1 1   20    7   28 o  546.220   5.7784  228.602   4.8311  234.206   10.173  226.970   5.4896  551.801   12.045  544.172   6.5907 7.629639 13.72999 
1 1 1   20    7   29 f  386.656   6.1761  114.580   3.6552  123.271   8.5562  112.641   4.0426  399.875   13.979  383.302   6.8905 16.57312 15.58525 
1 1 1   20    7   30 o  344.524   6.1233   90.977   3.2290   93.848   6.2881   89.949   3.7631  349.208   11.764  342.475   7.1787 6.732971 13.78160 
1 1 1   20    7   31 o  561.935   6.5002  242.107   5.5909  254.125   10.883  237.798   6.5166  574.334   12.380  556.716   7.6474 17.61749 14.55143 
1 1 1   20    7   32 o  136.973   11.941   14.561   2.4784   12.191   5.5444   15.154   2.7707  121.368   30.013  139.552   13.125 -18.18407 32.75793 
1 1 1   20    7   33 o  189.320   9.6961   27.632   2.8003   22.593   6.0151   29.026   3.1641  167.818   24.109  193.898   10.703 -26.07924 26.37811 
1 1 1   20    7   34 o  207.317   9.3317   33.050   2.9612   34.202   6.2389   32.714   3.3643  208.306   19.806  205.835   10.715 2.471786 22.51874 
1 1 1   20    7   35 o  144.073   16.278   16.328   3.5267   17.329   6.0928   15.824   4.3249  144.820   28.501  140.641   20.711 4.178940 35.23160 
1 1 1   20    7   36 o  148.103   12.569   17.074   2.8224   20.619   5.9008   16.022   3.2138  159.307   25.024  142.939   14.909 16.36761 29.12882 
1 1 1   20    7   37 o  286.952   8.8619   63.353   3.8923   72.130   6.8494   59.168   4.7303  304.776   14.683  276.880   11.162 27.89563 18.44350 
1 1 1   20    7   38 o  274.437   7.6611   57.882   3.2181   52.689   5.4630   60.642   3.9824  260.281   13.762  280.631   9.2714 -20.34988 16.59335 
1 1 1   20    7   39 o  139.015   12.812   15.095   2.6955   14.304   4.3363   15.593   3.4411  132.694   22.129  140.450   16.310 -7.755264 27.49064 
1 1 1   20    7   40 o   38.623   18.418  -3.8182   3.0234  -5.5774   6.8480  -3.3923   3.3696   62.181   29.053   42.746   20.102 19.43502 35.32976 
1 1 1   20    7   41 o   65.820   22.316   3.2567   2.6797   7.4497   4.0993   0.1280   3.5411   94.449   27.002   55.084   23.579 39.36495 35.84773 
1 1 1   20    7   42 o  135.859   14.401   14.540   2.9490   10.951   4.6283   16.992   3.8262  113.862   26.971  146.073   17.459 -32.21113 32.12909 
1 1 1   20    7   43 o  118.227   21.470   11.468   3.7421   11.530   4.7144   11.364   6.1522  116.662   26.945  114.279   33.200 2.383080 42.75801 
1 1 1   20    7   44 o  235.092   9.1843   42.658   3.3049   45.345   5.0977   40.710   4.3406  240.697   13.896  228.530   12.456 12.16689 18.66144 
1 1 1   20    7   45 o   62.535   22.945   2.6552   2.8769   9.1600   4.4416  -2.0464   3.7761  103.405   27.562   49.366   22.524 54.03880 35.59494 
1 1 1   20    7   46 o  153.518   13.676   18.561   3.1799   24.666   4.9787   14.354   4.1326  175.081   18.877  132.201   21.135 42.87952 28.33781 
1 1 1   20    7   47 o   95.446   23.660   7.7304   3.4393   8.2861   4.4401   6.8968   5.4382   97.842   28.141   91.399   31.763 6.443588 42.43581 
1 1 1   20    7   48 o   85.455   23.729   6.2114   3.2141   7.1675   4.4145   5.1328   4.6888   91.214   28.494   81.227   29.369 9.986557 40.92023 
1 1 1   20    7   49 o   83.069   26.243   5.8747   3.7339   2.6762   4.8241   10.654   5.8971   70.782   28.660  107.959   32.795 -37.17659 43.55384 
1 1 1   20    7   50 o  101.871   20.734   8.7509   3.1231   9.2863   4.3336   8.1724   4.5048  102.292   27.206   95.789   28.567 6.503059 39.44870 
1 1 1   20    7   51 o   65.358   23.685   3.2109   3.0520   2.1983   4.2447   4.2946   4.3913   65.625   26.768   75.245   28.208 -9.619919 38.88690 
1 1 1   20    7   52 o  187.114   12.935   27.806   3.6819   21.317   5.7270   32.378   4.8070  156.397   24.747  200.224   15.814 -43.82677 29.36834 
1 1 1   20    7   53 o  125.295   16.547   12.924   3.0958   8.9465   4.2877   17.256   4.4744   98.308   27.446  142.090   21.224 -43.78291 34.69456 
1 1 1   20    7   54 o  172.076   22.010   25.611   5.6642   0.0000   0.0000   25.611   5.6642  ?   ?   172.076   22.010 0.000000 22.00996 
1 1 1   20    7   55 o  166.536   13.049   22.298   3.2997   21.915   4.5587   22.720   4.7823  161.027   18.853  163.460   19.499 -2.433777 27.12244 
1 1 1   20    8    0 o  490.943   7.1172  184.624   5.3457  184.624   5.3457  184.624   5.3457  490.943   7.1172  490.943   7.1172 0.000000 0.000000 
1 1 1   20    8    1 o  343.397   4.8871   90.269   2.5687   86.708   3.6567   93.738   3.6092  336.509   7.0994  349.895   6.7392 -13.38562 9.788685 
1 1 1   20    8    2 o  189.204   7.6329   27.413   2.2105   0.0000   0.0000   27.413   2.2105  ?   ?   189.204   7.6329 0.000000 7.632861 
1 1 1   20    8    3 o  432.621   5.8777  143.288   3.8921  158.209   8.6119  139.457   4.3631  454.311   12.384  426.777   6.6792 27.53342 14.07076 
1 1 1   20    8    4 o  377.230   8.3254  108.985   4.8071  120.751   7.8184  101.833   6.0953  396.873   12.871  364.549   10.924 32.32373 16.88134 
1 1 1   20    8    5 o  346.373   9.0213   91.897   4.7828   95.622   8.1717   89.956   5.8987  353.050   15.122  342.615   11.248 10.43546 18.84645 
1 1 1   20    8    6 o  428.107   8.7039  140.377   5.7034  144.844   9.0273  137.409   7.3580  434.614   13.570  423.437   11.353 11.17688 17.69277 
1 1 1   20    8    7 o  231.712   12.561   41.281   4.4382   41.281   4.4382   0.0000   0.0000  231.712   12.561  ?   ?  0.000000 12.56086 
1 1 1   20    8    8 o  604.193   7.3764  279.547   6.8216  291.809   8.7556  260.607   10.882  617.194   9.2682  583.060   12.193 34.13354 15.31585 
1 1 1   20    8    9 o  135.232   15.207   14.209   3.0932   17.908   4.1606   9.6375   4.6250  151.593   18.301  109.625   27.586 41.96775 33.10448 
1 1 1   20    8   10 o  586.058   7.4398  263.029   6.6737  267.436   8.4478  255.713   10.885  590.835   9.3413  577.522   12.314 13.31378 15.45599 
1 1 1   20    8   11 o  685.604   7.7605  360.003   8.1439  352.742   10.034  374.017   13.941  678.518   9.6616  698.352   13.042 -19.83405 16.23069 
1 1 1   20    8   12 o  379.365   8.2573  110.238   4.7948  111.436   6.1153  108.327   7.7250  381.319   10.477  375.794   13.430 5.524750 17.03366 
1 1 1   20    8   13 o  509.639   6.6065  198.893   5.1536  195.002   7.6225  202.169   6.9944  504.449   9.8721  513.698   8.8956 -9.249329 13.28870 
1 1 1   20    8   14 o  661.737   7.5429  335.396   7.6400  341.076   13.443  332.686   9.2853  666.771   13.172  658.930   9.2063 7.841492 16.07046 
1 1 1   20    8   15 f  162.246   12.062   20.300   2.9739   29.227   4.9690   15.318   3.7122  194.288   16.877  140.051   17.713 54.23639 24.46593 
1 1 1   20    8   16 o  161.986   9.1429   20.172   2.2576   18.296   2.7293   24.236   4.0175  154.014   11.664  177.016   14.968 -23.00175 18.97620 
1 1 1   20    8   17 o  540.812   5.7862  223.963   4.7897  229.087   6.2026  216.394   7.5387  546.864   7.4101  531.360   9.2691 15.50421 11.86696 
1 1 1   20    8   18 o  385.045   6.2682  113.546   3.6943  116.456   4.8062  109.343   5.7751  389.859   8.0543  377.647   9.9910 12.21164 12.83318 
1 1 1   20    8   19 f  637.535   6.0057  311.279   5.8606  316.824   7.7454  303.852   8.9636  643.029   7.8694  629.578   9.3017 13.45087 12.18401 
1 1 1   20    8   20 o  264.909   10.835   53.837   4.3935   49.402   6.0867   58.662   6.3482  252.932   15.801  275.806   15.095 -22.87317 21.85247 
1 1 1   20    8   21 o  281.259   6.9096   60.605   2.9746   68.703   4.6980   55.186   3.8431  299.270   10.256  268.272   9.3591 30.99783 13.88446 
1 1 1   20    8   22 o  506.741   5.6816  196.673   4.4068  209.180   6.6568  186.916   5.8797  522.377   8.3256  493.846   7.7784 28.53015 11.39383 
1 1 1   20    8   23 o  374.639   5.2753  107.492   3.0251  113.967   5.4453  104.601   3.6381  385.478   9.2290  369.504   6.4326 15.97314 11.24958 
1 1 1   20    8   24 o  512.151   5.0759  200.883   3.9791  207.662   6.9030  197.509   4.8695  520.370   8.6667  507.739   6.2658 12.63141 10.69448 
1 1 1   20    8   25 o  221.291   8.9398   37.565   3.0280   37.321   5.6764   37.663   3.5799  219.247   17.049  221.475   10.560 -2.228165 20.05473 
1 1 1   20    8   26 o  250.909   7.1315   48.258   2.7388   55.858   7.7928   47.187   2.9255  267.961   19.125  248.076   7.7045 19.88528 20.61898 
1 1 1   20    8   27 o  106.781   14.033   8.9321   2.2380   17.799   6.6378   7.7949   2.3772  147.706   30.374   99.231   16.211 48.47417 34.42941 
1 1 1   20    8   28 o  228.915   7.7760   40.191   2.7246   43.381   7.3814   39.688   2.9316  235.409   20.696  227.434   8.4213 7.974304 22.34354 
1 1 1   20    8   29 o  320.944   6.2658   78.951   3.0781   72.066   6.0025   81.408   3.5853  305.891   12.820  325.821   7.1892 -19.93005 14.69841 
1 1 1   20    8   30 o  242.867   7.3839   45.244   2.7449   52.393   5.7136   43.099   3.1297  260.137   14.406  236.942   8.6296 23.19434 16.79274 
1 1 1   20    8   31 o  184.842   10.375   26.355   2.9233   27.987   7.6001   26.072   3.1670  186.327   27.473  183.705   11.318 2.622620 29.71279 
1 1 1   20    8   32 o  258.289   7.4789   51.194   2.9567   51.056   6.1382   51.236   3.3740  256.301   15.723  258.289   8.5342 -1.987335 17.88954 
1 1 1   20    8   33 o  179.352   10.073   24.825   2.7542   22.529   5.9435   25.453   3.1080  167.589   23.843  181.428   11.247 -13.83965 26.36230 
1 1 1   20    8   34 o   45.823   20.835  -1.8370   3.1958  -0.6410   5.7976  -2.3590   3.8303   67.887   29.614   49.592   22.650 18.29567 37.28260 
1 1 1   20    8   35 o  492.282   6.0285  185.877   4.5425  188.100   8.2220  184.900   5.4497  493.993   10.874  490.745   7.2552 3.248016 13.07211 
1 1 1   20    8   36 o  270.461   7.8961   56.210   3.2688   54.227   6.5606   56.865   3.7701  263.418   16.352  271.858   9.0602 -8.439972 18.69449 
1 1 1   20    8   37 o  496.355   6.9186  189.173   5.2563  203.985   8.6259  180.424   6.6293  514.143   10.961  484.206   8.9448 29.93729 14.14748 
1 1 1   20    8   38 o  352.362   7.3272   95.391   3.9518  107.864   9.2107   92.576   4.3750  371.907   16.180  346.948   8.2384 24.95871 18.15703 
1 1 1   20    8   39 o  338.090   7.6043   87.870   3.9351   97.778   9.1286   85.608   4.3612  353.577   16.867  333.517   8.5431 20.06024 18.90751 
1 1 1   20    8   40 o  113.846   18.659   10.441   3.1388   7.4578   8.0814   10.971   3.4062  101.630   38.234  116.416   19.826 -14.78613 43.06853 
1 1 1   20    8   41 o  262.876   9.2987   53.281   3.7415   52.182   8.9664   53.512   4.1170  254.323   23.292  263.245   10.218 -8.922607 25.43494 
1 1 1   20    8   42 o   90.717   19.698   6.7547   2.6568   3.3852   3.9802   9.4624   3.5680   71.779   26.866  106.929   22.512 -35.14946 35.05062 
1 1 1   20    8   43 o  111.137   18.668   10.009   3.0631   13.958   4.7284   7.1545   4.0207  129.407   24.774   92.312   26.846 37.09481 36.53010 
1 1 1   20    8   44 o   74.032   22.471   4.4660   2.7694   11.752   4.4611  -0.1028   3.5326  118.081   25.434   53.881   23.312 64.19962 34.50113 
1 1 1   20    8   45 o  132.741   14.659   13.955   2.9287   13.721   4.5334   14.122   3.8367  128.204   23.984  131.863   19.606 -3.658875 30.97790 
1 1 1   20    8   46 f  242.860   10.122   45.683   3.7626   42.987   5.5106   48.038   5.1499  233.243   15.524  247.487   13.648 -14.24380 20.67033 
1 1 1   20    8   47 o   68.624   23.844   3.6016   3.0646   2.5694   4.5272   4.4746   4.1635   69.673   27.921   76.862   27.693 -7.189011 39.32485 
1 1 1   20    8   48 o   54.342   22.508   0.9619   3.0612  -0.9215   4.3167   2.8672   4.3417   55.985   24.936   69.752   27.539 -13.76752 37.15141 
1 1 1   20    8   49 o   43.418   20.453  -3.3257   3.5144  -1.4033   4.5005  -6.3299   5.6261   55.539   25.040   52.049   24.904 3.490051 35.31587 
1 1 1   20    8   50 o  102.752   19.910   8.8503   3.0183   13.010   4.3889   5.1178   4.1576  122.916   24.189   79.032   27.755 43.88413 36.81646 
1 1 1   20    8   51 o   68.470   24.937   3.5748   3.3891  -2.2809   5.6382   6.8875   4.2408   59.498   27.288   88.131   27.981 -28.63249 39.08455 
1 1 1   20    8   52 o   48.779   21.354  -0.1357   3.0386   1.1933   4.3273  -1.4283   4.2676   61.604   26.210   53.094   24.117 8.510509 35.61696 
1 1 1   20    8   53 o  195.780   10.950   30.225   3.2682   27.518   4.5467   33.119   4.7010  183.488   16.361  202.192   15.303 -18.70352 22.40241 
1 1 1   20    8   54 o  207.379   12.020   34.206   3.7989   26.429   5.9018   39.708   4.9641  174.043   22.694  221.426   14.731 -47.38364 27.05590 
1 1 1   20    9    0 o   42.601   22.619   2.0018   1.9883   2.0018   1.9883   2.0018   1.9883   42.601   22.619   42.601   22.619 0.000000 0.000000 
1 1 1   20    9    1 o  572.753   5.2563  251.132   4.6081  247.842   6.4759  254.505   6.5585  568.906   7.4369  576.503   7.4325 -7.596985 10.51421 
1 1 1   20    9    2 o  275.116   5.5311   57.945   2.3292   56.940   3.7742   58.562   2.9600  272.647   9.0439  276.552   6.9928 -3.905426 11.43204 
1 1 1   20    9    3 o  213.318   6.6755   34.842   2.1796   31.464   2.4710   46.681   4.6263  202.695   7.9647  246.776   12.248 -44.08122 14.60989 
1 1 1   20    9    4 o  281.113   9.1406   60.533   3.9330   78.549   6.5071   50.164   4.9368  320.063   13.283  255.800   12.609 64.26268 18.31428 
1 1 1   20    9    5 o   89.622   23.555   6.4085   3.2737   5.6573   5.8786   6.7462   3.9413   92.336   32.944   92.464   26.490 -0.1278152 42.27329 
1 1 1   20    9    6 o  625.382   8.7481  299.573   8.3739  304.371   12.458  295.618   11.310  630.052   12.918  621.015   11.899 9.037476 17.56277 
1 1 1   20    9    7 f  491.421   9.1625  184.997   6.8919  184.997   6.8919   0.0000   0.0000  491.421   9.1625  ?   ?  0.000000 9.162526 
1 1 1   20    9    8 o  441.783   7.4345  149.465   5.0272  149.763   6.4024  148.985   8.1186  442.135   9.4605  440.844   12.032 1.291290 15.30566 
1 1 1   20    9    9 o  432.460   7.5785  143.229   5.0165  144.868   6.4418  140.703   7.9963  434.833   9.6786  428.395   12.195 6.438354 15.56884 
1 1 1   20    9   10 o  392.604   7.9403  118.057   4.7716  110.100   5.8129  134.492   8.3545  379.056   10.019  418.764   13.034 -39.70767 16.43980 
1 1 1   20    9   11 o  138.471   16.597   14.936   3.4475   17.876   4.2844   9.5339   5.8067  151.323   18.910  109.953   32.344 41.37048 37.46610 
1 1 1   20    9   12 o  832.422   8.3580  530.806   10.649  547.128   13.454  503.426   17.425  844.905   10.403  809.972   14.055 34.93317 17.48657 
1 1 1   20    9   13 o  508.311   8.0136  197.922   6.2349  201.502   7.8737  191.902   10.209  512.756   10.032  500.119   13.337 12.63644 16.68897 
1 1 1   20    9   14 o  313.893   10.753   75.536   5.1662   74.389   7.1359   76.799   7.4889  311.250   14.979  316.215   15.473 -4.964935 21.53523 
1 1 1   20    9   15 o  669.782   6.9219  343.586   7.0962  370.002   10.909  324.206   9.3434  694.740   10.258  650.412   9.3852 44.32727 13.90385 
1 1 1   20    9   16 o  376.347   6.0592  108.464   3.4904  108.536   4.4312  108.345   5.6654  376.401   7.6914  375.952   9.8453 0.4497986 12.49352 
1 1 1   20    9   17 o  329.174   6.5492   82.990   3.2998   81.594   4.2761   85.044   5.1882  326.305   8.5615  333.044   10.178 -6.738464 13.29981 
1 1 1   20    9   18 o  587.230   5.9720  264.089   5.3678  265.920   6.9933  261.464   8.3745  589.125   7.7555  584.014   9.3684 5.110413 12.16197 
1 1 1   20    9   19 f  540.732   6.7359  223.978   5.5750  226.242   6.5280  217.878   10.716  543.368   7.8490  532.630   13.145 10.73889 15.30970 
1 1 1   20    9   20 o  398.030   6.6144  121.362   4.0297  118.635   7.2004  122.606   4.8626  393.108   11.967  399.981   7.9425 -6.872864 14.36266 
1 1 1   20    9   21 o   71.063   20.541   3.9850   2.3605   8.5782   3.8567   1.2339   2.9848  103.110   24.751   56.745   22.695 46.36483 33.58102 
1 1 1   20    9   22 o  195.605   8.8406   29.339   2.6469   32.814   4.3368   27.276   3.3414  206.120   13.826  188.109   11.663 18.01198 18.08800 
1 1 1   20    9   23 o  101.374   17.051   8.1379   2.5518   12.119   4.9072   6.6624   2.9875  122.354   26.933   90.937   21.755 31.41683 34.62170 
1 1 1   20    9   24 o  290.362   7.5194   64.628   3.3419   69.363   6.0644   62.564   4.0049  300.305   13.193  285.575   9.1622 14.73026 16.06270 
1 1 1   20    9   25 o  292.896   8.0173   65.784   3.5942   70.669   7.2536   64.194   4.1380  302.328   15.729  289.233   9.3470 13.09570 18.29684 
1 1 1   20    9   26 o  312.835   6.6189   75.005   3.1693   75.462   10.089   74.955   3.3383  311.008   21.323  312.706   6.9747 -1.697449 22.43435 
1 1 1   20    9   27 o  264.229   6.5490   53.512   2.6487   52.750   5.4080   53.752   3.0380  261.353   13.566  264.760   7.4965 -3.406860 15.49907 
1 1 1   20    9   28 o  248.311   6.8465   47.271   2.6021   54.611   5.4346   45.088   2.9640  265.906   13.396  242.432   7.9876 23.47362 15.59637 
1 1 1   20    9   29 o  114.548   12.814   10.232   2.2083   13.774   5.0984   9.4136   2.4500  130.122   26.499  109.418   15.025 20.70455 30.46226 
1 1 1   20    9   30 o  333.176   6.1517   85.093   3.1372   98.330   6.1459   80.429   3.6483  357.475   11.232  323.802   7.3610 33.67380 13.42947 
1 1 1   20    9   31 o  158.677   11.489   19.487   2.7715   32.546   7.5337   17.443   2.9805  201.953   24.899  149.811   13.131 52.14214 28.14935 
1 1 1   20    9   32 o  261.745   7.4880   52.579   3.0000   49.590   6.1490   53.512   3.4367  252.458   15.995  263.951   8.5065 -11.49274 18.11667 
1 1 1   20    9   33 o  142.979   14.036   15.958   3.0321   15.753   5.7521   16.036   3.5681  138.292   28.132  142.774   16.640 -4.481476 32.68467 
1 1 1   20    9   34 o  179.020   11.310   24.805   3.0831   21.217   6.0859   26.044   3.5759  161.771   25.416  183.163   12.836 -21.39165 28.47368 
1 1 1   20    9   35 o  129.829   13.340   13.176   2.6133   18.507   6.1793   12.015   2.8839  149.767   27.985  123.422   15.615 26.34525 32.04648 
1 1 1   20    9   36 o  220.507   8.8028   37.405   2.9711   42.574   6.5949   36.088   3.3279  232.462   18.693  216.423   10.046 16.03879 21.22137 
1 1 1   20    9   37 o  154.717   14.714   18.758   3.4424   17.448   6.3168   19.311   4.1057  144.340   29.586  156.276   17.463 -11.93599 34.35477 
1 1 1   20    9   38 o  288.835   8.1326   64.160   3.5954   50.951   8.5758   66.977   3.9603  252.478   22.425  294.990   8.7710 -42.51198 24.07894 
1 1 1   20    9   39 f  161.596   12.349   20.338   3.0313   36.610   7.2482   16.888   3.3371  213.463   22.524  146.511   15.097 66.95137 27.11569 
1 1 1   20    9   40 o  368.635   7.5620  104.493   4.2668  107.406   9.5770  103.771   4.7659  370.267   16.898  367.137   8.4811 3.129639 18.90726 
1 1 1   20    9   41 o  343.660   7.9859   90.891   4.2007   95.906   9.7079   89.735   4.6595  348.502   18.263  341.233   8.9211 7.269440 20.32511 
1 1 1   20    9   42 o  176.728   12.505   24.367   3.3609   31.074   7.5375   22.702   3.7549  194.077   26.030  169.971   14.574 24.10631 29.83183 
1 1 1   20    9   43 o  212.037   12.704   35.075   4.1040   27.245   10.460   36.499   4.4618  172.589   40.322  216.031   13.562 -43.44157 42.54134 
1 1 1   20    9   44 o   58.821   23.659   1.5288   3.2639  -1.6384   7.5816   2.2494   3.6162   73.109   32.769   64.262   25.209 8.846901 41.34386 
1 1 1   20    9   45 o  142.738   16.869   16.286   3.6143   16.808   7.9357   16.150   4.0599  135.611   37.139  141.234   19.284 -5.622772 41.84764 
1 1 1   20    9   46 o   83.438   27.371   5.7300   4.0369  -1.4894   7.9150   8.2683   4.6933   74.282   33.375   97.830   29.154 -23.54743 44.31559 
1 1 1   20    9   47 o  196.773   11.451   30.239   3.4339   31.502   4.9587   29.075   4.7600  198.780   16.445  190.921   16.449 7.859406 23.25992 
1 1 1   20    9   48 o  113.079   18.193   10.469   3.0421   9.0486   4.3899   11.781   4.2194  101.511   27.549  117.419   24.279 -15.90815 36.72104 
1 1 1   20    9   49 o  128.505   19.406   13.623   3.6981   15.117   4.8795   11.607   5.6684  132.590   24.959  112.583   31.601 20.00722 40.26901 
1 1 1   20    9   50 o  180.301   11.910   25.577   3.2684   31.044   4.5821   19.914   4.6635  197.020   15.315  155.079   20.121 41.94069 25.28608 
1 1 1   20    9   51 o  220.537   11.117   38.176   3.7406   26.507   5.8214   46.382   4.8818  177.304   21.917  241.905   13.235 -64.60075 25.60321 
1 1 1   20    9   52 o   80.086   23.099   5.6293   2.9877   2.0591   4.1554   9.4503   4.2989   63.840   26.313  101.571   27.136 -37.73069 37.79812 
1 1 1   20    9   53 o   41.372   19.477  -2.7615   3.1785   1.9274   4.3252  -8.2669   4.6868   63.599   26.582   42.105   20.716 21.49366 33.70090 
1 1 1   20    9   54 o   77.688   23.118   5.3980   2.9526   1.8739   4.0423   9.4285   4.3230   61.681   25.731   99.871   27.436 -38.19075 37.61468 
1 1 1   20   10    0 o  386.601   7.1464  114.534   4.2256  114.534   4.2256  114.534   4.2256  386.601   7.1464  386.601   7.1464 0.000000 0.000000 
1 1 1   20   10    1 f  911.033   6.7042  635.515   9.3487  635.766   13.222  635.264   13.220  910.984   9.4824  910.624   9.4847 0.3599854 13.41177 
1 1 1   20   10    2 o   97.314   10.869   7.3473   1.5913   4.5467   2.7064   8.8272   1.9673   76.089   21.996  106.604   12.281 -30.51568 25.19202 
1 1 1   20   10    3 o  978.320   8.2136  733.049   12.299  738.085   15.069  722.998   21.289  981.491   10.031  970.835   14.326 10.65613 17.48861 
1 1 1   20   10    4 o  107.516   20.495   9.1831   3.2497   9.7504   4.9954   8.7669   4.2788  110.372   29.140  104.614   26.648 5.758682 39.48714 
1 1 1   20   10    5 f  351.700   9.1362   94.756   4.9182   89.203   7.2933   99.386   6.6605  341.019   13.973  360.061   12.085 -19.04175 18.47404 
1 1 1   20   10    6 o  506.656   8.5998  196.628   6.6692  206.396   9.9007  188.514   9.0236  518.838   12.467  495.895   11.888 22.94373 17.22666 
1 1 1   20   10    7 o  318.566   10.304   77.767   5.0245   77.767   5.0245   0.0000   0.0000  318.566   10.304  ?   ?  0.000000 10.30449 
1 1 1   20   10    8 o  433.857   7.5944  144.160   5.0433  144.144   6.3902  144.186   8.2122  433.739   9.6254  433.639   12.373 0.9979248E-01 15.67577 
1 1 1   20   10    9 o  548.041   7.4990  230.027   6.2905  219.639   7.7208  250.536   10.849  535.413   9.4211  571.595   12.401 -36.18231 15.57338 
1 1 1   20   10   10 o  408.844   8.0767  128.036   5.0543  127.099   6.2629  129.786   8.5590  407.249   10.047  411.303   13.595 -4.054199 16.90502 
1 1 1   20   10   11 o   42.743   20.143  -3.8071   3.4156  -1.7648   4.2844  -7.3683   5.6577   55.510   24.775   52.972   25.242 2.537640 35.36891 
1 1 1   20   10   12 o  268.440   10.404   55.235   4.2746   50.658   5.2947   63.801   7.2441  256.586   13.529  287.696   16.520 -31.11002 21.35291 
1 1 1   20   10   13 o  599.502   7.9639  275.320   7.3078  281.386   9.1678  264.748   12.102  605.913   9.8851  587.355   13.462 18.55762 16.70140 
1 1 1   20   10   14 o  361.195   10.524  100.021   5.8184   98.916   7.9901  101.269   8.4895  358.906   14.545  363.087   15.276 -4.180573 21.09252 
1 1 1   20   10   15 o  671.927   8.2168  345.923   8.4507  357.268   10.644  326.582   13.899  682.647   10.187  652.177   13.923 30.46985 17.25205 
1 1 1   20   10   16 o  252.905   8.6789   49.016   3.3596   48.893   3.8005   49.458   7.1863  252.538   9.8321  252.741   18.709 -0.2030182 21.13539 
1 1 1   20   10   17 o  635.412   6.0112  309.207   5.8464  326.908   7.7879  286.350   8.8495  653.195   7.7895  611.166   9.4600 42.02832 12.25427 
1 1 1   20   10   18 o  305.236   8.0920   71.398   3.7806   72.540   4.3395   67.801   7.7011  307.607   9.2167  296.291   17.053 11.31622 19.38447 
1 1 1   20   10   19 o  448.026   8.4537  153.857   5.7972  154.187   7.6453  153.409   8.8923  448.254   11.143  446.905   13.000 1.348389 17.12169 
1 1 1   20   10   20 o  824.678   6.5126  520.994   8.2207  547.085   13.572  505.876   10.331  844.417   10.501  812.376   8.3087 32.04065 13.39051 
1 1 1   20   10   21 o  150.032   11.723   17.389   2.6707   23.844   4.8154   14.522   3.2096  174.870   18.260  136.462   15.649 38.40810 24.04836 
1 1 1   20   10   22 o  298.293   7.3335   68.193   3.3483   72.180   5.8374   66.238   4.0876  306.483   12.443  293.875   9.0873 12.60748 15.40837 
1 1 1   20   10   23 o  523.419   5.8275  209.872   4.6688  203.072   6.8281  215.842   6.3982  514.573   8.6693  530.602   7.8780 -16.02899 11.71406 
1 1 1   20   10   24 o  211.270   9.6723   34.256   3.1278   31.589   6.2886   35.132   3.6054  200.840   20.756  213.580   11.067 -12.73935 23.52194 
1 1 1   20   10   25 f  324.977   6.8860   80.948   3.4252   73.813   5.3572   85.880   4.4547  309.930   11.293  334.582   8.6985 -24.65219 14.25460 
1 1 1   20   10   26 o  216.277   9.4990   35.908   3.1445   36.540   5.6721   35.628   3.7783  216.747   17.239  214.972   11.525 1.775726 20.73686 
1 1 1   20   10   27 o  373.050   6.6897  106.680   3.8198  105.761   6.0640  107.284   4.9183  370.973   10.679  373.908   8.5937 -2.934784 13.70766 
1 1 1   20   10   28 o  354.146   6.8947   96.163   3.7374   99.259   5.9949   94.195   4.7800  359.303   10.901  350.285   8.9153 9.017487 14.08211 
1 1 1   20   10   29 o  383.051   5.7368  112.447   3.3635  114.826   6.3265  111.510   3.9713  386.424   10.696  381.345   6.8037 5.079041 12.67669 
1 1 1   20   10   30 o  114.143   12.721   10.165   2.1846   16.532   5.0174   8.6755   2.4267  143.432   23.681  104.793   15.605 38.63927 28.36006 
1 1 1   20   10   31 o  509.302   7.2804  199.020   5.6755  205.567   10.358  196.211   6.7845  516.140   13.111  505.405   8.7702 10.73438 15.77417 
1 1 1   20   10   32 o   97.849   16.910   7.6392   2.4410   8.1097   5.4409   7.5207   2.7312  100.490   31.672   96.598   19.149 3.891762 37.01075 
1 1 1   20   10   33 o  156.343   11.684   18.951   2.7757   30.126   5.8001   15.632   3.1612  195.391   19.661  141.307   14.837 54.08432 24.63085 
1 1 1   20   10   34 o  163.057   10.661   20.573   2.6460   28.087   6.0895   18.824   2.9379  187.833   21.572  155.624   12.437 32.20883 24.90059 
1 1 1   20   10   35 o  386.353   6.4156  114.542   3.7940  109.804   7.2171  116.351   4.4599  376.881   12.511  389.206   7.4865 -12.32474 14.57986 
1 1 1   20   10   36 o  101.854   16.998   8.3004   2.5566   17.492   6.0243   6.2814   2.8235  145.168   28.128   87.560   21.277 57.60741 35.26886 
1 1 1   20   10   37 o  291.851   9.0226   65.567   4.0305   69.803   6.9949   63.462   4.9315  299.128   15.329  286.670   11.239 12.45804 19.00789 
1 1 1   20   10   38 o   58.480   22.149   2.0245   2.7229  -0.8626   7.7317   2.4333   2.9093   76.801   33.830   61.908   23.009 14.89295 40.91322 
1 1 1   20   10   39 o  227.325   9.4399   39.831   3.2846   33.972   8.1100   40.980   3.5924  203.555   26.671  230.449   10.185 -26.89410 28.54972 
1 1 1   20   10   40 o  176.596   11.551   24.236   3.1051   29.219   7.4670   23.195   3.4143  188.297   26.653  172.383   13.036 15.91409 29.66995 
1 1 1   20   10   41 o  117.665   17.778   11.116   3.1020   20.764   7.5329   9.1465   3.4040  155.067   32.764  105.330   21.831 49.73711 39.37088 
1 1 1   20   10   42 o  260.184   10.057   52.307   4.0052   53.412   8.6212   52.003   4.5229  257.456   22.091  259.074   11.406 -1.618225 24.86214 
1 1 1   20   10   43 o   83.982   24.798   5.8542   3.4077 -28.4691   10.434   9.9525   3.6054   55.019   27.664  109.580   22.255 -54.56154 35.50471 
1 1 1   20   10   44 o   39.046   18.628  -3.8526   3.0999 -10.2160   7.6869  -2.6168   3.3876   58.817   28.389   44.667   20.723 14.14996 35.14798 
1 1 1   20   10   45 o   86.937   26.485   6.3475   3.8420   11.333   7.9692   4.8377   4.3853  112.978   38.483   79.704   28.452 33.27399 47.85870 
1 1 1   20   10   46 o   50.449   22.483  -0.9630   3.5146   9.0275   7.5674  -3.7107   3.9686  103.228   37.313   46.385   21.814 56.84329 43.22207 
1 1 1   20   10   47 o  118.865   19.131   11.587   3.3626   8.4787   6.1367   12.920   4.0198   98.784   33.769  124.459   21.901 -25.67574 40.24941 
1 1 1   20   10   48 o  108.081   20.562   9.7609   3.2772   10.957   5.6179   9.1440   4.0349  109.832   31.673  102.484   25.753 7.348518 40.82171 
1 1 1   20   10   49 o   57.502   24.951   0.1685   4.0708  -2.8360   6.5079   2.0997   5.2176   63.399   29.166   70.126   29.243 -6.727196 41.30087 
1 1 1   20   10   50 o   79.101   24.704   5.3642   3.3185   1.2613   5.4556   7.7739   4.1810   68.083   29.209   93.401   27.436 -25.31802 40.07366 
1 1 1   20   10   51 o   58.004   23.901   1.4681   3.4273   2.3234   5.4050   0.8930   4.4324   70.564   29.618   61.320   26.318 9.243938 39.62169 
1 1 1   20   10   52 f   85.181   25.067   6.5076   3.4872  -2.0545   6.1522   10.561   4.2329   61.666   28.364  107.937   25.942 -46.27010 38.43897 
1 1 1   20   10   53 o   63.135   23.353   3.0556   2.9900   3.8628   3.7877   1.7209   4.8706   69.822   26.193   65.103   27.755 4.718933 38.16312 
1 1 1   20   10   54 o  100.097   20.412   8.7244   3.0213   9.2518   4.1381   8.1221   4.4217   99.270   26.667   92.125   28.474 7.145195 39.01136 
1 1 1   20   11    1 o  337.895   6.2033   87.418   3.2083   92.299   5.7874   85.253   3.8548  347.035   10.895  333.647   7.5483 13.38861 13.25457 
1 1 1   20   11    2 o  293.660   6.8077   66.034   3.0600   62.188   3.5486   77.184   6.0423  284.946   8.1364  317.281   12.442 -32.33481 14.86620 
1 1 1   20   11    3 o  178.090   9.1038   24.360   2.4733   25.415   2.8434   21.082   5.0134  181.829   10.259  164.325   20.369 17.50385 22.80642 
1 1 1   20   11    4 o  678.019   6.8597  352.024   7.1190  347.656   8.4376  362.817   13.262  673.717   8.1823  687.866   12.596 -14.14917 15.02037 
1 1 1   20   11    5 o   61.800   19.129   2.9219   1.9947   2.5675   2.1685   4.8714   5.0856   59.759   20.076   85.791   30.638 -26.03233 36.62970 
1 1 1   20   11    6 o  384.687   13.191  113.504   7.7667  113.504   7.7667   0.0000   0.0000  384.687   13.191  ?   ?  0.000000 13.19051 
1 1 1   20   11    7 o  433.637   9.3074  144.072   6.1776  144.072   6.1776   0.0000   0.0000  433.637   9.3074  ?   ?  0.000000 9.307359 
1 1 1   20   11    8 o  274.483   9.3149   57.726   3.9135   67.150   4.9720   42.380   6.3446  295.975   10.975  234.155   17.837 61.82016 20.94258 
1 1 1   20   11    9 o  264.827   9.6216   53.742   3.9001   53.982   4.8563   53.307   6.5456  265.324   11.958  262.935   16.345 2.388977 20.25234 
1 1 1   20   11   10 o  294.884   9.6029   66.637   4.3343   66.436   5.3051   67.039   7.5168  294.342   11.775  294.910   16.721 -0.5675354 20.45123 
1 1 1   20   11   11 o  464.772   8.1275  165.480   5.7819  162.472   7.1635  171.103   9.7935  460.400   10.165  472.189   13.550 -11.78897 16.93953 
1 1 1   20   11   12 o  267.707   10.673   54.945   4.3734   58.695   5.5196   48.620   7.1686  276.570   13.039  250.667   18.821 25.90393 22.89639 
1 1 1   20   11   13 o  437.480   9.9258  146.708   6.6465  153.974   9.4116  139.480   9.3877  447.853   13.730  426.189   14.391 21.66406 19.88964 
1 1 1   20   11   14 o  493.937   7.0189  186.876   5.3065  187.873   6.1324  183.902   10.588  495.185   8.0908  489.358   14.135 5.826508 16.28695 
1 1 1   20   11   15 o  148.669   12.651   17.086   2.8515   18.259   3.1338   11.444   6.8747  153.624   13.463  119.842   35.176 33.78166 37.66404 
1 1 1   20   11   16 o  201.143   9.9598   31.022   3.0664   29.998   3.3864   35.689   7.2260  197.422   11.253  213.781   22.417 -16.35861 25.08255 
1 1 1   20   11   17 o  224.712   10.647   38.734   3.6619   44.396   4.3137   24.131   6.9279  240.516   11.718  174.366   26.817 66.15071 29.26525 
1 1 1   20   11   18 o  300.692   7.6927   69.285   3.5406   74.573   5.0091   64.005   5.0051  311.785   10.496  288.794   11.323 22.99088 15.43954 
1 1 1   20   11   19 o  302.957   11.907   70.472   5.5216   70.832   10.000   70.314   6.6227  301.822   21.793  302.400   14.308 -0.5777588 26.07005 
1 1 1   20   11   20 o  181.719   9.0054   25.322   2.5048   30.183   3.7944   21.568   3.3346  197.811   12.598  167.011   13.151 30.79958 18.21123 
1 1 1   20   11   21 o  310.123   6.5789   73.688   3.1229   75.222   4.6169   72.394   4.2401  313.133   9.6327  307.237   9.0164 5.896637 13.19410 
1 1 1   20   11   22 o  287.013   9.3736   63.198   4.1179   0.0000   0.0000   63.198   4.1179  ?   ?   287.013   9.3736 0.000000 9.373646 
1 1 1   20   11   23 o  248.485   8.7766   47.362   3.3381   41.246   6.4097   49.638   3.9102  230.299   18.335  254.296   10.046 -23.99716 20.90715 
1 1 1   20   11   24 o  446.674   6.0086  152.867   4.1080  155.796   6.0947  150.429   5.5611  450.634   8.8360  442.880   8.2036 7.753693 12.05713 
1 1 1   20   11   25 o  222.607   8.5677   38.018   2.9192   41.634   4.6471   35.660   3.7519  232.207   13.129  215.089   11.437 17.11800 17.41206 
1 1 1   20   11   26 o  319.252   7.3122   78.151   3.5732   75.191   6.0470   79.739   4.4291  312.557   12.640  322.323   8.9775 -9.766724 15.50361 
1 1 1   20   11   27 o  247.154   8.3236   46.873   3.1488   47.983   5.2217   46.238   3.9473  249.126   13.747  245.283   10.514 3.843002 17.30661 
1 1 1   20   11   28 o   86.611   20.266   6.0661   2.6389   10.984   4.6807   3.7746   3.1951  115.880   26.906   71.827   24.368 44.05333 36.30043 
1 1 1   20   11   29 f  179.681   12.410   24.990   3.3921   21.854   4.9678   27.730   4.6429  166.433   19.895  188.594   16.242 -22.16135 25.68346 
1 1 1   20   11   30 o  100.976   21.397   8.2582   3.2043   2.5117   4.9621   12.368   4.1965   73.938   29.362  123.751   23.002 -49.81291 37.29900 
1 1 1   20   11   31 f  257.858   10.594   51.174   4.1813   60.261   8.3176   48.101   4.8369  277.245   19.729  249.372   12.714 27.87297 23.47113 
1 1 1   20   11   32 o   72.096   25.646   3.6181   3.5601   1.8915   5.3528   4.9875   4.7673   73.432   30.018   83.625   29.685 -10.19257 42.21695 
1 1 1   20   11   33 o   85.032   18.047   5.8437   2.2762   0.5237   5.5566   6.9164   2.4951   69.865   29.712   92.636   18.247 -22.77050 34.86728 
1 1 1   20   11   34 o  263.381   7.4535   53.274   3.0048   68.761   6.6045   49.231   3.3743  297.797   14.489  253.031   8.7123 44.76630 16.90707 
1 1 1   20   11   35 o   43.023   18.766  -0.3852   2.3277  -9.0726   5.6812   1.3674   2.5517   49.496   24.013   53.727   21.144 -4.231720 31.99554 
1 1 1   20   11   36 o  319.818   7.0004   78.546   3.4269   81.796   7.0359   77.536   3.9237  324.664   14.158  317.575   8.0720 7.088867 16.29775 
1 1 1   20   11   37 o  127.519   19.264   13.044   3.6429   20.978   8.5803   11.300   4.0235  155.326   36.677  117.348   23.223 37.97746 43.41075 
1 1 1   20   11   38 o  147.361   12.669   16.945   2.8298   7.5875   7.4470   18.525   3.0593  100.824   36.927  154.022   13.101 -53.19795 39.18262 
1 1 1   20   11   39 o  104.702   17.862   8.8298   2.7599   15.282   6.9783   7.6334   3.0049  132.660   34.161   96.412   20.960 36.24853 40.07855 
1 1 1   20   11   40 o   75.923   22.507   4.6889   2.8025   11.852   7.4429   3.5055   3.0252  117.028   37.060   68.657   23.700 48.37133 43.99032 
1 1 1   20   11   41 o  118.252   17.583   11.222   3.0857   8.9668   7.3079   11.712   3.4040  104.824   36.798  120.372   19.115 -15.54795 41.46660 
1 1 1   20   11   42 o  102.955   21.863   8.7766   3.3389   8.8137   7.4278   8.7672   3.7378  104.062   37.042  102.240   24.252 1.822525 44.27459 
1 1 1   20   11   43 o  154.831   15.140   18.944   3.5421 -10.1833   14.219   20.871   3.6573   86.137   40.747  162.675   14.852 -76.53738 43.36972 
1 1 1   20   11   44 o   61.066   23.718   2.1071   3.1766   12.610   7.5573  -0.1467   3.5008  118.452   37.326   53.390   23.153 65.06146 43.92397 
1 1 1   20   11   45 o  127.456   22.493   13.491   4.2278   16.804   7.9296   12.175   4.9973  135.056   37.182  118.669   27.970 16.38614 46.52769 
1 1 1   20   11   46 o  201.250   11.931   31.665   3.6587   26.401   7.2797   33.444   4.2321  175.588   28.029  206.251   13.480 -30.66287 31.10179 
1 1 1   20   11   47 o   65.157   24.118   2.9623   3.1904   2.7129   5.7301   3.0743   3.8408   75.055   30.913   68.511   26.220 6.544395 40.53490 
1 1 1   20   11   48 o  161.081   13.884   20.579   3.3897   18.370   5.5854   21.867   4.2648  146.030   25.939  164.591   17.182 -18.56160 31.11366 
1 1 1   20   11   49 o  103.311   25.957   9.3910   4.0995   12.843   6.7019   7.3273   5.1819  116.280   34.881   91.398   31.032 24.88185 46.68717 
1 1 1   20   11   50 f   59.399   23.590   1.9832   3.2030   7.4064   5.6557  -0.5776   3.8864   91.418   32.346   53.517   23.758 37.90112 40.13345 
1 1 1   20   11   51 o   44.634   20.747  -2.3568   3.4203  -1.3047   6.2067  -2.8156   4.0988   63.984   29.071   48.435   22.579 15.54884 36.80959 
1 1 1   20   11   52 o  130.171   17.831   14.097   3.4593   6.4712   5.1315   20.449   4.6834   84.869   30.719  155.536   20.146 -70.66692 36.73562 
1 1 1   20   11   53 o   69.730   24.903   4.0623   3.3600  -1.6259   4.9300   8.9965   4.5916   55.750   25.550   97.030   28.819 -41.27969 38.51369 
1 1 1   20   12    0 o  560.047   11.629  240.560   9.9591  240.560   9.9591  240.560   9.9591  560.047   11.629  560.047   11.629 0.000000 0.000000 
1 1 1   20   12    1 o  124.276   12.266   11.957   2.3028   18.870   4.7713   9.8582   2.6294  155.270   20.584  112.234   15.739 43.03618 25.91119 
1 1 1   20   12    2 f  940.960   8.1600  678.194   11.753  679.301   14.256  675.846   20.764  941.538   9.8921  938.470   14.455 3.067505 17.51560 
1 1 1   20   12    3 o  656.642   6.9592  330.195   6.9945  332.802   8.4053  324.323   12.613  659.140   8.3312  650.304   12.672 8.835693 15.16526 
1 1 1   20   12    4 o  495.003   6.7425  187.636   5.1085  189.582   6.0452  182.773   9.5545  497.507   7.9385  488.168   12.787 9.338837 15.05085 
1 1 1   20   12    5 o  517.916   6.7293  205.410   5.3346  208.991   6.3273  196.608   9.9203  522.351   7.9138  506.296   12.801 16.05441 15.04985 
1 1 1   20   12    6 o  328.690   8.3124   82.760   4.1820   82.760   4.1820   0.0000   0.0000  328.690   8.3124  ?   ?  0.000000 8.312361 
1 1 1   20   12    7 o  278.764   7.9124   59.524   3.3761   57.670   3.8442   65.778   7.0594  274.347   9.1546  292.230   15.842 -17.88284 18.29646 
1 1 1   20   12    8 o  246.070   10.085   46.408   3.7985   44.807   4.6243   49.731   6.6605  241.365   12.560  253.789   17.248 -12.42421 21.33719 
1 1 1   20   12    9 o  707.851   7.8600  383.817   8.5160  395.028   10.660  364.040   14.158  717.942   9.7006  688.765   13.429 29.17731 16.56659 
1 1 1   20   12   10 o  146.792   16.454   16.765   3.6333   19.503   4.3189   10.136   6.7203  158.209   18.164  113.959   35.084 44.25038 39.50721 
1 1 1   20   12   11 o  514.132   7.9257  202.502   6.2371  198.796   7.5535  210.443   11.057  509.278   9.6900  523.577   13.797 -14.29947 16.85994 
1 1 1   20   12   12 o  402.809   6.9546  124.277   4.2878  124.038   4.8259  125.174   9.3444  402.376   7.8357  403.645   15.125 -1.268280 17.03380 
1 1 1   20   12   13 o  113.259   9.8735   9.9085   1.6945   10.114   1.7562   7.1340   6.4486  114.410   10.134  100.126   34.600 14.28394 36.05327 
1 1 1   20   12   14 o  246.474   8.7017   46.558   3.2828   51.740   3.6772   26.211   7.2862  259.806   9.2469  181.949   26.980 77.85745 28.52075 
1 1 1   20   12   15 o  199.582   10.073   30.623   3.0672   30.419   3.3882   31.548   7.2197  198.810   11.180  200.523   23.999 -1.712997 26.47559 
1 1 1   20   12   16 o  519.560   6.6062  206.777   5.2536  210.611   5.9739  193.691   11.036  524.292   7.4442  502.009   14.363 22.28296 16.17728 
1 1 1   20   12   17 o  324.092   7.4943   80.484   3.7177   85.165   4.1314   60.564   8.5228  333.349   8.0971  279.383   20.064 53.96597 21.63606 
1 1 1   20   12   18 o  758.552   10.538  441.493   12.235  441.493   12.235   0.0000   0.0000  758.552   10.538  ?   ?  0.000000 10.53792 
1 1 1   20   12   19 o  781.000   7.1669  467.400   8.5674  487.180   10.103  416.745   16.167  797.187   8.2795  736.075   14.350 61.11218 16.56683 
1 1 1   20   12   20 o  553.010   6.4010  234.298   5.4181  253.332   9.3826  224.776   6.6365  574.490   10.670  541.493   8.0071 32.99689 13.34041 
1 1 1   20   12   21 o  285.765   7.8968   62.605   3.4541   62.691   6.2258   62.566   4.1516  285.407   14.252  285.567   9.4980 -0.1607361 17.12656 
1 1 1   20   12   22 o   93.863   17.008   7.0057   2.3536   11.996   3.5703   3.1707   3.1299  123.030   19.618   68.141   24.067 54.88859 31.05037 
1 1 1   20   12   23 o  493.767   5.7951  186.784   4.3798  194.428   6.4007  180.054   6.0060  503.491   8.3055  484.549   8.0980 18.94254 11.59997 
1 1 1   20   12   24 o  379.838   6.2130  110.558   3.6121  111.781   5.3641  109.543   4.8860  381.644   9.1827  377.886   8.4474 3.758240 12.47718 
1 1 1   20   12   25 o   48.523   20.028   0.5455   2.4117   6.3905   4.1245  -2.4912   2.9729   89.926   27.452   42.003   19.461 47.92256 33.64977 
1 1 1   20   12   26 o  199.000   9.3094   30.406   2.8356   30.012   4.5151   30.662   3.6438  196.622   15.118  199.268   12.003 -2.646454 19.30367 
1 1 1   20   12   27 o  319.678   7.0016   78.364   3.4259   79.680   5.3108   77.426   4.4835  321.918   10.778  317.531   9.2250 4.387482 14.18695 
1 1 1   20   12   28 o  224.766   9.9312   38.827   3.4167   43.774   4.9497   34.324   4.7221  237.831   13.654  210.295   14.764 27.53616 20.10992 
1 1 1   20   12   29 o  448.160   6.4237  154.001   4.4065  167.370   6.8736  144.674   5.7414  466.662   9.6231  434.046   8.6420 32.61588 12.93400 
1 1 1   20   12   30 o  141.248   14.241   15.572   3.0368   14.966   4.8602   15.960   3.8897  136.019   24.233  142.136   18.304 -6.116302 30.36885 
1 1 1   20   12   31 o  226.933   15.354   40.077   5.3019   39.748   8.1357   40.319   6.9900  223.302   24.190  226.204   20.409 -2.902390 31.64889 
1 1 1   20   12   32 o  299.175   8.0786   68.752   3.6994   75.633   6.0561   64.657   4.6725  312.957   12.643  289.754   10.535 23.20276 16.45691 
1 1 1   20   12   33 o  601.983   6.4690  278.043   5.9607  303.386   9.4953  261.561   7.6574  627.759   9.8820  583.308   8.5766 44.45062 13.08481 
1 1 1   20   12   34 o  302.384   8.1728   70.281   3.7827   69.833   6.4045   70.520   4.6876  300.186   13.939  302.551   10.122 -2.365234 17.22658 
1 1 1   20   12   35 o  309.725   8.1476   73.749   3.8626   74.815   6.3357   73.118   4.8728  310.789   13.319  307.975   10.337 2.813660 16.85939 
1 1 1   20   12   36 o   78.442   24.129   4.9318   3.1795   9.9850   6.0862   3.0350   3.7288  109.147   33.352   69.386   25.997 39.76038 42.28726 
1 1 1   20   12   37 o  303.096   9.2567   70.764   4.2944   70.144   8.1355   71.003   5.0563  298.651   17.879  303.231   10.894 -4.580078 20.93673 
1 1 1   20   12   38 o  265.453   8.1351   54.212   3.3054   58.336   7.3803   53.177   3.6969  272.139   17.816  262.716   9.1934 9.422638 20.04853 
1 1 1   20   12   39 o  184.095   10.785   26.278   3.0257   21.938   6.9967   27.276   3.3557  161.526   29.382  187.343   11.762 -25.81769 31.64913 
1 1 1   20   12   40 o  393.842   6.9963  119.225   4.2175  123.495   8.6862  117.908   4.8244  398.128   14.254  391.385   8.0532 6.742859 16.37163 
1 1 1   20   12   41 o  265.649   8.8193   54.404   3.5860   57.533   7.6987   53.537   4.0525  269.143   18.806  263.236   10.058 5.907501 21.32691 
1 1 1   20   12   42 o   93.238   22.524   7.2496   3.1785   0.1027   7.2207   8.9674   3.5399   75.698   33.034  103.731   22.907 -28.03300 40.19967 
1 1 1   20   12   43 o   50.359   21.811  -0.1555   3.0992  -6.6272   10.862   0.4181   3.2336   78.480   36.642   53.691   22.742 24.78923 43.12602 
1 1 1   20   12   44 o  255.623   11.932   50.812   4.6684   60.698   9.5267   47.687   5.3555  272.774   23.033  246.425   14.259 26.34921 27.08965 
1 1 1   20   12   45 o  178.364   12.759   24.948   3.4602   14.085   7.5379   27.848   3.8948  123.717   36.966  188.189   13.613 -64.47250 39.39265 
1 1 1   20   12   46 o   69.876   24.375   3.7523   3.2040   1.3400   6.2852   4.5993   3.7243   73.437   31.424   76.185   26.296 -2.748138 40.97505 
1 1 1   20   12   47 o  244.983   9.7051   46.561   3.6392   28.334   5.8260   58.224   4.6602  185.681   20.860  273.367   11.138 -87.68533 23.64712 
1 1 1   20   12   48 o  125.489   22.711   13.332   4.2017   2.3586   6.5218   21.119   5.4937   76.414   32.328  158.201   23.393 -81.78654 39.90432 
1 1 1   20   12   49 o   46.513   21.671  -2.7979   3.7668 -10.0454   5.5072   3.5736   5.1636   45.599   22.440   74.926   29.890 -29.32737 37.37585 
1 1 1   20   12   50 o   98.319   23.248   8.4339   3.4436   8.2461   6.2353   8.5163   4.1306   94.942   33.923   97.261   26.860 -2.318329 43.26940 
1 1 1   20   12   51 o   35.416   17.346  -5.5769   3.1697  -4.0771   5.2038  -6.4615   3.9967   52.594   24.809   40.319   19.690 12.27514 31.67294 
1 1 1   20   12   52 o  129.686   16.928   13.916   3.2801   11.921   5.0983   15.324   4.2846  111.883   29.391  133.117   21.782 -21.23347 36.58227 
1 1 1   20   12   53 o  263.058   10.673   54.489   4.2975   37.939   5.6136   77.923   6.6796  214.155   17.272  311.430   14.013 -97.27452 22.24148 
1 1 1   20   13    0 o   77.539   38.403   6.8347   5.4898   6.8347   5.4898   6.8347   5.4898   77.539   38.403   77.539   38.403 0.000000 0.000000 
1 1 1   20   13    1 o  880.880   7.9568  594.371   10.728  605.333   13.213  573.166   18.377  888.774   9.7130  864.241   13.892 24.53241 16.95108 
1 1 1   20   13    2 o   64.185   22.462   2.8097   2.7218   4.8123   3.0612  -4.7500   5.9477   78.616   23.572   59.985   27.698 18.63136 36.37059 
1 1 1   20   13    3 f  495.183   6.9217  187.788   5.2462  187.252   6.1223  189.267   10.177  494.415   8.0901  496.668   13.388 -2.252075 15.64210 
1 1 1   20   13    4 o  273.191   8.4365   57.176   3.5278   54.392   3.9787   67.415   7.6293  266.410   9.7570  295.709   16.926 -29.29977 19.53690 
1 1 1   20   13    5 o  723.638   8.7947  401.212   9.7412  401.212   9.7412   0.0000   0.0000  723.638   8.7947  ?   ?  0.000000 8.794742 
1 1 1   20   13    6 o  564.425   6.9897  243.989   6.0386  245.458   7.1093  240.184   11.442  566.044   8.2056  559.465   13.362 6.578796 15.68011 
1 1 1   20   13    7 o  273.746   8.4101   57.412   3.5239   59.685   4.0009   49.552   7.4413  279.074   9.3664  253.000   19.363 26.07378 21.50912 
1 1 1   20   13    8 o  663.428   7.2331  337.121   7.3449  343.404   8.7604  322.253   13.476  669.472   8.5491  647.957   13.588 21.51520 16.05367 
1 1 1   20   13    9 o  482.060   6.3726  177.964   4.7020  181.555   5.2702  163.950   10.410  486.863   7.0722  462.028   14.720 24.83530 16.33117 
1 1 1   20   13   10 o  476.007   6.2359  173.521   4.5434  170.805   4.9859  186.820   11.032  472.231   6.8979  493.180   14.614 -20.94904 16.16039 
1 1 1   20   13   11 o  229.437   6.0039   40.313   2.1085   40.728   2.1899   35.039   7.8032  230.611   6.2042  211.474   24.565 19.13702 25.33611 
1 1 1   20   13   12 o  380.246   7.1434  110.758   4.1576  113.303   4.6454  100.516   9.3195  384.549   7.8923  361.467   16.844 23.08228 18.60158 
1 1 1   20   13   13 o  339.268   5.7419   88.146   2.9817   87.522   3.1498   93.523   9.2526  338.053   6.0873  348.568   17.342 -10.51474 18.37969 
1 1 1   20   13   14 o  421.504   6.5229  136.087   4.2083  137.475   4.6309  129.503   10.084  423.613   7.1421  410.295   16.057 13.31836 17.57348 
1 1 1   20   13   15 o  436.139   6.6218  145.711   4.4205  147.968   4.9409  136.656   9.8954  439.457   7.3455  421.519   15.337 17.93854 17.00545 
1 1 1   20   13   16 o   89.173   17.780   6.3427   2.3417   5.9875   2.4716   9.4586   7.3211   86.426   19.184  111.699   36.870 -25.27282 41.56245 
1 1 1   20   13   17 o  251.045   11.860   48.392   4.5574   53.167   5.6626   39.613   7.6788  262.580   14.141  225.077   22.594 37.50333 26.65457 
1 1 1   20   13   18 o  534.558   10.593  219.299   8.6669  219.299   8.6669   0.0000   0.0000  534.558   10.593  ?   ?  0.000000 10.59254 
1 1 1   20   13   19 o  356.275   10.097   97.403   5.5061  105.627   6.8118   81.900   9.3525  370.806   12.002  325.078   18.878 45.72757 22.36968 
1 1 1   20   13   20 o  394.818   9.7247  119.612   5.8768  117.841   7.1833  123.198   10.220  391.617   11.984  399.669   16.706 -8.051819 20.55947 
1 1 1   20   13   21 o  805.489   5.9892  497.071   7.3841  500.216   10.401  493.875   10.485  807.617   8.4143  802.458   8.5361 5.159424 11.98602 
1 1 1   20   13   22 o   57.298   20.213   2.2301   2.2071   2.5278   3.1839   1.9547   3.0621   64.717   24.067   60.876   23.385 3.841698 33.55650 
1 1 1   20   13   23 o  341.145   6.3303   89.185   3.3054   94.099   4.7920   84.725   4.5654  350.188   8.9402  332.283   8.9765 17.90454 12.66900 
1 1 1   20   13   24 o  455.007   5.8927  158.636   4.1040  163.242   5.9896  154.560   5.6345  461.265   8.4835  448.868   8.2010 12.39725 11.79937 
1 1 1   20   13   25 o  452.548   6.4109  156.975   4.4407  163.383   6.9606  152.577   5.7667  461.211   9.8600  445.913   8.4491 15.29871 12.98487 
1 1 1   20   13   26 o  203.535   12.828   32.035   3.9758   32.928   4.4773   28.705   8.6457  206.112   14.280  187.878   31.156 18.23346 34.27283 
1 1 1   20   13   27 o  266.604   8.5815   54.566   3.5018   58.046   4.8158   50.660   5.1012  274.642   11.456  256.039   13.060 18.60385 17.37252 
1 1 1   20   13   28 o  118.195   15.137   10.972   2.6756   12.086   4.3291   10.283   3.4034  122.106   24.018  113.224   20.388 8.881287 31.50499 
1 1 1   20   13   29 f  192.343   9.8421   28.519   2.8879   30.339   4.6105   27.344   3.7046  197.405   15.380  187.826   12.965 9.578751 20.11609 
1 1 1   20   13   30 o  267.239   10.296   54.955   4.2114   56.964   5.2601   51.368   7.0287  271.704   12.648  256.334   18.029 15.36984 22.02328 
1 1 1   20   13   31 o  175.132   12.753   23.805   3.3951   20.569   7.4780   24.646   3.8105  157.006   32.198  177.940   14.106 -20.93405 35.15233 
1 1 1   20   13   32 o  321.020   7.6108   79.139   3.7396   76.689   5.8624   80.821   4.8559  315.175   12.152  324.048   9.7902 -8.872711 15.60531 
1 1 1   20   13   33 o  156.193   12.551   18.975   2.9754   26.161   5.1790   15.435   3.6351  181.934   18.872  139.671   17.379 42.26318 25.65570 
1 1 1   20   13   34 o  159.975   13.364   19.952   3.2423   17.775   5.7977   20.943   3.9110  146.938   26.764  163.333   15.843 -16.39464 31.10185 
1 1 1   20   13   35 o  355.984   7.9881   97.416   4.3525  108.251   7.7713   92.464   5.2539  373.695   13.586  346.404   9.9090 27.29068 16.81607 
1 1 1   20   13   36 o  188.782   11.831   27.661   3.4015   33.027   5.9056   24.997   4.1610  204.182   19.119  178.552   15.375 25.62964 24.53431 
1 1 1   20   13   37 o  124.103   19.455   12.396   3.5741   5.6410   7.2149   14.593   4.1145   93.235   35.876  134.483   20.648 -41.24783 41.39340 
1 1 1   20   13   38 o  128.617   18.155   13.234   3.4748   11.817   6.5806   13.782   4.0917  117.122   34.426  130.313   21.246 -13.19120 40.45378 
1 1 1   20   13   39 o  319.825   9.1705   78.850   4.4892   71.350   7.7522   82.635   5.5065  301.216   16.882  326.891   11.005 -25.67554 20.15268 
1 1 1   20   13   40 o  109.076   22.258   9.8250   3.5903   2.6384   6.5922   12.856   4.2809   80.320   33.128  124.803   23.266 -44.48300 40.48142 
1 1 1   20   13   41 o  192.496   10.847   28.768   3.1831   25.406   6.9281   29.668   3.5837  174.676   26.766  195.168   12.055 -20.49222 29.35534 
1 1 1   20   13   42 o  202.182   11.499   31.804   3.5438   32.431   7.3007   31.611   4.0534  198.629   24.535  201.030   13.247 -2.400833 27.88253 
1 1 1   20   13   43 o  154.622   16.441   19.024   3.8314   32.389   11.543   17.369   4.0616  186.478   41.507  146.938   18.467 39.53966 45.43021 
1 1 1   20   13   44 f   62.970   24.897   2.0967   3.5533  -0.6753   7.4406   2.9156   4.0443   74.112   32.888   69.212   26.796 4.899765 42.42241 
1 1 1   20   13   45 o  133.054   17.091   14.251   3.4002   14.800   7.6911   14.117   3.7908  126.170   37.255  131.511   19.416 -5.340874 42.01064 
1 1 1   20   13   46 o  141.448   16.655   16.089   3.5368   8.4906   6.9653   18.728   4.1055   99.510   35.822  152.166   17.974 -52.65589 40.07843 
1 1 1   20   13   47 o   89.763   22.916   6.8951   3.1593   9.5457   5.7107   5.7260   3.7925  102.737   32.455   82.236   26.499 20.50063 41.89889 
1 1 1   20   13   48 o  126.663   22.884   13.624   4.2733   10.882   7.0860   15.191   5.3571  107.618   36.290  131.206   27.552 -23.58728 45.56373 
1 1 1   20   13   49 o   94.475   23.662   7.7750   3.4143   12.384   6.6631   6.1338   3.9760  113.422   34.937   83.960   27.140 29.46145 44.24009 
1 1 1   20   13   50 o  212.332   10.992   35.425   3.5603   22.603   5.7568   43.367   4.5306  161.656   23.994  233.988   12.698 -72.33195 27.14665 
1 1 1   20   13   51 o   64.683   24.048   3.1566   3.1787  -2.0136   4.9831   6.7037   4.1274   55.613   25.561   85.833   27.643 -30.22051 37.64911 
1 1 1   20   13   52 o   82.556   23.437   6.1052   3.0995   4.0260   4.9793   7.4205   3.9604   73.747   29.373   89.468   26.808 -15.72130 39.76741 
1 1 1   20   14    0 o  668.553   8.6941  342.439   8.8933  342.439   8.8933  342.439   8.8933  668.553   8.6941  668.553   8.6941 0.000000 0.000000 
1 1 1   20   14    1 o  698.432   7.2982  373.632   7.8021  376.404   9.4298  367.617   13.892  700.889   8.7899  692.157   13.112 8.732178 15.78583 
1 1 1   20   14    2 o  494.255   7.0332  187.100   5.3207  185.947   6.2558  190.114   10.117  492.656   8.2961  497.733   13.279 -5.076294 15.65760 
1 1 1   20   14    3 o  839.571   7.8801  539.978   10.127  539.370   12.159  541.355   18.296  838.918   9.4688  839.720   14.235 -0.8022461 17.09663 
1 1 1   20   14    4 o  442.758   8.2478  150.190   5.5895  150.190   5.5895   0.0000   0.0000  442.758   8.2478  ?   ?  0.000000 8.247828 
1 1 1   20   14    5 o  451.851   7.2991  156.388   5.0482  154.704   5.6978  162.538   10.887  449.356   8.2841  459.962   15.463 -10.60611 17.54266 
1 1 1   20   14    6 o  230.434   9.6083   40.700   3.3889   40.254   3.7644   42.606   7.7846  229.126   10.734  234.010   21.992 -4.883636 24.47119 
1 1 1   20   14    7 o  266.451   8.7110   54.404   3.5527   54.696   3.9551   53.185   8.0837  267.125   9.6733  261.932   20.322 5.192596 22.50673 
1 1 1   20   14    8 o  156.589   11.273   18.904   2.6838   20.034   2.8696   11.012   7.5823  161.180   11.711  118.979   37.372 42.20169 39.16382 
1 1 1   20   14    9 o  643.477   6.4729  317.125   6.3753  317.015   7.1596  317.547   14.009  643.302   7.2712  642.980   14.235 0.3214111 15.98448 
1 1 1   20   14   10 o  256.139   7.7093   50.266   3.0225   49.274   3.2247   57.439   8.6724  253.578   8.3081  272.059   20.988 -18.48183 22.57283 
1 1 1   20   14   11 o  393.707   6.5722  118.726   3.9605  122.136   4.3656  102.869   9.4147  399.290   7.1431  365.630   16.823 33.66019 18.27642 
1 1 1   20   14   12 o  369.052   7.3761  104.349   4.1666  106.828   4.6613   94.492   9.2938  373.365   8.1566  350.328   17.332 23.03674 19.15529 
1 1 1   20   14   13 o  323.863   5.5898   80.324   2.7709   81.426   2.9084   69.486   9.1215  326.067   5.8274  299.416   20.019 26.65155 20.84950 
1 1 1   20   14   14 f  399.443   8.9610  122.324   5.4787  135.014   6.6895   96.469   9.5484  419.522   10.418  353.836   17.630 65.68628 20.47808 
1 1 1   20   14   15 o  316.945   10.214   77.063   4.9552   82.355   5.9418   64.978   8.9793  327.512   11.853  289.305   20.408 38.20639 23.60069 
1 1 1   20   14   16 o  480.209   8.6107  176.797   6.3290  178.733   7.7400  172.891   10.995  482.624   10.478  473.990   15.155 8.634247 18.42398 
1 1 1   20   14   17 o  387.593   11.573  115.362   6.8656  115.362   6.8656   0.0000   0.0000  387.593   11.573  ?   ?  0.000000 11.57261 
1 1 1   20   14   18 f  402.294   11.382  124.288   7.0084  124.288   7.0084   0.0000   0.0000  402.294   11.382  ?   ?  0.000000 11.38163 
1 1 1   20   14   19 o  124.449   14.458   12.080   2.7028   9.5352   2.8541   34.192   8.4123  109.809   17.574  207.581   27.125 -97.77217 32.32031 
1 1 1   20   14   20 o  468.676   7.0589  168.357   5.0638  172.689   5.6534  150.774   11.389  474.593   7.7825  441.994   16.834 32.59851 18.54617 
1 1 1   20   14   21 o  370.457   6.7460  105.180   3.8252  105.346   4.7027  104.857   6.5760  370.614   8.2900  369.369   11.631 1.245087 14.28339 
1 1 1   20   14   22 o  412.874   5.8810  130.609   3.7166  127.139   5.0851  134.587   5.4454  407.139   8.1599  418.856   8.4937 -11.71649 11.77828 
1 1 1   20   14   23 o  240.281   7.9583   44.283   2.9269   46.473   3.7972   41.076   4.5944  245.986   10.085  230.622   13.069 15.36465 16.50782 
1 1 1   20   14   24 o  175.440   10.585   23.739   2.8292   31.650   3.8412   14.359   4.1826  202.402   12.460  134.349   21.029 68.05257 24.44332 
1 1 1   20   14   25 o  346.269   6.8569   91.933   3.6342   96.601   5.6039   88.545   4.7743  354.535   10.327  339.579   9.1854 14.95612 13.82071 
1 1 1   20   14   26 o  283.716   7.3724   61.744   3.2016   55.798   4.6686   67.023   4.3988  269.293   11.326  295.347   9.7305 -26.05377 14.93225 
1 1 1   20   14   27 o   52.007   20.414   1.2567   2.3726   0.4340   3.7324   1.8146   3.0734   58.319   24.553   59.999   23.323 -1.680222 33.86407 
1 1 1   20   14   28 o  422.119   6.4497  136.637   4.1672  140.555   6.1882  133.386   5.6370  427.644   9.4539  416.706   8.8379 10.93829 12.94155 
1 1 1   20   14   29 o  182.180   12.278   25.708   3.4039   29.513   4.4263   20.203   5.3249  194.713   14.966  158.990   22.510 35.72304 27.03157 
1 1 1   20   14   30 f  192.095   12.698   28.608   3.7126   34.576   7.5506   26.706   4.2636  208.025   24.164  185.049   15.187 22.97546 28.53992 
1 1 1   20   14   31 o  168.569   11.333   22.006   2.9072   19.733   4.7458   23.371   3.6781  157.539   20.142  173.222   13.992 -15.68367 24.52510 
1 1 1   20   14   32 o  294.002   7.9408   66.411   3.5734   80.005   5.8327   58.242   4.5213  321.925   11.837  274.882   10.746 47.04288 15.98735 
1 1 1   20   14   33 o  143.533   14.523   16.141   3.1468   23.587   5.6258   12.750   3.7962  171.620   21.917  125.894   20.398 45.72640 29.94078 
1 1 1   20   14   34 o  189.107   11.487   27.715   3.3091   32.094   5.4508   25.159   4.1643  201.860   17.825  179.251   15.325 22.60880 23.50714 
1 1 1   20   14   35 o   59.156   23.050   1.8172   3.0075   5.4186   5.1256  -0.0737   3.7140   86.107   30.758   55.786   24.019 30.32124 39.02525 
1 1 1   20   14   36 o   82.876   23.903   5.6198   3.1993   0.0688   6.1100   7.7168   3.7553   70.984   30.685   96.354   25.182 -25.37053 39.69520 
1 1 1   20   14   37 o   59.874   23.639   1.7472   3.1988   4.2626   5.6708   0.5733   3.8739   82.763   31.816   59.190   24.972 23.57352 40.44515 
1 1 1   20   14   38 o  206.434   11.621   33.086   3.6571   40.862   6.5262   29.526   4.4154  226.934   18.962  194.047   14.982 32.88675 24.16669 
1 1 1   20   14   39 o   43.454   20.318  -3.0467   3.3594   1.5579   6.4977  -4.7266   3.9246   76.729   32.354   44.195   21.050 32.53442 38.59942 
1 1 1   20   14   40 o  296.320   9.4558   67.765   4.2887   84.908   7.4285   59.194   5.2526  329.739   14.718  276.110   12.429 53.62857 19.26395 
1 1 1   20   14   41 o  206.961   15.616   33.749   4.9103   31.812   6.8689   35.773   7.0220  197.566   23.154  210.149   22.165 -12.58363 32.05279 
1 1 1   20   14   42 f   52.203   23.788  -2.1628   4.1945   2.2800   6.9473  -4.7113   5.2618   80.132   33.604   53.625   25.187 26.50632 41.99545 
1 1 1   20   14   43 o  142.726   28.474   17.472   6.0024   30.223   11.634   12.848   7.0069  178.057   43.143  119.489   35.626 58.56826 55.95051 
1 1 1   20   14   44 o   86.405   26.747   6.2831   3.8999   11.845   7.0396   3.8202   4.6845  114.466   36.019   75.757   28.965 38.70856 46.22047 
1 1 1   20   14   45 o  136.322   19.450   15.182   3.9434   27.693   6.3425   7.2974   5.0348  182.700   23.204   92.467   30.579 90.23278 38.38568 
1 1 1   20   14   46 o  107.877   21.294   9.7642   3.3912   7.3725   6.5664   10.634   3.9602   94.216   34.650  111.558   23.911 -17.34216 42.09925 
1 1 1   20   14   47 o   87.710   24.064   6.6338   3.3281   14.706   6.6247   3.9087   3.8491  125.557   33.746   72.286   26.537 53.27091 42.93028 
1 1 1   20   14   48 o  112.111   27.862   11.246   4.7603   6.4836   9.3113   12.931   5.5389   95.007   39.295  118.947   30.329 -23.93999 49.63805 
1 1 1   20   14   49 o  291.457   8.8364   65.966   3.9420   49.501   6.1585   77.396   5.1309  247.723   16.334  314.667   10.653 -66.94365 19.50056 
1 1 1   20   14   50 o   75.331   24.032   4.9123   3.1254   5.0204   5.1744   4.8501   3.9215   79.289   30.412   75.947   26.927 3.341652 40.62001 
1 1 1   20   14   51 o  191.334   11.890   29.032   3.4648   19.067   5.3655   36.160   4.5377  146.550   24.804  212.175   14.052 -65.62546 28.50827 
1 1 1   20   14   52 o  109.219   21.215   10.397   3.4188   7.9810   5.1604   12.286   4.5642   90.966   30.968  115.327   26.423 -24.36092 40.70819 
1 1 1   20   15    1 o  464.564   7.1761  165.315   5.1028  164.050   6.0152  168.561   9.6368  462.702   8.4934  468.589   13.436 -5.886414 15.89541 
1 1 1   20   15    2 f  382.801   7.4572  112.253   4.3694  109.352   5.0019  121.598   8.9765  377.759   8.6507  397.864   14.740 -20.10538 17.09113 
1 1 1   20   15    3 o  456.981   8.3174  160.013   5.8178  160.013   5.8178   0.0000   0.0000  456.981   8.3174  ?   ?  0.000000 8.317418 
1 1 1   20   15    4 o  391.595   7.7024  117.480   4.6167  118.648   5.2240  113.315   9.8656  393.482   8.6738  383.844   16.792 9.637756 18.89982 
1 1 1   20   15    5 o  525.741   7.2100  211.731   5.8020  216.115   6.8074  200.090   11.093  531.070   8.3745  510.405   14.199 20.66486 16.48476 
1 1 1   20   15    6 o  259.952   9.0336   51.793   3.5944   49.177   3.9852   63.199   8.3225  253.248   10.281  285.788   19.136 -32.54048 21.72315 
1 1 1   20   15    7 o  629.800   7.3345  303.864   7.0704  300.748   8.1844  313.029   14.037  626.452   8.5355  638.324   14.367 -11.87189 16.71134 
1 1 1   20   15    8 o  379.833   6.7426  110.510   3.9201  110.004   4.2487  113.410   10.165  378.932   7.3253  383.855   17.301 -4.923218 18.78811 
1 1 1   20   15    9 o  583.389   6.4393  260.681   5.7500  261.706   6.4108  256.466   13.004  584.477   7.1659  577.660   14.707 6.817017 16.36019 
1 1 1   20   15   10 o  496.575   6.4648  188.877   4.9137  191.187   5.4442  178.726   11.412  499.558   7.1200  482.082   15.466 17.47549 17.02624 
1 1 1   20   15   11 o  337.974   18.812   88.337   9.6930   0.0000   0.0000   88.337   9.6930  ?   ?   337.974   18.812 0.000000 18.81168 
1 1 1   20   15   12 o  250.521   7.8790   48.097   3.0212   47.864   3.2121   49.881   8.8969  249.891   8.3979  252.776   23.256 -2.884521 24.72567 
1 1 1   20   15   13 o  563.643   6.5602  243.373   5.6597  244.492   6.3101  238.772   12.800  564.871   7.2982  557.135   15.010 7.735168 16.68987 
1 1 1   20   15   14 o  309.124   10.182   73.312   4.8178   68.660   5.6101   86.380   9.4031  298.991   12.259  334.110   18.459 -35.11887 22.15841 
1 1 1   20   15   15 o  188.165   14.290   27.389   4.0851   29.768   4.7524   20.658   7.9940  195.960   15.984  159.197   33.848 36.76379 37.43259 
1 1 1   20   15   16 o  177.847   15.650   24.546   4.2168   22.315   4.9689   30.286   7.9718  168.816   19.594  195.234   27.434 -26.41847 33.71281 
1 1 1   20   15   17 o  351.230   7.7345   94.566   4.1581   94.566   4.1581   0.0000   0.0000  351.230   7.7345  ?   ?  0.000000 7.734493 
1 1 1   20   15   18 o  320.954   7.4804   78.963   3.6748   80.818   3.9816   68.300   9.5474  324.663   8.0122  296.098   21.206 28.56516 22.66952 
1 1 1   20   15   19 o  141.629   12.530   15.543   2.6882   15.941   2.8294   11.849   8.6170  143.375   13.035  122.863   39.974 20.51161 42.04554 
1 1 1   20   15   20 o  200.340   9.9423   30.813   3.0488   31.660   3.2455   24.451   8.8916  202.772   10.493  172.624   34.853 30.14824 36.39793 
1 1 1   20   15   21 o  180.738   10.934   25.190   3.0106   25.438   3.2002   23.284   8.8796  181.545   11.577  167.994   35.637 13.55118 37.47002 
1 1 1   20   15   22 o  174.454   11.443   23.498   3.0386   23.199   3.2287   25.816   8.9872  173.222   12.257  177.304   34.357 -4.081726 36.47727 
1 1 1   20   15   23 o  266.903   7.9668   54.648   3.2547   57.680   3.9353   48.085   5.7899  274.082   9.3805  249.126   15.257 24.95651 17.91047 
1 1 1   20   15   24 o   93.462   17.015   6.9655   2.3444   8.8595   3.5265   5.4655   3.1384  104.595   22.681   82.584   23.631 22.01067 32.75457 
1 1 1   20   15   25 o  200.901   8.7826   30.989   2.7007   29.788   3.8893   32.106   3.7530  196.171   13.027  203.848   12.082 -7.677032 17.76752 
1 1 1   20   15   26 o  210.052   8.5565   33.877   2.7510   35.005   4.0099   32.874   3.7812  212.794   12.365  206.249   12.030 6.544876 17.25112 
1 1 1   20   15   27 o  165.807   10.512   21.233   2.6540   23.340   3.9262   19.462   3.6014  173.093   14.967  157.923   15.082 15.17014 21.24784 
1 1 1   20   15   28 o  428.519   7.2132  140.903   4.7312  149.427   6.1134  128.174   7.4706  440.958   9.0577  407.770   11.969 33.18802 15.01019 
1 1 1   20   15   29 o  429.509   6.9303  141.547   4.5561  143.470   6.2284  139.334   6.6820  431.945   9.4206  425.487   10.260 6.458374 13.92900 
1 1 1   20   15   30 o  270.624   9.3138   56.329   3.8580   60.138   7.8797   55.128   4.4246  276.957   18.697  267.493   10.807 9.463196 21.59572 
1 1 1   20   15   31 o  255.829   8.6655   50.319   3.3932   54.107   5.5733   48.088   4.2774  263.997   13.841  249.712   11.191 14.28468 17.79902 
1 1 1   20   15   32 o  200.314   10.608   31.017   3.2409   34.961   5.3953   28.791   4.0537  211.173   16.832  192.284   13.866 18.88910 21.80779 
1 1 1   20   15   33 o  126.060   15.258   12.524   2.8841   13.435   4.5667   11.919   3.7197  128.100   24.177  121.486   20.749 6.613831 31.85997 
1 1 1   20   15   34 o  205.831   10.395   32.753   3.2644   33.279   5.2186   32.415   4.1842  205.867   16.705  204.068   13.471 1.798645 21.46047 
1 1 1   20   15   35 o  454.242   7.0730  158.503   4.9177  165.245   7.6101  153.669   6.4438  462.677   10.746  446.616   9.4262 16.06058 14.29434 
1 1 1   20   15   36 o  119.120   19.188   11.428   3.3796   18.981   6.3005   8.3766   4.0045  150.749   28.346  100.162   25.921 50.58629 38.41058 
1 1 1   20   15   37 o  182.536   12.701   25.959   3.5264   24.619   6.0124   26.662   4.3539  174.240   23.115  184.189   15.590 -9.949066 27.88057 
1 1 1   20   15   38 o  114.031   20.750   10.609   3.4883   9.5303   6.0004   11.160   4.2872  106.083   33.233  115.671   24.948 -9.588135 41.55561 
1 1 1   20   15   39 o  177.272   13.433   24.582   3.6178   25.623   6.2708   24.063   4.4293  177.126   23.726  174.324   16.808 2.801910 29.07658 
1 1 1   20   15   40 o  165.851   16.020   21.758   4.0162   18.434   6.2009   24.160   5.2713  147.487   28.500  173.232   20.263 -25.74446 34.96883 
1 1 1   20   15   41 o  148.502   17.886   17.652   3.9837   18.190   6.2130   17.275   5.1913  146.065   28.814  144.296   24.372 1.768127 37.73905 
1 1 1   20   15   42 o  165.126   24.070   22.551   5.9048   12.076   10.749   27.078   7.0666  118.228   44.169  179.891   26.454 -61.66303 51.48573 
1 1 1   20   15   43 o  191.357   13.910   28.799   4.0463   34.886   6.7955   25.455   5.0364  206.883   21.787  177.875   18.783 29.00850 28.76594 
1 1 1   20   15   44 o  207.440   13.117   33.778   4.1433   31.054   6.5108   35.632   5.3713  194.365   22.288  211.450   16.733 -17.08511 27.87002 
1 1 1   20   15   45 o   83.015   26.585   5.7981   3.8217   0.8737   5.9851   9.1882   4.9659   70.511   30.425  101.885   29.893 -31.37396 42.65313 
1 1 1   20   15   46 o  197.840   14.067   30.986   4.2321   16.223   6.1438   44.315   5.8380  134.353   30.565  235.485   16.297 -101.1314 34.63808 
1 1 1   20   15   47 o   83.589   28.918   5.8634   4.5051   1.0296   8.3991   7.8158   5.3379   79.759   35.190   93.966   31.498 -14.20706 47.22777 
1 1 1   20   15   48 o   92.809   28.111   7.7112   4.3375   10.722   7.0110   5.8445   5.5208  105.931   36.095   84.690   31.652 21.24131 48.00750 
1 1 1   20   15   49 o   47.282   21.841  -2.1846   3.7034  -5.3460   5.0728   1.4232   5.4191   49.635   23.721   67.663   29.072 -18.02813 37.52168 
1 1 1   20   15   50 o   66.962   26.220   3.0830   3.9062   1.3282   5.4012   5.0074   5.6561   66.704   28.842   79.943   31.474 -13.23964 42.69080 
1 1 1   20   15   51 o   55.439   24.048   0.4797   3.7790   0.6267   5.1549   0.3090   5.5562   63.025   27.697   63.964   28.401 -0.9381523 39.67020 
1 1 1   20   16    0 o  403.442   14.241  125.268   8.7694  125.268   8.7694  125.268   8.7694  403.442   14.241  403.442   14.241 0.000000 0.000000 
1 1 1   20   16    1 o  334.694   7.9499   85.833   4.0727   84.906   4.7017   88.620   8.1505  332.813   9.2296  339.499   15.685 -6.686218 18.19882 
1 1 1   20   16    2 o  375.947   8.8026  108.325   5.0653  108.325   5.0653   0.0000   0.0000  375.947   8.8026  ?   ?  0.000000 8.802565 
1 1 1   20   16    3 o  109.934   19.210   9.5811   3.1147   8.6548   3.5026   13.082   6.8092  103.854   22.671  127.161   34.228 -23.30740 41.05487 
1 1 1   20   16    4 o  650.850   7.4100  324.537   7.3819  316.332   8.6202  347.099   14.295  642.434   8.7664  672.196   13.894 -29.76239 16.42818 
1 1 1   20   16    5 o  761.234   7.7441  444.005   9.0232  438.554   10.630  458.062   17.070  756.366   9.1816  772.062   14.444 -15.69678 17.11559 
1 1 1   20   16    6 o  677.008   7.4821  351.168   7.7533  347.929   9.0783  359.899   14.904  673.734   8.8033  684.370   14.228 -10.63641 16.73153 
1 1 1   20   16    7 o  256.642   9.1942   50.495   3.6117   49.462   3.9695   55.462   8.7052  253.953   10.212  267.106   21.474 -13.15306 23.77855 
1 1 1   20   16    8 o  513.463   6.5191  201.951   5.1235  206.111   5.7125  184.844   11.585  518.674   7.1955  490.226   15.439 28.44775 17.03388 
1 1 1   20   16    9 o  357.195   6.9560   97.747   3.8031   97.725   4.1147   97.881   9.9626  357.122   7.5274  355.867   18.353 1.254608 19.83637 
1 1 1   20   16   10 o  325.429   8.1453   81.170   4.0572   83.277   4.5155   72.337   9.2432  329.576   8.9512  305.468   19.877 24.10806 21.79973 
1 1 1   20   16   11 o  315.489   8.1524   76.291   3.9367   75.683   4.3030   79.415   9.7512  314.180   8.9480  320.049   20.006 -5.869080 21.91568 
1 1 1   20   16   12 o   56.385   20.850   1.9215   2.3829   2.3114   2.4914  -2.2663   8.1650   59.572   21.426   78.238   34.599 -18.66555 40.69587 
1 1 1   20   16   13 o  157.584   17.286   19.370   4.1011   17.865   4.6804   24.348   8.5099  150.586   20.867  173.283   33.295 -22.69649 39.29333 
1 1 1   20   16   14 o  228.578   12.595   40.271   4.3896   39.395   5.1177   42.710   8.5381  225.750   14.894  233.261   24.269 -7.510986 28.47527 
1 1 1   20   16   15 o  406.348   6.7959  126.525   4.2268  129.233   4.6016  111.904   10.693  410.632   7.3213  380.656   18.352 29.97525 19.75883 
1 1 1   20   16   16 o  463.449   7.2807  164.624   5.1647  164.624   5.1647   0.0000   0.0000  463.449   7.2807  ?   ?  0.000000 7.280696 
1 1 1   20   16   17 o  425.212   6.8014  138.562   4.4266  138.232   4.8038  140.421   11.397  424.653   7.3906  426.429   17.462 -1.775604 18.96124 
1 1 1   20   16   18 o  400.050   6.9601  122.664   4.2618  125.209   4.6270  108.422   10.945  404.132   7.4801  373.795   19.195 30.33716 20.60106 
1 1 1   20   16   19 o  254.678   8.3333   49.750   3.2485   48.545   3.4420   59.566   9.8249  251.533   8.9403  275.584   23.517 -24.05099 25.15902 
1 1 1   20   16   20 o  198.735   9.9998   30.405   3.0321   32.184   3.2083   15.529   9.2780  204.445   10.285  137.327   41.006 67.11856 42.27635 
1 1 1   20   16   21 o  359.763   7.6424   99.261   4.2084   99.120   4.5698  100.045   10.797  359.440   8.3062  358.545   19.751 0.8949280 21.42621 
1 1 1   20   16   22 o  371.652   6.8728  105.897   3.9097  112.404   4.7891   92.897   6.7694  382.758   8.1746  347.344   12.733 35.41397 15.13100 
1 1 1   20   16   23 o  341.319   7.5687   89.361   3.9541   88.086   5.0083   91.472   6.4429  338.632   9.6625  344.699   12.212 -6.066742 15.57203 
1 1 1   20   16   24 o  115.205   15.932   10.454   2.7341   11.804   3.3198   7.6066   4.8204  122.038   18.340   97.468   29.660 24.57030 34.87211 
1 1 1   20   16   25 o  119.204   13.259   11.092   2.3782   11.772   3.3088   10.365   3.4205  121.827   18.310  113.690   20.406 8.137238 27.41683 
1 1 1   20   16   26 o  176.945   9.6989   24.140   2.6168   23.373   3.6994   24.908   3.7021  173.394   14.060  179.118   13.605 -5.724213 19.56470 
1 1 1   20   16   27 o  273.293   8.6315   57.375   3.6107   56.807   4.4730   58.437   6.1169  271.656   10.758  274.478   14.612 -2.821991 18.14518 
1 1 1   20   16   28 o  255.147   8.0214   49.993   3.1326   48.847   4.5044   51.068   4.3596  251.720   11.691  257.476   11.062 -5.756180 16.09495 
1 1 1   20   16   29 o  260.941   10.922   52.466   4.3624   52.385   10.933   52.481   4.7575  254.395   28.572  260.811   11.917 -6.415512 30.95740 
1 1 1   20   16   30 o  166.383   11.212   21.443   2.8388   20.584   4.5094   22.006   3.6536  161.315   18.604  167.934   14.352 -6.619308 23.49647 
1 1 1   20   16   31 o  280.525   7.8887   60.466   3.3873   58.831   4.9538   61.901   4.6420  276.045   11.724  283.363   10.703 -7.317841 15.87474 
1 1 1   20   16   32 o  364.724   7.1792  102.155   4.0078  116.090   6.0314   91.137   5.3631  388.139   10.152  343.897   10.189 44.24216 14.38320 
1 1 1   20   16   33 o  478.204   6.6739  175.556   4.8850  187.038   7.4171  166.760   6.4918  492.700   9.8351  465.447   9.1123 27.25357 13.40758 
1 1 1   20   16   34 o  161.776   12.780   20.392   3.1389   21.718   5.0584   19.561   4.0028  164.781   20.499  157.386   16.879 7.394165 26.55392 
1 1 1   20   16   35 o  138.288   15.073   15.058   3.1389   12.599   5.1130   16.544   3.9764  122.475   27.898  144.072   18.456 -21.59681 33.45035 
1 1 1   20   16   36 o  169.561   13.291   22.450   3.4219   25.487   5.9917   20.979   4.1686  177.625   22.546  162.854   16.973 14.77040 28.22031 
1 1 1   20   16   37 o  162.295   13.683   20.618   3.3673   17.989   5.4420   22.249   4.2864  147.723   24.957  167.675   16.934 -19.95132 30.15977 
1 1 1   20   16   38 f  151.807   15.105   18.165   3.4632   16.151   5.6779   19.359   4.3704  138.470   27.756  155.593   18.727 -17.12317 33.48272 
1 1 1   20   16   39 o   46.266   21.612  -3.3050   3.7859   1.5742   5.6151  -7.3721   5.1265   72.328   30.263   48.028   23.182 24.30004 38.12201 
1 1 1   20   16   40 o  234.980   11.225   42.790   4.0372   46.164   6.5967   40.768   5.1049  241.122   18.004  227.908   14.713 13.21443 23.25063 
1 1 1   20   16   41 o  153.846   22.492   19.414   5.1399   17.391   6.2216   23.764   9.1222  142.171   29.555  161.934   37.536 -19.76340 47.77463 
1 1 1   20   16   42 o  205.666   14.917   33.351   4.6640   25.780   11.033   34.999   5.1465  163.758   43.340  210.200   16.119 -46.44189 46.24057 
1 1 1   20   16   43 o   67.897   25.842   2.9795   3.7181   8.0327   6.2745   0.2448   4.6158   97.672   34.108   61.817   26.696 35.85497 43.31342 
1 1 1   20   16   44 o  119.213   21.803   11.860   3.8319   10.043   5.9124   13.176   5.0317  105.948   32.956  123.176   27.396 -17.22818 42.85566 
1 1 1   20   16   45 o  228.877   12.025   41.040   4.1979   41.587   6.2252   40.584   5.6849  227.163   18.053  225.263   16.605 1.899796 24.52802 
1 1 1   20   16   46 o  140.439   20.547   16.351   4.2862   4.3143   6.7115   24.641   5.5700   83.114   33.752  172.236   21.603 -89.12182 40.07372 
1 1 1   20   16   47 o   61.317   26.001   1.0355   4.2344   8.0538   6.8305  -3.3451   5.3964   95.809   35.324   56.052   26.056 39.75722 43.89434 
1 1 1   20   16   48 o  124.297   23.712   13.392   4.3467   15.671   6.7022   11.738   5.7106  127.521   33.794  111.413   31.876 16.10867 46.45528 
1 1 1   20   16   49 o  145.764   20.022   17.869   4.3490   12.284   6.4439   22.541   5.8938  111.245   34.372  160.376   24.811 -49.13174 42.39150 
1 1 1   20   16   50 o  106.747   24.610   10.240   3.9387   5.7366   5.3550   15.548   5.8134   81.839   31.045  127.789   30.199 -45.95031 43.31086 
1 1 1   20   16   51 o   70.311   26.406   3.9577   3.8516   2.7645   5.2535   5.3444   5.6636   69.874   29.258   80.156   31.515 -10.28194 43.00241 
1 1 1   20   17    1 o  159.128   14.481   19.623   3.4885   19.623   3.4885   0.0000   0.0000  159.128   14.481  ?   ?  0.000000 14.48097 
1 1 1   20   17    2 o  331.209   8.2486   84.075   4.1817   88.089   4.9581   74.182   7.7834  338.941   9.5570  310.025   16.461 28.91656 19.03434 
1 1 1   20   17    3 o  206.500   11.060   32.812   3.4830   36.485   3.9896   21.044   7.1418  217.679   12.021  161.852   29.931 55.82628 32.25424 
1 1 1   20   17    4 o  333.868   8.2841   85.434   4.2334   84.361   4.8584   88.817   8.6285  331.684   9.5696  339.664   16.597 -7.979553 19.15786 
1 1 1   20   17    5 o  350.889   7.9860   94.358   4.2891   97.693   4.9174   83.754   8.7698  356.967   8.9998  329.268   17.463 27.69962 19.64588 
1 1 1   20   17    6 o  731.696   7.7266  410.274   8.6535  409.374   10.249  412.510   16.149  730.696   9.1639  732.492   14.404 -1.795410 17.07173 
1 1 1   20   17    7 o  593.597   7.3867  269.996   6.7114  270.460   7.8205  268.701   13.074  593.976   8.6019  591.143   14.449 2.832581 16.81547 
1 1 1   20   17    8 o  389.473   6.8459  116.216   4.0811  114.714   4.4688  123.762   10.018  386.903   7.5460  400.903   16.325 -13.99997 17.98457 
1 1 1   20   17    9 o  110.439   17.921   9.6415   2.9256   7.8168   3.1582   20.677   7.7668   98.647   21.522  159.568   32.893 -60.92084 39.30853 
1 1 1   20   17   10 o  333.074   8.1320   85.040   4.1458   82.494   4.5844   96.469   9.7127  327.981   9.1320  353.185   18.027 -25.20383 20.20774 
1 1 1   20   17   11 o  452.034   8.5129  156.666   5.8900  155.572   6.9586  159.432   11.061  450.284   10.096  454.975   15.884 -4.691284 18.82099 
1 1 1   20   17   12 o  532.833   8.3530  217.678   6.8124  222.293   8.0769  206.302   12.681  538.267   9.8034  517.463   16.011 20.80383 18.77351 
1 1 1   20   17   13 o  141.192   12.753   15.447   2.7264   15.142   2.8704   18.258   8.7161  139.660   13.600  148.766   38.108 -9.106094 40.46227 
1 1 1   20   17   14 o  524.931   8.5360  211.317   6.8585  210.788   8.0629  212.702   13.044  524.066   10.052  525.242   16.225 -1.176819 19.08657 
1 1 1   20   17   15 o   91.812   28.551   6.5865   4.4379   6.5865   4.4379   0.0000   0.0000   91.812   28.551  ?   ?  0.000000 28.55091 
1 1 1   20   17   16 o  137.905   23.269   15.180   4.7369   15.180   4.7369   0.0000   0.0000  137.905   23.269  ?   ?  0.000000 23.26923 
1 1 1   20   17   17 o  462.124   6.8066  163.680   4.8146  166.399   5.2721  150.021   11.816  465.885   7.3932  440.606   17.521 25.27911 19.01691 
1 1 1   20   17   18 o  140.037   12.123   15.193   2.5728   15.209   2.6781   14.993   9.2657  140.042   12.630  135.345   41.107 4.696732 43.00335 
1 1 1   20   17   19 o   69.525   20.058   3.8334   2.2526   2.9559   2.3303   16.339   8.7968   63.076   20.801  140.248   39.368 -77.17269 44.52500 
1 1 1   20   17   20 o  136.698   12.532   14.502   2.5930   14.133   2.7006   18.842   9.2747  134.827   13.258  149.952   39.761 -15.12509 41.91344 
1 1 1   20   17   21 o  398.753   7.3841  121.943   4.5068  123.402   4.8850  113.598   11.682  401.064   7.9575  381.830   20.059 19.23349 21.57977 
1 1 1   20   17   22 o  253.964   8.9075   49.519   3.4626   49.078   3.6844   52.855   10.131  252.772   9.5230  258.106   25.998 -5.334015 27.68711 
1 1 1   20   17   23 o  207.568   11.977   33.283   3.7891   33.283   3.7891   0.0000   0.0000  207.568   11.977  ?   ?  0.000000 11.97721 
1 1 1   20   17   24 o  290.940   7.8291   64.959   3.4865   65.399   4.1789   63.953   6.3239  291.750   9.3580  287.745   14.358 4.005371 17.13872 
1 1 1   20   17   25 o  514.325   6.6784  202.880   5.2575  203.024   6.5240  202.612   8.8796  514.213   8.2889  512.969   11.309 1.243774 14.02158 
1 1 1   20   17   26 o   78.689   21.896   4.9980   2.7337   5.2287   3.2595   4.4507   5.0198   80.961   24.334   82.190   30.285 -1.228241 38.85056 
1 1 1   20   17   27 o  382.490   6.8753  112.248   4.0252  115.607   6.1093  109.672   5.3507  387.561   10.299  377.688   9.2556 9.873047 13.84667 
1 1 1   20   17   28 o  271.417   10.561   56.738   4.3874   46.954   10.003   59.068   4.8820  241.143   27.599  276.767   11.524 -35.62419 29.90870 
1 1 1   20   17   29 o   51.889   20.653   1.1477   2.4603   2.0255   3.6337   0.4047   3.3431   64.199   25.243   55.097   23.219 9.102325 34.29729 
1 1 1   20   17   30 o  532.459   6.3250  217.529   5.1548  223.525   7.4035  211.887   7.1816  539.056   8.9729  524.845   8.9396 14.21112 12.66612 
1 1 1   20   17   31 o  225.887   9.1531   39.267   3.1647   41.336   4.6670   37.506   4.3059  230.692   13.273  219.812   12.854 10.88007 18.47689 
1 1 1   20   17   32 o  377.754   7.1380  109.594   4.1272  111.147   6.0692  108.257   5.6291  379.661   10.444  374.859   9.8107 4.802856 14.32925 
1 1 1   20   17   33 o  204.025   10.536   32.198   3.2790   32.547   4.6727   31.860   4.6025  204.010   15.071  201.855   15.004 2.155075 21.26594 
1 1 1   20   17   34 o  163.319   12.592   20.777   3.1235   24.541   4.9039   18.208   4.0516  175.907   18.490  151.463   17.817 24.44431 25.67727 
1 1 1   20   17   35 o  232.378   10.208   41.672   3.6307   45.396   6.1111   39.640   4.5137  240.333   16.717  225.667   13.124 14.66565 21.25292 
1 1 1   20   17   36 o  170.370   13.236   22.670   3.4245   18.870   5.4274   25.184   4.4141  151.740   24.179  178.722   16.316 -26.98167 29.16930 
1 1 1   20   17   37 o  194.654   13.231   29.577   3.9186   29.650   5.6146   29.509   5.4717  192.809   19.283  192.532   18.808 0.2773438 26.93657 
1 1 1   20   17   38 f   55.913   23.783   0.3402   3.5617  -8.6436   5.3401   7.5395   4.7804   47.495   23.097   95.037   29.645 -47.54161 37.58071 
1 1 1   20   17   39 f  196.099   12.555   30.001   3.7487   35.622   6.0544   26.507   4.7739  211.309   18.919  182.707   17.276 28.60167 25.62005 
1 1 1   20   17   40 o  198.385   16.640   31.182   5.0062   33.238   6.0100   26.522   9.0477  203.592   19.526  173.005   35.361 30.58740 40.39383 
1 1 1   20   17   41 o  137.590   20.628   15.454   4.2102   40.969   10.316   10.354   4.6119  217.895   31.872  109.758   27.506 108.1368 42.10046 
1 1 1   20   17   42 o   78.986   26.089   5.0559   3.6653   7.4200   6.2795   3.8343   4.5140   95.312   34.044   75.242   28.513 20.07008 44.40720 
1 1 1   20   17   43 o  145.030   17.575   16.952   3.8218   18.098   5.9939   16.167   4.9610  144.711   28.074  138.556   24.277 6.154358 37.11482 
1 1 1   20   17   44 o   54.917   24.087  -0.3332   3.8822 -11.2917   6.1937   6.7583   4.9824   48.507   23.856   89.381   30.429 -40.87445 38.66563 
1 1 1   20   17   45 o  169.814   16.781   23.203   4.3048   17.121   6.9988   26.903   5.4597  135.908   33.788  181.172   20.023 -45.26376 39.27577 
1 1 1   20   17   46 o  216.018   13.222   36.856   4.3507   31.586   6.3508   41.516   5.9724  194.919   21.653  226.851   17.331 -31.93248 27.73466 
1 1 1   20   17   47 o   75.459   27.760   4.4693   4.2149  -7.8824   6.3866   14.000   5.6102   53.463   25.823  123.470   29.985 -70.00688 39.57131 
1 1 1   20   17   48 o  179.129   15.001   25.827   4.0752   22.648   5.6241   29.342   5.9132  162.233   23.319  186.747   21.054 -24.51396 31.41746 
1 1 1   20   17   49 o   80.729   27.256   5.7811   3.9973   5.5429   5.7805   5.9993   5.5335   82.161   31.972   83.530   31.589 -1.369629 44.94550 
1 1 1   20   17   50 o   62.305   25.904   1.9094   4.0766  -6.3975   5.9685   9.1734   5.5814   52.355   25.206   96.684   32.206 -44.32825 40.89703 
1 1 1   20   18    0 f   82.899   40.156   7.8662   5.9475   7.8662   5.9475   7.8662   5.9475   82.899   40.156   82.899   40.156 0.000000 0.000000 
1 1 1   20   18    1 o  264.795   17.845   54.295   7.1906   0.0000   0.0000   54.295   7.1906  ?   ?   264.795   17.845 0.000000 17.84538 
1 1 1   20   18    2 o  322.981   16.811   80.573   8.2819   0.0000   0.0000   80.573   8.2819  ?   ?   322.981   16.811 0.000000 16.81079 
1 1 1   20   18    3 o  488.400   7.5177  182.795   5.6200  178.722   6.5646  193.973   10.875  482.801   8.8832  502.268   14.145 -19.46652 16.70309 
1 1 1   20   18    4 o  200.676   11.113   31.004   3.4000   31.598   3.8437   28.865   7.2900  202.443   12.465  191.123   25.560 11.31990 28.43761 
1 1 1   20   18    5 o  473.332   7.4897  171.694   5.4262  169.463   6.2486  178.538   10.942  470.137   8.6834  481.725   14.840 -11.58847 17.19419 
1 1 1   20   18    6 o  485.475   7.4022  180.615   5.5005  183.449   6.4415  172.985   10.569  489.154   8.6034  474.201   14.562 14.95337 16.91340 
1 1 1   20   18    7 f  639.274   7.4993  313.200   7.3380  313.229   8.6280  313.124   13.951  639.133   8.8196  638.024   14.285 1.108582 16.78870 
1 1 1   20   18    8 o  571.925   7.6913  250.711   6.7330  252.638   7.9102  245.642   12.828  573.959   9.0040  564.959   14.834 9.000244 17.35294 
1 1 1   20   18    9 o  406.713   11.233  127.013   6.9925  118.304   9.4034  137.786   10.458  391.911   15.676  422.867   16.158 -30.95590 22.51253 
1 1 1   20   18   10 o   83.117   26.343   5.3094   3.7599   6.2575   4.2748   2.0696   7.9021   89.743   28.040   87.702   36.230 2.040825 45.81353 
1 1 1   20   18   11 o  429.039   6.8338  141.057   4.4878  139.943   4.9155  146.633   11.000  427.284   7.5159  436.083   16.479 -8.798370 18.11232 
1 1 1   20   18   12 o  158.161   11.716   19.324   2.8161   21.212   2.9861   4.1477   8.4658  165.732   11.850   96.073   38.289 69.65858 40.08087 
1 1 1   20   18   13 o  532.554   6.7950  217.350   5.5389  224.597   6.1706  187.291   12.567  541.286   7.4478  492.681   16.665 48.60504 18.25323 
1 1 1   20   18   14 o  243.479   12.702   45.715   4.7173   43.983   5.2646   52.771   10.625  238.535   14.488  258.335   27.285 -19.79912 30.89253 
1 1 1   20   18   15 o  316.525   12.325   77.044   5.9710   77.044   5.9710   0.0000   0.0000  316.525   12.325  ?   ?  0.000000 12.32455 
1 1 1   20   18   16 o  377.579   9.7918  109.452   5.6590  113.711   6.6646   98.445   10.713  384.653   11.320  355.855   19.746 28.79770 22.76091 
1 1 1   20   18   17 o  404.946   9.5747  125.892   5.9346  127.455   6.9309  121.598   11.489  407.230   11.119  396.174   18.946 11.05554 21.96806 
1 1 1   20   18   18 o  516.328   6.9150  204.378   5.4650  206.138   5.9708  195.290   13.567  518.465   7.5239  502.360   17.644 16.10461 19.18082 
1 1 1   20   18   19 o  268.855   8.0782   55.455   3.3243   55.640   3.5095   53.834   10.370  269.268   8.5152  260.625   26.358 8.643158 27.69928 
1 1 1   20   18   20 o  173.213   10.458   23.143   2.7597   23.806   2.8813   15.774   9.6036  175.645   10.769  137.847   41.846 37.79860 43.20943 
1 1 1   20   18   21 o  376.365   7.4152  108.653   4.2717  107.746   4.5991  114.351   11.528  374.720   8.0186  382.999   19.732 -8.279968 21.29906 
1 1 1   20   18   22 f  439.784   8.2157  148.452   5.5304  153.604   6.1964  128.280   12.262  447.210   9.0523  406.002   19.731 41.20779 21.70857 
1 1 1   20   18   23 o  184.050   10.881   26.154   3.0516   27.154   3.2124   16.922   9.7654  187.490   11.246  141.475   42.030 46.01466 43.50823 
1 1 1   20   18   24 o  127.340   14.616   12.697   2.7973   14.984   3.3027   6.8941   5.2613  138.204   15.903   94.398   31.261 43.80672 35.07326 
1 1 1   20   18   25 o  286.549   8.7062   63.083   3.8185   67.394   4.7655   55.351   6.3826  295.914   10.521  266.814   15.698 29.10031 18.89751 
1 1 1   20   18   26 o   53.188   21.099   1.2330   2.5595   3.8092   2.9685  -6.2329   5.0533   70.975   23.480   50.111   23.873 20.86463 33.48456 
1 1 1   20   18   27 o  336.156   8.3017   86.823   4.2715   89.735   7.8776   85.611   5.0837  340.191   15.129  333.512   9.9586 6.679535 18.11209 
1 1 1   20   18   28 o  225.468   8.8873   39.092   3.0671   36.962   4.0431   41.979   4.7073  218.461   12.139  232.597   13.277 -14.13553 17.98998 
1 1 1   20   18   29 o  379.944   6.6671  110.790   3.8773  114.284   5.5098  107.363   5.4572  385.367   9.3410  373.470   9.5464 11.89624 13.35621 
1 1 1   20   18   30 o  128.359   13.568   12.899   2.6253   12.070   3.7987   13.657   3.6322  122.222   21.066  130.868   18.662 -8.645775 28.14335 
1 1 1   20   18   31 o  417.190   6.7380  133.617   4.3026  150.613   6.4273  119.817   5.7919  442.249   9.4949  394.427   9.5936 47.82208 13.49783 
1 1 1   20   18   32 o  170.217   11.410   22.481   2.9557   24.298   4.3649   20.941   4.0167  175.757   16.415  163.090   16.309 12.66690 23.13977 
1 1 1   20   18   33 o  361.009   7.4852  100.163   4.1361  107.785   6.0797   93.596   5.6433  373.694   10.629  348.241   10.587 25.45319 15.00228 
1 1 1   20   18   34 o   50.844   21.477   0.3227   2.8713  -0.9572   4.4881   1.2095   3.7358   58.163   25.690   60.841   24.998 -2.678120 35.84473 
1 1 1   20   18   35 o   57.904   23.705   1.1385   3.3442   2.2277   5.1577   0.3484   4.3927   72.694   29.562   61.686   26.330 11.00851 39.58764 
1 1 1   20   18   36 f  229.780   11.191   40.851   3.9361   39.722   5.4626   42.071   5.6767  224.791   15.980  231.313   16.134 -6.522385 22.70883 
1 1 1   20   18   37 o   97.127   21.697   7.8039   3.1442   12.221   5.0914   5.0807   3.9976  119.874   28.217   80.606   27.257 39.26839 39.23224 
1 1 1   20   18   38 o  144.268   15.674   16.484   3.4055   16.715   5.4685   16.337   4.3526  141.283   26.254  141.921   20.642 -0.6376648 33.39694 
1 1 1   20   18   39 o   96.580   28.955   7.9075   4.6191   17.632   6.3111  -3.3111   6.7788  143.318   29.744   65.579   30.020 77.73933 42.25943 
1 1 1   20   18   40 o  254.425   14.013   50.743   5.4359   52.321   6.4517   46.879   10.093  257.213   16.474  236.018   28.516 21.19533 32.93236 
1 1 1   20   18   41 o  138.604   20.908   15.738   4.2978   17.701   10.518   15.344   4.7089  135.441   44.168  135.691   23.525 -0.2493896 50.04212 
1 1 1   20   18   42 o   68.059   25.477   3.1462   3.5797   8.3249   5.7262  -0.1760   4.5864   98.220   32.617   60.224   26.303 37.99525 41.90137 
1 1 1   20   18   43 o  111.980   28.337   11.032   4.8609   0.0000   0.0000   11.032   4.8609  ?   ?   111.980   28.337 0.000000 28.33681 
1 1 1   20   18   44 f  201.190   13.138   31.892   4.0236   26.179   5.8237   37.109   5.5654  177.734   21.868  215.045   17.048 -37.31053 27.72833 
1 1 1   20   18   45 o  175.312   15.279   24.551   4.0590   22.045   6.0627   26.587   5.4645  160.259   25.575  179.767   20.210 -19.50859 32.59662 
1 1 1   20   18   46 o  171.972   17.114   23.983   4.4449   19.395   7.1025   26.937   5.6988  144.067   32.928  179.821   21.106 -35.75446 39.11144 
1 1 1   20   18   47 o  305.045   10.716   72.806   5.0034   66.508   6.4459   82.352   7.9359  288.507   14.645  319.541   16.279 -31.03476 21.89736 
1 1 1   20   18   48 o  152.618   17.491   19.185   4.0121   15.875   5.6051   22.664   5.7454  131.137   28.720  161.327   23.998 -30.19023 37.42628 
1 1 1   20   18   49 o   65.242   25.958   2.7775   3.8848  -3.0233   5.3202   9.4034   5.6860   55.049   25.683   98.002   32.500 -42.95285 41.42313 
1 1 1   20   19    0 o  164.106   27.431   22.428   6.3116   22.428   6.3116   22.428   6.3116  164.106   27.431  164.106   27.431 0.000000 0.000000 
1 1 1   20   19    1 o  361.695   10.103  100.382   5.5930  108.233   7.7035   91.631   8.1333  375.199   13.414  344.974   15.403 30.22546 20.42523 
1 1 1   20   19    2 o  412.006   7.8255  130.116   4.9350  130.948   5.9035  128.186   8.9923  413.184   9.3345  408.174   14.393 5.009583 17.15507 
1 1 1   20   19    3 o  149.716   18.994   17.584   4.2547   21.825   5.4337   10.861   6.8405  166.475   21.852  116.659   35.295 49.81602 41.51218 
1 1 1   20   19    4 f  893.169   15.150  614.200   20.712   0.0000   0.0000  614.200   20.712  ?   ?   893.169   15.150 0.000000 15.15033 
1 1 1   20   19    5 o  238.326   13.284   43.807   4.8266   47.199   6.1954   38.569   7.6985  246.912   16.488  221.797   23.012 25.11522 28.30857 
1 1 1   20   19    6 o  460.838   9.7591  162.948   6.8838  168.373   9.3150  156.421   10.218  467.982   13.004  450.762   14.810 17.22021 19.70880 
1 1 1   20   19    7 o  172.438   31.612   24.056   8.0362   0.0000   0.0000   24.056   8.0362  ?   ?   172.438   31.612 0.000000 31.61233 
1 1 1   20   19    8 o  188.611   13.768   27.513   3.9472   29.894   4.5991   20.856   7.6906  196.392   15.424  160.027   32.507 36.36508 35.98028 
1 1 1   20   19    9 o  412.071   6.9724  130.134   4.3977  129.123   4.8531  134.774   10.397  410.402   7.7258  418.066   16.248 -7.663971 17.99150 
1 1 1   20   19   10 o  378.190   7.1883  109.627   4.1611  106.017   4.5215  129.598   10.635  371.849   7.9442  409.784   16.955 -37.93509 18.72385 
1 1 1   20   19   11 o  170.252   11.280   22.365   2.9229   21.654   3.0957   28.207   8.8714  167.398   12.165  186.669   32.213 -19.27028 34.43388 
1 1 1   20   19   12 o  546.984   6.8904  229.312   5.7688  234.756   6.4305  206.867   13.057  553.352   7.5923  517.734   16.476 35.61737 18.14146 
1 1 1   20   19   13 o   86.986   20.711   6.1023   2.7179   6.2578   2.8345   4.3284   9.5734   88.059   21.269  100.613   40.502 -12.55381 45.74675 
1 1 1   20   19   14 o  374.337   11.372  107.701   6.5157  107.701   6.5157   0.0000   0.0000  374.337   11.372  ?   ?  0.000000 11.37177 
1 1 1   20   19   15 o  259.589   11.932   51.824   4.7412   51.550   5.3659   52.799   10.124  258.360   13.617  258.487   25.938 -0.1260376 29.29558 
1 1 1   20   19   16 o   72.976   27.194   3.2528   4.0692   2.1149   4.5629   7.6742   8.9944   70.525   28.109  108.394   40.422 -37.86948 49.23489 
1 1 1   20   19   17 o  315.465   11.080   76.510   5.3500   77.345   6.1747   73.994   10.716  316.952   12.728  307.141   22.960 9.811127 26.25149 
1 1 1   20   19   18 o   93.824   28.161   7.0313   4.3675   8.1579   4.9301   2.9232   9.4144  100.661   29.854   95.701   39.541 4.959740 49.54527 
1 1 1   20   19   19 o  323.612   7.6104   80.335   3.7696   80.567   4.0129   78.596   10.995  324.028   8.0910  316.364   22.860 7.664215 24.24932 
1 1 1   20   19   20 o  168.899   10.815   22.028   2.7812   22.637   2.9051   15.341   9.6269  171.179   11.149  135.900   42.016 35.27890 43.47028 
1 1 1   20   19   21 o  389.422   9.2695  116.503   5.5252  107.386   6.1237  156.421   12.814  373.638   10.708  448.635   18.660 -74.99701 21.51435 
1 1 1   20   19   22 o  413.873   9.3987  131.633   5.9540  131.480   6.7990  132.139   12.331  413.371   10.746  411.852   19.561 1.518555 22.31847 
1 1 1   20   19   23 o  159.454   12.194   19.713   2.9537   20.905   3.0956   7.6008   9.8679  164.195   12.409  109.410   41.991 54.78563 43.78572 
1 1 1   20   19   24 o  448.090   6.8625  154.038   4.7067  157.929   5.7668  146.275   8.1459  453.456   8.3086  435.503   12.220 17.95303 14.77726 
1 1 1   20   19   25 o  367.405   7.2181  103.603   4.0592   99.315   4.8332  113.867   7.4781  359.475   8.7841  384.023   12.722 -24.54810 15.46013 
1 1 1   20   19   26 o  247.316   12.249   47.218   4.6367   54.475   6.7845   40.858   6.3516  264.112   16.871  228.146   18.344 35.96614 24.92199 
1 1 1   20   19   27 o  299.956   8.5553   69.165   3.9279   71.180   4.4718   62.361   8.2177  304.117   9.6067  281.704   19.173 22.41275 21.44473 
1 1 1   20   19   28 o  241.600   9.5540   44.931   3.5331   48.553   4.2330   36.611   6.4148  250.912   11.022  215.257   19.688 35.65497 22.56285 
1 1 1   20   19   29 o   68.502   21.073   3.7078   2.4250   4.5962   3.3480   2.7272   3.5173   76.806   24.913   66.889   25.212 9.917389 35.44419 
1 1 1   20   19   30 o   57.362   20.939   2.1476   2.3915   3.1813   3.3999   1.1355   3.3644   68.675   24.982   58.261   23.805 10.41356 34.50761 
1 1 1   20   19   31 o  185.414   10.380   26.596   2.9340   25.835   4.1585   27.349   4.1402  181.651   15.093  187.072   14.574 -5.420319 20.98125 
1 1 1   20   19   32 f  249.857   8.7972   48.055   3.3644   47.870   4.8740   48.224   4.6498  248.237   12.872  249.637   12.169 -1.399673 17.71372 
1 1 1   20   19   33 o  222.389   9.5376   38.121   3.2465   42.055   4.7554   34.688   4.4430  232.400   13.426  210.876   13.842 21.52368 19.28350 
1 1 1   20   19   34 o   92.833   23.496   7.1526   3.3416   12.243   4.8628   2.5983   4.5996  120.769   26.986   71.388   28.295 49.38089 39.10028 
1 1 1   20   19   35 o  249.909   9.5542   48.176   3.6546   49.814   5.4344   46.824   4.9381  252.577   14.113  245.161   13.208 7.415329 19.32981 
1 1 1   20   19   36 o  258.010   9.6394   51.377   3.8068   49.769   5.8056   52.590   5.0420  251.980   15.123  260.249   12.657 -8.268723 19.72054 
1 1 1   20   19   37 o  165.008   13.666   21.346   3.4205   21.794   5.2201   21.009   4.5280  164.050   21.291  162.081   18.588 1.969223 28.26313 
1 1 1   20   19   38 o   80.323   27.449   5.0474   4.0546   6.1006   5.0645   3.1673   6.7665   88.004   30.648   82.294   33.708 5.710289 45.55796 
1 1 1   20   19   39 o  232.942   14.518   42.618   5.1505   42.654   6.1294   42.531   9.5003  231.756   17.406  225.047   28.199 6.709183 33.13853 
1 1 1   20   19   40 o  169.442   17.877   22.999   4.5665   20.566   10.728   23.537   5.0465  145.532   44.239  170.648   19.681 -25.11546 48.41921 
1 1 1   20   19   41 o  280.727   10.088   61.073   4.3348   63.193   6.5981   59.464   5.7498  282.904   15.294  275.591   13.631 7.313477 20.48672 
1 1 1   20   19   42 o   62.793   24.998   2.0738   3.6047   5.7943   5.8252  -0.2349   4.5887   87.001   32.513   59.884   26.228 27.11681 41.77375 
1 1 1   20   19   43 o   58.934   24.409   1.2416   3.6004   3.3971   5.5900  -0.2865   4.7066   76.709   30.925   60.210   26.462 16.49891 40.70096 
1 1 1   20   19   44 o  154.854   16.849   19.348   3.9292   17.922   5.9887   20.425   5.2064  142.589   28.437  156.215   22.417 -13.62697 36.21006 
1 1 1   20   19   45 o  100.154   25.266   8.8024   3.8730   16.153   6.0441   3.6809   5.0449  133.287   30.311   74.978   29.660 58.30861 42.40813 
1 1 1   20   19   46 o   57.167   24.860   0.2434   4.0586   1.9089   6.5215  -0.8095   5.1850   73.902   31.824   60.458   27.099 13.44342 41.79865 
1 1 1   20   19   47 f  187.285   14.296   28.122   4.0672   26.612   5.9494   29.447   5.5728  176.433   22.546  187.987   19.658 -11.55403 29.91284 
1 1 1   20   19   48 o   65.382   25.637   2.9030   3.7386  -0.7258   5.2206   6.7231   5.3565   60.003   27.019   86.222   31.358 -26.21963 41.39251 
1 1 1   20   19   49 o  139.273   20.051   16.508   4.1511   20.965   5.5634   10.909   6.2349  153.694   24.469  103.645   34.016 50.04955 41.90308 
1 1 1   20   20    0 o   70.962   38.582   5.5698   5.9143   5.5698   5.9143   5.5698   5.9143   70.962   38.582   70.962   38.582 0.000000 0.000000 
1 1 1   20   20    1 o  394.119   10.217  119.227   6.1633  123.668   8.6438  114.633   8.7904  400.862   14.088  385.816   14.885 15.04630 20.49483 
1 1 1   20   20    2 o  362.733   10.251  100.997   5.6912   98.257   7.4851  104.751   8.7621  357.365   13.684  368.706   15.526 -11.34082 20.69569 
1 1 1   20   20    3 o  223.979   10.543   38.515   3.6145   37.978   4.1871   40.084   7.1604  221.940   12.375  226.527   20.887 -4.586639 24.27722 
1 1 1   20   20    4 o  233.590   10.300   41.886   3.6825   37.734   4.1949   55.839   7.6893  221.210   12.440  268.104   18.858 -46.89481 22.59102 
1 1 1   20   20    5 o  117.083   36.848   10.852   7.3673   0.0000   0.0000   10.852   7.3673  ?   ?   117.083   36.848 0.000000 36.84816 
1 1 1   20   20    6 o  463.587   14.881  165.550   10.559   0.0000   0.0000  165.550   10.559  ?   ?   463.587   14.881 0.000000 14.88092 
1 1 1   20   20    7 o  600.356   7.6586  276.325   7.0376  270.084   8.2264  293.359   13.591  593.330   9.0583  617.217   14.386 -23.88641 17.00031 
1 1 1   20   20    8 o  510.670   8.3500  200.006   6.5268  199.481   7.8117  201.220   11.878  509.762   10.012  510.966   15.188 -1.203888 18.19063 
1 1 1   20   20    9 o  297.238   10.492   67.848   4.7736   62.270   5.5190   84.413   9.5113  284.536   12.672  329.750   18.924 -45.21478 22.77491 
1 1 1   20   20   10 o  338.674   9.7489   88.048   5.0537   93.700   6.0352   74.784   9.2451  349.195   11.291  310.112   19.577 39.08276 22.60031 
1 1 1   20   20   11 o  553.253   8.6364  234.827   7.3135  230.263   8.6989  245.831   13.508  547.554   10.379  564.502   15.633 -16.94769 18.76487 
1 1 1   20   20   12 o  176.171   12.226   23.986   3.2764   23.986   3.2764   0.0000   0.0000  176.171   12.226  ?   ?  0.000000 12.22625 
1 1 1   20   20   13 o   67.330   22.900   3.2778   2.8219   3.2778   2.8219   0.0000   0.0000   67.330   22.900  ?   ?  0.000000 22.89986 
1 1 1   20   20   14 o  470.462   9.1452  169.900   6.5855  172.510   7.8268  163.573   12.186  473.783   10.793  459.840   17.314 13.94299 20.40225 
1 1 1   20   20   15 o  170.088   17.187   22.604   4.4131   21.434   5.0279   26.531   9.2100  164.895   20.353  179.469   34.783 -14.57314 40.30036 
1 1 1   20   20   16 o  377.241   12.324  109.553   7.1161  111.621   9.2415  106.539   11.153  380.052   15.886  369.815   19.776 10.23679 25.36640 
1 1 1   20   20   17 o  102.442   31.562   8.3922   5.4375   8.5834   6.6944   8.0215   9.3219  105.533   35.274  110.034   41.128 -4.500793 54.18306 
1 1 1   20   20   18 o  490.457   11.619  185.135   8.7223  189.832   11.555  178.914   13.299  495.638   15.231  480.226   18.092 15.41220 23.64988 
1 1 1   20   20   19 o  334.361   14.151   86.310   7.2421   87.725   9.4443   84.290   11.283  335.586   18.457  327.483   22.649 8.102631 29.21728 
1 1 1   20   20   20 o   58.333   26.100  -1.8436   4.7868  -0.6799   5.5311  -5.3157   9.5542   66.478   28.964   78.090   35.707 -11.61166 45.97741 
1 1 1   20   20   21 o  118.632   15.586   11.077   2.7615   10.018   2.8578   26.004   10.733  112.389   17.156  174.300   40.929 -61.91106 44.37903 
1 1 1   20   20   22 o   55.756   20.663   1.9120   2.3429   1.0563   2.4043   18.042   10.438   51.048   20.386  145.116   43.532 -94.06831 48.06855 
1 1 1   20   20   23 o  253.611   9.0580   49.439   3.5162   49.640   3.6862   47.406   11.711  254.075   9.4787  240.343   32.683 13.73132 34.02972 
1 1 1   20   20   24 o  169.966   20.491   22.929   5.2232   18.361   5.9599   38.060   10.846  149.834   26.979  213.928   34.281 -64.09435 43.62437 
1 1 1   20   20   25 o  227.456   13.086   40.122   4.5367   43.904   6.6017   36.736   6.2450  236.505   18.381  216.003   19.085 20.50256 26.49726 
1 1 1   20   20   26 o  182.973   11.350   25.921   3.1632   27.830   3.5309   18.164   7.1186  189.440   12.243  146.811   32.534 42.62894 34.76110 
1 1 1   20   20   27 o   45.092   19.900  -0.7141   2.6875  -0.2545   3.0474  -2.3223   5.7010   50.054   21.654   62.675   28.227 -12.62094 35.57621 
1 1 1   20   20   28 o   56.132   21.780   1.6402   2.6764   3.5018   3.0247  -5.0757   5.7452   69.011   23.705   56.798   26.562 12.21249 35.60167 
1 1 1   20   20   29 o  184.551   11.610   26.409   3.2628   25.676   3.7680   28.609   6.5234  181.504   13.663  188.664   23.071 -7.160492 26.81295 
1 1 1   20   20   30 o  117.270   15.248   10.870   2.6723   14.698   3.7778   7.0375   3.7805  135.717   18.681   92.294   25.773 43.42291 31.83128 
1 1 1   20   20   31 o  207.468   10.221   33.200   3.2458   32.090   4.2355   34.779   5.0524  202.896   13.719  210.658   15.784 -7.762146 20.91284 
1 1 1   20   20   32 o  151.239   13.225   17.875   3.0306   17.149   4.0823   18.765   4.5233  146.642   18.606  153.111   19.762 -6.469772 27.14312 
1 1 1   20   20   33 o   70.957   22.950   3.9420   2.8427   1.7620   4.3998   5.5040   3.7244   66.978   27.278   82.698   26.219 -15.71914 37.83564 
1 1 1   20   20   34 o  218.889   10.518   37.018   3.5240   33.748   4.8878   40.558   5.0854  207.305   15.517  227.656   14.672 -20.35057 21.35506 
1 1 1   20   20   35 o  118.095   17.357   11.176   3.0438   10.308   4.6591   11.822   4.0204  110.247   27.657  119.770   22.763 -9.522163 35.81958 
1 1 1   20   20   36 f  156.681   13.951   19.276   3.3106   22.714   5.0230   16.636   4.4021  168.114   19.907  143.277   20.671 24.83665 28.69813 
1 1 1   20   20   37 o  200.430   14.170   31.504   4.3192   29.031   5.3092   36.345   7.4275  190.783   18.410  211.192   23.369 -20.40892 29.74920 
1 1 1   20   20   38 o   94.155   23.309   7.4412   3.3413   8.3210   5.1832   6.8156   4.3707   98.808   30.876   90.303   28.375 8.505211 41.93466 
1 1 1   20   20   39 o  255.547   10.531   50.606   4.1192   53.865   6.0556   47.799   5.6197  261.494   15.195  246.387   14.972 15.10664 21.33202 
1 1 1   20   20   40 o  283.089   12.221   62.450   5.2954   62.775   13.895   62.394   5.7277  265.981   34.978  282.522   13.245 -16.54077 37.40155 
1 1 1   20   20   41 o  179.822   14.178   25.549   3.8708   26.075   5.7202   25.104   5.2573  178.233   21.395  175.626   19.909 2.607132 29.22538 
1 1 1   20   20   42 o  162.614   15.042   21.047   3.7015   17.236   5.4579   24.293   5.0368  141.675   26.132  172.705   19.389 -31.02957 32.53898 
1 1 1   20   20   43 o  315.114   9.5869   77.051   4.6240   74.126   6.7571   79.627   6.3412  306.439   14.406  318.504   13.007 -12.06445 19.40946 
1 1 1   20   20   44 o  150.911   17.328   18.488   3.9300   16.512   5.9322   20.034   5.2465  135.609   29.425  154.028   22.955 -18.41829 37.31970 
1 1 1   20   20   45 o  134.715   19.728   15.117   3.9473   13.060   6.0887   16.608   5.1844  117.363   32.685  137.800   25.519 -20.43767 41.46713 
1 1 1   20   20   46 o  100.101   25.063   8.9399   3.8314   9.2104   5.6177   8.7046   5.2391   98.637   32.285   96.461   31.152 2.176201 44.86333 
1 1 1   20   20   47 o   39.773   19.275  -5.2007   3.6337  -8.2238   5.3560  -2.6228   4.9460   46.488   22.722   54.026   25.056 -7.537857 33.82431 
1 1 1   20   20   48 o   54.387   24.134  -0.2637   4.0063  -0.0187   5.2582  -0.6028   6.1856   61.817   27.528   64.597   29.219 -2.779621 40.14403 
1 1 1   20   21    0 o  817.221   14.374  513.214   17.968  513.214   17.968  513.214   17.968  817.221   14.374  817.221   14.374 0.000000 0.000000 
1 1 1   20   21    1 o   95.248   27.853   7.2478   4.3175   12.894   5.8666   0.5768   6.3769  125.551   30.768   75.548   31.965 50.00305 44.36683 
1 1 1   20   21    2 o  472.335   9.4888  171.218   6.8601  162.820   9.3980  180.797   10.037  459.981   13.348  484.672   13.530 -24.69101 19.00592 
1 1 1   20   21    3 o  297.229   11.723   67.901   5.3333   72.281   7.1948   62.559   7.9459  305.810   15.421  283.839   18.388 21.97040 23.99848 
1 1 1   20   21    4 o  405.598   14.849  126.774   9.2185   0.0000   0.0000  126.774   9.2185  ?   ?   405.598   14.849 0.000000 14.84888 
1 1 1   20   21    5 o  195.342   11.843   29.440   3.5243   29.411   4.0273   29.534   7.2825  195.001   13.578  192.958   25.264 2.043488 28.68168 
1 1 1   20   21    6 o  437.346   7.8711  146.675   5.2690  143.515   6.0780  156.232   10.570  432.453   9.1823  450.116   15.342 -17.66248 17.87985 
1 1 1   20   21    7 o  282.212   11.200   61.203   4.8379   56.752   5.7988   71.396   8.7754  271.086   14.023  303.069   19.013 -31.98312 23.62545 
1 1 1   20   21    8 o  105.178   24.019   8.9631   3.7819   9.9010   4.3826   6.2276   7.4844  110.322   26.321   98.926   36.877 11.39577 45.30695 
1 1 1   20   21    9 o  255.814   11.671   50.315   4.5698   51.321   5.3687   47.670   8.7070  257.784   13.655  246.243   23.382 11.54141 27.07700 
1 1 1   20   21   10 o  151.346   14.337   17.810   3.2817   17.771   3.5621   18.033   8.4393  150.949   15.644  147.183   37.388 3.766327 40.52895 
1 1 1   20   21   11 o   83.922   24.358   5.6209   3.3130   5.6209   3.3130   0.0000   0.0000   83.922   24.358  ?   ?  0.000000 24.35787 
1 1 1   20   21   12 o  510.533   9.0015  200.071   7.0341  200.071   7.0341   0.0000   0.0000  510.533   9.0015  ?   ?  0.000000 9.001544 
1 1 1   20   21   13 o  285.910   9.1611   62.760   4.0091   62.276   4.4180   65.015   9.5418  284.705   10.138  288.099   21.799 -3.394806 24.04154 
1 1 1   20   21   14 o  106.816   29.955   9.3020   5.0956   10.701   6.2723   6.5862   8.7390  114.521   33.595  103.806   39.592 10.71581 51.92451 
1 1 1   20   21   15 f   92.551   27.878   6.8400   4.2745   8.4919   4.8050   0.5741   9.3585  102.254   29.234   89.535   38.329 12.71883 48.20528 
1 1 1   20   21   16 o  244.673   13.548   46.307   5.0540   44.988   5.7685   50.663   10.485  240.705   15.744  251.916   27.645 -11.21060 31.81404 
1 1 1   20   21   17 o  233.135   14.104   42.107   5.0092   43.170   5.7245   38.635   10.349  235.671   15.963  217.867   31.986 17.80391 35.74815 
1 1 1   20   21   18 o   93.798   28.709   7.0344   4.5076   11.636   5.1183  -8.8685   9.5150  118.843   28.504   72.133   33.877 46.70959 44.27332 
1 1 1   20   21   19 o  269.785   13.296   56.172   5.4904   58.263   6.3619   50.070   10.868  273.996   15.230  249.356   29.017 24.63979 32.77062 
1 1 1   20   21   20 o  197.716   22.323   31.014   6.6373   34.230   8.4922   25.967   10.640  206.000   27.629  174.077   40.667 31.92227 49.16500 
1 1 1   20   21   21 o  228.136   15.521   40.510   5.3877   41.389   6.1340   37.543   11.270  230.078   17.550  212.077   36.005 18.00116 40.05474 
1 1 1   20   21   22 f  325.235   12.069   81.599   6.0083   79.346   6.8792   88.845   12.337  320.268   14.033  334.583   24.255 -14.31470 28.02189 
1 1 1   20   21   23 o  170.558   20.129   23.070   5.1537   23.446   5.8500   21.769   10.892  171.099   22.913  157.525   43.662 13.57370 49.30901 
1 1 1   20   21   24 o  247.087   9.4773   46.975   3.5843   48.436   3.7574   32.206   11.946  250.856   9.7857  192.337   41.774 58.51923 42.90464 
1 1 1   20   21   25 o  237.568   9.4104   43.430   3.4219   45.899   3.8361   33.816   7.5704  244.100   10.267  205.096   24.606 39.00342 26.66255 
1 1 1   20   21   26 o  197.168   10.428   30.041   3.1359   29.547   3.4706   32.235   7.3191  195.301   11.663  200.150   24.396 -4.848511 27.04022 
1 1 1   20   21   27 o  106.806   17.434   9.1225   2.7518   11.159   3.0945   1.4239   6.0161  118.327   17.624   74.857   31.324 43.46986 35.94128 
1 1 1   20   21   28 o  148.801   13.490   17.295   3.0391   18.319   3.4912   14.091   6.1753  152.791   15.127  128.894   31.555 23.89638 34.99322 
1 1 1   20   21   29 o  269.931   10.177   56.179   4.2048   55.437   4.4085   63.660   13.992  268.027   10.746  275.697   33.870 -7.669281 35.53425 
1 1 1   20   21   30 o  131.213   17.820   13.718   3.4864   13.516   3.6367   16.009   12.253  129.935   18.835  135.633   47.647 -5.697556 51.23433 
1 1 1   20   21   31 f  134.817   13.534   14.245   2.7551   12.338   3.6467   16.781   4.2054  123.638   19.949  144.758   19.474 -21.11975 27.87823 
1 1 1   20   21   32 o  153.506   12.363   18.374   2.8802   21.316   4.0465   15.352   4.1005  164.354   16.300  138.104   19.979 26.24942 25.78452 
1 1 1   20   21   33 o  269.784   9.2005   56.108   3.7993   63.704   5.8330   50.511   5.0070  286.336   13.309  254.780   12.881 31.55576 18.52173 
1 1 1   20   21   34 f  302.745   8.3313   70.582   3.8606   75.029   5.7036   66.822   5.2448  311.109   11.977  293.696   11.667 17.41351 16.72058 
1 1 1   20   21   35 o  226.653   9.9444   39.681   3.4499   43.290   5.0872   36.609   4.6943  235.208   14.197  216.206   14.265 19.00261 20.12594 
1 1 1   20   21   36 o  248.077   11.682   47.735   4.4359   49.114   5.4469   45.018   7.6442  250.436   14.269  236.430   21.354 14.00616 25.68225 
1 1 1   20   21   37 o  218.025   11.098   36.943   3.6913   35.026   5.4205   38.600   5.0407  210.134   16.998  221.519   14.954 -11.38495 22.64001 
1 1 1   20   21   38 o  217.596   17.957   37.772   5.9274   37.772   5.9274   0.0000   0.0000  217.596   17.957  ?   ?  0.000000 17.95713 
1 1 1   20   21   39 o  135.078   31.645   16.160   6.4281   17.722   13.131   15.668   7.3719  133.941   49.038  130.876   35.776 3.064514 60.70140 
1 1 1   20   21   40 o  120.357   20.074   11.929   3.5679   3.5676   4.9863   20.702   5.1073   75.543   29.612  158.522   21.612 -82.97827 36.65983 
1 1 1   20   21   41 o   82.833   24.922   5.8228   3.4176   1.2268   5.0259   9.7759   4.6612   66.860   28.338  105.339   28.304 -38.47906 40.05215 
1 1 1   20   21   42 o   70.185   25.386   3.6964   3.5036   10.118   5.2460  -1.4739   4.7072  106.013   30.617   56.740   25.593 49.27384 39.90463 
1 1 1   20   21   43 f  222.835   12.318   39.042   4.1851   26.802   6.0285   50.429   5.8146  178.912   22.513  251.661   15.166 -72.74937 27.14444 
1 1 1   20   21   44 o   41.811   19.879  -3.7524   3.4688  -3.2643   5.0331  -4.1940   4.7875   53.856   25.078   50.344   23.762 3.512321 34.54770 
1 1 1   20   21   45 f  104.048   24.935   9.6130   3.9193   15.304   5.9552   5.2647   5.2056  127.834   30.800   80.834   30.623 46.99957 43.43240 
1 1 1   20   21   46 o  108.999   22.110   10.316   3.5626   3.4622   4.9461   17.707   5.1359   72.321   29.112  141.895   24.535 -69.57345 38.07236 
1 1 1   20   21   47 o  109.996   24.895   10.894   4.0936   12.079   5.5248   9.4511   6.0956  111.495   31.164   97.930   33.651 13.56571 45.86483 
1 1 1   20   22    0 o  724.857   13.841  403.851   15.344  403.851   15.344  403.851   15.344  724.857   13.841  724.857   13.841 0.000000 0.000000 
1 1 1   20   22    1 o  407.686   14.370  128.092   8.9670   0.0000   0.0000  128.092   8.9670  ?   ?   407.686   14.370 0.000000 14.36988 
1 1 1   20   22    2 o   81.184   32.605   2.6898   6.1887   0.0000   0.0000   2.6898   6.1887  ?   ?    81.184   32.605 0.000000 32.60532 
1 1 1   20   22    3 o  238.701   13.268   44.002   4.8285   41.853   6.4421   46.757   7.2942  231.832   18.303  244.809   19.631 -12.97719 26.84025 
1 1 1   20   22    4 o  165.916   13.716   21.346   3.4520   21.845   3.9733   19.811   6.9709  167.526   15.678  155.986   30.289 11.53941 34.10568 
1 1 1   20   22    5 o  187.416   12.581   27.150   3.5881   28.436   4.0847   22.804   7.5090  191.598   14.026  167.576   30.395 24.02255 33.47462 
1 1 1   20   22    6 o  474.515   7.8619  172.698   5.7101  171.755   6.6531  175.338   11.126  473.027   9.1890  476.692   15.249 -3.664703 17.80373 
1 1 1   20   22    7 o  285.784   8.5134   62.668   3.7240   66.219   4.1332   47.350   8.5844  293.706   9.1939  245.359   23.131 48.34685 24.89111 
1 1 1   20   22    8 o  204.735   10.461   32.291   3.2673   32.863   3.5530   29.157   8.3164  206.436   11.287  190.151   29.532 16.28427 31.61534 
1 1 1   20   22    9 o  132.452   15.659   13.733   3.1133   11.945   3.3657   24.329   8.1940  122.839   18.472  172.477   32.223 -49.63811 37.14222 
1 1 1   20   22   10 o  189.768   14.231   27.926   4.1034   27.926   4.1034   0.0000   0.0000  189.768   14.231  ?   ?  0.000000 14.23071 
1 1 1   20   22   11 o  203.701   12.193   32.053   3.7840   31.616   4.2020   33.929   8.7033  202.061   13.667  205.575   28.420 -3.513977 31.53488 
1 1 1   20   22   12 o  216.209   10.122   35.923   3.3498   36.704   3.5898   30.663   9.3176  218.490   10.734  193.763   32.572 24.72710 34.29564 
1 1 1   20   22   13 o  187.219   11.408   27.068   3.2536   28.125   3.4743   19.529   9.2780  190.770   11.959  152.100   39.500 38.66995 41.27090 
1 1 1   20   22   14 o  353.962   10.537   96.341   5.7088  107.023   6.8009   70.860   10.504  372.823   11.918  300.071   23.046 72.75208 25.94478 
1 1 1   20   22   15 o  150.205   20.109   17.869   4.5072   17.075   5.1536   20.451   9.2948  145.773   23.928  155.383   39.110 -9.609314 45.84917 
1 1 1   20   22   16 o  485.268   9.5929  180.983   7.1253  177.384   8.3545  190.585   13.647  480.009   11.371  495.349   17.999 -15.34015 21.28987 
1 1 1   20   22   17 o  268.617   12.954   55.664   5.3261   58.145   6.1318   48.037   10.749  273.851   14.682  244.034   29.368 29.81686 32.83316 
1 1 1   20   22   18 o  192.678   17.353   29.058   5.0628   30.523   5.8225   24.517   10.251  196.931   19.576  169.274   40.168 27.65785 44.68409 
1 1 1   20   22   19 o  200.451   22.872   31.955   6.8918   31.717   8.8114   32.329   11.060  197.047   30.176  195.461   38.339 1.585648 48.79018 
1 1 1   20   22   20 o   91.239   29.913   6.4994   4.8219   10.939   5.4232 -10.2586   10.536  114.668   30.404   74.638   35.236 40.02965 46.54047 
1 1 1   20   22   21 o  302.987   12.692   70.895   5.8862   68.457   6.7018   79.123   12.311  297.267   14.729  314.757   25.780 -17.48990 29.69062 
1 1 1   20   22   22 o  313.585   13.006   76.006   6.2427   84.708   7.2541   51.161   12.257  330.703   14.331  248.985   32.973 81.71797 35.95288 
1 1 1   20   22   23 o  310.640   8.5916   74.182   4.0851   74.198   4.2975   74.032   13.158  310.599   9.0395  302.351   28.779 8.248077 30.16492 
1 1 1   20   22   24 o  199.456   10.615   30.746   3.2291   31.978   3.3475   14.240   12.254  203.391   10.791  132.231   47.522 71.15967 48.73201 
1 1 1   20   22   25 o  239.521   10.083   44.195   3.6964   44.195   3.6964   0.0000   0.0000  239.521   10.083  ?   ?  0.000000 10.08253 
1 1 1   20   22   26 o  169.731   12.424   22.392   3.2054   24.152   3.3243  -0.8842   12.091  176.313   12.397   95.245   42.112 81.06798 43.89882 
1 1 1   20   22   27 o   48.314   20.728  -0.0453   2.7476  -0.4180   2.8196   6.9740   12.236   47.388   20.663  111.915   45.525 -64.52723 49.99495 
1 1 1   20   22   28 o  354.372   8.8426   96.654   4.7963   96.598   5.0718   97.128   14.754  354.149   9.3563  345.495   28.143 8.654358 29.65800 
1 1 1   20   22   29 o   87.061   22.137   6.2414   2.9565   7.3657   3.3605   2.3909   6.2190   94.367   23.384   78.571   32.264 15.79651 39.84725 
1 1 1   20   22   30 o  103.868   20.353   8.7955   3.1200   9.6392   3.5562   5.9745   6.5025  108.337   22.192   92.234   34.375 16.10332 40.91565 
1 1 1   20   22   31 o  281.028   9.4104   60.884   4.0479   65.295   4.8096   50.169   7.4954  290.695   10.809  251.374   19.636 39.32104 22.41501 
1 1 1   20   22   32 o  343.714   8.0382   90.918   4.2289   88.561   6.2356   92.925   5.7544  338.064   12.051  346.701   10.844 -8.637299 16.21123 
1 1 1   20   22   33 o   65.570   22.416   3.2177   2.7041   3.1395   3.8289   3.2954   3.8194   69.937   26.316   70.675   26.344 -0.7378693 37.23619 
1 1 1   20   22   34 o  282.650   8.8227   61.589   3.8170   61.758   5.5332   61.435   5.2724  281.902   12.823  281.352   12.243 0.5493164 17.72938 
1 1 1   20   22   35 o  135.171   19.250   14.749   3.8703   17.262   4.6379   8.9859   7.0236  145.570   21.459  104.030   36.100 41.53996 41.99663 
1 1 1   20   22   36 f  118.976   17.698   11.406   3.1248   14.323   4.6814   9.0618   4.1965  131.083   24.225  103.173   26.450 27.90984 35.86678 
1 1 1   20   22   37 o   45.843   20.784  -1.5243   3.1512  -0.8819   4.6329  -2.0774   4.2988   58.682   26.001   53.064   24.142 5.618828 35.48075 
1 1 1   20   22   38 o  184.686   15.686   27.051   4.3922   25.781   9.9561   27.357   4.8942  165.798   39.748  184.962   17.495 -19.16479 43.42772 
1 1 1   20   22   39 o  176.481   14.267   24.611   3.8209   25.771   5.8035   23.724   5.0765  177.000   21.888  170.817   19.782 6.182999 29.50256 
1 1 1   20   22   40 f  171.365   14.211   23.248   3.6939   23.903   5.3286   22.643   5.1251  170.628   20.836  166.145   20.595 4.483612 29.29636 
1 1 1   20   22   41 o  121.137   19.482   12.102   3.4899   13.843   4.8160   10.177   5.0642  126.654   25.721  106.627   29.848 20.02733 39.40153 
1 1 1   20   22   42 o  260.905   13.857   53.827   5.5141   23.407   9.9499   67.310   6.6243  152.047   41.564  291.105   14.917 -139.0588 44.15982 
1 1 1   20   22   43 o  140.946   17.263   16.200   3.6463   17.241   5.3644   15.306   4.9715  140.449   25.908  132.434   25.450 8.014526 36.31698 
1 1 1   20   22   44 o   62.048   24.949   2.1393   3.6281   2.6016   5.5651   1.7976   4.7848   72.138   30.151   66.186   27.829 5.952438 41.03083 
1 1 1   20   22   45 o  126.921   20.759   13.698   3.8935   9.1397   5.2059   19.483   5.8652   98.246   30.982  147.196   27.029 -48.94962 41.11501 
1 1 1   20   22   46 o   76.792   26.367   5.1313   3.7420  -0.9460   4.9095   13.556   5.7804   57.770   26.090  118.266   31.405 -60.49555 40.82805 
1 1 1   20   23    1 o  446.220   13.433  153.409   9.1746  153.409   9.1746   0.0000   0.0000  446.220   13.433  ?   ?  0.000000 13.43284 
1 1 1   20   23    2 o  201.376   14.850   31.457   4.5448   37.298   5.9571   23.322   7.0301  218.738   17.951  170.059   27.982 48.68004 33.24452 
1 1 1   20   23    3 o  502.554   9.5793  193.956   7.3686  194.255   9.9736  193.596   10.934  502.221   12.974  501.041   14.257 1.179688 19.27724 
1 1 1   20   23    4 o  251.176   10.132   48.471   3.8953   46.685   4.4720   54.088   7.9304  246.327   11.861  263.176   19.833 -16.84814 23.10888 
1 1 1   20   23    5 o  144.872   15.770   16.401   3.4403   16.436   3.8743   16.273   7.4809  144.604   17.886  139.909   35.016 4.695419 39.31960 
1 1 1   20   23    6 o  136.232   16.911   14.574   3.4504   19.550   3.9012  -3.3054   7.3943  158.194   16.347   71.141   32.084 87.05267 36.00826 
1 1 1   20   23    7 o  123.263   17.001   11.974   3.1222   12.903   3.4164   7.2686   7.6895  127.834   17.956  102.913   37.550 24.92027 41.62191 
1 1 1   20   23    8 o  498.071   8.0907  190.354   6.1680  190.354   6.1680   0.0000   0.0000  498.071   8.0907  ?   ?  0.000000 8.090656 
1 1 1   20   23    9 o  579.179   8.0469  257.403   7.1336  257.403   7.1336   0.0000   0.0000  579.179   8.0469  ?   ?  0.000000 8.046902 
1 1 1   20   23   10 o  586.144   7.1140  263.492   6.3824  264.778   7.1918  258.724   13.848  587.408   7.9988  578.476   15.640 8.932129 17.56669 
1 1 1   20   23   11 o  172.216   16.516   23.166   4.3001   27.990   5.0929   11.190   8.0253  189.156   17.800  118.313   38.581 70.84281 42.48928 
1 1 1   20   23   12 o  304.698   9.6767   71.346   4.5130   72.080   5.1136   68.761   9.5979  306.090   10.915  296.067   21.322 10.02350 23.95354 
1 1 1   20   23   13 o   48.148   21.587  -1.4120   3.2925  -2.3201   3.5483   4.2145   8.8320   47.518   21.740   96.478   38.879 -48.96012 44.54438 
1 1 1   20   23   14 o   97.514   33.078   7.2382   5.8877   12.160   7.7770   0.6298   9.0118  121.631   37.791   87.741   37.588 33.88941 53.30124 
1 1 1   20   23   15 o  592.931   9.3015  270.185   8.4417  271.381   10.135  267.477   15.255  593.700   11.153  587.107   16.976 6.592590 20.31137 
1 1 1   20   23   16 f  210.167   15.573   34.395   4.9739   32.760   5.7076   39.557   10.141  204.372   18.444  220.306   30.926 -15.93375 36.00834 
1 1 1   20   23   17 o   85.911   33.093   4.2875   6.1441   6.0648   7.7440   1.2677   10.094   97.976   37.294   93.365   39.884 4.610741 54.60344 
1 1 1   20   23   18 o   89.762   33.689   5.2024   6.2672   4.4978   7.8931   6.4046   10.310   93.246   37.031  106.813   42.353 -13.56667 56.25923 
1 1 1   20   23   19 o  257.012   13.976   51.253   5.4774   57.128   6.3477   34.126   10.839  271.005   15.366  201.272   36.527 69.73221 39.62772 
1 1 1   20   23   20 o  391.074   11.042  117.877   6.6099  120.108   7.6019  110.963   13.382  394.340   12.595  374.147   23.487 20.19284 26.65094 
1 1 1   20   23   21 o  421.751   10.967  137.111   7.0798  138.701   8.2353  132.609   13.860  423.671   12.699  409.713   22.183 13.95844 25.56126 
1 1 1   20   23   22 o  158.868   22.409   20.264   5.2978   26.520   5.9444  -3.8870   11.680  182.343   21.726   88.870   40.179 93.47276 45.67666 
1 1 1   20   23   23 o  243.113   15.968   46.153   5.9089   44.974   6.6185   50.785   13.117  239.259   18.209  245.791   35.928 -6.532028 40.27887 
1 1 1   20   23   24 o   98.828   19.038   7.8955   2.7754   7.8955   2.7754   0.0000   0.0000   98.828   19.038  ?   ?  0.000000 19.03765 
1 1 1   20   23   25 o  376.978   8.2659  109.270   4.7695  106.088   5.0286  137.786   15.053  371.323   8.8476  415.750   23.754 -44.42758 25.34827 
1 1 1   20   23   26 o   61.144   22.114   2.5150   2.6585   3.1006   2.7162 -10.8421   12.973   65.155   22.459   83.216   39.228 -18.06106 45.20253 
1 1 1   20   23   27 f  237.819   9.6824   43.583   3.5245   40.727   3.9841   53.864   7.5590  229.603   11.337  261.195   19.038 -31.59198 22.15803 
1 1 1   20   23   28 o  207.066   10.620   33.181   3.3547   30.298   3.7668   44.236   7.3759  197.406   12.531  235.794   20.645 -38.38829 24.15044 
1 1 1   20   23   29 o  145.107   14.211   16.521   3.1157   19.025   3.5771   8.6528   6.3422  155.538   15.221  102.868   34.334 52.67017 37.55663 
1 1 1   20   23   30 o  179.618   12.313   25.115   3.3647   25.129   3.9047   25.074   6.6315  179.128   14.362  174.805   25.539 4.323990 29.29997 
1 1 1   20   23   31 o  184.977   13.046   26.697   3.6702   25.305   4.3375   30.208   6.8866  179.206   15.981  192.749   23.852 -13.54260 28.71044 
1 1 1   20   23   32 o  254.291   10.597   49.989   4.1245   47.045   4.8820   57.331   7.7092  245.733   13.026  268.830   18.855 -23.09750 22.91675 
1 1 1   20   23   33 o  130.771   18.789   13.766   3.6529   13.401   4.2626   14.777   7.0880  127.641   22.647  129.371   34.963 -1.730011 41.65718 
1 1 1   20   23   34 o  211.437   13.090   34.922   4.2155   36.499   5.0866   31.462   7.5327  215.300   15.540  195.027   25.873 20.27318 30.18078 
1 1 1   20   23   35 o  138.255   15.405   15.163   3.2046   12.288   4.7107   17.640   4.3722  120.380   26.301  147.641   19.851 -27.26186 32.95147 
1 1 1   20   23   36 o  156.833   14.435   19.414   3.4263   24.980   4.8661   13.941   4.8252  176.555   18.271  128.524   25.429 48.03096 31.31194 
1 1 1   20   23   37 o   84.415   28.167   5.8402   4.2686   18.051   9.2594   2.5447   4.8102  137.726   40.928   71.095   28.678 66.63084 49.97544 
1 1 1   20   23   38 o  206.565   11.491   33.311   3.6188   37.335   5.3333   29.879   4.9263  216.670   16.199  193.428   16.806 23.24150 23.34200 
1 1 1   20   23   39 o   85.361   23.881   6.2054   3.2428   12.059   4.7563   1.1211   4.4327  117.745   26.971   63.408   26.729 54.33677 37.97219 
1 1 1   20   23   40 o  158.250   14.834   19.938   3.5513   21.353   5.1058   18.613   4.9427  160.678   21.285  149.329   22.309 11.34869 30.83362 
1 1 1   20   23   41 o  115.108   20.762   11.095   3.5234   11.290   5.1484   10.924   4.8322  111.873   29.605  110.595   28.399 1.277428 41.02385 
1 1 1   20   23   42 o  224.209   13.692   39.868   4.6763   36.029   9.3473   41.150   5.4007  198.868   31.778  226.585   15.669 -27.71637 35.43076 
1 1 1   20   23   43 o  116.343   21.672   11.564   3.7173   8.7577   5.4981   13.928   5.0452   97.019   31.948  124.492   27.235 -27.47344 41.98111 
1 1 1   20   23   44 o  116.793   21.665   11.724   3.7305   13.990   5.0473   8.9970   5.5381  124.112   27.310   97.375   32.064 26.73772 42.11847 
1 1 1   20   23   45 o  172.587   14.442   23.999   3.7801   19.672   5.3136   28.432   5.3787  149.825   23.979  184.439   19.340 -34.61443 30.80680 
1 1 1   20   24    0 o  329.153   15.476   83.867   7.7579   83.867   7.7579   83.867   7.7579  329.153   15.476  329.153   15.476 0.000000 0.000000 
1 1 1   20   24    1 o  409.264   10.149  128.730   6.3579  124.986   8.6297  133.174   9.4029  402.504   14.007  415.288   14.792 -12.78427 20.37213 
1 1 1   20   24    2 o  680.356   13.681  356.982   14.247  356.982   14.247   0.0000   0.0000  680.356   13.681  ?   ?  0.000000 13.68089 
1 1 1   20   24    3 o  147.123   25.784   17.477   5.5947   17.477   5.5947   0.0000   0.0000  147.123   25.784  ?   ?  0.000000 25.78397 
1 1 1   20   24    4 o  147.216   24.654   17.430   5.3588   17.430   5.3588   0.0000   0.0000  147.216   24.654  ?   ?  0.000000 24.65357 
1 1 1   20   24    5 f  277.853   9.7487   59.321   4.1460   58.494   4.8198   61.674   8.1305  275.705   11.421  281.130   19.006 -5.425079 22.17397 
1 1 1   20   24    6 o  182.722   15.287   25.982   4.2362   25.982   4.2362   0.0000   0.0000  182.722   15.287  ?   ?  0.000000 15.28721 
1 1 1   20   24    7 o  508.260   8.2962  198.293   6.4541  198.293   6.4541   0.0000   0.0000  508.260   8.2962  ?   ?  0.000000 8.296214 
1 1 1   20   24    8 o  169.488   12.732   22.264   3.2789   20.374   3.6105   31.162   7.8325  161.734   14.747  197.102   26.645 -35.36905 30.45373 
1 1 1   20   24    9 o  182.130   12.069   25.663   3.3454   23.528   3.6482   36.950   8.3872  174.056   13.807  215.051   26.009 -40.99571 29.44651 
1 1 1   20   24   10 o  520.310   7.2894  207.696   5.8053  206.072   6.4704  214.396   13.146  518.114   8.1589  526.062   16.327 -7.948730 18.25179 
1 1 1   20   24   11 o  195.340   11.554   29.487   3.4391   31.237   3.7518   20.282   8.6050  200.953   12.256  155.042   36.810 45.91098 38.79669 
1 1 1   20   24   12 o  159.619   13.583   19.811   3.2870   18.755   3.5176   27.077   9.2286  155.001   15.015  180.327   34.695 -25.32564 37.80461 
1 1 1   20   24   13 o  262.958   9.5424   53.159   3.8407   52.937   4.1706   54.399   9.8534  262.299   10.388  261.526   24.916 0.7726135 26.99498 
1 1 1   20   24   14 o  303.570   15.144   71.358   7.0369   71.999   9.4940   70.577   10.483  302.779   20.608  298.791   23.101 3.988617 30.95708 
1 1 1   20   24   15 o   90.987   33.071   5.7551   5.9563   1.9218   7.5865   11.915   9.6171   84.404   35.234  122.382   42.256 -37.97741 55.01830 
1 1 1   20   24   16 o   65.807   29.302  -1.7895   5.9559  -3.5623   7.5110   1.2132   9.7751   70.625   32.047   91.772   39.227 -21.14706 50.65341 
1 1 1   20   24   17 o  102.021   34.328   8.1569   6.3404   4.9759   7.9911   13.562   10.417   94.942   37.401  128.657   43.997 -33.71545 57.74554 
1 1 1   20   24   18 o  259.752   13.895   52.360   5.5045   53.212   6.2890   49.571   11.381  261.337   15.796  246.174   30.885 15.16331 34.69051 
1 1 1   20   24   19 o  110.016   28.773   10.071   4.9003   11.839   5.5447   3.7637   10.473  118.924   30.357  100.018   41.545 18.90616 51.45433 
1 1 1   20   24   20 o  381.679   11.509  112.394   6.7234  122.954   7.8128   82.248   13.200  398.828   12.798  319.647   27.240 79.18106 30.09640 
1 1 1   20   24   21 o  223.026   16.307   38.898   5.5282   38.248   6.2356   41.289   11.950  220.420   18.658  220.939   36.618 -0.5189056 41.09734 
1 1 1   20   24   22 o  170.055   21.862   23.155   5.5587   20.868   6.1789   32.865   12.730  159.800   26.168  192.225   44.191 -32.42566 51.35728 
1 1 1   20   24   23 o  680.099   11.865  357.344   12.351  357.344   12.351   0.0000   0.0000  680.099   11.865  ?   ?  0.000000 11.86487 
1 1 1   20   24   24 o  287.913   14.336   64.345   6.3176   61.245   7.1107   75.961   13.765  279.731   16.683  304.541   29.916 -24.81058 34.25384 
1 1 1   20   24   25 o  196.933   10.997   30.030   3.3016   31.288   3.4166   12.282   12.831  200.997   11.149  126.257   48.018 74.74063 49.29488 
1 1 1   20   24   26 o  508.729   7.9746  199.008   6.2097  196.460   6.6236  217.502   17.846  505.280   8.5642  523.501   22.272 -18.22141 23.86186 
1 1 1   20   24   27 o  328.428   9.5874   83.137   4.8196   83.137   4.8196   0.0000   0.0000  328.428   9.5874  ?   ?  0.000000 9.587358 
1 1 1   20   24   28 o  213.947   10.495   35.342   3.4368   38.493   3.9756   26.024   6.8373  222.745   11.702  178.133   25.830 44.61201 28.35719 
1 1 1   20   24   29 o  287.336   9.1639   63.631   4.0303   62.096   4.6894   67.970   7.8838  283.461   10.808  293.731   17.617 -10.27008 20.66812 
1 1 1   20   24   30 o  136.606   16.867   14.838   3.4520   15.407   4.0477   13.320   6.6106  138.340   19.670  123.705   33.905 14.63440 39.19728 
1 1 1   20   24   31 o  253.695   10.450   49.744   4.0577   52.754   4.8585   42.805   7.3778  260.801   12.171  231.037   21.096 29.76447 24.35499 
1 1 1   20   24   32 o  238.862   11.667   44.228   4.2654   50.823   5.2450   31.347   7.3299  255.175   13.476  195.339   25.096 59.83604 28.48537 
1 1 1   20   24   33 o   73.794   25.585   4.1323   3.5275   1.0886   4.0314   14.076   7.2868   61.784   25.729  125.588   36.030 -63.80418 44.27339 
1 1 1   20   24   34 f  166.034   12.377   21.552   3.1229   22.404   4.3184   20.618   4.5215  167.752   17.056  160.200   18.797 7.551727 25.38124 
1 1 1   20   24   35 o  158.462   13.169   19.720   3.1652   21.023   4.3986   18.322   4.5581  161.892   18.059  150.075   20.369 11.81706 27.22182 
1 1 1   20   24   36 o  155.110   39.679   22.648   9.4585   22.648   9.4585   0.0000   0.0000  155.110   39.679  ?   ?  0.000000 39.67909 
1 1 1   20   24   37 o  365.261   11.067  103.735   6.1872   90.609   10.860  110.044   7.5285  333.728   21.373  375.013   13.116 -41.28513 25.07612 
1 1 1   20   24   38 o  148.859   15.559   17.694   3.4927   18.184   4.9884   17.222   4.8919  147.587   22.818  143.434   23.064 4.152878 32.44380 
1 1 1   20   24   39 o  212.671   14.418   35.813   4.6655   32.943   10.000   36.611   5.2747  188.720   35.932  214.101   16.216 -25.38098 39.42122 
1 1 1   20   24   40 o  232.467   11.016   42.153   3.9196   50.038   5.7530   35.322   5.3546  250.836   15.054  209.597   16.833 41.23834 22.58231 
1 1 1   20   24   41 o  238.800   14.323   45.351   5.2112   29.936   9.0758   52.933   6.3651  178.542   34.459  256.661   16.286 -78.12001 38.11368 
1 1 1   20   24   42 o   55.764   23.359   1.0329   3.3506  -0.2794   4.3423   2.9641   5.2675   57.129   25.249   72.367   29.702 -15.23827 38.98408 
1 1 1   20   24   43 o   80.704   26.892   5.7140   3.8914   9.2912   5.6560   2.4989   5.3622   98.757   32.398   70.630   29.565 28.12736 43.86031 
1 1 1   20   24   44 o   82.672   24.779   6.1008   3.3832   2.9825   4.7254   9.3806   4.8462   69.548   28.291   99.634   29.610 -30.08637 40.95271 
1 1 1   20   25    0 o  395.502   15.077  120.845   9.0971  120.845   9.0971  120.845   9.0971  395.502   15.077  395.502   15.077 0.000000 0.000000 
1 1 1   20   25    1 o  324.788   11.586   81.222   5.7599   83.368   7.9953   78.907   8.3049  328.171   15.917  318.554   17.095 9.616760 23.35813 
1 1 1   20   25    2 o   90.010   28.199   6.4016   4.3203   9.0605   5.8795   3.2809   6.3695  106.015   32.845   83.549   33.239 22.46606 46.72938 
1 1 1   20   25    3 o  186.398   16.548   27.127   4.6722   28.677   6.2597   25.176   7.0207  190.333   21.885  176.702   26.799 13.63152 34.59923 
1 1 1   20   25    4 o  418.117   13.766  134.962   8.8102  134.962   8.8102   0.0000   0.0000  418.117   13.766  ?   ?  0.000000 13.76636 
1 1 1   20   25    5 o   78.449   26.901   4.5119   3.8945   4.5119   3.8945   0.0000   0.0000   78.449   26.901  ?   ?  0.000000 26.90113 
1 1 1   20   25    6 o  145.722   19.176   16.801   4.1733   16.801   4.1733   0.0000   0.0000  145.722   19.176  ?   ?  0.000000 19.17628 
1 1 1   20   25    7 o  390.709   7.9186  117.178   4.7356  117.630   5.3290  115.480   10.326  391.309   8.8973  385.642   17.494 5.666840 19.62624 
1 1 1   20   25    8 o  161.492   13.647   20.279   3.3419   23.439   3.7085   6.6258   7.7086  173.618   14.076  100.038   37.399 73.57970 39.95996 
1 1 1   20   25    9 o  369.414   9.0477  104.864   5.1159  100.263   5.8295  120.280   10.671  360.957   10.551  393.386   17.723 -32.42957 20.62575 
1 1 1   20   25   10 o  150.003   14.876   17.578   3.3704   15.463   3.6532   29.675   8.7364  140.044   17.419  190.204   31.082 -50.16029 35.63042 
1 1 1   20   25   11 o  527.168   7.5482  213.314   6.0906  211.549   6.8053  220.419   13.653  524.781   8.4723  532.804   16.742 -8.022705 18.76327 
1 1 1   20   25   12 o  308.277   9.0769   73.050   4.2830   68.634   4.6483   97.881   11.022  298.648   10.169  353.152   20.479 -54.50412 22.86469 
1 1 1   20   25   13 o  434.798   7.9471  145.180   5.2889  144.321   5.8424  149.080   12.449  433.340   8.8083  437.252   18.601 -3.911896 20.58075 
1 1 1   20   25   14 o  445.805   8.1312  152.663   5.5484  155.856   6.2017  139.856   12.420  450.257   8.9987  423.152   19.176 27.10495 21.18209 
1 1 1   20   25   15 o  263.008   17.699   54.118   7.0837   57.260   9.4652   50.117   10.680  268.491   23.262  248.760   28.568 19.73141 36.84045 
1 1 1   20   25   16 o  134.877   25.016   14.844   4.9742   17.890   5.6068   3.5858   10.780  148.180   25.649  100.736   42.022 47.44397 49.23117 
1 1 1   20   25   17 o  128.315   33.165   13.915   6.5609   6.5175   8.0871   28.159   11.222  100.030   38.103  179.662   41.623 -79.63136 56.42944 
1 1 1   20   25   18 o  154.047   30.815   19.794   7.0121   22.880   8.8203   14.494   11.559  163.726   36.162  132.389   46.291 31.33748 58.74151 
1 1 1   20   25   19 o  229.316   21.871   41.792   7.5836   39.086   9.6650   46.126   12.232  218.374   29.685  234.594   35.149 -16.22018 46.00694 
1 1 1   20   25   20 o  186.010   19.197   27.378   5.3871   23.441   6.0344   42.832   11.956  170.460   23.775  225.260   35.880 -54.79976 43.04261 
1 1 1   20   25   21 o  299.977   15.214   70.104   6.9629   70.104   6.9629   0.0000   0.0000  299.977   15.214  ?   ?  0.000000 15.21441 
1 1 1   20   25   22 o  398.925   13.326  123.277   8.1371  123.277   8.1371   0.0000   0.0000  398.925   13.326  ?   ?  0.000000 13.32635 
1 1 1   20   25   23 o  169.425   22.396   23.097   5.6656   22.278   6.2966   26.578   12.985  165.090   25.759  169.895   47.879 -4.805450 54.36860 
1 1 1   20   25   24 f  219.024   18.227   37.847   6.0551   34.684   6.7379   51.124   13.804  208.417   21.427  243.692   38.270 -35.27571 43.85949 
1 1 1   20   25   25 o  183.491   21.095   26.946   5.8168   21.509   6.4062   52.479   13.883  161.479   26.863  246.799   37.968 -85.31940 46.51024 
1 1 1   20   25   26 o   72.628   30.388   1.4283   5.6616   2.5807   6.2766  -3.6028   13.115   79.323   32.475   93.246   42.325 -13.92329 53.34781 
1 1 1   20   25   27 o  132.465   16.534   13.926   3.2794   13.272   3.3842   23.990   13.276  128.967   17.604  159.237   49.360 -30.27039 52.40489 
1 1 1   20   25   28 o  279.739   9.2446   60.322   3.9583   64.269   4.5964   48.994   7.7872  288.468   10.410  247.779   20.723 40.68869 23.19072 
1 1 1   20   25   29 o  113.685   21.384   10.587   3.5844   12.997   4.1738   3.8133   6.9961  125.885   22.487   85.822   34.597 40.06337 41.26233 
1 1 1   20   25   30 o  277.038   11.417   59.438   4.8411   65.731   6.0582   48.321   8.0525  290.611   13.620  245.229   21.676 45.38191 25.59998 
1 1 1   20   25   31 o  146.638   16.459   17.078   3.6304   15.210   4.2287   22.313   7.0794  136.783   20.858  162.081   29.628 -25.29895 36.23336 
1 1 1   20   25   32 o  177.220   13.788   24.638   3.7107   25.460   4.2706   22.104   7.4959  179.531   15.699  159.830   31.760 19.70158 35.42802 
1 1 1   20   25   33 o  218.036   11.744   37.023   3.9048   39.661   4.5839   30.044   7.4552  225.128   13.362  189.783   26.378 35.34494 29.56935 
1 1 1   20   25   34 o  171.574   15.058   23.275   3.9144   23.583   4.5734   22.433   7.5695  171.700   17.653  159.987   32.028 11.71280 36.57128 
1 1 1   20   25   35 o   84.286   27.717   5.8665   4.1386   5.5588   8.6282   5.9584   4.7167   94.198   38.263   85.763   29.593 8.434715 48.37198 
1 1 1   20   25   36 o  168.352   12.913   22.285   3.3021   18.522   4.4898   26.719   4.8737  150.588   19.972  182.406   17.678 -31.81859 26.67168 
1 1 1   20   25   37 o  203.693   11.512   32.432   3.5745   34.053   5.0434   30.796   5.0669  206.726   16.065  196.042   17.056 10.68410 23.43055 
1 1 1   20   25   38 o   77.896   24.002   5.1017   3.1446   1.4465   4.5471   8.4522   4.3535   64.979   27.215   98.049   27.755 -33.06949 38.87169 
1 1 1   20   25   39 o   83.236   24.047   5.9563   3.2356   8.5770   4.8233   3.8121   4.3629   97.874   29.643   73.433   27.983 24.44112 40.76484 
1 1 1   20   25   40 o   53.470   23.007   0.3181   3.4030   0.0321   4.8528   0.5948   4.7734   61.305   26.908   62.609   27.093 -1.303738 38.18483 
1 1 1   20   25   41 o  164.478   14.993   21.747   3.7330   25.387   5.1748   17.797   5.3905  174.925   19.668  142.325   25.690 32.60022 32.35429 
1 1 1   20   25   42 o  250.699   18.533   51.717   7.0612   0.0000   0.0000   51.717   7.0612  ?   ?   250.699   18.533 0.000000 18.53291 
1 1 1   20   25   43 o   58.693   23.642   1.9002   3.2643   1.6494   4.5002   2.1788   4.7421   63.755   26.907   66.700   27.852 -2.945393 38.72575 
1 1 1   20   26    0 o  325.322   16.949   82.229   8.3874   82.229   8.3874   82.229   8.3874  325.322   16.949  325.322   16.949 0.000000 0.000000 
1 1 1   20   26    1 o   81.933   32.441   3.2950   6.0408   3.2950   6.0408   0.0000   0.0000   81.933   32.441  ?   ?  0.000000 32.44109 
1 1 1   20   26    2 o  258.418   18.788   52.272   7.3807   52.272   7.3807   0.0000   0.0000  258.418   18.788  ?   ?  0.000000 18.78827 
1 1 1   20   26    3 f  493.610   14.040  188.326   10.607  188.326   10.607   0.0000   0.0000  493.610   14.040  ?   ?  0.000000 14.03953 
1 1 1   20   26    4 o   74.871   28.499   3.2864   4.5220   2.9543   6.0516   3.7063   6.8046   80.732   32.306   86.608   34.387 -5.876251 47.18236 
1 1 1   20   26    5 o  517.682   10.137  206.184   8.0326  201.031   10.588  213.173   12.330  510.115   13.560  524.600   15.355 -14.48477 20.48567 
1 1 1   20   26    6 o  448.402   8.5753  154.466   5.8856  159.102   6.9395  142.586   11.109  454.776   9.9692  428.449   16.940 26.32745 19.65587 
1 1 1   20   26    7 o  335.901   9.5275   86.763   4.8985   86.763   4.8985   0.0000   0.0000  335.901   9.5275  ?   ?  0.000000 9.527505 
1 1 1   20   26    8 o  591.318   8.4989  268.631   7.6922  268.631   7.6922   0.0000   0.0000  591.318   8.4989  ?   ?  0.000000 8.498899 
1 1 1   20   26    9 o  359.478   8.5455   99.290   4.7020  100.749   5.1719   92.337   11.290  361.971   9.3348  342.378   21.655 19.59302 23.58087 
1 1 1   20   26   10 o  149.302   15.476   17.463   3.4853   16.899   3.8059   20.395   8.6763  146.419   17.317  154.608   37.130 -8.188248 40.97025 
1 1 1   20   26   11 o  209.280   11.661   33.878   3.7204   32.766   4.0853   39.284   9.0060  205.528   13.054  220.544   27.259 -15.01578 30.22339 
1 1 1   20   26   12 o  213.337   11.546   35.197   3.7562   36.047   4.0530   30.023   10.001  215.750   12.324  188.663   35.944 27.08665 37.99822 
1 1 1   20   26   13 o  356.257   10.299   97.733   5.6158   93.406   6.3477  113.315   12.047  347.920   11.920  379.505   20.819 -31.58456 23.98962 
1 1 1   20   26   14 o  111.228   24.958   10.178   4.1447   8.9687   4.5362   16.291   10.199  104.064   27.905  137.658   43.360 -33.59435 51.56355 
1 1 1   20   26   15 o  308.395   12.327   73.454   5.8189   74.050   6.7035   71.632   11.720  309.194   14.164  298.983   25.866 10.21109 29.49014 
1 1 1   20   26   16 o  266.466   14.083   55.153   5.7235   51.375   6.5099   68.018   12.013  256.387   16.679  290.391   27.348 -34.00424 32.03328 
1 1 1   20   26   17 o  233.668   15.499   42.600   5.5118   40.668   6.1382   50.644   12.525  227.606   17.760  246.515   34.108 -18.90900 38.45484 
1 1 1   20   26   18 o  446.182   10.947  153.547   7.4762  157.779   8.7227  141.833   14.512  451.715   12.616  423.038   22.493 28.67639 25.78965 
1 1 1   20   26   19 o  115.342   29.775   11.176   5.2927   11.339   5.8607   10.456   12.324  115.903   31.989  121.240   46.821 -5.337517 56.70517 
1 1 1   20   26   20 o  113.995   41.149   10.108   9.1988   10.108   9.1988   0.0000   0.0000  113.995   41.149  ?   ?  0.000000 41.14926 
1 1 1   20   26   21 o  332.507   22.647   88.036   11.458   88.036   11.458   0.0000   0.0000  332.507   22.647  ?   ?  0.000000 22.64746 
1 1 1   20   26   22 o   96.726   36.896   6.2355   7.5894   4.7387   9.2542   9.3099   13.263   97.377   39.599  119.493   47.824 -22.11662 62.09023 
1 1 1   20   26   23 o  266.149   15.190   55.318   6.1622   51.425   6.7764   73.919   14.813  255.777   17.412  297.435   33.099 -41.65729 37.39960 
1 1 1   20   26   24 o  141.342   28.143   16.709   5.8744   18.171   6.5268   10.475   13.480  146.751   30.068  122.007   48.413 24.74380 56.98999 
1 1 1   20   26   25 o  384.520   12.658  114.614   7.4497  112.217   8.4683  122.821   15.667  379.692   14.571  389.043   26.467 -9.351410 30.21274 
1 1 1   20   26   26 o  252.113   18.297   50.236   7.0127   47.746   7.9456   59.011   14.916  244.309   21.466  260.257   38.616 -15.94777 44.18090 
1 1 1   20   26   27 o  151.561   34.366   19.991   7.7887   23.397   9.4430   12.743   13.776  161.969   38.631  126.749   49.347 35.21996 62.66973 
1 1 1   20   26   28 o  142.063   18.803   16.180   3.9882   15.435   4.1684   24.244   13.715  138.190   20.313  158.266   50.328 -20.07689 54.27274 
1 1 1   20   26   29 o  142.188   16.213   16.039   3.4654   18.309   3.9216   7.9534   7.4023  151.710   17.192  101.055   36.846 50.65473 40.65959 
1 1 1   20   26   30 o  154.072   14.884   18.721   3.4663   18.325   3.9025   20.202   7.5455  151.706   17.105  152.007   33.347 -0.3011169 37.47802 
1 1 1   20   26   31 o  137.730   16.811   15.140   3.4705   17.011   3.9656   9.0155   7.1731  145.620   18.188  104.074   36.462 41.54616 40.74641 
1 1 1   20   26   32 o  161.172   15.100   20.540   3.6818   22.946   4.2717   13.588   7.2609  169.860   16.644  122.772   36.183 47.08824 39.82720 
1 1 1   20   26   33 o  202.770   18.005   32.876   5.5299   38.430   9.0416   29.557   6.9896  212.958   28.450  188.629   24.811 24.32892 37.74871 
1 1 1   20   26   34 o  259.560   18.312   53.945   7.2286   59.515   9.6557   46.841   10.903  268.781   23.713  232.144   31.498 36.63683 39.42632 
1 1 1   20   26   35 o  240.900   13.802   45.666   5.0680   45.666   5.0680   0.0000   0.0000  240.900   13.802  ?   ?  0.000000 13.80189 
1 1 1   20   26   36 o  322.000   9.8568   80.423   4.8580   90.420   6.0577   62.405   8.1323  340.543   11.622  277.935   19.235 62.60883 22.47280 
1 1 1   20   26   37 o   66.158   24.105   3.1861   3.1674   4.1645   4.3390   2.0701   4.6343   75.301   28.076   67.674   27.828 7.626839 39.53066 
1 1 1   20   26   38 o  180.195   13.337   25.693   3.6524   29.364   5.0477   21.660   5.2915  190.518   17.505  160.866   22.072 29.65225 28.17143 
1 1 1   20   26   39 o  115.024   20.857   11.166   3.5369   11.346   4.8989   10.970   5.1119  111.918   28.516  109.399   29.745 2.518448 41.20567 
1 1 1   20   26   40 o  120.303   19.077   12.073   3.3956   15.431   4.9301   9.0423   4.6835  132.607   25.211   99.256   29.005 33.35088 38.43021 
1 1 1   20   26   41 o   69.794   25.206   3.8771   3.4522   8.9939   5.2759   0.0461   4.5651   97.696   31.231   59.105   26.017 38.59092 40.64762 
1 1 1   20   26   42 o  129.936   17.530   13.978   3.3974   13.929   4.9852   14.021   4.6425  123.640   27.091  125.507   25.044 -1.867142 36.89358 
1 1 1   20   27    1 o  555.050   14.488  238.490   12.309   0.0000   0.0000  238.490   12.309  ?   ?   555.050   14.488 0.000000 14.48786 
1 1 1   20   27    2 o   68.945   30.698  -1.8908   6.5360   0.0000   0.0000  -1.8908   6.5360  ?   ?    68.945   30.698 0.000000 30.69785 
1 1 1   20   27    3 o  194.679   17.523   29.721   5.1655   28.536   6.9948   31.143   7.6607  188.461   24.855  196.548   26.111 -8.086517 36.04879 
1 1 1   20   27    4 o  199.279   16.220   31.029   4.9045   31.839   6.4978   29.957   7.4769  200.351   21.526  192.732   26.010 7.618988 33.76232 
1 1 1   20   27    5 o  229.802   14.803   41.072   5.1791   44.319   6.6850   36.197   8.1909  237.704   18.520  212.219   25.743 25.48515 31.71248 
1 1 1   20   27    6 o  104.786   28.529   9.0789   4.6989   8.0798   5.8221   10.946   7.9583  100.747   32.862  116.165   38.446 -15.41786 50.57641 
1 1 1   20   27    7 o  160.572   14.177   20.107   3.4485   18.496   3.7932   27.783   8.2794  153.460   16.403  183.678   30.520 -30.21837 34.64898 
1 1 1   20   27    8 o  368.830   8.4398  104.535   4.7646  101.281   5.3348  117.363   10.592  362.826   9.6062  388.082   17.831 -25.25644 20.25406 
1 1 1   20   27    9 o  337.714   9.7830   87.768   5.0570   87.768   5.0570   0.0000   0.0000  337.714   9.7830  ?   ?  0.000000 9.782977 
1 1 1   20   27   10 o  198.952   13.623   30.761   4.1236   30.761   4.1236   0.0000   0.0000  198.952   13.623  ?   ?  0.000000 13.62336 
1 1 1   20   27   11 o  171.409   15.600   22.990   4.0480   22.990   4.0480   0.0000   0.0000  171.409   15.600  ?   ?  0.000000 15.59982 
1 1 1   20   27   12 o  176.299   16.934   24.408   4.5133   26.416   5.0818   16.913   9.8205  183.065   18.384  139.733   42.293 43.33145 46.11605 
1 1 1   20   27   13 o  213.961   12.422   35.485   4.0507   35.982   4.3874   32.611   10.544  215.245   13.383  196.063   36.477 19.18181 38.85474 
1 1 1   20   27   14 o  147.628   17.285   17.210   3.8319   17.981   4.0970   11.830   10.828  150.712   18.124  122.897   44.601 27.81561 48.14278 
1 1 1   20   27   15 o  337.445   12.163   87.976   6.2821   83.174   7.1292  104.657   13.287  327.539   14.220  362.375   24.092 -34.83588 27.97600 
1 1 1   20   27   16 o  208.967   17.278   34.292   5.4767   36.905   6.2276   25.374   11.505  216.270   19.006  168.529   44.094 47.74141 48.01527 
1 1 1   20   27   17 o  103.011   30.550   8.8057   5.1627   5.5482   5.7708   21.863   11.554   88.880   32.514  155.966   45.551 -67.08640 55.96440 
1 1 1   20   27   18 o  216.227   17.587   36.768   5.7703   39.759   6.5173   25.920   12.412  224.352   19.163  168.749   46.545 55.60292 50.33499 
1 1 1   20   27   19 f  204.305   20.176   33.153   6.2268   33.153   6.2268   0.0000   0.0000  204.305   20.176  ?   ?  0.000000 20.17556 
1 1 1   20   27   20 o  148.498   24.484   18.009   5.3711   17.873   5.9415   18.616   12.563  146.818   27.449  144.168   48.322 2.649399 55.57356 
1 1 1   20   27   21 o   93.223   31.811   6.8085   5.4455   9.4202   6.1343  -2.9016   11.828  106.356   33.641   90.112   40.614 16.24387 52.73764 
1 1 1   20   27   22 o  412.550   15.626  132.711   9.8670  124.892   12.838  143.997   15.423  396.619   21.224  423.959   23.865 -27.34000 31.93712 
1 1 1   20   27   23 o   91.543   41.788  -4.4376   13.016   0.0000   0.0000  -4.4376   13.016  ?   ?    91.543   41.788 0.000000 41.78773 
1 1 1   20   27   24 o  217.028   41.334   41.947   13.229   0.0000   0.0000   41.947   13.229  ?   ?   217.028   41.334 0.000000 41.33393 
1 1 1   20   27   25 o  204.908   25.792   34.376   7.9101   23.915   9.7172   54.926   13.619  163.554   39.304  252.474   36.284 -88.92061 53.49189 
1 1 1   20   27   26 o   95.252   33.952   7.0167   6.2426   9.7054   7.0556  -2.6738   13.395  107.737   36.212   94.842   42.939 12.89572 56.17048 
1 1 1   20   27   27 o  132.346   39.943   15.771   8.7685   14.230   10.966   18.503   14.600  127.138   45.035  141.277   51.711 -14.13840 68.57259 
1 1 1   20   27   28 o  160.041   37.445   22.932   9.0099   23.905   11.537   21.411   14.425  158.762   45.267  148.316   51.721 10.44614 68.73249 
1 1 1   20   27   29 o  171.969   14.284   23.244   3.7259   24.358   3.8527   7.1415   14.644  176.024   14.426  113.974   48.343 62.05071 50.44990 
1 1 1   20   27   30 o   35.497   17.217  -4.6996   2.9149  -5.1955   3.2109  -2.3756   6.9510   37.155   18.032   68.345   30.938 -31.19038 35.80986 
1 1 1   20   27   31 o   90.852   24.339   6.9703   3.4528   6.9444   3.9444   7.0551   7.1413   90.592   26.660   96.004   35.976 -5.411911 44.77709 
1 1 1   20   27   32 o   75.633   30.089   3.2570   5.2195   3.6364   8.6846   3.0425   6.5306   89.362   37.528   80.115   32.999 9.247009 49.97319 
1 1 1   20   27   33 o  133.059   19.505   14.454   3.8546   16.236   4.2724   6.6596   8.9368  140.753   20.428   97.788   39.214 42.96566 44.21557 
1 1 1   20   27   34 o  228.194   12.137   40.743   4.2240   48.865   5.1588   24.218   7.3582  249.298   13.570  166.451   29.984 82.84653 32.91188 
1 1 1   20   27   35 o  136.643   18.215   15.177   3.7148   17.234   4.3817   9.9198   7.0051  144.754   20.337  105.067   36.076 39.68711 41.41339 
1 1 1   20   27   36 o   53.905   23.768  -0.4742   3.8256  -1.7324   4.1616   6.3876   9.7185   52.420   23.812   96.882   40.113 -44.46191 46.64863 
1 1 1   20   27   37 o  126.579   18.459   13.173   3.4711   15.851   4.7896   10.209   5.0377  136.182   23.847  106.046   29.800 30.13564 38.16698 
1 1 1   20   27   38 o   77.789   24.326   5.1872   3.2166   6.7135   4.5713   3.6904   4.5270   87.339   29.149   72.881   28.312 14.45753 40.63567 
1 1 1   20   27   39 o   43.300   19.941  -1.8251   3.0536  -3.8413   4.1505   0.5542   4.5087   46.592   22.033   60.663   26.291 -14.07068 34.30222 
1 1 1   20   27   40 o   72.524   24.948   4.3990   3.3508   0.3835   4.9577   7.7762   4.5465   62.183   27.248   91.996   28.946 -29.81376 39.75316 
1 1 1   20   28    0 o  399.220   15.604  123.386   9.5017  123.386   9.5017  123.386   9.5017  399.220   15.604  399.220   15.604 0.000000 0.000000 
1 1 1   20   28    1 o  233.105   14.537   42.252   5.1608   41.082   7.0723   43.585   7.5480  228.081   20.476  234.708   21.240 -6.627060 29.50318 
1 1 1   20   28    2 f  497.245   10.283  190.389   7.8267  174.491   10.395  211.196   11.892  474.677   14.308  521.968   14.885 -47.29169 20.64649 
1 1 1   20   28    3 o  183.035   18.090   26.367   5.0017   23.510   6.4318   30.738   7.9555  170.434   25.433  194.515   27.486 -24.08054 37.44811 
1 1 1   20   28    4 o  375.541   17.331  109.833   9.9623   0.0000   0.0000  109.833   9.9623  ?   ?   375.541   17.331 0.000000 17.33134 
1 1 1   20   28    5 o  170.377   32.224   24.216   8.0957   0.0000   0.0000   24.216   8.0957  ?   ?   170.377   32.224 0.000000 32.22413 
1 1 1   20   28    6 o  132.449   37.663   14.993   7.9976   0.0000   0.0000   14.993   7.9976  ?   ?   132.449   37.663 0.000000 37.66305 
1 1 1   20   28    7 o  421.769   9.7839  136.924   6.3162  128.265   7.5013  158.021   11.709  407.620   12.023  450.511   16.980 -42.89050 20.80536 
1 1 1   20   28    8 o  134.935   22.556   14.715   4.4941   12.963   5.3404   18.964   8.3195  124.783   28.576  148.668   36.766 -23.88449 46.56479 
1 1 1   20   28    9 o  101.158   27.508   8.4700   4.3717   8.6376   5.0943   8.0017   8.5148  102.336   30.346  106.022   39.371 -3.686317 49.70861 
1 1 1   20   28   10 o  199.498   21.277   31.645   6.3967   30.032   8.6409   33.599   9.5147  190.582   30.661  201.179   31.968 -10.59718 44.29541 
1 1 1   20   28   11 o  384.451   14.468  114.621   8.5136  126.398   11.821  101.927   12.272  401.703   19.225  358.594   22.472 43.10846 29.57381 
1 1 1   20   28   12 o  202.570   19.245   32.421   5.8953   32.421   5.8953   0.0000   0.0000  202.570   19.245  ?   ?  0.000000 19.24454 
1 1 1   20   28   13 o  202.164   19.444   32.324   5.9425   32.324   5.9425   0.0000   0.0000  202.164   19.444  ?   ?  0.000000 19.44383 
1 1 1   20   28   14 o  307.781   13.134   73.333   6.1874   76.195   7.0088   63.227   13.172  313.302   14.615  276.879   31.650 36.42313 34.86193 
1 1 1   20   28   15 o  188.924   41.563   31.444   11.692   0.0000   0.0000   31.444   11.692  ?   ?   188.924   41.563 0.000000 41.56275 
1 1 1   20   28   16 o  318.400   12.884   78.486   6.2792   73.504   7.1252   95.810   13.286  307.458   15.141  345.379   25.309 -37.92075 29.49199 
1 1 1   20   28   17 o  471.455   12.589  172.030   9.0846  172.030   9.0846   0.0000   0.0000  471.455   12.589  ?   ?  0.000000 12.58908 
1 1 1   20   28   18 o   70.350   30.413   0.0133   6.0033   0.0133   6.0033   0.0000   0.0000   70.350   30.413  ?   ?  0.000000 30.41324 
1 1 1   20   28   19 o  236.058   19.977   44.208   7.1503   50.230   8.6622   31.331   12.667  250.400   22.853  185.475   45.065 64.92465 50.52787 
1 1 1   20   28   20 f  166.044   27.843   22.854   6.8259   15.153   8.0330   42.860   12.947  131.531   37.857  221.297   39.681 -89.76529 54.84325 
1 1 1   20   28   21 o  265.265   19.732   55.793   7.9542   59.180   10.008   49.985   13.106  270.797   24.408  241.151   36.662 29.64662 44.04361 
1 1 1   20   28   22 o  419.190   12.220  136.122   7.8406  134.879   8.9721  140.139   16.129  416.452   14.075  416.405   25.427 0.4730225E-01 29.06312 
1 1 1   20   28   23 o  292.709   15.224   67.020   6.7973   69.188   7.8404   60.460   13.639  296.468   17.354  266.724   34.194 29.74384 38.34594 
1 1 1   20   28   24 o  108.372   32.933   10.016   5.9459   10.749   6.7033   7.3147   12.877  111.997   35.132  112.255   46.299 -0.2577438 58.11982 
1 1 1   20   28   25 o  200.074   28.938   33.452   8.6046   37.091   11.158   28.112   13.516  205.892   36.753  170.561   49.111 35.33147 61.34090 
1 1 1   20   28   26 o  114.785   39.249   11.315   8.2901   20.527   10.379  -4.9194   13.779  148.557   43.111   92.165   42.413 56.39184 60.47683 
1 1 1   20   28   27 o  204.931   30.119   35.529   9.1656   25.750   11.610   51.707   14.933  164.673   44.848  237.645   42.619 -72.97215 61.86882 
1 1 1   20   28   28 o  102.266   35.218   8.7347   6.6783   5.3451   7.7704   18.315   13.063   92.406   36.729  138.390   49.138 -45.98380 61.34745 
1 1 1   20   28   29 o  147.740   30.893   18.965   6.7611   27.002   8.2905   3.0042   11.683  176.395   31.879   97.706   42.333 78.68864 52.99436 
1 1 1   20   28   30 o  274.624   14.725   59.321   6.1669   71.231   9.5384   50.767   8.0835  296.882   21.128  250.312   21.301 46.57039 30.00235 
1 1 1   20   28   31 o   64.585   24.232   2.7591   3.2420   6.3249   3.7347  -8.1420   6.5300   86.504   26.059   55.050   26.468 31.45422 37.14341 
1 1 1   20   28   32 o  177.880   15.098   25.089   4.0720   26.277   4.4221   18.466   10.441  181.657   16.070  136.653   43.961 45.00380 46.80648 
1 1 1   20   28   33 o   65.831   24.867   2.8803   3.4263   3.3205   3.9569   1.5612   6.8501   70.274   26.680   76.366   32.745 -6.091904 42.23801 
1 1 1   20   28   34 f  179.491   15.548   25.683   4.2294   33.022   4.7503  -2.3811   9.2892  203.778   15.342   77.105   35.238 126.6728 38.43310 
1 1 1   20   28   35 o  242.020   12.657   46.063   4.6722   52.164   5.3088   25.101   9.8406  257.097   13.538  159.254   40.328 97.84331 42.54017 
1 1 1   20   28   36 o   62.836   24.715   2.3586   3.4843  -1.5974   4.0641   13.332   6.7688   51.842   23.543  118.008   34.977 -66.16586 42.16193 
1 1 1   20   28   37 o  120.220   28.083   13.047   5.0743   3.5821   8.2834   18.733   6.4198   84.234   36.060  143.100   30.256 -58.86680 47.07168 
1 1 1   20   28   38 o   57.916   23.234   1.7993   3.1387   1.2697   4.5291   2.2886   4.3535   63.107   26.831   66.026   27.040 -2.918892 38.09276 
1 1 1   20   28   39 o   98.487   22.550   8.4719   3.3261   5.4750   5.0498   10.768   4.4204   81.075   30.277  108.927   26.716 -27.85213 40.37897 
1 1 1   20   29    0 o  295.379   18.497   68.253   8.2875   68.253   8.2875   68.253   8.2875  295.379   18.497  295.379   18.497 0.000000 0.000000 
1 1 1   20   29    1 o  273.581   13.269   57.909   5.5562   55.566   7.5798   60.629   8.1686  265.947   18.740  277.623   19.344 -11.67581 26.93312 
1 1 1   20   29    2 o  230.117   14.710   41.233   5.1542   42.945   6.9034   39.077   7.7475  233.376   19.505  221.183   23.232 12.19334 30.33380 
1 1 1   20   29    3 o  279.968   13.514   60.673   5.7912   63.848   7.6405   56.385   8.8779  285.587   17.564  266.623   21.949 18.96402 28.11172 
1 1 1   20   29    4 o  107.240   28.606   9.5769   4.7821   9.4304   6.1179   9.8069   7.6670  107.064   33.560  110.749   37.746 -3.685158 50.50785 
1 1 1   20   29    5 o  134.610   24.484   14.789   4.8588   12.499   6.1484   18.597   7.9290  121.642   32.431  147.406   35.554 -25.76466 48.12309 
1 1 1   20   29    6 o  320.827   12.788   79.593   6.2799   79.566   7.9021   79.641   10.346  319.383   16.218  317.326   21.427 2.056458 26.87216 
1 1 1   20   29    7 o  237.761   13.595   43.914   4.9269   49.107   5.8605   31.397   9.0982  250.979   15.329  194.365   31.673 56.61336 35.18741 
1 1 1   20   29    8 o  116.118   24.375   11.082   4.1942   11.675   4.7766   9.0859   8.7646  118.573   26.932  110.021   40.097 8.552750 48.30213 
1 1 1   20   29    9 o  162.673   18.328   20.941   4.4840   18.084   5.1213   30.324   9.2815  149.557   23.117  190.148   33.092 -40.59106 40.36711 
1 1 1   20   29   10 o  301.945   9.9979   70.239   4.6207   69.450   5.1162   73.730   10.763  300.005   11.142  304.146   23.296 -4.141602 25.82363 
1 1 1   20   29   11 o  257.448   12.045   51.222   4.7466   50.016   5.3217   55.914   10.497  253.667   13.758  263.022   26.432 -9.355164 29.79802 
1 1 1   20   29   12 o  343.615   10.386   91.032   5.4627   87.151   6.1043  106.633   12.241  335.833   11.875  366.683   21.909 -30.85004 24.92076 
1 1 1   20   29   13 o  210.179   14.296   34.442   4.5717   39.820   5.1157   13.110   10.188  225.896   14.879  125.351   43.479 100.5446 45.95447 
1 1 1   20   29   14 o  324.630   12.208   81.507   6.0658   81.507   6.0658   0.0000   0.0000  324.630   12.208  ?   ?  0.000000 12.20755 
1 1 1   20   29   15 o  212.135   26.079   36.592   8.2897   36.592   8.2897   0.0000   0.0000  212.135   26.079  ?   ?  0.000000 26.07948 
1 1 1   20   29   16 o  126.478   37.313   13.863   7.7181   13.863   7.7181   0.0000   0.0000  126.478   37.313  ?   ?  0.000000 37.31275 
1 1 1   20   29   17 o  260.644   17.495   53.425   6.9391   53.425   6.9391   0.0000   0.0000  260.644   17.495  ?   ?  0.000000 17.49480 
1 1 1   20   29   18 o  351.857   12.410   95.886   6.6836   90.396   7.6546  113.504   13.712  340.832   14.673  376.137   23.941 -35.30502 28.07941 
1 1 1   20   29   19 o   69.998   29.579   0.9658   5.4496  -0.3581   6.1680   5.6771   11.635   69.988   30.537  106.212   43.927 -36.22360 53.49856 
1 1 1   20   29   20 o  399.013   12.387  123.378   7.5650  128.012   8.8837  111.151   14.430  405.596   14.310  370.539   25.600 35.05737 29.32751 
1 1 1   20   29   21 o  230.581   17.957   42.023   6.2875   41.987   7.1606   42.145   13.139  229.337   20.619  217.501   40.970 11.83525 45.86573 
1 1 1   20   29   22 f  192.931   22.065   30.016   6.3986   25.909   7.1959   45.533   13.986  176.626   27.513  224.982   42.162 -48.35576 50.34507 
1 1 1   20   29   23 o  241.241   17.859   46.043   6.5475   45.147   7.4500   49.081   13.724  237.556   20.696  235.350   39.497 2.205856 44.59051 
1 1 1   20   29   24 o  362.212   13.623  102.152   7.5528  101.969   8.7614  102.680   14.903  360.792   15.865  352.872   27.817 7.919586 32.02331 
1 1 1   20   29   25 o  204.807   28.225   35.069   8.6130   38.042   11.653   31.491   12.786  206.612   38.258  181.827   45.929 24.78499 59.77617 
1 1 1   20   29   26 o   74.058   31.469   1.2623   6.2241  -0.2501   7.2490   5.5048   12.141   74.847   32.869  104.826   44.216 -29.97879 55.09457 
1 1 1   20   29   27 o   56.488   26.820  -6.5220   6.2715  -7.1059   7.6095  -5.2855   11.074   62.923   29.779   81.168   37.590 -18.24482 47.95580 
1 1 1   20   29   28 o  121.676   37.711   13.479   7.7498   9.3165   11.996   16.461   10.153  112.054   45.257  131.788   43.416 -19.73371 62.71413 
1 1 1   20   29   29 o   93.324   36.777   6.0020   7.7294   10.899   12.438   2.9214   9.8656  115.750   46.317   91.278   39.222 24.47198 60.69264 
1 1 1   20   29   30 o  217.612   24.590   39.367   8.0468   57.100   13.827   30.286   9.8950  250.941   37.120  181.967   36.791 68.97395 52.26355 
1 1 1   20   29   31 o   75.043   27.201   4.2192   4.0257   4.2192   4.0257   0.0000   0.0000   75.043   27.201  ?   ?  0.000000 27.20121 
1 1 1   20   29   32 o   90.277   33.907   6.3770   6.3507   8.5805   8.9807   4.1731   8.9818  102.621   39.874   90.355   38.066 12.26558 55.12714 
1 1 1   20   29   33 o  132.596   17.625   14.286   3.4884   13.050   4.0713   17.700   6.7656  124.612   22.157  139.386   32.337 -14.77412 39.20014 
1 1 1   20   29   34 o   68.372   24.715   3.5274   3.3200   4.4427   3.8414   0.8254   6.5998   74.891   26.640   72.312   31.569 2.579086 41.30738 
1 1 1   20   29   35 o   83.810   25.848   6.1124   3.6459   8.3924   4.3403   0.6470   6.7199   96.748   27.822   71.878   31.604 24.86966 42.10558 
1 1 1   20   29   36 o   92.605   24.927   7.5790   3.6114   7.2977   4.3191   8.2328   6.5842   90.210   28.185   95.305   34.750 -5.094902 44.74349 
1 1 1   20   29   37 o   65.870   24.912   3.1184   3.4415   4.3980   4.1473   0.2887   6.1674   74.463   27.511   67.814   30.025 6.649033 40.72340 
1 1 1   20   29   38 o   80.488   25.873   5.7063   3.6172   5.6332   4.3881   5.8612   6.3893   80.725   28.499   85.053   33.463 -4.328148 43.95390 
1 1 1   20   30    0 o  281.218   18.718   62.013   7.9749   62.013   7.9749   62.013   7.9749  281.218   18.718  281.218   18.718 0.000000 0.000000 
1 1 1   20   30    1 o  146.375   22.023   17.260   4.7813   17.873   6.3724   16.470   7.2327  146.390   29.460  138.823   34.250 7.567719 45.17635 
1 1 1   20   30    2 o   76.779   28.468   3.8780   4.4484   3.0541   5.8920   4.9703   6.7839   79.720   31.886   90.084   34.752 -10.36414 47.16388 
1 1 1   20   30    3 o  145.070   22.757   17.017   4.8868   21.120   6.4531   11.501   7.4827  160.281   27.281  117.096   37.168 43.18504 46.10524 
1 1 1   20   30    4 o  173.108   19.771   23.813   5.1446   23.849   6.5692   23.755   8.2731  171.068   25.898  167.569   33.428 3.499100 42.28643 
1 1 1   20   30    5 o   55.666   25.230  -2.2886   4.6394  -8.8874   5.7598   9.9010   7.8284   50.270   24.339  111.014   38.136 -60.74395 45.24054 
1 1 1   20   30    6 o   63.788   26.419   1.1325   4.2174   2.6154   4.8905  -3.1698   8.3300   73.322   29.140   75.097   33.943 -1.774254 44.73535 
1 1 1   20   30    7 o  371.594   10.461  106.469   5.9500  104.128   7.0002  112.563   11.294  366.913   12.465  378.107   19.582 -11.19424 23.21236 
1 1 1   20   30    8 o  344.565   10.968   91.618   5.7844   91.856   6.7660   90.972   11.150  344.487   12.832  338.719   21.620 5.768921 25.14113 
1 1 1   20   30    9 f  108.132   23.501   9.6245   3.7786   6.3160   4.1280   26.719   9.3835   88.410   27.543  176.472   35.960 -88.06187 45.29616 
1 1 1   20   30   10 o  274.511   10.790   58.148   4.5338   57.409   5.0003   61.561   10.750  272.500   11.988  276.181   25.726 -3.680969 28.38230 
1 1 1   20   30   11 o  293.768   10.320   66.554   4.6404   69.582   5.1840   54.343   10.410  300.153   11.284  258.760   26.665 41.39322 28.95452 
1 1 1   20   30   12 o  189.392   14.246   28.010   4.0996   29.088   4.4920   22.635   10.029  192.717   15.356  159.541   40.882 33.17630 43.67056 
1 1 1   20   30   13 o  251.581   11.971   48.958   4.6096   49.081   5.0597   48.357   11.179  251.278   13.202  241.331   30.980 9.946915 33.67563 
1 1 1   20   30   14 o   95.142   27.413   7.5137   4.2100   7.5137   4.2100   0.0000   0.0000   95.142   27.413  ?   ?  0.000000 27.41325 
1 1 1   20   30   15 o  333.103   14.901   86.378   7.5973   86.378   7.5973   0.0000   0.0000  333.103   14.901  ?   ?  0.000000 14.90087 
1 1 1   20   30   16 o  289.667   14.051   65.217   6.2297   65.435   7.1321   64.516   12.795  289.002   16.188  279.011   30.456 9.991333 34.49101 
1 1 1   20   30   17 o  252.896   18.017   50.462   6.9288   50.462   6.9288   0.0000   0.0000  252.896   18.017  ?   ?  0.000000 18.01748 
1 1 1   20   30   18 o  207.346   21.081   34.419   6.5975   34.419   6.5975   0.0000   0.0000  207.346   21.081  ?   ?  0.000000 21.08125 
1 1 1   20   30   19 o  259.480   18.158   53.201   7.1664   53.201   7.1664   0.0000   0.0000  259.480   18.158  ?   ?  0.000000 18.15820 
1 1 1   20   30   20 o  276.768   15.404   60.012   6.4997   59.166   7.3755   62.954   13.751  273.799   17.694  272.149   33.734 1.649414 38.09314 
1 1 1   20   30   21 o  318.882   14.068   79.217   6.8667   70.547   7.7973  109.174   14.494  299.225   17.096  365.854   26.052 -66.62878 31.16040 
1 1 1   20   30   22 o  136.230   30.001   15.899   6.0866   15.569   6.8852   17.082   13.020  133.242   33.729  136.352   48.987 -3.110275 59.47610 
1 1 1   20   30   23 o  167.954   25.492   23.365   6.3474   23.126   7.3655   24.056   12.512  164.596   30.354  157.523   47.753 7.073105 56.58341 
1 1 1   20   30   24 o  213.709   27.192   38.040   8.6935   35.915   12.236   40.206   12.354  197.267   41.822  210.746   39.755 -13.47862 57.70213 
1 1 1   20   30   25 o   84.797   33.065   4.6185   6.1923   3.6071   7.4799   6.8215   11.039   85.957   35.351  104.733   42.994 -18.77618 55.66132 
1 1 1   20   30   26 o  221.063   20.139   39.378   6.7396   40.362   8.4072   37.609   11.274  220.694   25.348  204.263   37.439 16.43071 45.21281 
1 1 1   20   30   27 o  213.216   20.507   36.809   6.6100   36.248   8.2654   37.806   11.010  207.827   26.593  204.911   36.438 2.915314 45.11037 
1 1 1   20   30   28 o  149.366   42.029   21.581   10.014   0.0000   0.0000   21.581   10.014  ?   ?   149.366   42.029 0.000000 42.02873 
1 1 1   20   30   29 o  186.371   23.440   28.806   6.5386   33.849   8.8262   22.673   9.7342  197.579   30.140  153.528   40.746 44.05103 50.68207 
1 1 1   20   30   30 o   77.758   34.649  -0.3768   8.3446  -0.3768   8.3446   0.0000   0.0000   77.758   34.649  ?   ?  0.000000 34.64919 
1 1 1   20   30   31 o  308.305   16.054   75.634   7.5499  110.923   11.382   47.905   10.089  369.510   20.200  235.582   28.563 133.9280 34.98454 
1 1 1   20   30   32 o  223.872   16.034   40.075   5.4578   40.075   5.4578   0.0000   0.0000  223.872   16.034  ?   ?  0.000000 16.03375 
1 1 1   20   30   33 o   75.016   25.641   4.6199   3.5380   7.7528   4.0928  -4.6442   7.0380   93.547   27.051   62.371   29.242 31.17604 39.83481 
1 1 1   20   30   34 o  264.957   11.330   54.965   4.5949   60.326   5.7363   45.367   7.6755  276.230   13.567  233.001   21.774 43.22972 25.65524 
1 1 1   20   30   35 o   99.587   23.331   8.6584   3.4941   10.440   4.0480   3.4511   6.9207  108.768   24.857   79.516   33.453 29.25199 41.67701 
1 1 1   20   30   36 o  145.005   19.242   17.515   4.1653   27.454   5.2914   1.3218   6.7540  181.923   19.297   72.735   31.840 109.1876 37.23088 
1 1 1   20   31    0 o  188.072   25.657   29.110   6.9967   29.110   6.9967   29.110   6.9967  188.072   25.657  188.072   25.657 0.000000 0.000000 
1 1 1   20   31    1 o   64.173   27.232   0.5247   4.6504  -3.0277   6.3405   4.6606   6.8414   64.669   29.383   88.967   34.737 -24.29841 45.49729 
1 1 1   20   31    2 o  191.164   18.362   28.880   5.3066   30.945   6.9854   26.061   8.1601  195.929   23.780  176.334   31.384 19.59476 39.37567 
1 1 1   20   31    3 o  178.368   19.340   25.265   5.1955   22.183   6.6664   30.032   8.2918  163.998   27.533  190.513   29.380 -26.51494 40.26450 
1 1 1   20   31    4 o  166.392   20.903   22.158   5.2062   28.602   6.6763   12.160   8.3165  188.274   23.692  119.974   39.282 68.29966 45.87370 
1 1 1   20   31    5 o  377.329   12.345  110.162   7.1300  101.739   8.9184  125.080   11.869  361.231   16.130  398.869   19.442 -37.63785 25.26169 
1 1 1   20   31    6 o  209.187   15.010   34.204   4.7741   29.256   5.4979   49.373   9.6263  192.171   18.937  246.915   25.854 -54.74376 32.04779 
1 1 1   20   31    7 o  443.027   9.7797  151.265   6.6317  145.891   7.8160  165.079   12.531  434.413   11.755  459.109   17.832 -24.69644 21.35766 
1 1 1   20   31    8 o  366.521   10.792  103.699   6.0544  106.942   7.1923   95.810   11.216  371.616   12.644  347.501   21.188 24.11475 24.67398 
1 1 1   20   31    9 o   67.093   25.490   2.7074   3.6134   1.5776   3.9493   8.5147   8.9534   63.786   25.895  107.650   40.293 -43.86374 47.89693 
1 1 1   20   31   10 o  236.711   12.178   43.475   4.3974   45.540   4.8934   34.813   10.023  241.976   13.262  202.834   33.452 39.14255 35.98496 
1 1 1   20   31   11 o  274.181   11.070   58.075   4.6458   56.328   5.1546   65.636   10.724  269.683   12.487  285.259   24.808 -15.57611 27.77328 
1 1 1   20   31   12 o  173.352   17.117   23.736   4.4826   23.736   4.4826   0.0000   0.0000  173.352   17.117  ?   ?  0.000000 17.11736 
1 1 1   20   31   13 o  225.601   14.069   39.709   4.8340   39.709   4.8340   0.0000   0.0000  225.601   14.069  ?   ?  0.000000 14.06910 
1 1 1   20   31   14 o  519.070   8.5161  207.411   6.7661  202.189   7.4283  232.843   16.393  512.138   9.4762  543.109   19.720 -30.97058 21.87886 
1 1 1   20   31   15 o  212.330   13.478   35.154   4.3578   36.993   4.6520   21.976   12.451  217.668   14.038  153.314   47.847 64.35356 49.86388 
1 1 1   20   31   16 o   69.516   29.258   1.1108   5.2977  -2.7480   5.9768   15.256   11.443   62.791   28.529  131.564   46.055 -68.77246 54.17551 
1 1 1   20   31   17 o   99.010   31.677   8.1438   5.4269   7.5577   6.0494   10.560   12.283   97.219   33.517  118.871   46.508 -21.65220 57.32688 
1 1 1   20   31   18 o  264.225   16.052   54.846   6.4613   53.627   7.2787   59.378   14.034  260.216   18.393  262.279   35.900 -2.063690 40.33757 
1 1 1   20   31   19 o  123.445   30.703   13.128   5.7771   13.355   6.3504   12.037   13.914  123.809   32.936  124.353   49.235 -0.5445709 59.23588 
1 1 1   20   31   20 o  184.844   24.935   28.092   6.8749   28.092   6.8749   0.0000   0.0000  184.844   24.935  ?   ?  0.000000 24.93531 
1 1 1   20   31   21 o  107.744   34.856   9.9764   6.5571   9.9764   6.5571   0.0000   0.0000  107.744   34.856  ?   ?  0.000000 34.85617 
1 1 1   20   31   22 f  121.070   43.521   12.913   10.278   12.913   10.278   0.0000   0.0000  121.070   43.521  ?   ?  0.000000 43.52101 
1 1 1   20   31   23 o  225.764   25.260   42.078   8.5793   51.500   12.234   32.959   12.035  243.514   33.727  187.130   42.929 56.38422 54.59368 
1 1 1   20   31   24 o  184.572   24.202   28.161   6.6726   31.566   8.0713   20.809   11.860  193.193   28.120  145.207   46.867 47.98549 54.65582 
1 1 1   20   31   25 o  175.168   24.528   25.521   6.3959   35.185   8.0185   8.6163   10.605  205.059   26.142  107.309   42.827 97.75068 50.17481 
1 1 1   20   31   26 o  185.049   23.227   28.279   6.4340   28.283   8.0487   28.272   10.708  180.774   30.150  172.437   41.145 8.336578 51.00975 
1 1 1   20   31   27 o  101.731   33.867   9.0486   6.1723   8.2116   7.7844   10.466   10.129  100.341   37.568  110.830   42.541 -10.48856 56.75503 
1 1 1   20   31   28 o  258.459   18.073   53.581   7.1048   61.446   9.2955   42.531   11.018  273.590   22.394  217.922   34.154 55.66805 40.84065 
1 1 1   20   31   29 o   78.643   34.887   0.1434   8.3655   0.1434   8.3655   0.0000   0.0000   78.643   34.887  ?   ?  0.000000 34.88736 
1 1 1   20   31   30 o  190.650   22.751   30.331   6.5080   37.209   9.0278   22.889   9.3904  205.990   29.473  152.608   39.791 53.38181 49.51721 
1 1 1   20   31   31 o  111.550   33.925   11.679   6.3079   22.313   8.5181  -1.2329   9.3864  152.134   36.948   78.516   35.703 73.61813 51.37982 
1 1 1   20   31   32 o   72.498   31.047   1.7517   6.1443   4.2189   8.1539  -1.4899   9.3463   85.990   36.251   77.356   35.350 8.634163 50.63336 
1 1 1   20   31   33 o   65.383   24.844   2.9785   3.4329   1.8893   3.9149   6.6030   7.1416   62.586   25.638   90.167   35.409 -27.58084 43.71608 
1 1 1   20   31   34 o  105.762   22.733   9.7039   3.5705   9.2661   4.0948   11.093   7.2933  101.593   26.172  106.118   36.789 -4.524414 45.14870 
1 1 1   20   32    0 o  293.932   20.020   68.018   8.9112   68.018   8.9112   68.018   8.9112  293.932   20.020  293.932   20.020 0.000000 0.000000 
1 1 1   20   32    1 o   59.615   26.630  -1.5755   4.9619   0.1028   6.7071  -3.6046   7.3747   74.191   32.110   69.037   31.491 5.154945 44.97486 
1 1 1   20   32    2 o   69.341   29.163   1.0501   5.2570   0.0397   7.2134   2.1948   7.6774   76.519   33.209   84.342   35.345 -7.823708 48.49856 
1 1 1   20   32    3 o  318.937   13.376   78.909   6.5300   75.923   8.6574   82.850   9.9458  310.537   18.295  323.470   20.189 -12.93341 27.24497 
1 1 1   20   32    4 o  289.829   14.407   65.308   6.3913   60.338   8.3437   72.366   9.9425  275.990   19.885  301.424   21.695 -25.43390 29.42910 
1 1 1   20   32    5 o  113.070   30.316   10.840   5.3542   13.826   6.9020   6.3274   8.4846  126.487   34.634   99.335   38.712 27.15206 51.94421 
1 1 1   20   32    6 o   63.267   26.648   0.7488   4.3999  -0.9880   5.1220   5.6385   8.5943   62.235   27.468   97.512   38.668 -35.27733 47.43134 
1 1 1   20   32    7 o  228.319   14.606   40.718   5.0775   36.894   5.9297   51.227   9.8303  216.113   18.092  251.067   25.955 -34.95325 31.63872 
1 1 1   20   32    8 o  284.219   12.396   62.573   5.3928   61.821   6.2948   64.648   10.456  281.473   14.661  283.180   24.359 -1.707489 28.43132 
1 1 1   20   32    9 o  101.198   28.352   8.5960   4.5671   7.9033   5.2565   10.729   9.2246   97.946   31.159  115.075   41.246 -17.12952 51.69190 
1 1 1   20   32   10 o   68.742   27.388   2.2813   4.3303   2.2813   4.3303   0.0000   0.0000   68.742   27.388  ?   ?  0.000000 27.38812 
1 1 1   20   32   11 o  121.684   25.156   12.303   4.5306   12.303   4.5306   0.0000   0.0000  121.684   25.156  ?   ?  0.000000 25.15584 
1 1 1   20   32   12 o  250.092   12.158   48.458   4.6541   48.641   5.1071   47.566   11.303  249.893   13.401  237.874   31.843 12.01854 34.54808 
1 1 1   20   32   13 o  316.033   10.492   77.155   5.0754   75.761   5.5174   84.827   12.941  312.864   11.521  322.547   26.445 -9.682739 28.84597 
1 1 1   20   32   14 o  169.338   16.903   22.698   4.3227   21.091   4.6211   33.948   12.227  162.490   18.935  193.151   42.510 -30.66107 46.53621 
1 1 1   20   32   15 o   71.012   27.306   3.0268   4.1777   2.4420   4.4327   7.6751   12.498   69.713   27.731  111.908   45.821 -42.19449 53.55872 
1 1 1   20   32   16 o   45.040   22.139 -10.2584   5.3097 -12.1829   5.9503  -2.7359   11.764   46.704   23.048   88.843   40.230 -42.13942 46.36499 
1 1 1   20   32   17 o  335.023   13.373   87.352   6.8578   83.926   7.7935   99.104   14.434  327.430   15.551  346.887   27.409 -19.45721 31.51290 
1 1 1   20   32   18 o  128.585   28.944   14.147   5.5592   11.358   6.2465   24.771   12.190  114.079   33.543  160.351   46.777 -46.27142 57.56027 
1 1 1   20   32   19 o   61.163   27.634  -2.0876   5.5148  -3.9432   6.2639   4.3086   11.630   61.421   28.383  100.998   42.969 -39.57750 51.49674 
1 1 1   20   32   20 o  102.758   32.644   9.0553   5.7711   7.0215   6.6113   15.567   11.830   95.143   34.802  129.878   46.691 -34.73550 58.23418 
1 1 1   20   32   21 o  100.086   37.543   7.7837   7.7813   3.1519   10.653   13.082   11.393   94.983   40.784  121.722   45.475 -26.73816 61.08393 
1 1 1   20   32   22 o  101.923   33.430   8.9526   6.0221   7.4451   7.0646   12.960   11.518   97.127   35.902  120.855   45.606 -23.72874 58.04236 
1 1 1   20   32   23 o  105.904   36.153   9.7621   7.0334   9.7621   7.0334   0.0000   0.0000  105.904   36.153  ?   ?  0.000000 36.15273 
1 1 1   20   32   24 o  121.657   36.567   13.583   7.3601   13.583   7.3601   0.0000   0.0000  121.657   36.567  ?   ?  0.000000 36.56721 
1 1 1   20   32   25 o  126.087   38.155   14.878   7.9934   14.878   7.9934   0.0000   0.0000  126.087   38.155  ?   ?  0.000000 38.15491 
1 1 1   20   32   26 o  139.378   29.788   17.097   6.1622   13.966   7.6039   23.087   10.518  122.190   37.267  152.529   43.128 -30.33930 56.99869 
1 1 1   20   32   27 o   91.681   36.979   5.6878   7.9976   5.6878   7.9976   0.0000   0.0000   91.681   36.979  ?   ?  0.000000 36.97917 
1 1 1   20   32   28 o  107.038   38.672   10.500   8.1273   10.500   8.1273   0.0000   0.0000  107.038   38.672  ?   ?  0.000000 38.67224 
1 1 1   20   32   29 o  293.371   16.455   68.940   7.3591   74.550   9.7717   61.589   11.186  300.591   21.378  266.559   27.826 34.03229 35.08975 
1 1 1   20   32   30 o  177.921   24.239   26.992   6.4291   29.302   8.6064   24.075   9.6707  178.482   32.709  154.101   40.477 24.38109 52.04105 
1 1 1   20   32   31 o   62.888   28.807  -2.2015   6.2565   2.4438   8.2213  -8.5937   9.6440   81.366   35.383   67.475   32.369 13.89039 47.95532 
1 1 1   20   32   32 f   67.158   29.810   0.0219   6.1169  -4.3763   8.2440   5.4088   9.1238   67.548   31.662   90.343   38.230 -22.79586 49.63901 
1 1 1   20   32   33 o   48.938   24.034 -10.3262   6.2151 -11.5717   8.1466  -8.5918   9.6134   57.072   27.922   66.708   32.084 -9.636120 42.53246 
1 1 1   20   33    0 o  204.133   27.236   34.418   8.0858   34.418   8.0858   34.418   8.0858  204.133   27.236  204.133   27.236 0.000000 0.000000 
1 1 1   20   33    1 o  169.027   22.065   23.058   5.5724   21.910   7.7878   24.263   7.9767  159.958   32.906  168.981   32.012 -9.022888 45.90853 
1 1 1   20   33    2 o  281.703   14.904   61.990   6.4036   58.022   8.5575   67.039   9.6531  269.891   20.878  289.631   21.938 -19.74069 30.28421 
1 1 1   20   33    3 o   71.351   29.446   1.7625   5.2123  -1.5915   7.0375   5.8380   7.7577   71.428   31.825   95.329   37.054 -23.90094 48.84524 
1 1 1   20   33    4 o  110.380   31.337   10.377   5.5411   8.4281   7.6036   12.583   8.0919  103.967   37.427  120.612   38.690 -16.64563 53.83053 
1 1 1   20   33    5 o   70.971   29.469   1.5797   5.2663   8.3217   6.8345  -8.2737   8.2624  102.078   35.600   65.277   30.933 36.80025 47.16158 
1 1 1   20   33    6 o  167.255   19.862   22.389   4.9853   20.141   5.9058   27.962   9.2987  156.319   25.567  179.823   35.043 -23.50395 43.37856 
1 1 1   20   33    7 o  210.911   19.030   35.340   6.0772   35.340   6.0772   0.0000   0.0000  210.911   19.030  ?   ?  0.000000 19.03006 
1 1 1   20   33    8 f   84.924   30.912   5.2174   5.2069   5.2174   5.2069   0.0000   0.0000   84.924   30.912  ?   ?  0.000000 30.91225 
1 1 1   20   33    9 o  202.233   20.298   32.703   6.1983   32.703   6.1983   0.0000   0.0000  202.233   20.298  ?   ?  0.000000 20.29796 
1 1 1   20   33   10 f  255.078   14.463   50.866   5.6235   47.011   6.4743   62.709   11.348  244.020   17.449  276.329   27.183 -32.30960 32.30145 
1 1 1   20   33   11 o  255.831   12.406   50.781   4.8580   49.971   5.3244   54.804   11.870  253.021   13.800  255.454   30.992 -2.433014 33.92606 
1 1 1   20   33   12 o  128.664   22.666   13.598   4.3007   10.717   4.6376   31.294   11.494  112.495   27.226  185.387   41.537 -72.89255 49.66451 
1 1 1   20   33   13 o   71.664   27.247   3.2356   4.1306   2.1315   4.4406   10.325   11.252   68.383   27.564  115.660   44.718 -47.27717 52.53122 
1 1 1   20   33   14 o  122.788   24.045   12.537   4.3574   12.398   4.6745   13.459   12.037  121.395   25.944  125.121   46.742 -3.726494 53.45961 
1 1 1   20   33   15 o  228.245   13.883   40.769   4.8273   36.610   5.2003   66.681   12.980  215.508   15.877  281.223   30.650 -65.71495 34.51822 
1 1 1   20   33   16 o  163.823   25.069   22.245   6.0861   26.023   7.0678   11.407   11.971  176.389   27.041  118.721   46.062 57.66772 53.41277 
1 1 1   20   33   17 o   47.805   23.199  -8.2094   5.3123  -5.0489   6.1771 -17.1856   10.410   58.641   27.462   63.904   31.328 -5.263027 41.66000 
1 1 1   20   33   18 o  101.225   32.343   8.7870   5.6589   6.3057   6.6200   15.520   10.905   92.202   34.621  129.025   44.970 -36.82239 56.75282 
1 1 1   20   33   19 o   70.402   31.951  -2.5025   7.4698   10.259   10.442 -15.8773   10.690  112.113   43.154   66.112   32.267 46.00129 53.88349 
1 1 1   20   33   20 o  100.167   37.926   7.8254   7.9823   10.193   11.037   5.2291   11.558  112.451   44.062  101.393   42.975 11.05858 61.54868 
1 1 1   20   33   21 o   83.638   32.705   4.5704   6.0713   11.044   7.2118 -11.1810   11.250  111.172   36.589   73.245   35.090 37.92702 50.69601 
1 1 1   20   33   22 o  133.554   30.824   15.741   6.1732   17.092   7.4242   12.715   11.112  136.800   35.240  118.746   44.799 18.05357 56.99870 
1 1 1   20   33   23 o   95.992   33.967   7.7181   6.2372   9.3993   7.4014   3.5990   11.585  104.103   36.984   96.900   42.070 7.203583 56.01523 
1 1 1   20   33   24 o  139.378   31.358   17.340   6.5279   18.661   7.8246   14.315   11.840  141.704   36.003  122.309   46.219 19.39582 58.58663 
1 1 1   20   33   25 o   86.088   33.211   5.4258   6.1954   3.8554   7.5556   8.6483   10.823   84.973   35.291  105.299   42.823 -20.32627 55.49128 
1 1 1   20   33   26 o   86.828   35.692   4.5988   7.6204   4.5988   7.6204   0.0000   0.0000   86.828   35.692  ?   ?  0.000000 35.69185 
1 1 1   20   33   27 o  103.079   37.269   9.6996   7.5501   9.6996   7.5501   0.0000   0.0000  103.079   37.269  ?   ?  0.000000 37.26875 
1 1 1   20   33   28 o   78.887   33.957   2.2793   7.4193   2.2793   7.4193   0.0000   0.0000   78.887   33.957  ?   ?  0.000000 33.95735 
1 1 1   20   33   29 o   68.303   30.020   0.4293   6.0576  -1.0249   7.6898   2.8075   9.8339   71.866   32.536   86.895   38.219 -15.02922 50.19226 
1 1 1   20   33   30 o   49.030   23.961  -9.2257   5.9486  -7.3864   7.9922 -11.5104   8.9072   61.967   29.658   60.766   29.613 1.201141 41.91135 
1 1 1   20   33   31 o   80.135   33.824   3.5273   7.1129  -0.9920   10.933   6.8441   9.3662   82.007   37.754   94.098   39.204 -12.09047 54.42752 
1 1 1   20   34    0 o  137.356   41.946   18.814   7.7043   18.814   7.7043   18.814   7.7043  137.356   41.946  137.356   41.946 0.000000 0.000000 
1 1 1   20   34    1 o  151.557   25.188   18.973   5.6380   20.856   8.2670   17.336   7.7090  153.959   35.764  140.163   35.804 13.79602 50.60631 
1 1 1   20   34    2 o  349.547   13.375   94.997   7.1561   91.782   9.8231   98.633   10.446  340.444   18.926  352.641   19.428 -12.19730 27.12270 
1 1 1   20   34    3 o  262.545   15.596   54.076   6.2393   49.279   8.2442   60.507   9.5456  247.617   21.980  273.965   22.976 -26.34854 31.79643 
1 1 1   20   34    4 f  317.374   19.009   79.848   9.1915   79.848   9.1915   0.0000   0.0000  317.374   19.009  ?   ?  0.000000 19.00862 
1 1 1   20   34    5 o   92.165   35.702   5.5792   7.1828   5.5792   7.1828   0.0000   0.0000   92.165   35.702  ?   ?  0.000000 35.70219 
1 1 1   20   34    6 o  166.607   24.201   22.764   5.9911   22.764   5.9911   0.0000   0.0000  166.607   24.201  ?   ?  0.000000 24.20124 
1 1 1   20   34    7 o  245.717   14.556   47.270   5.4503   43.134   6.2983   59.604   10.875  233.395   17.764  269.220   26.746 -35.82518 32.10764 
1 1 1   20   34    8 o   97.199   30.271   7.9305   4.9866   10.042   5.7716   1.7129   9.9039  108.068   32.359   90.561   39.107 17.50641 50.75882 
1 1 1   20   34    9 o  206.814   17.399   33.899   5.4565   32.710   6.3550   37.232   10.644  201.620   20.896  206.966   34.837 -5.345200 40.62370 
1 1 1   20   34   10 o  210.863   17.697   35.289   5.6589   31.177   6.4565   48.912   11.754  196.277   21.863  238.904   33.025 -42.62769 39.60615 
1 1 1   20   34   11 o  134.532   26.428   15.231   5.2478   12.722   5.9074   24.621   11.429  120.853   31.584  160.887   44.771 -40.03442 54.79009 
1 1 1   20   34   12 o   45.612   21.746  -5.0433   4.2099  -7.3148   4.5556   8.2408   11.017   44.050   21.402  108.789   43.570 -64.73867 48.54219 
1 1 1   20   34   13 o  124.539   24.309   12.962   4.4676   11.432   4.8965   20.564   10.916  115.473   27.994  146.686   44.633 -31.21246 52.68541 
1 1 1   20   34   14 o   74.329   28.112   3.6656   4.3825   1.4703   4.7560   16.019   11.282   67.184   27.959  130.849   45.733 -63.66520 53.60272 
1 1 1   20   34   15 o  228.323   13.944   40.895   4.8497   40.200   5.3581   44.046   11.406  225.675   15.608  224.170   34.336 1.505310 37.71714 
1 1 1   20   34   16 o   77.494   31.102   3.2506   5.6268   7.3707   6.5551  -8.2841   10.968   95.956   34.721   76.149   35.950 19.80681 49.97969 
1 1 1   20   34   17 o   89.655   35.855   5.0128   7.4489   13.204   9.7777  -6.3171   11.499  120.363   42.536   80.730   37.696 39.63306 56.83562 
1 1 1   20   34   18 o  218.857   24.644   39.679   8.1119   27.623   10.734   55.735   12.387  170.519   41.514  252.913   32.769 -82.39415 52.88853 
1 1 1   20   34   19 o  151.595   27.155   19.594   6.0695   23.547   7.0905   8.7556   11.741  165.339   29.079  109.271   44.538 56.06711 53.19049 
1 1 1   20   34   20 o  266.720   16.820   56.591   6.8314   62.465   8.1971   43.237   12.360  278.591   19.343  216.352   38.748 62.23920 43.30796 
1 1 1   20   34   21 o   95.282   33.161   7.6876   5.9284   8.0330   7.1220   6.9081   10.698   98.363   36.100  101.843   42.120 -3.480438 55.47315 
1 1 1   20   34   22 o   84.765   32.696   5.1586   6.0043   6.6527   7.2116   1.7826   10.840   93.104   35.855   90.413   39.930 2.690964 53.66601 
1 1 1   20   34   23 o   86.143   32.836   5.6065   6.0084   4.0020   7.3601   8.8121   10.403   84.595   34.958  104.756   42.203 -20.16137 54.80065 
1 1 1   20   34   24 o   67.209   30.607  -2.0819   6.9298  -2.0819   6.9298   0.0000   0.0000   67.209   30.607  ?   ?  0.000000 30.60651 
1 1 1   20   34   25 o   65.575   30.145  -2.7639   6.9349  -2.7639   6.9349   0.0000   0.0000   65.575   30.145  ?   ?  0.000000 30.14462 
1 1 1   20   34   26 o   94.772   33.259   8.0103   5.9697   14.033   7.6077  -1.6395   9.6301  119.530   37.416   78.272   35.812 41.25778 51.79255 
1 1 1   20   34   27 o   75.564   32.569   1.9377   6.8429   6.3764   9.7050  -2.4508   9.6500   94.715   39.719   76.549   35.323 18.16636 53.15358 
1 1 1   20   34   28 o  101.007   36.362   9.6212   7.1770   19.228   10.224   0.2871   10.078  132.750   43.558   82.263   37.244 50.48790 57.31013 
1 1 1   20   35    1 o  432.709   17.941  147.856   11.882  147.856   11.882   0.0000   0.0000  432.709   17.941  ?   ?  0.000000 17.94050 
1 1 1   20   35    2 o  118.835   38.407   12.508   7.9627   12.508   7.9627   0.0000   0.0000  118.835   38.407  ?   ?  0.000000 38.40734 
1 1 1   20   35    3 o  328.592   14.911   84.465   7.4998   90.069   9.6080   75.726   11.998  336.763   18.714  303.546   26.077 33.21738 32.09723 
1 1 1   20   35    4 o  115.728   32.874   11.719   6.0963   21.957   8.1574  -1.2310   9.1747  157.663   34.740   81.160   36.236 76.50356 50.19882 
1 1 1   20   35    5 o  314.783   12.921   77.117   6.2254   72.566   7.3667   88.488   11.644  303.672   15.904  330.483   23.165 -26.81070 28.09889 
1 1 1   20   35    6 o  210.653   17.181   35.197   5.4913   34.653   6.3653   36.780   10.858  207.590   20.293  204.090   36.078 3.499741 41.39352 
1 1 1   20   35    7 o  189.623   19.238   28.832   5.5062   29.587   6.4117   26.710   10.747  190.614   22.403  169.211   41.752 21.40376 47.38277 
1 1 1   20   35    8 o  172.555   21.019   24.146   5.4369   21.582   6.2255   32.385   11.161  160.561   26.238  188.009   40.012 -27.44791 47.84739 
1 1 1   20   35    9 o  223.048   17.190   39.492   5.8235   40.968   6.7196   35.039   11.672  225.994   19.620  195.231   40.392 30.76389 44.90491 
1 1 1   20   35   10 o  159.211   23.061   20.866   5.4563   19.657   6.3582   24.244   10.627  151.812   28.407  159.782   42.655 -7.970032 51.24833 
1 1 1   20   35   11 o   70.233   29.472   1.4959   5.3491   6.7709   6.1256 -15.4444   10.977   92.784   33.566   67.829   33.016 24.95497 47.08192 
1 1 1   20   35   12 o  155.908   19.145   19.621   4.4727   19.513   4.8776   20.188   11.212  154.611   21.166  143.846   45.480 10.76561 50.16443 
1 1 1   20   35   13 f  113.829   26.213   11.067   4.4727   9.4889   4.9283   18.437   10.651  104.526   29.511  138.117   44.397 -33.59058 53.31053 
1 1 1   20   35   14 o  259.832   12.904   52.677   5.1321   54.669   5.6723   43.689   12.049  263.864   14.096  220.195   37.067 43.66960 39.65621 
1 1 1   20   35   15 o  131.315   27.753   14.842   5.4037   14.874   6.2594   14.748   10.707  129.470   31.813  125.209   44.482 4.261536 54.68803 
1 1 1   20   35   16 o  135.650   27.234   15.788   5.4581   17.892   6.2726   9.2299   11.076  143.342   29.571  109.221   43.706 34.12091 52.76991 
1 1 1   20   35   17 o  173.822   23.983   25.166   6.2109   23.093   7.2768   30.729   11.920  162.590   30.356  176.637   44.195 -14.04770 53.61672 
1 1 1   20   35   18 o  139.470   29.384   17.050   6.0748   19.277   7.1925   11.510   11.346  146.306   32.914  114.587   44.737 31.71949 55.54035 
1 1 1   20   35   19 o  224.413   18.826   40.676   6.4069   36.848   7.6662   49.543   11.668  209.935   24.307  235.725   33.262 -25.78911 41.19690 
1 1 1   20   35   20 o  140.236   28.550   17.267   5.9200   15.060   7.1972   21.882   10.409  126.643   35.630  146.848   43.335 -20.20590 56.10233 
1 1 1   20   35   21 o   81.002   31.819   4.4877   5.7682   4.1061   7.1273   5.2121   9.8204   83.917   34.509   94.129   39.738 -10.21196 52.63080 
1 1 1   20   35   22 o   71.838   30.416   1.8581   5.7803   0.4367   7.0682   4.7284   10.044   73.400   32.339   93.024   39.762 -19.62318 51.25252 
1 1 1   20   35   23 o  142.221   42.955   21.129   10.138   21.129   10.138   0.0000   0.0000  142.221   42.955  ?   ?  0.000000 42.95531 
1 1 1   20   35   24 o   77.734   33.008   2.6430   6.8389   1.8738   9.7458   3.3891   9.5991   85.155   37.722   87.945   38.238 -2.789627 53.71287 
1 1 1   20   35   25 o  149.165   31.263   20.470   6.9095   27.717   9.8263   13.383   9.7175  166.434   39.216  114.479   42.144 51.95583 57.56783 
1 1 1   20   35   26 o  166.857   24.179   23.930   5.9952   26.712   7.4913   18.974   9.9986  172.106   29.499  132.414   43.058 39.69275 52.19385 
1 1 1   20   36    0 o   96.348   49.478   11.934   9.2879   11.934   9.2879   11.934   9.2879   96.348   49.478   96.348   49.478 0.000000 0.000000 
1 1 1   20   36    1 o  262.149   18.144   54.732   7.2357   54.870   10.101   54.587   10.369  257.321   26.004  256.013   26.862 1.308563 37.38697 
1 1 1   20   36    2 o  305.176   23.850   76.121   11.052   0.0000   0.0000   76.121   11.052  ?   ?   305.176   23.850 0.000000 23.84959 
1 1 1   20   36    3 o  179.822   37.729   29.345   10.053   0.0000   0.0000   29.345   10.053  ?   ?   179.822   37.729 0.000000 37.72887 
1 1 1   20   36    4 o  172.625   39.577   27.538   10.234   0.0000   0.0000   27.538   10.234  ?   ?   172.625   39.577 0.000000 39.57750 
1 1 1   20   36    5 o  446.171   14.893  156.144   10.171  162.444   15.462  151.338   13.504  447.535   22.646  434.752   20.293 12.78363 30.40740 
1 1 1   20   36    6 o   93.218   35.602   6.3417   7.0721   8.9852   9.8584   3.5388   10.151  107.487   41.774   94.071   40.086 13.41591 57.89567 
1 1 1   20   36    7 o  346.962   16.832   95.114   8.9387  104.563   12.619   85.598   12.664  358.221   23.138  321.479   25.957 36.74261 34.77283 
1 1 1   20   36    8 o  105.314   30.959   9.6866   5.3216   6.4171   6.2003   18.833   10.370   91.272   33.655  139.712   43.676 -48.43949 55.13851 
1 1 1   20   36    9 o   50.235   23.937  -5.7638   5.0871  -5.7536   5.8919  -5.7938   10.083   55.362   26.201   75.977   35.417 -20.61525 44.05528 
1 1 1   20   36   10 o  228.308   16.602   41.392   5.7620   43.980   6.8296   35.002   10.733  233.941   19.244  196.502   37.043 37.43953 41.74329 
1 1 1   20   36   11 o   68.278   28.756   1.3444   5.1228   1.3070   5.8623   1.4654   10.536   71.793   30.525   90.187   39.616 -18.39375 50.01174 
1 1 1   20   36   12 o  187.772   20.150   28.613   5.7008   31.703   6.6739   20.273   10.964  196.347   22.620  142.887   44.949 53.45979 50.31996 
1 1 1   20   36   13 o  165.260   22.668   22.592   5.5828   26.976   6.6631   12.263   10.227  179.477   24.928  116.354   43.160 63.12241 49.84182 
1 1 1   20   36   14 o  142.018   26.702   17.291   5.5913   17.466   6.5769   16.837   10.619  140.010   31.457  130.559   44.423 9.451019 54.43261 
1 1 1   20   36   15 o  123.504   26.544   13.184   4.8685   13.789   5.4874   10.946   10.552  125.010   29.205  111.775   43.281 13.23515 52.21250 
1 1 1   20   36   16 o  106.596   32.844   10.272   5.8883   17.002   7.3748  -1.5651   9.7798  135.101   35.280   80.512   36.547 54.58857 50.79726 
1 1 1   20   36   17 o  170.142   23.587   24.297   5.9773   27.461   7.4518   18.588   10.009  177.776   28.337  135.492   42.985 42.28345 51.48520 
1 1 1   20   36   18 o  104.279   36.304   9.9108   7.1060   7.5434   10.271   12.084   9.8417  100.741   41.427  113.015   42.256 -12.27385 59.17554 
1 1 1   20   36   19 o  177.664   28.775   27.732   7.5574   33.458   11.486   23.360   10.036  182.906   41.923  151.725   41.854 31.18143 59.23934 
1 1 1   20   36   20 o  152.921   31.831   21.353   7.2081   29.148   10.693   14.861   9.7584  170.050   41.458  120.870   42.518 49.18009 59.38457 
1 1 1   20   36   21 o  113.294   42.913   12.706   10.222   12.706   10.222   0.0000   0.0000  113.294   42.913  ?   ?  0.000000 42.91302 
1 1 1   20   36   22 o  108.247   36.822   11.291   7.2960   11.291   7.2960   0.0000   0.0000  108.247   36.822  ?   ?  0.000000 36.82201 
1 1 1   20   36   23 o   49.571   24.045  -7.8496   5.6900 -17.0201   7.0643   9.0888   9.6008   46.728   23.391  101.467   40.660 -54.73919 46.90855 
1 1 1   20   37    0 o  140.725   50.218   21.938   9.8704   21.938   9.8704   21.938   9.8704  140.725   50.218  140.725   50.218 0.000000 0.000000 
1 1 1   20   37    1 o  465.064   13.535  169.216   9.6350  169.973   13.666  168.467   13.586  460.865   19.373  458.848   19.345 2.016785 27.37761 
1 1 1   20   37    2 o  154.297   29.273   20.597   6.6604   26.164   9.2976   14.729   9.5459  168.999   36.971  124.943   42.120 44.05619 56.04471 
1 1 1   20   37    3 o  179.879   25.772   27.173   6.8930   29.044   9.4188   25.016   10.115  179.347   35.567  162.168   40.788 17.17903 54.11711 
1 1 1   20   37    4 o  201.280   22.532   33.272   6.8226   37.966   8.9222   26.663   10.587  211.215   28.310  166.821   41.605 44.39406 50.32319 
1 1 1   20   37    5 o  150.281   25.453   19.066   5.6459   12.389   6.7059   35.322   10.464  116.840   34.856  197.728   35.896 -80.88852 50.03422 
1 1 1   20   37    6 o  330.057   13.476   85.289   6.8082   75.928   8.0019  109.833   12.957  308.968   16.986  365.921   23.254 -56.95313 28.79722 
1 1 1   20   37    7 o  168.078   22.311   23.319   5.5980   24.754   6.5958   19.623   10.585  171.130   25.999  140.559   44.157 30.57108 51.24228 
1 1 1   20   37    8 o  214.309   20.463   37.354   6.6309   33.110   8.2750   44.969   11.084  196.551   28.323  225.375   33.119 -28.82329 43.57847 
1 1 1   20   37    9 o  189.491   23.944   29.936   6.7898   25.336   8.7323   36.969   10.798  166.387   35.377  200.950   36.447 -34.56326 50.79291 
1 1 1   20   37   10 o  295.212   16.502   69.374   7.4266   68.855   9.6327   70.135   11.661  289.940   21.866  288.054   26.754 1.886261 34.55279 
1 1 1   20   37   11 o  246.247   18.528   48.873   6.9322   47.011   9.0292   51.547   10.819  236.431   25.345  243.854   29.592 -7.422791 38.96268 
1 1 1   20   37   12 o  197.922   23.416   32.677   6.9564   40.658   9.1427   21.703   10.720  217.244   28.157  145.673   44.210 71.57164 52.41517 
1 1 1   20   37   13 o  168.286   25.404   24.106   6.3398   30.635   8.3878   15.407   9.6828  186.207   30.484  124.494   42.419 61.71349 52.23675 
1 1 1   20   37   14 o   56.504   26.130  -3.0990   5.3226   0.1270   6.3951 -10.3716   9.6019   69.943   30.790   66.198   31.895 3.744621 44.33239 
1 1 1   20   37   15 o   74.262   29.953   3.1914   5.2472   3.2822   6.2679   2.9788   9.5931   78.336   32.305   88.124   38.271 -9.787285 50.08282 
1 1 1   20   37   16 o  241.751   16.636   46.905   6.1184   53.943   7.5638   33.581   10.407  257.268   19.350  187.588   37.554 69.67969 42.24624 
1 1 1   20   37   17 o   96.588   32.569   8.3876   5.7073   12.302   7.0669   1.0456   9.6780  113.351   36.135   83.744   37.316 29.60634 51.94448 
1 1 1   20   37   18 f  238.020   17.609   45.849   6.3698   49.027   8.0085   40.376   10.510  242.759   21.785  208.822   34.054 33.93678 40.42591 
1 1 1   20   37   19 o  115.521   37.337   13.107   7.5250   13.107   7.5250   0.0000   0.0000  115.521   37.337  ?   ?  0.000000 37.33673 
1 1 1   20   37   20 o   94.580   35.958   7.7495   7.1938   7.7495   7.1938   0.0000   0.0000   94.580   35.958  ?   ?  0.000000 35.95808 
1 1 1   20   38    0 o  108.199   51.682   15.379   9.8171   15.379   9.8171   15.379   9.8171  108.199   51.682  108.199   51.682 0.000000 0.000000 
1 1 1   20   38    1 o  211.204   22.099   36.807   7.0384   30.898   9.7031   43.369   10.225  183.040   35.916  222.234   30.895 -39.19386 47.37614 
1 1 1   20   38    2 o   69.330   30.253   0.3739   6.0552   0.1197   8.0183   0.7111   9.2370   77.236   34.215   83.002   36.748 -5.766388 50.21009 
1 1 1   20   38    3 o   73.847   31.688   1.4107   6.4238  -7.2874   8.6170   12.292   9.6377   66.359   31.487  114.541   42.001 -48.18214 52.49257 
1 1 1   20   38    4 o  334.566   13.398   87.882   6.8610   89.835   8.4218   84.027   11.831  336.183   16.367  317.136   24.564 19.04709 29.51714 
1 1 1   20   38    5 o  173.721   22.734   25.147   5.8999   21.316   7.1062   33.646   10.585  154.441   31.136  188.997   37.909 -34.55580 49.05659 
1 1 1   20   38    6 o  266.700   15.351   56.488   6.2402   48.589   7.3182   77.533   11.945  244.410   19.730  302.773   26.028 -58.36232 32.66120 
1 1 1   20   38    7 o  348.095   12.941   95.046   6.8952  100.876   8.3439   82.493   12.245  356.909   15.274  312.394   25.840 44.51538 30.01621 
1 1 1   20   38    8 o  164.115   22.963   22.568   5.6102   23.791   6.6676   19.604   10.382  165.820   27.215  138.003   43.777 27.81648 51.54675 
1 1 1   20   38    9 o  267.389   15.472   56.893   6.3051   57.871   7.6688   54.851   11.077  267.230   18.870  250.547   29.445 16.68225 34.97256 
1 1 1   20   38   10 o  354.939   13.427   99.128   7.2948   95.820   8.7734  106.539   13.130  346.520   16.541  356.565   24.202 -10.04495 29.31465 
1 1 1   20   38   11 f  158.638   25.526   21.611   5.9879   19.797   7.2495   25.505   10.622  146.426   33.121  157.678   42.880 -11.25121 54.18195 
1 1 1   20   38   12 o  159.427   24.037   21.600   5.6833   29.716   6.9361   5.0201   9.9139  186.762   24.883   93.148   39.652 93.61335 46.81281 
1 1 1   20   38   13 o   56.531   26.255  -3.3295   5.4596 -10.4469   6.6046   12.028   9.7017   51.468   25.172  111.562   41.907 -60.09385 48.88565 
1 1 1   20   38   14 o  149.226   26.056   19.355   5.7349   14.694   6.9117   29.656   10.275  123.923   34.934  173.026   39.645 -49.10233 52.84110 
1 1 1   20   38   15 o  104.208   29.131   9.8514   4.8272   8.9736   5.5329   12.649   9.8779   99.004   32.017  112.879   42.308 -13.87486 53.05761 
1 1 1   20   38   16 o   62.007   26.761   0.6401   4.6320   0.2282   5.2738   2.0301   9.6883   64.110   28.098   85.149   37.670 -21.03877 46.99452 
1 1 1   20   39    0 o  158.482   46.894   26.192   9.8926   26.192   9.8926   26.192   9.8926  158.482   46.894  158.482   46.894 0.000000 0.000000 
1 1 1   20   39    1 o   97.059   34.812   8.2990   6.5725   15.087   9.2072   1.2461   9.3852  122.566   41.366   83.573   37.019 38.99265 55.51205 
1 1 1   20   39    2 o   92.683   34.235   7.2482   6.4216   13.139   8.6201  -0.0968   9.6258  115.892   40.006   81.658   36.737 34.23412 54.31454 
1 1 1   20   39    3 o  213.440   22.256   37.941   7.1640   41.966   9.9606   33.628   10.312  216.972   30.862  188.133   37.127 28.83852 48.27930 
1 1 1   20   39    4 o  133.385   28.980   15.893   5.7474   9.3207   6.8419   31.651   10.594  101.233   35.602  179.818   39.564 -78.58498 53.22399 
1 1 1   20   39    5 o  158.568   23.937   21.362   5.6288   17.481   6.5667   32.112   10.930  138.116   31.729  179.890   40.651 -41.77391 51.56828 
1 1 1   20   39    6 o  267.550   15.587   57.136   6.3555   56.591   7.4414   58.606   12.219  264.047   18.529  255.132   31.992 8.915192 36.97073 
1 1 1   20   39    7 f  199.205   19.922   32.617   5.9931   39.294   7.0141   14.560   11.535  217.738   21.319  119.144   45.477 98.59344 50.22588 
1 1 1   20   39    8 o   85.579   32.030   5.8900   5.6573   0.8027   6.6591   19.087   10.725   72.300   31.633  133.550   44.648 -61.25007 54.71827 
1 1 1   20   39    9 o  365.353   13.309  105.216   7.4425  107.618   9.0883  100.327   12.968  366.956   16.181  344.004   24.794 22.95163 29.60681 
1 1 1   20   39   10 o  125.085   31.113   14.414   5.9321   7.7118   7.0771   30.249   10.878   94.744   35.750  172.312   41.694 -77.56871 54.92259 
1 1 1   21    0    1 o  114.306   15.748   10.566   2.6064   10.566   2.6064   10.566   2.6064  114.306   15.748  114.306   15.748 0.000000 0.000000 
1 1 1   21    0    2 o  379.282   7.5759  110.259   4.3942  110.259   4.3942  110.259   4.3942  379.282   7.5759  379.282   7.5759 0.000000 0.000000 
1 1 1   21    0    3 o  700.589   12.214  376.275   13.088  376.275   13.088  376.275   13.088  700.589   12.214  700.589   12.214 0.000000 0.000000 
1 1 1   21    0    4 o  658.384   11.958  332.323   12.042  332.323   12.042  332.323   12.042  658.384   11.958  658.384   11.958 0.000000 0.000000 
1 1 1   21    0    5 f  757.156   12.883  439.521   14.920  439.521   14.920  439.521   14.920  757.156   12.883  757.156   12.883 0.000000 0.000000 
1 1 1   21    0    6 o  631.877   8.2573  305.838   7.9831  305.838   7.9831  305.838   7.9831  631.877   8.2573  631.877   8.2573 0.000000 0.000000 
1 1 1   21    0    7 o  763.893   8.9440  446.971   10.454  446.971   10.454  446.971   10.454  763.893   8.9440  763.893   8.9440 0.000000 0.000000 
1 1 1   21    0    9 o   60.682   27.519   4.1033   2.7594   4.1033   2.7594   4.1033   2.7594   60.682   27.519   60.682   27.519 0.000000 0.000000 
1 1 1   21    0   10 o  688.738   8.7276  363.378   9.1973  363.378   9.1973  363.378   9.1973  688.738   8.7276  688.738   8.7276 0.000000 0.000000 
1 1 1   21    0   12 o  345.773   11.946   91.914   6.3056   91.914   6.3056   91.914   6.3056  345.773   11.946  345.773   11.946 0.000000 0.000000 
1 1 1   21    0   13 o  587.452   8.7611  264.427   7.8738  264.427   7.8738  264.427   7.8738  587.452   8.7611  587.452   8.7611 0.000000 0.000000 
1 1 1   21    0   14 o  496.898   8.9150  189.254   6.7756  189.254   6.7756  189.254   6.7756  496.898   8.9150  496.898   8.9150 0.000000 0.000000 
1 1 1   21    0   15 o  322.544   10.574   79.944   5.2075   79.944   5.2075   79.944   5.2075  322.544   10.574  322.544   10.574 0.000000 0.000000 
1 1 1   21    0   16 o  418.503   9.8582  134.370   6.3070  134.370   6.3070  134.370   6.3070  418.503   9.8582  418.503   9.8582 0.000000 0.000000 
1 1 1   21    0   17 o  315.824   6.8272   76.474   3.2968   76.474   3.2968   76.474   3.2968  315.824   6.8272  315.824   6.8272 0.000000 0.000000 
1 1 1   21    0   18 o  364.017   7.6647  101.601   4.2663  101.601   4.2663  101.601   4.2663  364.017   7.6647  364.017   7.6647 0.000000 0.000000 
1 1 1   21    0   19 o   85.494   21.976   6.6094   2.4856   6.6094   2.4856   6.6094   2.4856   85.494   21.976   85.494   21.976 0.000000 0.000000 
1 1 1   21    0   20 o  760.122   7.7915  442.614   9.0630  442.614   9.0630  442.614   9.0630  760.122   7.7915  760.122   7.7915 0.000000 0.000000 
1 1 1   21    0   21 o   91.349   21.353   7.3657   2.5952   7.3657   2.5952   7.3657   2.5952   91.349   21.353   91.349   21.353 0.000000 0.000000 
1 1 1   21    0   22 o  139.997   13.704   15.460   2.8720   15.460   2.8720   15.460   2.8720  139.997   13.704  139.997   13.704 0.000000 0.000000 
1 1 1   21    0   23 o  316.960   11.061   77.291   5.3514   77.291   5.3514   77.291   5.3514  316.960   11.061  316.960   11.061 0.000000 0.000000 
1 1 1   21    0   24 o  103.366   19.446   9.0295   2.7584   9.0295   2.7584   9.0295   2.7584  103.366   19.446  103.366   19.446 0.000000 0.000000 
1 1 1   21    0   25 o  238.340   10.055   43.773   3.6533   43.773   3.6533   43.773   3.6533  238.340   10.055  238.340   10.055 0.000000 0.000000 
1 1 1   21    0   26 f  484.898   6.8980  180.194   5.1174  180.194   5.1174  180.194   5.1174  484.898   6.8980  484.898   6.8980 0.000000 0.000000 
1 1 1   21    0   27 o   43.428   25.362   1.7440   2.8047   1.7440   2.8047   1.7440   2.8047   43.428   25.362   43.428   25.362 0.000000 0.000000 
1 1 1   21    0   28 o  261.345   10.649   52.642   4.2438   52.642   4.2438   52.642   4.2438  261.345   10.649  261.345   10.649 0.000000 0.000000 
1 1 1   21    0   29 o   35.504   22.961  -0.0662   2.9297  -0.0662   2.9297  -0.0662   2.9297   35.504   22.961   35.504   22.961 0.000000 0.000000 
1 1 1   21    0   30 o  132.514   21.276   14.548   3.9819   14.548   3.9819   14.548   3.9819  132.514   21.276  132.514   21.276 0.000000 0.000000 
1 1 1   21    0   31 o  171.415   12.765   22.942   3.3066   22.942   3.3066   22.942   3.3066  171.415   12.765  171.415   12.765 0.000000 0.000000 
1 1 1   21    0   32 o   60.098   31.120   4.1379   3.6939   4.1379   3.6939   4.1379   3.6939   60.098   31.120   60.098   31.120 0.000000 0.000000 
1 1 1   21    0   33 o  425.166   8.9816  138.828   5.8391  138.828   5.8391  138.828   5.8391  425.166   8.9816  425.166   8.9816 0.000000 0.000000 
1 1 1   21    0   34 o   50.815   28.880   2.6696   3.4927   2.6696   3.4927   2.6696   3.4927   50.815   28.880   50.815   28.880 0.000000 0.000000 
1 1 1   21    0   35 o   72.323   30.708   5.7989   3.4493   5.7989   3.4493   5.7989   3.4493   72.323   30.708   72.323   30.708 0.000000 0.000000 
1 1 1   21    0   36 o   24.230   17.443  -5.5642   3.1974  -5.5642   3.1974  -5.5642   3.1974   24.230   17.443   24.230   17.443 0.000000 0.000000 
1 1 1   21    0   37 o   52.908   29.768   2.9948   3.6611   2.9948   3.6611   2.9948   3.6611   52.908   29.768   52.908   29.768 0.000000 0.000000 
1 1 1   21    0   38 o   31.809   21.990  -2.7940   3.6340  -2.7940   3.6340  -2.7940   3.6340   31.809   21.990   31.809   21.990 0.000000 0.000000 
1 1 1   21    0   39 o  295.495   10.682   67.389   4.8173   67.389   4.8173   67.389   4.8173  295.495   10.682  295.495   10.682 0.000000 0.000000 
1 1 1   21    0   40 o  183.520   15.608   26.585   4.3115   26.585   4.3115   26.585   4.3115  183.520   15.608  183.520   15.608 0.000000 0.000000 
1 1 1   21    0   41 o   56.240   33.639   2.8681   5.1502   2.8681   5.1502   2.8681   5.1502   56.240   33.639   56.240   33.639 0.000000 0.000000 
1 1 1   21    0   42 o  139.951   37.859   18.674   7.0096   18.674   7.0096   18.674   7.0096  139.951   37.859  139.951   37.859 0.000000 0.000000 
1 1 1   21    0   43 o  135.677   25.951   15.919   4.8179   15.919   4.8179   15.919   4.8179  135.677   25.951  135.677   25.951 0.000000 0.000000 
1 1 1   21    0   44 o  125.696   29.162   14.285   4.8805   14.285   4.8805   14.285   4.8805  125.696   29.162  125.696   29.162 0.000000 0.000000 
1 1 1   21    0   45 o  227.377   15.861   40.688   5.4584   40.688   5.4584   40.688   5.4584  227.377   15.861  227.377   15.861 0.000000 0.000000 
1 1 1   21    0   46 o   49.855   31.191   1.5050   4.8995   1.5050   4.8995   1.5050   4.8995   49.855   31.191   49.855   31.191 0.000000 0.000000 
1 1 1   21    0   47 o  244.398   15.203   46.924   5.6365   46.924   5.6365   46.924   5.6365  244.398   15.203  244.398   15.203 0.000000 0.000000 
1 1 1   21    0   48 o   39.056   26.731  -2.7397   5.0650  -2.7397   5.0650  -2.7397   5.0650   39.056   26.731   39.056   26.731 0.000000 0.000000 
1 1 1   21    0   49 o  190.660   16.810   29.064   4.8180   29.064   4.8180   29.064   4.8180  190.660   16.810  190.660   16.810 0.000000 0.000000 
1 1 1   21    0   50 o  154.776   22.251   20.121   4.9550   20.121   4.9550   20.121   4.9550  154.776   22.251  154.776   22.251 0.000000 0.000000 
1 1 1   21    0   51 o   39.692   26.671  -1.2885   4.5942  -1.2885   4.5942  -1.2885   4.5942   39.692   26.671   39.692   26.671 0.000000 0.000000 
1 1 1   21    0   52 o   39.521   26.574  -1.2364   4.5747  -1.2364   4.5747  -1.2364   4.5747   39.521   26.574   39.521   26.574 0.000000 0.000000 
1 1 1   21    0   53 o   64.230   38.252   5.0236   6.6030   5.0236   6.6030   5.0236   6.6030   64.230   38.252   64.230   38.252 0.000000 0.000000 
1 1 1   21    0   54 o   43.730   28.426   0.4929   4.5681   0.4929   4.5681   0.4929   4.5681   43.730   28.426   43.730   28.426 0.000000 0.000000 
1 1 1   21    1    0 o  819.773   9.1319  514.730   11.455  514.730   11.455  514.730   11.455  819.773   9.1319  819.773   9.1319 0.000000 0.000000 
1 1 1   21    1    1 o  337.141   6.3682   87.026   3.2862   86.351   5.9107   87.328   3.9536  335.669   11.504  337.693   7.6490 -2.023956 13.81494 
1 1 1   21    1    2 o  814.106   9.2330  507.685   11.505  526.861   16.868  491.003   15.733  828.937   13.294  800.281   12.844 28.65588 18.48533 
1 1 1   21    1    3 o  835.088   9.3877  534.210   11.999  542.766   17.257  526.202   16.696  841.338   13.401  828.428   13.167 12.91028 18.78716 
1 1 1   21    1    4 f  890.298   7.8408  607.013   10.685  591.048   18.355  615.197   13.141  877.920   13.659  896.133   9.5804 -18.21295 16.68389 
1 1 1   21    1    5 f  185.123   11.756   26.373   3.3137   24.376   4.7341   28.291   4.6399  177.294   17.681  191.338   15.990 -14.04373 23.83882 
1 1 1   21    1    6 o  990.892   10.370  752.335   15.728  752.335   15.728   0.0000   0.0000  990.892   10.370  ?   ?  0.000000 10.36982 
1 1 1   21    1    7 o  353.021   5.6328   95.411   3.0436   98.258   4.4950   93.000   4.1361  358.178   8.1990  348.476   7.7543 9.701660 11.28506 
1 1 1   21    1    8 o  205.922   10.819   32.586   3.3982   32.586   3.3982   0.0000   0.0000  205.922   10.819  ?   ?  0.000000 10.81948 
1 1 1   21    1    9 o  519.791   5.7075  206.855   4.5409  206.028   6.4963  207.645   6.3499  518.645   8.1833  520.688   7.9675 -2.042725 11.42132 
1 1 1   21    1   10 f  752.101   6.3894  433.121   7.3554  432.340   10.486  433.878   10.320  751.227   9.1195  752.575   8.9592 -1.348328 12.78410 
1 1 1   21    1   11 o  369.940   6.9154  104.801   3.9158  112.641   5.1521   94.078   6.0254  383.456   8.7780  350.329   11.237 33.12674 14.25898 
1 1 1   21    1   12 o  703.889   7.2056  379.444   7.7633  382.581   13.304  377.824   9.5597  706.327   12.306  702.259   8.8936 4.067993 15.18297 
1 1 1   21    1   13 o  357.437   6.6722   97.838   3.6504   93.582   5.1685  102.074   5.1563  349.457   9.6628  364.990   9.2297 -15.53265 13.36250 
1 1 1   21    1   14 o  323.448   7.1677   80.127   3.5486   83.576   5.0526   76.768   4.9850  330.221   9.9964  316.471   10.291 13.74948 14.34689 
1 1 1   21    1   15 o  443.570   5.7884  150.657   3.9300  153.013   6.3973  149.229   4.9807  446.838   9.3535  441.392   7.3721 5.445862 11.90953 
1 1 1   21    1   16 o  586.487   5.7826  263.387   5.1910  265.236   8.4403  262.263   6.5833  588.278   9.3736  585.134   7.3505 3.143738 11.91198 
1 1 1   21    1   17 o  288.047   5.3530   63.531   2.3601   61.309   3.5093   65.366   3.1890  282.873   8.1051  292.120   7.1323 -9.247009 10.79638 
1 1 1   21    1   18 o  105.698   12.340   8.6903   1.9589   9.5215   2.7788   7.8692   2.7617  109.966   17.062   99.460   18.831 10.50623 25.41106 
1 1 1   21    1   19 o  175.554   7.8590   23.615   2.1118   22.518   3.5313   24.226   2.6348  170.676   13.631  177.486   9.7359 -6.809372 16.75099 
1 1 1   21    1   20 o  312.729   5.3918   74.894   2.5809   77.377   3.8738   72.912   3.4609  317.753   7.9649  308.482   7.3298 9.271301 10.82433 
1 1 1   21    1   21 o  245.223   6.1315   46.061   2.3014   44.472   3.1247   47.946   3.4024  240.860   8.4758  250.069   8.8891 -9.208908 12.28233 
1 1 1   21    1   22 f  533.908   4.9430  218.290   4.0395  215.544   5.3578  221.908   6.1492  530.414   6.5993  538.106   7.4658 -7.692017 9.964423 
1 1 1   21    1   23 o  471.920   4.7500  170.544   3.4311  165.433   4.8418  175.700   4.8630  464.648   6.8078  478.864   6.6346 -14.21613 9.506053 
1 1 1   21    1   24 o  343.126   5.6628   90.187   2.9741   87.628   4.1717   92.831   4.2412  338.066   8.0619  347.965   7.9631 -9.898926 11.33161 
1 1 1   21    1   25 o  338.458   5.7929   87.760   3.0011   84.727   4.7943   89.714   3.8482  332.278   9.4266  342.099   7.3492 -9.820618 11.95287 
1 1 1   21    1   26 o  379.155   5.0851  110.113   2.9511  113.430   4.2682  107.076   4.0848  384.655   7.2494  373.735   7.1407 10.91968 10.17567 
1 1 1   21    1   27 o  334.388   5.9012   85.678   3.0204   89.045   4.0107   81.266   4.5907  340.751   7.6897  325.381   9.2177 15.37012 12.00404 
1 1 1   21    1   28 o  325.649   5.6036   81.255   2.7931   77.700   4.0193   84.575   3.8842  318.227   8.2517  332.068   7.6420 -13.84134 11.24680 
1 1 1   21    1   29 o  120.623   12.711   11.329   2.3116   12.595   3.7742   10.569   2.9242  125.738   20.302  115.654   17.028 10.08443 26.49787 
1 1 1   21    1   30 o  238.680   8.7042   43.741   3.1799   40.709   4.6839   46.334   4.3310  229.364   13.400  245.350   11.533 -15.98613 17.67948 
1 1 1   21    1   31 o  300.966   6.7356   69.468   3.1029   68.664   4.9022   70.006   4.0079  298.738   10.721  301.920   8.6727 -3.181488 13.78960 
1 1 1   21    1   32 o  416.330   5.5017  132.853   3.5059  133.090   5.0655  132.635   4.8573  416.360   7.9485  415.699   7.6339 0.6606445 11.02069 
1 1 1   21    1   33 o  237.437   8.0760   43.298   2.9351   42.641   3.9027   44.153   4.4532  235.299   10.836  238.927   12.218 -3.628067 16.33074 
1 1 1   21    1   34 o  303.775   7.0949   70.829   3.2989   72.816   4.6406   68.799   4.6905  307.589   9.8567  298.917   10.252 8.672180 14.22158 
1 1 1   21    1   35 o  170.355   10.096   22.429   2.6208   23.370   3.5594   21.315   3.8732  173.245   13.530  164.945   15.524 8.299286 20.59278 
1 1 1   21    1   36 o   49.243   19.969   0.8465   2.3457   3.2083   3.3459  -1.4362   3.2894   68.602   24.809   47.783   21.488 20.81910 32.82106 
1 1 1   21    1   37 o  210.307   9.6511   34.074   3.1067   33.496   4.5017   34.599   4.2928  207.237   14.279  210.877   13.369 -3.639771 19.56073 
1 1 1   21    1   38 f  310.168   6.9551   73.893   3.3020   74.518   4.8193   73.340   4.5332  310.850   10.129  308.502   9.6001 2.348358 13.95557 
1 1 1   21    1   39 o   84.770   20.117   5.8942   2.5710   1.9403   3.6810   9.6605   3.5926   63.697   25.291  108.383   22.396 -44.68659 33.78239 
1 1 1   21    1   40 o   72.823   22.854   4.2252   2.8363   6.7232   3.8439   1.2399   4.2022   90.071   26.264   63.753   26.385 26.31784 37.22894 
1 1 1   21    1   41 f  111.785   19.025   10.118   3.1386   8.0459   4.9627   11.499   4.0518   98.000   30.145  117.949   23.270 -19.94936 38.08187 
1 1 1   21    1   42 o  140.520   26.332   16.524   5.4555   20.677   9.7505   14.631   6.5823  149.993   41.205  129.357   33.106 20.63538 52.85662 
1 1 1   21    1   43 o  151.934   14.400   18.184   3.3089   20.747   4.6231   15.491   4.7378  160.709   19.173  136.935   23.448 23.77448 30.28853 
1 1 1   21    1   44 o   91.871   23.776   7.0947   3.3692   5.7579   4.7645   8.4317   4.7649   85.473   29.729   99.274   29.326 -13.80045 41.75935 
1 1 1   21    1   45 o  129.809   18.500   13.625   3.5718   14.128   5.1410   13.156   4.9661  128.712   26.959  124.119   26.915 4.592857 38.09500 
1 1 1   21    1   46 o   70.648   24.570   3.8179   3.2543   0.6021   4.9739   6.2248   4.3032   65.051   27.898   86.494   28.253 -21.44279 39.70594 
1 1 1   21    1   47 o  118.801   18.851   11.542   3.3134   10.989   4.5022   12.196   4.8938  112.704   26.538  118.410   27.524 -5.705376 38.23402 
1 1 1   21    1   48 o  309.592   9.3822   74.285   4.4460   75.486   6.2458   73.052   6.3302  310.211   13.154  304.934   13.562 5.277130 18.89364 
1 1 1   21    1   49 o   94.842   22.074   7.6744   3.1443   7.0953   4.4620   8.2458   4.4316   90.063   28.713   96.397   28.227 -6.333824 40.26447 
1 1 1   21    1   50 f   48.118   21.346  -0.6153   3.1317   1.0806   4.4972  -2.2120   4.3636   62.864   26.732   52.209   23.967 10.65513 35.90313 
1 1 1   21    1   51 o  194.347   11.863   29.771   3.5120   25.468   5.0632   33.761   4.8757  175.661   19.141  204.848   15.669 -29.18712 24.73660 
1 1 1   21    1   52 o   67.302   24.938   3.4647   3.4128   4.4596   4.7831   2.4331   4.8708   75.934   29.213   68.310   28.350 7.624245 40.70764 
1 1 1   21    1   53 f  147.507   19.674   18.398   4.3312   17.295   6.8007   19.150   5.6180  131.408   33.662  145.548   26.180 -14.14063 42.64384 
1 1 1   21    1   54 o   60.539   23.600   2.5158   3.1539  -3.5607   4.4242   8.7945   4.4972   48.185   22.774   95.716   28.542 -47.53059 36.51423 
1 1 1   21    2    0 o  261.763   12.296   52.827   4.9019   52.827   4.9019   52.827   4.9019  261.763   12.296  261.763   12.296 0.000000 0.000000 
1 1 1   21    2    1 o  544.266   11.196  227.008   9.3273  227.008   9.3273   0.0000   0.0000  544.266   11.196  ?   ?  0.000000 11.19629 
1 1 1   21    2    2 o  555.264   6.4687  236.065   5.4978  247.525   10.092  231.230   6.5559  568.300   11.602  549.492   7.7947 18.80774 13.97768 
1 1 1   21    2    3 o  217.395   7.6067   36.192   2.5311   34.832   5.0448   36.649   2.9261  212.491   15.620  218.742   8.7395 -6.250824 17.89894 
1 1 1   21    2    4 o  391.188   6.2940  117.165   3.7686  124.421   7.2692  114.498   4.4072  402.902   11.787  386.676   7.4463 16.22586 13.94239 
1 1 1   21    2    5 o  973.297   7.1323  725.394   10.625  739.468   22.292  721.256   12.087  981.780   14.834  970.435   8.1372 11.34479 16.91929 
1 1 1   21    2    6 o  508.509   4.8297  197.948   3.7592  204.481   6.4438  194.578   4.6284  516.708   8.1475  504.126   5.9982 12.58228 10.11731 
1 1 1   21    2    7 o  418.755   5.5286  134.249   3.5436  140.922   5.3682  129.096   4.7175  428.947   8.1763  410.579   7.5066 18.36804 11.09957 
1 1 1   21    2    8 o  334.003   5.7884   85.411   2.9592   87.493   4.5082   83.834   3.9226  337.968   8.7148  330.854   7.7458 7.113281 11.65961 
1 1 1   21    2    9 o  718.990   6.2194  395.811   6.8445  403.910   10.023  388.734   9.3690  726.124   9.0184  712.384   8.5923 13.73975 12.45627 
1 1 1   21    2   10 o  379.875   6.6995  110.500   3.8954  112.462   5.1038  107.763   6.0289  383.160   8.7025  374.988   10.504 8.171417 13.64054 
1 1 1   21    2   11 o  149.535   10.520   17.222   2.3925   19.538   3.5061   15.203   3.2729  158.900   14.578  139.872   15.551 19.02805 21.31555 
1 1 1   21    2   12 o  448.346   8.4579  153.987   5.8042   0.0000   0.0000  153.987   5.8042  ?   ?   448.346   8.4579 0.000000 8.457907 
1 1 1   21    2   13 o  138.913   11.710   14.901   2.4665   9.6751   4.7854   16.792   2.8783  109.769   28.301  147.394   12.888 -37.62530 31.09710 
1 1 1   21    2   14 o   95.746   15.860   7.2278   2.2430   9.7087   3.9739   6.0679   2.7172  110.037   24.248   87.036   20.699 23.00060 31.88134 
1 1 1   21    2   15 o  365.889   6.0005  102.514   3.3605  101.075   5.6521  103.300   4.1795  363.121   10.169  367.234   7.4356 -4.113434 12.59761 
1 1 1   21    2   16 o  296.688   7.3887   67.427   3.3554   81.900   7.9122   64.254   3.7050  326.450   15.835  289.586   8.3588 36.86453 17.90562 
1 1 1   21    2   17 o  364.985   7.7294  102.059   4.3181   0.0000   0.0000  102.059   4.3181  ?   ?   364.985   7.7294 0.000000 7.729389 
1 1 1   21    2   18 o  298.644   5.7556   68.300   2.6309   64.790   3.7313   71.770   3.7102  290.767   8.3839  306.051   7.9201 -15.28397 11.53339 
1 1 1   21    2   19 o  242.031   14.803   45.197   5.4575   45.197   5.4575   0.0000   0.0000  242.031   14.803  ?   ?  0.000000 14.80280 
1 1 1   21    2   20 o  271.292   6.1969   56.374   2.5733   57.430   3.8309   55.505   3.4736  273.688   9.1447  269.099   8.4333 4.589081 12.43969 
1 1 1   21    2   21 o  417.330   5.0504  133.370   3.2261  134.204   5.0779  132.805   4.1774  418.452   7.9281  416.362   6.5549 2.089722 10.28702 
1 1 1   21    2   22 o  475.115   4.9559  172.863   3.6040  177.966   5.7817  169.620   4.6091  481.855   7.8391  470.542   6.3995 11.31339 10.11958 
1 1 1   21    2   23 o  519.511   4.9554  206.687   3.9404  207.746   5.3204  205.400   5.8643  520.701   6.6756  517.682   7.4009 3.019104 9.966763 
1 1 1   21    2   24 o  424.407   5.1230  137.954   3.3280  142.774   4.6189  132.750   4.7991  431.618   6.9915  416.144   7.5344 15.47476 10.27856 
1 1 1   21    2   25 o   66.809   18.762   3.5478   1.9976   2.6441   3.2062   4.1211   2.5538   65.486   24.191   72.367   21.492 -6.881401 32.35868 
1 1 1   21    2   26 o  376.966   5.8125  108.874   3.3538  109.365   4.6733  108.354   4.8159  377.618   8.0854  375.839   8.3715 1.778900 11.63852 
1 1 1   21    2   27 o  269.498   6.1695   55.658   2.5449   55.678   3.6763   55.640   3.5265  269.351   8.9172  269.287   8.5557 0.6402588E-01 12.35785 
1 1 1   21    2   28 o  220.235   7.0146   37.189   2.3646   37.474   3.5025   36.951   3.2053  220.836   10.362  219.355   9.5467 1.480881 14.08930 
1 1 1   21    2   29 o  562.750   5.8754  242.703   5.0608  247.432   9.9236  241.041   5.8834  567.106   11.432  560.678   6.8556 6.427795 13.33038 
1 1 1   21    2   30 o  293.984   8.2341   66.338   3.7052   53.648   6.9309   71.416   4.3842  262.503   17.348  304.893   9.3946 -42.39081 19.72827 
1 1 1   21    2   31 o  246.661   7.5140   46.686   2.8369   46.611   3.8500   46.775   4.1964  246.189   10.217  246.512   11.122 -0.3227692 15.10210 
1 1 1   21    2   32 o  286.448   6.4848   62.928   2.8432   63.737   4.2718   62.286   3.8097  287.907   9.6936  284.736   8.7413 3.170715 13.05288 
1 1 1   21    2   33 o  403.066   5.8283  124.564   3.5957  127.277   5.6005  122.660   4.6900  406.916   8.9920  399.706   7.6658 7.209808 11.81611 
1 1 1   21    2   34 f   76.351   19.739   4.7321   2.3238   4.9635   3.4393   4.5378   3.1520   79.462   25.196   76.110   24.119 3.351624 34.87929 
1 1 1   21    2   35 o  196.924   9.2396   29.838   2.7850   27.304   3.8234   32.703   4.0647  187.355   13.422  205.221   13.007 -17.86592 18.69044 
1 1 1   21    2   36 o   96.071   19.384   7.4874   2.7521   7.0763   3.5156   8.1380   4.4230   92.630   24.441   99.060   27.953 -6.429848 37.13123 
1 1 1   21    2   37 o  121.311   14.868   11.603   2.7029   10.669   4.1994   12.263   3.5317  113.557   24.850  123.598   19.299 -10.04057 31.46408 
1 1 1   21    2   38 o  153.583   11.548   18.332   2.6949   21.808   3.9817   15.394   3.6607  166.545   15.809  139.201   17.573 27.34398 23.63732 
1 1 1   21    2   39 o   40.424   18.518  -1.6950   2.5858  -4.6842   3.7014   1.1546   3.6139   42.574   20.323   59.812   24.582 -17.23815 31.89555 
1 1 1   21    2   40 o  232.143   9.9923   41.590   3.5505   43.056   5.1414   40.252   4.9091  234.740   14.379  226.998   14.200 7.742538 20.20871 
1 1 1   21    2   41 o  109.617   21.091   9.8477   3.4103   1.8614   7.0287   12.307   3.9001   79.989   33.686  122.702   21.553 -42.71233 39.99038 
1 1 1   21    2   42 o   55.811   24.109  -0.0692   3.7668  -0.9123   4.7026   1.4401   6.2920   59.401   26.264   75.197   31.780 -15.79592 41.22812 
1 1 1   21    2   43 o   59.557   23.278   1.9011   3.0745   1.5891   4.3542   2.2114   4.3420   65.601   26.974   68.018   27.313 -2.417107 38.38767 
1 1 1   21    2   44 o  137.782   15.347   15.061   3.1815   16.938   4.6948   13.466   4.3263  143.708   22.048  127.448   23.025 16.25925 31.87869 
1 1 1   21    2   45 o   92.380   22.242   7.1511   3.1073   8.3956   4.7668   6.2316   4.0974   98.802   29.367   86.551   27.507 12.25164 40.23784 
1 1 1   21    2   46 o   82.008   23.800   5.6438   3.1631   14.031   4.8272  -0.6676   4.1874  128.596   25.426   56.222   24.824 72.37320 35.53465 
1 1 1   21    2   47 o  136.594   15.607   14.911   3.2045   18.336   4.5735   11.608   4.4914  149.513   20.526  116.142   25.923 33.37129 33.06517 
1 1 1   21    2   48 o  102.286   23.432   8.9403   3.5898   3.4469   4.3136   21.315   6.4743   72.010   27.731  156.548   28.050 -84.53803 39.44363 
1 1 1   21    2   49 o   60.374   24.171   1.9015   3.3892   0.1401   5.1104   3.2845   4.5284   63.413   27.729   71.748   28.190 -8.334873 39.54157 
1 1 1   21    2   50 o   74.109   24.437   4.5748   3.2162   2.3913   4.4829   6.8907   4.6169   67.608   27.535   88.593   29.281 -20.98530 40.19394 
1 1 1   21    2   51 o   70.267   24.433   4.0011   3.2181   4.0370   4.7248   3.9701   4.3953   74.731   28.954   73.426   28.061 1.304970 40.32079 
1 1 1   21    2   52 o   68.366   24.849   3.6922   3.3630   4.1171   4.6569   3.2291   4.8617   74.108   28.736   71.178   28.789 2.930222 40.67632 
1 1 1   21    2   53 o   87.835   26.291   7.0850   3.8104   10.228   5.4756   4.1341   5.3059  102.009   31.713   75.194   30.194 26.81468 43.78743 
1 1 1   21    2   54 o  110.426   20.786   10.612   3.3844   13.432   5.1093   8.4076   4.5176  118.690   28.486   93.519   28.761 25.17132 40.48041 
1 1 1   21    3    1 o  885.231   9.5274  600.313   12.909  581.730   17.869  620.600   18.670  871.006   13.403  899.614   13.559 -28.60852 19.06542 
1 1 1   21    3    2 o  582.040   7.9340  259.443   7.0683  262.395   10.431  256.936   9.6112  585.112   11.647  579.051   10.844 6.061646 15.91397 
1 1 1   21    3    3 o  642.096   8.1700  315.758   8.0296  346.346   12.726  295.524   10.350  672.161   12.369  621.006   10.889 51.15533 16.47898 
1 1 1   21    3    4 o  474.114   6.4125  172.108   4.6535  181.079   9.0965  168.928   5.4158  486.023   12.228  469.673   7.5335 16.34988 14.36219 
1 1 1   21    3    5 o  135.108   8.0011   14.029   1.6473   13.572   5.2787   14.079   1.7338  130.222   27.353  135.317   8.4129 -5.094482 28.61788 
1 1 1   21    3    6 o  744.439   5.5058  424.275   6.2737  414.582   10.188  430.195   7.9622  735.671   9.0481  749.539   6.9401 -13.86786 11.40321 
1 1 1   21    3    7 o  408.998   4.7030  128.054   2.9442  138.853   5.5179  123.756   3.4811  425.773   8.4670  402.053   5.6568 23.72000 10.18279 
1 1 1   21    3    8 o  710.114   5.3749  386.051   5.8421  419.972   10.374  370.298   7.0697  740.414   9.1539  695.412   6.6419 45.00256 11.30964 
1 1 1   21    3    9 o   51.390   15.310   2.0495   1.2945   7.5110   3.1787   0.9636   1.4173   96.878   21.945   42.173   15.978 54.70531 27.14574 
1 1 1   21    3   10 o  281.251   5.8865   60.564   2.5341   66.188   4.4962   57.946   3.0678  293.899   9.9948  275.072   7.2863 18.82669 12.36873 
1 1 1   21    3   11 o  278.683   6.0207   59.466   2.5682   62.420   4.5138   58.052   3.1230  285.391   10.333  275.316   7.4108 10.07541 12.71580 
1 1 1   21    3   12 o  301.970   6.6280   69.827   3.0635   71.246   7.7670   69.566   3.3338  304.074   16.753  301.387   7.2267 2.686798 18.24492 
1 1 1   21    3   13 o  442.676   6.6532  150.068   4.5080   0.0000   0.0000  150.068   4.5080  ?   ?   442.676   6.6532 0.000000 6.653215 
1 1 1   21    3   14 o  503.983   6.0941  194.498   4.7010  168.185   10.009  201.946   5.3249  468.097   13.969  513.508   6.7748 -45.41113 15.52549 
1 1 1   21    3   15 o  337.924   6.5984   87.454   3.4129   86.078   8.1553   87.746   3.7578  334.697   15.919  338.463   7.2536 -3.766174 17.49381 
1 1 1   21    3   16 o  195.201   6.6999   29.183   2.0018   25.404   2.7281   33.591   2.9464  181.780   9.8415  209.354   9.1949 -27.57353 13.46856 
1 1 1   21    3   17 o  328.854   6.3076   82.824   3.1750   92.800   5.8569   78.673   3.7783  347.840   11.001  320.450   7.7030 27.39044 13.42950 
1 1 1   21    3   18 o  686.396   5.8826  360.810   6.1803  387.557   8.3325  328.099   9.2146  711.219   7.6542  654.227   9.2019 56.99133 11.96922 
1 1 1   21    3   19 o  454.552   5.6557  158.231   3.9350  162.367   5.2301  152.837   5.9734  460.344   7.4226  446.532   8.7398 13.81158 11.46646 
1 1 1   21    3   20 o  104.585   12.019   8.5072   1.8890   11.088   3.1354   7.0370   2.3667  118.664   17.813   94.163   17.048 24.50024 24.65631 
1 1 1   21    3   21 o  541.653   4.8674  224.659   4.0354  228.591   6.4241  222.097   5.1863  546.145   7.6849  538.454   6.2927 7.690857 9.932560 
1 1 1   21    3   22 o  667.973   5.0650  341.695   5.1785  344.718   8.2650  339.741   6.6444  670.591   8.0523  665.919   6.5188 4.671875 10.36017 
1 1 1   21    3   23 o  258.298   7.5324   51.139   2.9780   46.137   3.9507   57.720   4.5320  245.163   10.528  274.194   10.798 -29.03194 15.08125 
1 1 1   21    3   24 o  384.188   6.5952  113.104   3.8783  117.117   5.1710  107.944   5.8636  390.767   8.6455  374.991   10.216 15.77567 13.38308 
1 1 1   21    3   25 o  308.407   6.5645   72.890   3.0988   81.114   4.8434   67.191   4.0321  325.078   9.7340  295.937   8.9015 29.14041 13.19042 
1 1 1   21    3   26 o  332.603   5.5864   84.751   2.8440   89.736   4.5786   81.619   3.6289  341.988   8.7469  326.283   7.2663 15.70483 11.37132 
1 1 1   21    3   27 o  111.878   12.189   9.7420   2.0535   7.2041   3.1461   11.626   2.7105   94.354   22.162  121.898   14.833 -27.54422 26.66765 
1 1 1   21    3   28 o  274.227   6.6084   57.648   2.7738   60.037   4.7191   56.386   3.4286  279.438   11.033  271.083   8.2631 8.355164 13.78446 
1 1 1   21    3   29 o  418.280   5.6692  134.074   3.6296  126.180   6.1034  138.392   4.5146  405.247   9.8397  424.824   6.9429 -19.57761 12.04256 
1 1 1   21    3   30 f  462.044   5.4846  163.598   3.8788  164.538   6.3624  163.042   4.8933  462.857   8.9805  461.077   6.9336 1.780273 11.34570 
1 1 1   21    3   31 o   96.678   16.408   7.4371   2.3412   7.4614   3.2957   7.4123   3.3265   95.711   22.818   95.374   23.044 0.3372498 32.42997 
1 1 1   21    3   32 o  445.546   5.5702  152.163   3.7987  155.697   5.9736  149.763   4.9220  450.188   8.6691  441.773   7.2791 8.414948 11.31978 
1 1 1   21    3   33 f  404.101   5.5800  125.187   3.4514  131.575   5.3024  120.491   4.5464  413.842   8.3708  396.178   7.4974 17.66470 11.23749 
1 1 1   21    3   34 o  127.955   12.270   12.754   2.3736   16.565   3.6281   9.9031   3.1383  145.037   16.644  111.080   19.150 33.95754 25.37244 
1 1 1   21    3   35 o  209.937   8.1575   33.873   2.6213   33.032   3.9555   34.532   3.5002  206.340   12.584  211.354   10.856 -5.013519 16.62005 
1 1 1   21    3   36 o  362.459   7.7618  100.958   4.3062  106.704   5.0790   86.267   8.1212  372.388   8.9106  332.864   15.940 39.52475 18.26145 
1 1 1   21    3   37 o  254.215   8.5591   49.719   3.3304   47.779   4.8720   51.421   4.5630  248.066   12.876  257.974   11.556 -9.908478 17.30093 
1 1 1   21    3   38 o  169.690   10.629   22.310   2.7466   29.146   4.3022   17.606   3.5686  193.057   14.669  149.477   15.839 43.57959 21.58785 
1 1 1   21    3   39 o   83.306   22.217   5.7145   2.8850   12.167   4.3494   0.6453   3.8552  121.333   24.267   59.333   24.965 62.00036 34.81596 
1 1 1   21    3   40 o  206.692   9.9943   32.972   3.1619   25.282   4.7541   39.072   4.2341  178.626   17.618  224.169   12.388 -45.54306 21.53699 
1 1 1   21    3   41 o  303.498   9.0340   71.010   4.1967   57.912   8.4268   75.330   4.8395  269.309   20.599  312.302   10.124 -42.99347 22.95251 
1 1 1   21    3   42 o  141.443   16.761   15.920   3.5581   16.621   5.1037   15.258   4.9630  141.721   24.409  135.475   24.850 6.246964 34.83247 
1 1 1   21    3   43 o  164.517   13.099   21.198   3.2713   19.298   5.0676   22.556   4.2833  153.688   22.185  168.520   16.831 -14.83202 27.84681 
1 1 1   21    3   44 o  305.422   8.1439   71.896   3.8072   73.742   6.0013   70.654   4.9251  307.753   12.740  302.015   10.654 5.738068 16.60788 
1 1 1   21    3   45 o   73.439   23.852   4.3274   3.0686   5.3548   4.7943   3.6145   3.9938   83.330   29.749   72.386   26.947 10.94392 40.13909 
1 1 1   21    3   46 o  141.941   14.708   15.983   3.1492   17.905   4.5787   14.257   4.3383  147.868   20.805  130.982   22.447 16.88690 30.60571 
1 1 1   21    3   47 o   56.677   22.894   1.4309   3.0704   2.5359   4.2424   0.2155   4.4493   68.039   27.108   60.494   26.168 7.544125 37.67776 
1 1 1   21    3   48 o   93.898   25.018   7.6241   3.6604   5.7724   4.4007   11.781   6.5937   83.433   28.596  112.790   34.757 -29.35646 45.00857 
1 1 1   21    3   49 o   54.983   22.937   0.9454   3.2120  -1.0906   4.6857   2.7501   4.4115   57.437   25.752   69.020   27.596 -11.58296 37.74520 
1 1 1   21    3   50 o   62.052   23.983   2.4514   3.2355   2.5182   4.7148   2.3920   4.4483   69.091   28.200   67.431   27.441 1.660271 39.34779 
1 1 1   21    3   51 o  223.984   10.860   39.260   3.7234   42.825   5.2128   35.548   5.3201  231.347   14.799  209.427   16.736 21.92029 22.34068 
1 1 1   21    3   52 o  158.976   15.566   20.514   3.7391   14.444   5.8200   24.781   4.8793  123.106   30.927  172.721   18.758 -49.61548 36.17063 
1 1 1   21    3   53 o  195.734   13.370   30.698   3.9816   23.174   5.6423   38.161   5.6195  162.740   23.318  215.264   17.199 -52.52419 28.97435 
1 1 1   21    3   54 o  153.672   15.981   19.439   3.7040   21.334   5.0578   17.248   5.4395  156.704   21.667  136.315   27.025 20.38956 34.63822 
1 1 1   21    4    0 o  1107.55   15.628  940.594   26.481  940.594   26.481  940.594   26.481  1107.55   15.628  1107.55   15.628 0.000000 0.000000 
1 1 1   21    4    1 o  593.575   11.246  270.018   10.218   0.0000   0.0000  270.018   10.218  ?   ?   593.575   11.246 0.000000 11.24623 
1 1 1   21    4    2 o  695.191   8.5018  370.164   9.0466  372.228   13.268  368.370   12.367  696.810   12.440  693.261   11.655 3.549011 17.04659 
1 1 1   21    4    3 o  440.147   7.8362  148.365   5.2792  147.103   8.1745  149.268   6.9146  438.059   12.192  441.378   10.235 -3.318726 15.91819 
1 1 1   21    4    4 o  523.066   7.8603  209.533   6.2931  211.290   9.9768  208.373   8.1101  524.982   12.416  521.493   10.160 3.488403 16.04324 
1 1 1   21    4    5 o  768.094   7.0574  451.766   8.2971  459.850   15.928  448.756   9.7202  774.360   13.438  765.447   8.2964 8.912842 15.79280 
1 1 1   21    4    6 o  558.994   6.5429  239.260   5.5982  254.772   11.164  234.048   6.4705  576.440   12.653  552.823   7.6468 23.61670 14.78412 
1 1 1   21    4    7 o  480.805   8.6876  177.078   6.3935  206.961   10.055  156.797   8.2836  519.535   12.645  452.254   11.967 67.28098 17.40926 
1 1 1   21    4    8 o  260.520   10.050   52.006   4.0077   44.074   6.9866   55.895   4.8927  238.674   19.290  270.023   11.838 -31.34904 22.63239 
1 1 1   21    4    9 o  198.240   9.7887   30.112   2.9702   30.663   6.6595   29.975   3.3186  198.320   22.327  197.451   11.024 0.8684540 24.90037 
1 1 1   21    4   10 o  559.015   6.1616  239.276   5.2722  232.989   7.5733  245.187   7.3439  551.472   8.9721  565.755   8.4806 -14.28290 12.34583 
1 1 1   21    4   11 o  191.908   9.0225   28.216   2.6503   27.334   4.1044   28.847   3.4709  188.185   14.358  193.612   11.768 -5.427216 18.56410 
1 1 1   21    4   12 o  428.085   6.3198  140.327   4.1410  146.205   6.2667  135.771   5.5171  436.812   9.3729  420.980   8.5621 15.83194 12.69488 
1 1 1   21    4   13 o  429.304   7.0291  141.151   4.6188  137.409   7.8342  143.145   5.7184  423.275   12.092  432.246   8.6432 -8.970978 14.86351 
1 1 1   21    4   14 o  468.382   5.6542  167.979   4.0536  161.315   8.7052  169.824   4.5805  458.565   12.402  470.917   6.3547 -12.35214 13.93570 
1 1 1   21    4   15 o  431.246   5.3836  142.395   3.5536  136.710   6.2760  145.078   4.3113  422.325   9.7088  435.244   6.4715 -12.91901 11.66798 
1 1 1   21    4   16 o  355.253   5.6557   96.640   3.0754   93.657   3.8440  101.943   5.1260  349.668   7.1823  364.705   9.1826 -15.03738 11.65786 
1 1 1   21    4   17 o  493.542   5.5354  186.523   4.1816  188.936   5.3577  182.764   6.6888  496.635   7.0481  488.319   8.9490 8.316650 11.39125 
1 1 1   21    4   18 o  434.203   5.1703  144.362   3.4362  156.054   7.1372  140.834   3.9205  451.087   10.337  428.827   5.9730 22.26031 11.93864 
1 1 1   21    4   19 o  281.399   6.0634   60.649   2.6116   65.582   4.2902   57.744   3.2918  292.450   9.5841  274.508   7.8345 17.94220 12.37881 
1 1 1   21    4   20 o  536.266   4.7594  220.202   3.9067  218.734   6.1508  221.196   5.0579  534.271   7.5214  537.383   6.1492 -3.111816 9.715148 
1 1 1   21    4   21 o  151.941   8.5701   17.755   1.9850   20.494   3.4026   16.342   2.4439  162.695   13.793  145.499   11.057 17.19635 17.67789 
1 1 1   21    4   22 o  214.616   6.8311   35.293   2.2440   39.881   3.9306   33.074   2.7332  227.905   11.268  207.689   8.5978 20.21638 14.17326 
1 1 1   21    4   23 o   73.358   20.321   4.2901   2.3601   2.3890   3.4525   5.9579   3.2337   65.584   24.916   86.228   23.746 -20.64412 34.41953 
1 1 1   21    4   24 o   79.706   20.898   5.1037   2.5808   5.4702   3.6718   4.7460   3.6282   83.792   25.956   79.364   25.944 4.428398 36.69862 
1 1 1   21    4   25 o  488.644   5.7010  182.925   4.2639  192.611   6.4969  175.595   5.6514  501.103   8.4705  478.550   7.7154 22.55383 11.45761 
1 1 1   21    4   26 o  564.325   6.0712  244.027   5.2441  247.148   14.641  243.568   5.6167  565.551   16.914  563.741   6.5093 1.810120 18.12288 
1 1 1   21    4   27 o  359.346   6.2543   98.964   3.4400   99.899   7.8619   98.743   3.8257  359.975   14.269  358.884   6.9644 1.091339 15.87761 
1 1 1   21    4   28 o  158.665   9.9768   19.416   2.4106   21.405   5.1462   18.857   2.7285  164.610   20.895  156.155   11.496 8.454910 23.84920 
1 1 1   21    4   29 o  246.957   7.3612   46.780   2.7825   50.316   5.6550   45.650   3.1962  254.886   14.555  243.861   8.5630 11.02550 16.88728 
1 1 1   21    4   30 o  294.062   5.9689   66.284   2.6866   72.731   4.2611   62.030   3.4612  307.716   9.0469  284.295   7.9541 23.42136 12.04633 
1 1 1   21    4   31 o  328.706   7.0167   82.885   3.5303   85.919   6.0643   81.329   4.3418  333.941   11.864  325.400   8.7173 8.541473 14.72252 
1 1 1   21    4   32 o  307.148   6.2326   72.344   2.9301   72.501   4.5649   72.234   3.8212  307.044   9.7132  306.697   8.1400 0.3464661 12.67305 
1 1 1   21    4   33 o  264.389   6.9493   53.640   2.8123   55.757   4.3832   52.159   3.6664  269.072   10.643  260.453   9.1969 8.618469 14.06589 
1 1 1   21    4   34 o  337.094   6.1814   87.164   3.1894   92.122   4.8950   83.506   4.2043  346.062   9.2411  329.638   8.3328 16.42395 12.44323 
1 1 1   21    4   35 o  247.555   7.4451   47.069   2.8211   44.660   4.2683   48.937   3.7592  240.527   11.594  252.100   9.7422 -11.57224 15.14335 
1 1 1   21    4   36 o  175.223   10.322   23.750   2.7561   25.934   3.8175   21.373   3.9831  182.397   13.775  164.939   15.977 17.45828 21.09591 
1 1 1   21    4   37 o   54.177   21.843   1.1403   2.7892   2.0291   3.5888  -0.2154   4.4326   63.719   25.076   60.274   26.095 3.444763 36.19077 
1 1 1   21    4   38 o  209.329   9.8364   33.782   3.1516   31.092   4.6336   36.099   4.2993  199.228   15.312  215.395   13.103 -16.16640 20.15284 
1 1 1   21    4   39 o   58.399   21.663   2.1671   2.5765   1.1795   3.7908   3.0150   3.5125   61.034   25.141   68.050   25.283 -7.016254 35.65562 
1 1 1   21    4   40 o  172.429   11.153   23.088   2.9278   24.962   4.5140   21.728   3.8467  177.743   16.791  166.183   15.295 11.55978 22.71243 
1 1 1   21    4   41 o  164.280   14.038   21.166   3.4959   23.448   7.6191   20.557   3.9345  165.821   31.163  161.256   16.158 4.564636 35.10291 
1 1 1   21    4   42 o   53.194   22.607   0.3037   3.2132   3.3922   4.4809  -2.9656   4.6102   73.829   28.305   53.235   24.511 20.59327 37.44307 
1 1 1   21    4   43 o  127.244   16.419   12.921   3.1233   11.197   4.9265   14.080   4.0386  114.278   28.311  131.400   20.770 -17.12218 35.11269 
1 1 1   21    4   44 o   42.018   19.544  -2.4986   3.0441  -4.1117   4.8055  -1.4175   3.9341   51.768   24.236   52.379   23.532 -0.6106606 33.78107 
1 1 1   21    4   45 o   96.512   21.322   7.7631   3.0658   5.7413   4.6318   9.3397   4.0900   84.782   29.322  104.622   25.721 -19.83978 39.00456 
1 1 1   21    4   46 o   61.575   23.323   2.4090   3.0194   3.6177   4.4430   1.3716   4.1160   73.869   28.217   62.882   26.076 10.98719 38.42093 
1 1 1   21    4   47 o  103.896   21.662   9.0628   3.3332   14.747   4.4597   1.8690   5.0170  132.741   22.770   69.147   28.741 63.59441 36.66748 
1 1 1   21    4   48 o   92.308   23.582   7.3132   3.3440   7.0768   4.3291   7.6629   5.2655   90.279   28.219   93.746   31.284 -3.466316 42.13095 
1 1 1   21    4   49 o  116.230   18.754   11.151   3.2228   7.8811   4.8631   13.711   4.3036   94.150   29.972  127.035   22.978 -32.88594 37.76680 
1 1 1   21    4   50 o   62.363   23.759   2.5969   3.1449   0.2578   4.7444   4.4302   4.2003   61.434   26.794   75.437   27.717 -14.00360 38.55105 
1 1 1   21    4   51 o  156.793   15.007   19.790   3.5576   12.028   4.8081   29.180   5.2886  115.177   27.628  188.322   18.590 -73.14500 33.30023 
1 1 1   21    4   52 o   61.535   24.725   2.2002   3.5606  -2.9443   5.7078   5.4774   4.5556   57.577   26.775   79.861   28.938 -22.28430 39.42502 
1 1 1   21    4   53 o  153.857   14.773   19.218   3.4363   31.633   4.5526   2.7786   5.2386  197.384   15.185   70.036   29.261 127.3484 32.96688 
1 1 1   21    4   54 o  174.665   13.067   24.512   3.4681   26.026   5.1391   23.247   4.6996  175.103   19.506  165.953   18.835 9.149933 27.11527 
1 1 1   21    5    0 o  803.124   12.968  494.485   15.932  494.485   15.932  494.485   15.932  803.124   12.968  803.124   12.968 0.000000 0.000000 
1 1 1   21    5    1 o  420.352   8.4477  135.336   5.4353  127.809   7.8394  142.303   7.5425  408.298   12.544  430.892   11.436 -22.59369 16.97454 
1 1 1   21    5    2 o  564.195   11.058  243.948   9.5497   0.0000   0.0000  243.948   9.5497  ?   ?   564.195   11.058 0.000000 11.05833 
1 1 1   21    5    3 o  660.389   8.4050  334.032   8.4958  339.947   12.899  329.500   11.291  665.871   12.656  655.685   11.250 10.18628 16.93330 
1 1 1   21    5    4 o  198.043   10.085   30.129   3.0470   49.646   6.5517   24.743   3.4419  253.714   16.969  179.200   12.629 74.51389 21.15273 
1 1 1   21    5    5 o  372.674   14.140  106.539   8.0656  106.539   8.0656   0.0000   0.0000  372.674   14.140  ?   ?  0.000000 14.13959 
1 1 1   21    5    6 o  452.252   8.3446  156.660   5.7764  167.714   9.4297  150.021   7.3081  467.648   13.174  442.442   10.791 25.20621 17.02940 
1 1 1   21    5    7 o  400.447   9.1099  122.848   5.5838  122.848   5.5838   0.0000   0.0000  400.447   9.1099  ?   ?  0.000000 9.109916 
1 1 1   21    5    8 o  509.213   6.0156  198.533   4.6886  207.963   7.0992  191.238   6.2442  521.026   8.9018  499.675   8.1643 21.35147 12.07887 
1 1 1   21    5    9 o  322.641   6.5464   79.711   3.2329   90.515   5.2107   72.949   4.1222  343.690   9.9050  308.587   8.7274 35.10339 13.20140 
1 1 1   21    5   10 o  336.628   6.6024   86.774   3.4019   93.474   5.4103   82.394   4.3750  349.245   10.121  327.950   8.7156 21.29489 13.35643 
1 1 1   21    5   11 o  446.881   6.3331  152.920   4.3319  160.964   6.6124  146.871   5.7336  458.331   9.4256  437.854   8.5551 20.47644 12.72917 
1 1 1   21    5   12 o  343.338   6.8463   90.277   3.5979   89.500   5.5448   90.842   4.7285  341.697   10.602  344.327   8.9718 -2.629913 13.88850 
1 1 1   21    5   13 o  589.824   6.4227  266.413   5.7984  288.991   8.9429  250.038   7.6163  614.079   9.5145  571.259   8.7104 42.82025 12.89949 
1 1 1   21    5   14 o  815.564   7.9505  509.558   9.9248  555.472   18.382  490.665   11.791  850.593   14.119  800.114   9.6280 50.47870 17.08918 
1 1 1   21    5   15 o  209.151   9.3364   33.527   2.9889   37.755   5.0693   31.275   3.7006  221.178   15.064  201.546   12.051 19.63171 19.29082 
1 1 1   21    5   16 o  796.690   5.4313  486.013   6.6231  513.960   9.9681  463.925   8.8620  819.027   7.9514  778.195   7.4400 40.83264 10.88942 
1 1 1   21    5   17 o  135.070   8.0921   14.030   1.6653   16.605   2.5992   12.237   2.1689  146.648   11.676  125.781   11.389 20.86694 16.31097 
1 1 1   21    5   18 o   65.380   16.630   3.4162   1.6681   1.2266   2.5746   5.0002   2.1898   53.668   21.201   78.991   18.446 -25.32294 28.10269 
1 1 1   21    5   19 o  225.257   7.1098   38.875   2.4514   47.768   5.5643   36.733   2.7306  248.827   14.675  218.926   8.1489 29.90070 16.78540 
1 1 1   21    5   20 o   75.246   15.108   4.5104   1.6796   4.9448   2.9777   4.3077   2.0341   79.161   23.126   73.312   18.209 5.848221 29.43446 
1 1 1   21    5   21 o  407.567   5.3454  127.217   3.3346  121.305   4.9299  132.203   4.5275  397.804   8.0965  415.364   7.1213 -17.55981 10.78269 
1 1 1   21    5   22 f  445.112   5.8933  151.767   4.0151  157.562   5.6269  145.755   5.7309  453.346   8.1091  435.983   8.5879 17.36316 11.81137 
1 1 1   21    5   23 o  279.120   5.9639   59.684   2.5480   60.597   4.3771   59.216   3.1336  280.976   10.178  277.951   7.3656 3.025299 12.56325 
1 1 1   21    5   24 o  548.989   5.3391  230.856   4.4865  213.299   7.8892  239.248   5.4543  527.166   9.7772  558.775   6.3772 -31.60950 11.67319 
1 1 1   21    5   25 o  138.242   13.272   14.842   2.7738   20.275   6.3369   13.555   3.0850  158.840   27.033  131.665   15.612 27.17509 31.21728 
1 1 1   21    5   26 o  523.146   6.5089  209.758   5.2120   0.0000   0.0000  209.758   5.2120  ?   ?   523.146   6.5089 0.000000 6.508948 
1 1 1   21    5   27 o  342.218   5.8546   89.741   3.0667  100.129   5.6426   85.387   3.6534  361.018   10.211  333.708   7.1525 27.30963 12.46712 
1 1 1   21    5   28 o  546.828   5.3236  229.100   4.4558  243.215   7.7594  222.155   5.4426  562.837   9.0068  538.314   6.6054 24.52350 11.16937 
1 1 1   21    5   29 o  231.699   7.7371   41.190   2.7439   31.392   5.6556   44.206   3.1380  200.231   18.669  239.966   8.5434 -39.73474 20.53076 
1 1 1   21    5   30 o  185.622   9.1362   26.469   2.5958   26.125   5.5451   26.566   2.9375  182.019   20.246  185.573   10.383 -3.554352 22.75366 
1 1 1   21    5   31 o  218.713   9.4037   36.767   3.1481   34.208   7.1711   37.377   3.5037  207.609   22.951  220.419   10.385 -12.80936 25.19091 
1 1 1   21    5   32 o  144.712   10.156   16.191   2.2353   21.788   3.6615   12.866   2.8223  167.213   14.448  128.133   14.654 39.07997 20.57842 
1 1 1   21    5   33 o  358.379   5.8729   98.485   3.2215  101.556   5.0433   96.367   4.1871  363.437   9.0660  354.254   7.7221 9.182312 11.90892 
1 1 1   21    5   34 o  253.613   7.1866   49.379   2.7897   54.031   4.4126   46.283   3.6006  264.750   10.889  245.230   9.5926 19.51990 14.51167 
1 1 1   21    5   35 o  285.210   7.2500   62.469   3.1650   64.939   4.5656   60.183   4.3914  290.292   10.275  279.462   10.266 10.83008 14.52505 
1 1 1   21    5   36 o  208.001   8.3470   33.271   2.6575   35.294   4.1527   31.868   3.4583  213.171   12.786  202.881   11.180 10.29068 16.98454 
1 1 1   21    5   37 o  187.370   14.462   27.432   4.1155   27.432   4.1155   0.0000   0.0000  187.370   14.462  ?   ?  0.000000 14.46208 
1 1 1   21    5   38 o  142.834   12.489   15.917   2.7029   17.919   4.3605   14.668   3.4445  149.692   19.494  135.975   16.915 13.71724 25.80947 
1 1 1   21    5   39 o   69.053   22.032   3.7467   2.6266   1.4241   3.7576   5.9658   3.6730   61.841   25.200   85.408   25.868 -23.56651 36.11397 
1 1 1   21    5   40 o   67.253   24.117   3.1837   3.1542   4.1679   6.8927   2.9230   3.5474   86.678   34.548   67.620   25.352 19.05823 42.85193 
1 1 1   21    5   41 o   55.561   21.769   1.5764   2.6939  -2.1683   4.0371   4.5822   3.6170   51.235   23.343   76.845   25.927 -25.61063 34.88713 
1 1 1   21    5   42 o  260.753   9.3157   52.473   3.7180   49.679   5.2204   55.349   5.2966  252.192   13.574  266.760   12.972 -14.56808 18.77559 
1 1 1   21    5   43 f  203.459   10.997   32.163   3.4119   31.312   5.7383   32.628   4.2434  197.749   19.200  204.105   13.662 -6.356155 23.56479 
1 1 1   21    5   44 o  150.540   13.701   17.833   3.1223   16.568   4.8968   18.700   4.0532  141.429   23.441  152.842   17.650 -11.41304 29.34323 
1 1 1   21    5   45 o  147.891   13.886   17.253   3.1064   18.133   4.6785   16.560   4.1544  148.873   21.124  142.831   19.513 6.042267 28.75744 
1 1 1   21    5   46 o  164.179   12.680   21.162   3.1619   21.412   4.6163   20.941   4.3396  162.724   18.885  161.351   17.872 1.373596 26.00098 
1 1 1   21    5   47 o   65.636   24.137   3.0432   3.1861   2.8418   4.1779   3.3231   4.9255   68.974   27.084   74.127   29.312 -5.153633 39.90883 
1 1 1   21    5   48 o  173.220   12.049   23.571   3.1748   28.077   4.5304   19.222   4.4504  187.384   15.947  153.187   19.416 34.19655 25.12591 
1 1 1   21    5   49 o   46.311   21.403  -2.3110   3.5635  -7.3276   4.9973   2.8789   5.0829   46.324   22.485   72.229   29.357 -25.90454 36.97886 
1 1 1   21    5   50 o  259.884   10.917   52.777   4.3426   38.186   6.7320   63.174   5.6830  214.592   20.755  283.043   13.118 -68.45020 24.55275 
1 1 1   21    5   51 o  121.334   17.986   12.191   3.2392   15.962   4.7232   8.8421   4.4508  135.786   23.581   98.295   28.147 37.49147 36.71932 
1 1 1   21    5   52 o   60.095   24.461   1.9203   3.5355   3.6636   5.5768   0.7488   4.5717   74.805   30.616   60.984   26.452 13.82141 40.46061 
1 1 1   21    5   53 o  205.566   12.105   33.605   3.7921   32.585   4.6145   35.727   6.6551  200.293   15.164  203.898   21.656 -3.605072 26.43710 
1 1 1   21    5   54 o   88.389   23.501   7.0955   3.2343   4.0252   4.6901   9.8795   4.4661   72.294   28.598  101.635   27.873 -29.34186 39.93416 
1 1 1   21    6    0 o  407.511   11.988  127.527   7.4627  127.527   7.4627  127.527   7.4627  407.511   11.988  407.511   11.988 0.000000 0.000000 
1 1 1   21    6    1 o  249.893   10.205   47.849   3.9032   47.124   6.1490   48.338   5.0514  247.224   16.342  250.719   13.210 -3.494247 21.01321 
1 1 1   21    6    2 o  243.589   11.988   45.486   4.4696   0.0000   0.0000   45.486   4.4696  ?   ?   243.589   11.988 0.000000 11.98795 
1 1 1   21    6    3 o  780.154   8.8630  466.230   10.584  491.473   16.624  449.027   13.724  800.501   13.568  765.362   11.715 35.13849 17.92575 
1 1 1   21    6    4 o  449.326   8.1908  154.635   5.6333  153.691   9.2202  155.197   7.1158  447.651   13.457  450.036   10.330 -2.385620 16.96437 
1 1 1   21    6    5 o  847.575   9.6052  550.400   12.461  614.012   20.142  510.955   15.861  894.548   14.710  816.301   12.694 78.24634 19.43027 
1 1 1   21    6    6 o  586.958   8.5781  263.903   7.7067  281.595   12.409  252.795   9.8328  605.921   13.380  574.291   11.186 31.63074 17.43993 
1 1 1   21    6    7 o  781.534   9.6354  467.995   11.526  467.995   11.526   0.0000   0.0000  781.534   9.6354  ?   ?  0.000000 9.635404 
1 1 1   21    6    8 o  869.441   8.1031  579.012   10.784  592.502   13.760  557.542   17.360  879.291   10.224  852.558   13.303 26.73230 16.77794 
1 1 1   21    6    9 o  513.016   7.1524  201.557   5.6163  203.785   7.2895  198.302   8.8102  515.727   9.2343  508.598   11.317 7.129944 14.60662 
1 1 1   21    6   10 o  505.844   6.2825  195.933   4.8643  203.968   7.4341  189.918   6.4323  515.937   9.4138  497.910   8.4401 18.02698 12.64337 
1 1 1   21    6   11 o  530.482   6.3157  215.491   5.1281  231.102   7.9283  204.262   6.7241  549.168   9.4320  516.355   8.5078 32.81323 12.70218 
1 1 1   21    6   12 o  677.412   6.6143  351.423   6.8581  371.310   10.470  336.479   9.0761  696.040   9.8278  662.672   8.9481 33.36823 13.29111 
1 1 1   21    6   13 f  314.049   7.2736   75.544   3.4964   78.377   5.5652   73.696   4.4940  319.694   11.373  310.095   9.4683 9.598694 14.79847 
1 1 1   21    6   14 o  456.973   7.2511  159.956   5.0718  163.197   9.0621  158.477   6.1201  461.151   12.839  454.763   8.7924 6.387421 15.56073 
1 1 1   21    6   15 o  200.822   9.6418   30.915   2.9637   31.875   4.7477   30.303   3.7937  203.084   15.388  198.315   12.563 4.768997 19.86477 
1 1 1   21    6   16 o  491.385   5.4502  184.895   4.0993  189.279   5.2327  177.930   6.5955  497.095   6.8773  481.816   8.9433 15.27933 11.28183 
1 1 1   21    6   17 o  628.876   5.0437  302.822   4.8550  309.372   7.1872  297.325   6.5843  635.458   7.3893  623.005   6.9048 12.45325 10.11322 
1 1 1   21    6   18 o  286.596   5.2825   62.898   2.3173   64.942   3.6184   61.476   3.0172  291.100   8.1209  283.278   6.9585 7.821533 10.69444 
1 1 1   21    6   19 o  118.317   10.037   10.814   1.8005   14.722   2.9431   8.4775   2.2761  137.667   14.169  103.982   14.712 33.68533 20.42563 
1 1 1   21    6   20 o  159.031   9.0053   19.455   2.1831   19.868   5.2082   19.367   2.4045  158.746   22.028  158.579   9.9566 0.1670685 24.17414 
1 1 1   21    6   21 o  542.984   5.1195  225.789   4.2548  239.396   6.5919  216.071   5.5707  558.870   7.7060  531.030   6.8536 27.83972 10.31284 
1 1 1   21    6   22 o  131.012   9.6225   13.240   1.9161   12.106   3.5941   13.690   2.2648  123.648   19.647  133.048   11.226 -9.399849 22.62839 
1 1 1   21    6   23 o   91.015   15.072   6.5481   2.0262   4.3001   5.8278   6.8572   2.1610   85.703   32.417   93.069   15.731 -7.365646 36.03194 
1 1 1   21    6   24 f  171.446   9.0982   22.617   2.3790   21.443   6.3985   22.805   2.5627  163.677   26.441  172.090   9.7695 -8.412781 28.18823 
1 1 1   21    6   25 o  330.791   7.2650   83.889   3.6784   79.765   5.1106   88.322   5.2985  322.267   10.361  339.131   10.207 -16.86420 14.54426 
1 1 1   21    6   26 o  447.888   5.5929  153.694   3.8342  171.350   7.6133  147.694   4.4381  472.253   10.532  438.963   6.6055 33.28964 12.43238 
1 1 1   21    6   27 o  211.837   7.4685   34.416   2.4216   43.015   5.1508   31.976   2.7437  235.738   14.343  204.108   8.7824 31.63033 16.81830 
1 1 1   21    6   28 o   74.513   18.963   4.4752   2.1682  -2.6995   5.2155   5.9742   2.3840   59.144   26.784   86.138   18.624 -26.99372 32.62261 
1 1 1   21    6   29 o  511.954   5.6430  200.863   4.4219  212.824   8.8583  196.893   5.1032  525.964   11.003  506.745   6.5793 19.21970 12.82027 
1 1 1   21    6   30 o  122.107   12.469   11.610   2.2977   22.339   5.1200   8.9041   2.5712  168.102   20.311  106.016   16.373 62.08641 26.08805 
1 1 1   21    6   31 o  138.336   13.735   14.924   2.8698   9.7316   9.1389   15.492   3.0227  114.344   41.046  140.879   14.212 -26.53479 43.43701 
1 1 1   21    6   32 o   64.829   21.284   3.1745   2.4408  -6.5329   7.4603   4.3382   2.5830   64.733   30.271   73.654   21.545 -8.921066 37.15569 
1 1 1   21    6   33 f  145.750   11.604   16.485   2.5672   19.699   5.8094   15.705   2.8618  155.844   25.215  141.921   13.330 13.92268 28.52229 
1 1 1   21    6   34 o   46.095   19.912  -0.2121   2.5694   1.3516   5.7493  -0.6023   2.8722   73.408   30.661   47.205   20.711 26.20301 37.00046 
1 1 1   21    6   35 o  332.677   7.5578   85.023   3.8485   85.353   6.5865   84.852   4.7422  332.101   12.957  332.011   9.3316 0.9027100E-01 15.96769 
1 1 1   21    6   36 o  181.318   9.9841   25.412   2.7602   25.082   4.0648   25.695   3.7600  179.031   14.971  181.559   13.630 -2.527390 20.24577 
1 1 1   21    6   37 o  191.184   10.243   28.268   2.9864   26.186   4.2447   30.310   4.2024  182.793   15.312  197.108   14.021 -14.31512 20.76145 
1 1 1   21    6   38 o  123.863   14.020   12.067   2.6112   13.810   4.2154   10.982   3.3263  130.319   21.910  116.688   19.298 13.63126 29.19723 
1 1 1   21    6   39 o  225.793   8.5380   39.252   2.9508   45.875   4.6487   34.783   3.8187  242.949   12.544  211.651   11.835 31.29834 17.24581 
1 1 1   21    6   40 o  171.611   14.139   23.079   3.6809   33.713   7.5670   19.783   4.2129  203.218   24.844  157.705   17.762 45.51276 30.54067 
1 1 1   21    6   41 o  161.659   12.504   20.405   3.0700   15.174   4.3817   25.449   4.3028  136.408   21.714  179.646   15.809 -43.23872 26.85952 
1 1 1   21    6   42 o  193.885   11.165   29.214   3.2995   33.262   4.7079   25.305   4.6257  205.687   15.058  178.536   17.138 27.15102 22.81331 
1 1 1   21    6   43 o  178.549   13.235   24.969   3.5912   19.557   5.3807   29.317   4.8226  154.025   23.573  192.364   16.540 -38.33911 28.79688 
1 1 1   21    6   44 o  185.947   10.930   26.897   3.0972   33.567   4.8443   22.286   4.0281  206.208   15.461  167.653   15.887 38.55545 22.16800 
1 1 1   21    6   45 o  146.221   13.723   16.863   3.0355   17.036   4.5944   16.729   4.0438  144.000   21.504  143.805   18.823 0.1951141 28.57852 
1 1 1   21    6   46 o   47.783   20.818  -0.2467   2.8572   0.7902   4.1534  -1.1782   3.9367   60.829   25.770   52.820   23.648 8.009315 34.97646 
1 1 1   21    6   47 o   56.272   23.013   1.2581   3.1477  -1.2330   4.1003   4.8328   4.9117   53.610   24.059   80.352   29.889 -26.74131 38.36952 
1 1 1   21    6   48 o  178.054   11.781   24.881   3.1927   25.389   4.5437   24.386   4.4870  177.577   16.922  173.930   17.075 3.646713 24.03913 
1 1 1   21    6   49 o   99.868   24.937   8.7149   3.8004   9.8421   4.8962   7.0067   6.0276  104.320   29.401   90.879   33.232 13.44116 44.37091 
1 1 1   21    6   50 o   69.886   23.715   3.9816   3.0264   1.0499   4.2098   7.1171   4.3536   61.010   25.901   89.435   28.347 -28.42485 38.39807 
1 1 1   21    6   51 o  122.236   19.575   12.552   3.5389   2.2417   5.5100   19.791   4.6171   70.509   29.766  153.661   20.114 -83.15241 35.92463 
1 1 1   21    6   52 o  153.423   13.801   18.921   3.2063   20.390   4.4082   17.272   4.6720  156.236   18.812  141.299   22.345 14.93680 29.20944 
1 1 1   21    6   53 o  168.350   13.289   22.764   3.3965   19.863   4.2952   27.605   5.5486  153.773   18.629  179.938   20.513 -26.16476 27.70935 
1 1 1   21    6   54 f   73.338   23.730   4.7857   3.0391   7.3063   4.2391   2.1202   4.3592   87.642   27.992   63.709   26.662 23.93307 38.65723 
1 1 1   21    7    0 o  239.157   14.130   44.282   5.1312   44.282   5.1312   44.282   5.1312  239.157   14.130  239.157   14.130 0.000000 0.000000 
1 1 1   21    7    1 o  811.552   9.0005  504.539   11.180  505.873   16.219  503.332   15.433  812.188   13.047  810.220   12.444 1.967773 18.02995 
1 1 1   21    7    2 o  326.130   6.7492   81.444   3.3691   0.0000   0.0000   81.444   3.3691  ?   ?   326.130   6.7492 0.000000 6.749167 
1 1 1   21    7    3 o  747.252   7.0313  427.598   8.0422  446.862   15.527  420.535   9.4016  763.308   13.289  740.968   8.2896 22.34070 15.66283 
1 1 1   21    7    4 o  829.810   9.4024  527.558   11.942  553.401   18.281  508.320   15.773  849.319   14.063  814.179   12.657 35.14038 18.91958 
1 1 1   21    7    5 o  332.698   8.8417   84.794   4.5025   99.669   8.3936   78.784   5.3351  360.355   15.218  320.611   10.872 39.74332 18.70211 
1 1 1   21    7    6 o  763.103   9.3125  446.157   10.877  483.756   17.273  421.451   14.002  794.022   14.213  741.363   12.339 52.65906 18.82172 
1 1 1   21    7    7 o  233.453   12.636   41.919   4.4985   41.919   4.4985   0.0000   0.0000  233.453   12.636  ?   ?  0.000000 12.63632 
1 1 1   21    7    8 o  383.656   7.3296  112.729   4.3042  120.864   5.8145  102.869   6.4019  397.156   9.5649  366.303   11.418 30.85242 14.89502 
1 1 1   21    7    9 o  151.738   12.712   17.784   2.9252   14.866   4.0106   21.101   4.2760  137.650   19.588  164.823   17.203 -27.17329 26.06936 
1 1 1   21    7   10 o  529.821   7.3939  215.001   5.9961  221.650   7.7343  204.984   9.4930  537.820   9.3954  516.999   11.996 20.82098 15.23748 
1 1 1   21    7   11 o  498.616   6.4212  190.389   4.9007  207.552   7.6237  178.302   6.3976  520.409   9.5709  482.406   8.6643 38.00311 12.91014 
1 1 1   21    7   12 o  249.112   8.2698   47.544   3.1533   49.281   5.1730   46.517   3.9777  253.049   13.403  246.324   10.550 6.724823 17.05742 
1 1 1   21    7   13 o  480.884   6.5699  177.104   4.8358  172.898   7.3014  180.392   6.4543  474.912   10.044  485.197   8.6909 -10.28445 13.28237 
1 1 1   21    7   14 o  190.851   10.455   28.012   3.0425   26.870   5.5457   28.504   3.6391  185.710   19.816  192.333   12.428 -6.622406 23.39042 
1 1 1   21    7   15 f  398.215   6.9069  121.466   4.2099  129.007   6.5736  116.223   5.4815  410.157   10.471  389.393   9.1969 20.76407 13.93631 
1 1 1   21    7   16 o  216.361   6.5987   35.856   2.1853   32.961   2.6036   42.759   4.0199  207.394   8.2018  236.086   11.124 -28.69255 13.82108 
1 1 1   21    7   17 o  137.376   9.7419   14.544   2.0352   14.390   2.5076   14.841   3.4835  136.380   12.140  137.841   16.863 -1.460297 20.77775 
1 1 1   21    7   18 o  152.923   9.6002   18.003   2.2357   18.820   2.8138   16.605   3.6820  156.129   11.863  145.907   16.793 10.22183 20.56072 
1 1 1   21    7   19 o  438.397   5.8372  147.204   3.9169  155.268   5.1894  136.527   5.9712  450.126   7.5320  421.947   9.2456 28.17899 11.92522 
1 1 1   21    7   20 o  336.799   5.9693   86.889   3.0773   90.471   6.6681   85.920   3.4687  343.139   12.696  334.874   6.7674 8.265686 14.38684 
1 1 1   21    7   21 o   86.207   13.658   5.8542   1.7421   5.5104   3.4702   5.9700   2.0142   83.704   25.097   86.718   15.756 -3.014153 29.63309 
1 1 1   21    7   22 o  121.793   10.815   11.479   1.9952   12.085   5.7329   11.395   2.1282  121.731   30.757  121.243   11.610 0.4885330 32.87521 
1 1 1   21    7   23 o  368.056   5.4459  103.766   3.0680   86.437   5.7917  110.525   3.6171  335.429   11.281  379.803   6.2221 -44.37448 12.88282 
1 1 1   21    7   24 o  112.426   11.439   9.8131   1.9410   11.593   4.1021   9.2996   2.2033  120.106   23.153  109.103   13.480 11.00343 26.79154 
1 1 1   21    7   25 o  431.457   5.2476  142.600   3.4655  156.113   6.2392  136.571   4.1676  451.021   9.0377  422.136   6.4500 28.88489 11.10330 
1 1 1   21    7   26 o   84.158   20.130   5.7170   2.5581   3.1519   4.8572   6.7016   3.0093   76.347   29.419   91.006   21.874 -14.65884 36.66052 
1 1 1   21    7   27 o  242.956   7.1103   45.263   2.6442   50.829   6.0001   43.922   2.9456  256.093   15.378  239.264   8.0432 16.82895 17.35465 
1 1 1   21    7   28 o  104.882   13.678   8.6239   2.1435   8.5709   4.8267   8.6369   2.3924  102.657   29.282  104.635   15.398 -1.978111 33.08419 
1 1 1   21    7   29 o  164.814   9.4771   20.940   2.3807   23.031   5.2043   20.386   2.6772  170.783   20.307  162.433   10.830 8.350098 23.01453 
1 1 1   21    7   30 o  215.255   7.8627   35.565   2.5906   36.991   5.4622   35.151   2.9426  217.846   16.504  213.903   8.9875 3.943787 18.79244 
1 1 1   21    7   31 o  343.615   6.7593   90.573   3.5550   88.172   6.3117   91.688   4.3024  338.142   12.195  345.544   8.1346 -7.401306 14.65898 
1 1 1   21    7   32 o  229.354   8.6229   40.422   3.0271   30.456   10.466   41.332   3.1623  189.632   37.388  231.889   8.9094 -42.25644 38.43479 
1 1 1   21    7   33 o  305.335   7.0432   71.559   3.2917   80.471   7.4106   69.369   3.6740  322.118   15.030  300.499   7.9878 21.61832 17.02111 
1 1 1   21    7   34 f  155.536   12.817   18.831   3.0243   19.535   5.8036   18.568   3.5434  154.854   25.364  153.908   15.242 0.9466553 29.59105 
1 1 1   21    7   35 o   75.766   22.812   4.6043   2.8626   6.1213   5.7729   4.1096   3.2964   91.280   32.638   73.647   24.752 17.63357 40.96237 
1 1 1   21    7   36 o  110.192   16.603   9.6727   2.7135   25.029   6.0101   5.7412   3.0410  176.308   22.805   83.699   23.019 92.60880 32.40305 
1 1 1   21    7   37 o  175.301   13.155   23.952   3.5039   14.843   6.4374   27.786   4.1768  131.803   32.187  188.509   14.590 -56.70607 35.33958 
1 1 1   21    7   38 o  258.166   9.1102   51.345   3.6000   36.839   8.7582   54.294   3.9490  211.578   27.710  265.356   9.7227 -53.77834 29.36640 
1 1 1   21    7   39 o  252.105   8.8964   48.963   3.4329   49.036   7.6107   48.945   3.8465  248.182   20.210  251.844   9.9784 -3.661423 22.53939 
1 1 1   21    7   40 o  237.928   9.8689   43.698   3.5940   56.996   8.1039   40.442   4.0100  267.572   19.930  228.261   11.514 39.31076 23.01709 
1 1 1   21    7   41 o   46.679   20.481  -0.5128   2.8092   2.2974   3.9945  -3.2629   3.9515   66.731   26.394   47.688   22.210 19.04360 34.49525 
1 1 1   21    7   42 f  148.355   15.995   17.455   3.5746   14.354   4.7442   21.528   5.4368  131.298   24.508  162.394   22.476 -31.09602 33.25365 
1 1 1   21    7   43 o   82.776   22.408   5.7069   2.9087   5.0211   4.5481   6.1815   3.7836   81.366   28.983   86.173   26.289 -4.807808 39.12955 
1 1 1   21    7   44 f   60.009   23.045   2.1313   2.9732   8.4323   4.8113  -1.7613   3.7816   99.058   29.518   50.170   22.755 48.88806 37.27061 
1 1 1   21    7   45 o  149.314   13.719   17.584   3.1004   20.663   4.7479   15.296   4.0937  159.519   19.877  136.833   20.149 22.68657 28.30311 
1 1 1   21    7   46 o   89.729   23.472   6.8405   3.2606   9.0672   4.3623   4.0214   4.9084  102.132   27.356   77.138   29.612 24.99352 40.31437 
1 1 1   21    7   47 o   97.438   21.045   7.9802   3.0469   11.014   4.3420   5.0365   4.2766  112.848   25.711   79.563   28.129 33.28465 38.10945 
1 1 1   21    7   48 o  140.291   14.595   15.712   3.0881   14.016   4.2384   17.631   4.5085  128.994   22.272  145.784   20.794 -16.79039 30.47000 
1 1 1   21    7   49 o  104.078   23.518   9.3565   3.6584   7.3675   4.7354   12.301   5.7617   91.226   29.631  115.259   31.679 -24.03306 43.37682 
1 1 1   21    7   50 o   81.180   23.552   5.7161   3.0979   2.3258   4.3491   9.2079   4.4138   66.442   27.097  100.939   27.720 -34.49745 38.76437 
1 1 1   21    7   51 o   40.284   19.231  -3.7694   3.3142  -6.6130   5.2584  -1.8953   4.2689   48.492   23.424   51.820   23.758 -3.328625 33.36372 
1 1 1   21    7   52 o   77.103   23.606   5.2494   3.0472   2.4136   4.1514   8.5623   4.4871   64.815   26.458   95.459   28.520 -30.64420 38.90275 
1 1 1   21    7   53 o  105.300   20.964   9.6663   3.2601   6.1342   4.1524   15.341   5.2635   81.777   27.779  128.125   27.650 -46.34830 39.19476 
1 1 1   21    8    1 o  284.636   6.1470   62.033   2.6781   61.241   5.5722   62.271   3.0539  282.584   12.883  285.161   6.9968 -2.576996 14.66015 
1 1 1   21    8    2 o  339.471   6.6102   88.244   3.4347   0.0000   0.0000   88.244   3.4347  ?   ?   339.471   6.6102 0.000000 6.610206 
1 1 1   21    8    3 o  176.537   11.517   23.993   3.0951   25.007   5.7323   23.576   3.6772  178.995   21.344  174.756   13.861 4.238815 25.44959 
1 1 1   21    8    4 o  975.648   10.284  729.492   15.358  775.327   23.464  695.140   20.314  1005.01   15.253  951.853   13.943 53.15320 20.66561 
1 1 1   21    8    5 o  403.309   8.6667  124.608   5.3501  123.668   8.7239  125.174   6.7733  401.452   14.197  404.105   10.951 -2.653625 17.92990 
1 1 1   21    8    6 o  669.322   8.9869  343.227   9.2069  354.723   14.097  334.676   12.158  679.970   13.545  660.649   12.023 19.32080 18.11138 
1 1 1   21    8    7 o  407.776   9.5891  127.419   5.9851  127.419   5.9851   0.0000   0.0000  407.776   9.5891  ?   ?  0.000000 9.589080 
1 1 1   21    8    8 o  399.301   7.4055  122.118   4.5261  132.933   6.1023  108.892   6.7481  416.499   9.5722  376.840   11.699 39.65924 15.11616 
1 1 1   21    8    9 o  192.850   10.952   28.605   3.2195   27.295   4.3917   30.126   4.7337  187.901   15.405  197.419   15.798 -9.518524 22.06572 
1 1 1   21    8   10 o  393.109   7.7924  118.377   4.6887  125.191   6.1213  108.704   7.2934  404.150   9.8954  376.421   12.659 27.72968 16.06728 
1 1 1   21    8   11 o  118.885   18.255   11.122   3.2156   14.801   4.3552   6.7133   4.7678  136.958   21.482   93.703   29.661 43.25512 36.62306 
1 1 1   21    8   12 o  608.534   7.6939  283.684   7.1664  293.325   9.1759  268.607   11.475  618.610   9.6908  591.645   12.671 26.96484 15.95222 
1 1 1   21    8   13 o  361.996   7.0574  100.375   3.9104  108.880   6.1875   94.719   5.0457  376.807   10.728  351.533   9.3774 25.27475 14.24893 
1 1 1   21    8   14 o  375.194   7.7333  107.852   4.4411   98.069   7.7565  112.623   5.4169  357.311   14.182  383.315   9.2327 -26.00348 16.92280 
1 1 1   21    8   15 o   95.042   19.555   7.2166   2.7498   1.6837   4.5514   10.397   3.4508   69.175   27.898  114.409   20.456 -45.23390 34.59436 
1 1 1   21    8   16 o  457.470   6.8983  160.319   4.8303  171.217   7.5811  152.872   6.2670  472.462   10.483  446.552   9.1689 25.90994 13.92726 
1 1 1   21    8   17 o  305.490   6.1870   71.481   2.8930   69.562   3.5675   75.168   4.9440  301.291   7.7360  313.038   10.318 -11.74713 12.89623 
1 1 1   21    8   18 o  158.458   9.7190   19.330   2.3459   20.893   3.0097   16.910   3.7445  164.517   12.036  147.214   16.926 17.30292 20.76876 
1 1 1   21    8   19 o  403.494   9.2593  124.858   5.7185  124.858   5.7185   0.0000   0.0000  403.494   9.2593  ?   ?  0.000000 9.259267 
1 1 1   21    8   20 o  275.831   8.7862   58.343   3.7095   61.774   6.1215   56.352   4.6632  283.381   14.113  270.911   11.246 12.46936 18.04545 
1 1 1   21    8   21 o  408.484   6.4599  127.846   4.0390  129.574   7.4358  127.123   4.8105  410.681   11.829  407.228   7.7176 3.453522 14.12401 
1 1 1   21    8   22 o  359.625   6.0663   99.085   3.3392   98.244   5.0083   99.758   4.4803  357.851   9.1436  360.691   8.1153 -2.840088 12.22556 
1 1 1   21    8   23 o   65.583   16.714   3.4474   1.6827   6.0978   3.9131   2.8462   1.8638   87.970   26.713   60.547   18.447 27.42236 32.46325 
1 1 1   21    8   24 o  117.140   10.673   10.627   1.8927   1.4572   4.1412   13.049   2.1280   65.394   26.528  129.882   10.802 -64.48786 28.64268 
1 1 1   21    8   25 o  274.357   6.3232   57.688   2.6553   59.573   5.9104   57.211   2.9722  278.060   13.887  273.170   7.1084 4.890350 15.60063 
1 1 1   21    8   26 o  258.994   8.1225   51.463   3.2200   51.444   5.9052   51.471   3.8413  257.748   15.033  258.879   9.6941 -1.130554 17.88800 
1 1 1   21    8   27 o  556.480   5.2456  237.256   4.4680  248.479   7.8639  231.906   5.4295  568.875   9.0313  550.015   6.4494 18.85944 11.09771 
1 1 1   21    8   28 o  174.620   8.5847   23.410   2.2945   22.429   5.0792   23.661   2.5719  168.616   20.075  175.223   9.6262 -6.607712 22.26342 
1 1 1   21    8   29 o  137.399   10.713   14.610   2.2352   14.269   5.1286   14.691   2.4835  132.327   26.248  137.597   11.909 -5.269806 28.82336 
1 1 1   21    8   30 o   77.670   18.869   4.8816   2.2210   6.6510   5.2289   4.4921   2.4534   93.119   31.175   74.704   20.727 18.41525 37.43632 
1 1 1   21    8   31 o  205.850   8.8775   32.565   2.7971   42.503   5.8284   29.591   3.1883  233.454   16.415  195.759   10.681 37.69467 19.58424 
1 1 1   21    8   32 o  395.986   6.3976  120.282   3.8776  124.610   9.5119  119.420   4.2465  400.799   15.505  394.468   7.0331 6.330597 17.02557 
1 1 1   21    8   33 o   74.691   22.304   4.4614   2.7449   10.041   6.5806   3.2862   3.0202  110.418   34.835   67.762   23.664 42.65629 42.11214 
1 1 1   21    8   34 o  141.064   15.290   15.634   3.2486   19.156   6.8716   14.620   3.6865  151.258   30.729  135.619   18.220 15.63863 35.72454 
1 1 1   21    8   35 o   92.254   18.799   6.9006   2.5645   18.708   6.0453   4.3095   2.8320  150.544   27.238   73.657   22.791 76.88679 35.51546 
1 1 1   21    8   36 o   91.527   19.308   6.8173   2.6199   12.366   6.4094   5.7043   2.8707  120.332   33.542   83.388   22.125 36.94386 40.18246 
1 1 1   21    8   37 o  168.359   11.815   22.028   3.0254   33.061   8.1020   20.240   3.2614  200.813   27.047  161.001   13.355 39.81197 30.16444 
1 1 1   21    8   38 o   39.320   18.923  -4.8424   3.3567   1.7082   7.0017  -6.7973   3.8249   79.828   33.619   39.557   19.306 40.27037 38.76806 
1 1 1   21    8   39 o  234.759   9.5126   42.503   3.4181   53.662   7.8523   39.894   3.7967  259.766   19.900  227.164   10.919 32.60210 22.69935 
1 1 1   21    8   40 o  107.557   19.477   9.4089   3.0884  -0.8571   7.4600   11.532   3.3928   74.911   33.102  119.439   19.210 -44.52842 38.27216 
1 1 1   21    8   41 o  196.027   11.619   29.888   3.4706   39.073   8.6569   28.129   3.7884  217.471   26.559  189.729   13.126 27.74210 29.62521 
1 1 1   21    8   42 o  120.420   22.484   11.984   3.9918   5.7248   7.3331   14.620   4.7586   92.519   36.008  132.554   24.351 -40.03476 43.46949 
1 1 1   21    8   43 o   53.409   23.120  -0.1085   3.4788  -5.4064   7.5416   1.3234   3.9208   65.442   30.548   61.909   25.543 3.533226 39.81960 
1 1 1   21    8   44 o  107.583   19.679   9.4998   3.1211   17.666   5.4105   5.4271   3.8209  145.074   25.285   81.558   26.622 63.51593 36.71589 
1 1 1   21    8   45 f  115.022   17.369   10.705   2.9627   8.4804   4.4954   12.414   3.9392   98.972   28.269  122.285   21.847 -23.31290 35.72775 
1 1 1   21    8   46 o  322.877   8.2881   80.516   4.0960   76.589   5.5658   85.157   6.0498  313.541   11.597  330.426   11.962 -16.88556 16.66088 
1 1 1   21    8   47 o  143.359   14.615   16.370   3.1622   11.583   4.8349   19.949   4.1803  114.656   27.831  157.041   17.699 -42.38547 32.98201 
1 1 1   21    8   48 o  163.392   13.087   21.110   3.2455   24.010   4.5031   17.975   4.6818  172.328   17.306  146.774   21.475 25.55458 27.58031 
1 1 1   21    8   49 o   57.970   23.902   1.3605   3.4302   3.4101   4.6435  -1.1014   5.0891   72.376   28.511   59.549   26.758 12.82716 39.10091 
1 1 1   21    8   50 o   62.249   22.942   2.8280   2.8808   5.1924   4.0627   0.4369   4.0856   78.549   27.445   57.961   25.073 20.58883 37.17385 
1 1 1   21    8   51 o  128.358   17.660   13.644   3.3778   14.087   5.3831   13.357   4.3381  123.071   29.044  123.341   23.841 -0.2692032 37.57622 
1 1 1   21    8   52 o   45.219   20.321  -0.8071   2.9361   0.0320   4.0865  -1.7024   4.2214   55.779   24.581   51.580   23.640 4.198620 34.10413 
1 1 1   21    8   53 o   68.756   24.332   3.9810   3.2007   8.1696   4.1698  -2.0268   4.9938   92.968   27.426   54.969   25.381 37.99878 37.36808 
1 1 1   21    9    0 o  740.888   8.3258  420.445   9.4390  420.445   9.4390  420.445   9.4390  740.888   8.3258  740.888   8.3258 0.000000 0.000000 
1 1 1   21    9    1 o  416.518   7.0018  132.859   4.4639  132.859   4.4639   0.0000   0.0000  416.518   7.0018  ?   ?  0.000000 7.001805 
1 1 1   21    9    2 o   66.694   13.071   3.5302   1.2866   3.7082   1.9155   3.3840   1.7367   68.252   18.056   65.199   17.166 3.052193 24.91390 
1 1 1   21    9    3 o  396.760   8.0815  120.581   4.9078  116.986   7.4858  123.292   6.4996  390.559   12.522  401.068   10.588 -10.50900 16.39836 
1 1 1   21    9    4 o  487.802   8.1958  182.275   6.1194  199.808   9.5296  169.973   7.9826  510.439   12.197  470.874   11.076 39.56418 16.47557 
1 1 1   21    9    5 o  685.958   8.8991  360.508   9.3436  375.899   14.118  348.511   12.464  699.986   13.176  674.134   12.079 25.85242 17.87547 
1 1 1   21    9    6 o  628.081   8.8658  302.245   8.5232  301.265   12.675  303.053   11.516  626.633   13.214  628.631   11.968 -1.997559 17.82866 
1 1 1   21    9    7 o  847.788   10.085  550.884   13.087  550.884   13.087   0.0000   0.0000  847.788   10.085  ?   ?  0.000000 10.08537 
1 1 1   21    9    8 o  222.682   10.085   38.008   3.4374   35.026   4.5425   42.004   5.2579  213.161   14.000  233.425   14.793 -20.26414 20.36740 
1 1 1   21    9    9 o  799.042   7.9763  489.113   9.7554  500.755   12.436  470.485   15.730  808.261   10.052  783.018   13.125 25.24329 16.53166 
1 1 1   21    9   10 o  426.315   7.8196  139.229   5.1025  145.317   6.6247  130.350   8.0005  435.404   9.9404  412.167   12.682 23.23691 16.11315 
1 1 1   21    9   11 o  564.707   7.7122  244.299   6.6661  237.737   8.3166  256.089   11.149  556.905   9.7565  577.690   12.608 -20.78552 15.94234 
1 1 1   21    9   12 f   70.039   24.360   3.3977   3.1991   2.2489   4.2067   4.9731   4.9264   69.531   27.214   85.447   30.193 -15.91507 40.64758 
1 1 1   21    9   13 o  152.748   15.669   18.123   3.6115   21.508   4.7797   13.619   5.5133  166.000   19.164  129.965   28.500 36.03513 34.34361 
1 1 1   21    9   14 o  561.782   9.2701  241.934   7.9712  253.360   11.658  231.902   10.924  574.396   13.260  549.572   12.986 24.82440 18.55974 
1 1 1   21    9   15 o  261.860   8.6636   52.558   3.4725   56.025   5.5384   50.313   4.4574  270.070   13.398  256.064   11.373 14.00565 17.57399 
1 1 1   21    9   16 o  115.599   16.951   10.505   2.9101   6.4522   4.9524   12.642   3.5966   92.599   30.313  126.638   19.153 -34.03876 35.85689 
1 1 1   21    9   17 o  495.525   5.6927  188.057   4.3177  198.271   5.6527  173.753   6.6898  508.685   7.2601  476.026   9.1815 32.65915 11.70506 
1 1 1   21    9   18 o  186.786   14.071   26.978   3.9933   24.895   5.3084   29.694   6.0608  178.460   19.766  194.925   20.627 -16.46533 28.56858 
1 1 1   21    9   19 o  628.097   10.475  302.766   10.071  302.766   10.071   0.0000   0.0000  628.097   10.475  ?   ?  0.000000 10.47502 
1 1 1   21    9   20 o  170.667   10.520   22.443   2.7348   25.604   5.4214   21.364   3.1673  180.882   19.911  166.258   12.538 14.62366 23.53013 
1 1 1   21    9   21 o  184.354   8.9783   26.071   2.5335   23.471   4.0098   27.798   3.2685  173.893   15.218  189.904   11.296 -16.01056 18.95224 
1 1 1   21    9   22 o  296.768   7.1620   67.508   3.2533   69.542   5.6005   66.472   3.9967  300.761   12.166  294.359   8.8706 6.402527 15.05629 
1 1 1   21    9   23 o   68.058   21.348   3.5637   2.4752   2.9577   4.6663   3.8010   2.9198   74.696   28.821   71.156   23.275 3.540131 37.04519 
1 1 1   21    9   24 o  132.093   13.172   13.564   2.6276   11.430   5.0542   14.354   3.0759  118.303   28.293  135.610   15.074 -17.30679 32.05826 
1 1 1   21    9   25 o  326.541   6.8109   81.743   3.4042   77.282   5.3858   84.711   4.3929  317.063   11.098  332.245   8.6383 -15.18207 14.06338 
1 1 1   21    9   26 o  122.276   14.962   11.710   2.7418   10.767   5.0514   12.103   3.2646  114.591   28.826  123.792   17.736 -9.200829 33.84521 
1 1 1   21    9   27 o  286.510   6.1843   62.923   2.7121   68.085   5.5304   61.288   3.1120  297.358   12.151  282.685   7.1922 14.67322 14.11983 
1 1 1   21    9   28 o  240.316   6.8498   44.290   2.5196   45.357   5.4017   43.993   2.8484  241.865   14.660  239.438   7.7722 2.426529 16.59311 
1 1 1   21    9   29 o  139.476   10.315   15.044   2.1865   16.877   5.1330   14.637   2.4167  144.772   24.005  137.379   11.601 7.392563 26.66163 
1 1 1   21    9   30 o  209.087   7.9689   33.566   2.5503   31.040   5.5483   34.242   2.8717  198.872   18.437  211.101   8.8874 -12.22910 20.46704 
1 1 1   21    9   31 o  244.507   7.9654   45.911   2.9811   46.513   5.8911   45.704   3.4562  244.375   15.835  243.807   9.2616 0.5675049 18.34443 
1 1 1   21    9   32 o   98.690   18.422   7.8341   2.6805   13.422   7.7401   7.0726   2.8573  125.924   37.420   93.242   20.572 32.68201 42.70223 
1 1 1   21    9   33 o  218.003   10.059   36.603   3.3564   41.905   6.1466   34.351   4.0065  231.158   17.502  210.469   12.493 20.68825 21.50330 
1 1 1   21    9   34 o  180.796   9.9028   25.254   2.7300   25.815   7.0967   25.157   2.9576  177.688   26.938  180.291   10.767 -2.602524 29.00987 
1 1 1   21    9   35 o  178.273   10.399   24.589   2.8253   18.947   7.0938   25.653   3.0801  149.621   31.947  181.964   11.112 -32.34303 33.82431 
1 1 1   21    9   36 o  276.460   7.6422   58.744   3.2339   59.827   7.1171   58.463   3.6303  276.214   16.916  275.638   8.6045 0.5751343 18.97828 
1 1 1   21    9   37 o  255.886   8.4648   50.392   3.3154   72.630   8.7136   46.627   3.5850  303.337   18.861  245.961   9.5225 57.37592 21.12837 
1 1 1   21    9   38 o  252.111   10.208   49.059   3.9390   47.996   7.4193   49.476   4.6482  245.742   19.896  252.768   12.014 -7.025787 23.24161 
1 1 1   21    9   39 o  444.358   6.6583  151.696   4.5286  162.331   9.2073  148.302   5.2012  457.132   13.159  439.063   7.7394 18.06833 15.26625 
1 1 1   21    9   40 o   56.526   22.643   1.4005   2.9761  -0.5571   8.0490   1.7105   3.2030   78.237   34.488   59.525   23.606 18.71234 41.79265 
1 1 1   21    9   41 o  235.356   9.8446   42.792   3.5464   43.141   7.5969   42.695   4.0102  231.308   21.712  234.777   11.159 -3.468628 24.41153 
1 1 1   21    9   42 o  118.914   20.650   11.576   3.6223   4.7375   7.4512   13.692   4.1450   89.551   35.843  129.147   21.741 -39.59671 41.92158 
1 1 1   21    9   43 o  288.791   9.0272   64.391   3.9903   76.825   8.4068   60.775   4.5335  311.127   17.727  280.109   10.574 31.01822 20.64085 
1 1 1   21    9   44 o  109.776   23.294   10.124   3.7928   2.6581   10.560   11.230   4.0640   93.086   40.289  115.570   23.768 -22.48380 46.77738 
1 1 1   21    9   45 o  365.348   8.9812  103.190   5.0224  106.076   8.7666  101.781   6.1277  366.712   15.618  361.905   11.062 4.806244 19.13896 
1 1 1   21    9   46 o   73.447   24.822   4.3150   3.3152   6.2071   5.8573   3.4231   4.0213   88.625   32.705   70.975   26.908 17.65001 42.35144 
1 1 1   21    9   47 o  227.835   10.816   40.427   3.7719   36.338   5.6988   43.614   5.0317  212.319   17.697  234.867   14.061 -22.54808 22.60323 
1 1 1   21    9   48 o  119.744   19.614   11.900   3.4704   6.4371   6.7091   13.895   4.0550   90.027   34.607  128.743   21.324 -38.71613 40.64881 
1 1 1   21    9   49 o  178.996   14.478   25.569   3.9326   27.493   5.5989   23.695   5.5248  182.084   20.442  167.887   22.032 14.19745 30.05465 
1 1 1   21    9   50 o   44.510   20.526  -1.9476   3.2510  -4.1335   5.1532  -0.5025   4.1900   52.463   24.729   55.418   24.632 -2.954372 34.90400 
1 1 1   21    9   51 o   58.761   22.724   2.2728   2.9060   0.2195   4.0085   4.5474   4.2189   56.217   24.571   74.743   27.722 -18.52625 37.04328 
1 1 1   21    9   52 o   94.859   20.600   7.8240   2.9053   4.7940   3.9579   11.364   4.2782   74.868   26.997  111.593   25.592 -36.72537 37.19925 
1 1 1   21    9   53 o   93.931   23.321   7.9718   3.3375   8.2027   4.5156   7.6937   4.9547   92.347   28.813   89.220   30.344 3.126907 41.84453 
1 1 1   21   10    0 o  110.802   13.873   9.8410   2.2530   9.8410   2.2530   9.8410   2.2530  110.802   13.873  110.802   13.873 0.000000 0.000000 
1 1 1   21   10    1 f  373.752   5.0082  106.946   2.8651  105.980   4.0632  107.900   4.0406  371.993   7.1361  375.352   7.0330 -3.359253 10.01930 
1 1 1   21   10    2 o  213.446   6.1290   34.886   2.0024   37.195   3.3293   33.578   2.5064  220.301   9.8735  209.370   7.8210 10.93095 12.59583 
1 1 1   21   10    3 o  402.249   5.9347  123.894   3.6540  124.319   4.3748  122.915   6.6447  402.893   7.0942  400.418   10.842 2.475098 12.95637 
1 1 1   21   10    4 o  444.343   8.2662  151.256   5.6220  148.797   8.2287  153.409   7.6992  440.456   12.206  447.303   11.245 -6.847382 16.59627 
1 1 1   21   10    5 o  461.252   8.5696  163.002   6.0502  162.538   8.9954  163.385   8.1758  460.287   12.768  461.585   11.572 -1.298065 17.23166 
1 1 1   21   10    6 o  519.135   8.7043  206.492   6.9165  213.925   10.382  200.561   9.2738  528.038   12.846  511.374   11.848 16.66391 17.47562 
1 1 1   21   10    7 o  635.120   9.3725  309.135   9.1113  309.135   9.1113   0.0000   0.0000  635.120   9.3725  ?   ?  0.000000 9.372524 
1 1 1   21   10    8 o  737.735   7.7838  416.931   8.7895  420.786   11.096  410.439   14.401  740.928   9.7841  731.351   12.864 9.576172 16.16239 
1 1 1   21   10    9 o  345.906   8.1825   91.673   4.3322  102.898   5.7426   76.846   6.5999  366.357   10.241  316.387   13.629 49.97025 17.04736 
1 1 1   21   10   10 o  376.937   8.2383  108.865   4.7531  114.485   6.0944  100.139   7.5940  386.416   10.304  361.138   13.738 25.27777 17.17299 
1 1 1   21   10   11 f  283.948   9.6924   61.809   4.2125   57.393   5.3038   69.354   6.9328  273.453   12.672  300.037   15.145 -26.58398 19.74705 
1 1 1   21   10   12 o  218.309   11.604   36.669   3.8635   38.830   5.0498   33.618   5.9997  224.307   14.791  208.027   19.054 16.27951 24.12167 
1 1 1   21   10   13 o  377.003   8.7171  108.937   5.0302  107.453   6.4480  111.245   8.0401  374.240   11.257  380.548   13.803 -6.308655 17.81127 
1 1 1   21   10   14 o  215.522   13.709   35.829   4.4989   38.409   6.3295   33.195   6.3959  222.445   18.765  206.380   20.519 16.06560 27.80584 
1 1 1   21   10   15 o  274.628   10.307   57.853   4.3324   59.270   5.5683   55.679   6.8965  277.775   13.097  268.382   16.874 9.392792 21.36018 
1 1 1   21   10   16 o  396.306   7.2070  120.341   4.3718  132.953   7.0031  112.288   5.5961  416.229   10.992  382.645   9.5548 33.58392 14.56454 
1 1 1   21   10   17 f  309.427   9.7493   73.442   4.6174   75.283   6.0712   70.916   7.1116  313.036   12.671  303.163   15.376 9.873047 19.92427 
1 1 1   21   10   18 o  239.727   7.8224   44.050   2.8703   45.729   3.9102   42.089   4.2267  244.103   10.465  233.797   11.850 10.30656 15.80956 
1 1 1   21   10   19 o  559.486   6.6273  239.844   5.6754  248.065   6.7562  220.137   10.461  568.869   7.7593  535.153   12.770 33.71643 14.94290 
1 1 1   21   10   20 f  505.625   8.1803  196.031   6.3309  216.749   13.452  190.136   7.1752  530.109   16.579  497.811   9.4167 32.29742 19.06656 
1 1 1   21   10   21 o   71.741   20.726   4.0758   2.4037   3.9428   4.4600   4.1302   2.8536   78.246   28.590   73.186   22.917 5.060181 36.64101 
1 1 1   21   10   22 o  436.534   5.8016  145.997   3.8765  156.113   5.8522  138.088   5.1745  451.131   8.4751  424.344   7.9668 26.78687 11.63172 
1 1 1   21   10   23 o  297.993   6.8346   68.067   3.1174   70.941   4.8637   66.062   4.0613  303.900   10.456  293.399   9.0435 10.50092 13.82434 
1 1 1   21   10   24 o  261.660   7.3619   52.500   2.9485   55.435   4.7252   50.628   3.7732  268.503   11.497  256.780   9.6001 11.72302 14.97838 
1 1 1   21   10   25 o   35.565   16.803  -2.7483   2.4045  -2.7283   4.2212  -2.7579   2.9255   51.915   23.737   40.763   19.027 11.15197 30.42134 
1 1 1   21   10   26 o  189.904   9.8295   27.782   2.8474   25.335   5.1364   28.867   3.4212  179.684   18.962  193.344   11.614 -13.65979 22.23644 
1 1 1   21   10   27 o  216.990   8.8239   36.156   2.9307   33.982   4.7809   37.464   3.7093  209.177   15.033  220.679   10.982 -11.50224 18.61646 
1 1 1   21   10   28 o   50.646   20.847   0.6634   2.6040  -3.5503   4.8282   2.3918   3.0923   54.248   25.016   63.185   23.674 -8.937149 34.44230 
1 1 1   21   10   29 o  136.908   13.723   14.619   2.8371   12.167   5.0505   15.749   3.4292  121.523   27.761  141.672   16.100 -20.14907 32.09138 
1 1 1   21   10   30 o  234.011   7.3902   42.030   2.6471   46.084   5.6957   40.914   2.9895  243.410   15.366  230.777   8.4633 12.63272 17.54297 
1 1 1   21   10   31 o  265.724   8.1186   54.239   3.3020   56.356   5.9251   53.286   3.9768  269.414   14.420  263.144   9.8736 6.269989 17.47679 
1 1 1   21   10   32 o  188.173   10.503   27.364   3.0131   32.722   8.0757   26.497   3.2477  200.850   26.948  184.976   11.528 15.87349 29.31058 
1 1 1   21   10   33 o  249.900   7.4499   47.966   2.8496   49.637   6.3358   47.543   3.1905  251.938   16.522  248.676   8.3822 3.262650 18.52626 
1 1 1   21   10   34 o  571.691   5.7934  250.702   5.0695  265.250   9.4246  244.779   6.0135  586.510   10.498  564.611   6.9584 21.89941 12.59496 
1 1 1   21   10   35 o  123.737   13.888   12.022   2.5849   7.6914   6.3272   12.889   2.8321   99.146   34.272  127.983   14.726 -28.83697 37.30149 
1 1 1   21   10   36 o  186.167   10.417   26.823   2.9563   29.507   7.5060   26.331   3.2163  189.827   26.561  184.228   11.463 5.598907 28.92883 
1 1 1   21   10   37 o  137.959   13.872   14.930   2.8896   20.868   8.1142   14.068   3.0924  155.134   35.004  133.488   15.418 21.64647 38.24913 
1 1 1   21   10   38 o  207.556   11.978   33.473   3.7892   42.354   7.4288   30.350   4.4054  230.018   21.343  196.836   14.729 33.18260 25.93218 
1 1 1   21   10   39 o  124.484   16.207   12.323   3.0148   2.0663   7.9279   14.057   3.2597   84.348   35.662  133.036   16.352 -48.68736 39.23217 
1 1 1   21   10   40 o   66.878   23.199   3.3148   2.9004   10.449   7.1190   1.8951   3.1759  110.472   36.353   60.236   23.626 50.23620 43.35564 
1 1 1   21   10   41 o  191.978   11.429   28.668   3.3431   34.545   7.4958   27.208   3.7352  205.358   24.320  186.517   13.168 18.84059 27.65568 
1 1 1   21   10   42 o  205.219   11.848   32.808   3.7057   23.155   7.7213   35.696   4.2239  163.284   32.039  213.724   12.973 -50.43982 34.56569 
1 1 1   21   10   43 o  110.148   19.955   9.9553   3.2404   1.7493   7.6410   11.755   3.5781   81.185   34.691  119.811   20.232 -38.62603 40.15963 
1 1 1   21   10   44 o  216.139   11.626   36.430   3.8320   32.454   11.300   36.947   4.0734  185.811   40.843  217.435   12.290 -31.62357 42.65221 
1 1 1   21   10   45 o  115.623   23.546   11.293   4.0255   10.946   6.7463   11.484   5.0165  110.083   35.329  114.445   28.692 -4.361374 45.51175 
1 1 1   21   10   46 o  117.178   19.598   11.325   3.3908   6.2050   5.5072   14.451   4.3033   87.712   31.812  131.483   22.171 -43.77142 38.77568 
1 1 1   21   10   47 o   42.668   19.757  -2.1690   3.0572   0.3547   5.2550  -3.4601   3.7587   64.922   28.260   45.010   21.187 19.91134 35.32026 
1 1 1   21   10   48 o   59.646   23.931   1.8391   3.3302  -1.0449   6.2195   2.9983   3.9432   65.765   29.564   67.978   26.419 -2.213135 39.64828 
1 1 1   21   10   49 o   56.179   23.962   0.6580   3.6334   8.5486   5.1694  -7.0463   5.1080   96.637   30.916   47.239   22.883 49.39803 38.46348 
1 1 1   21   10   50 o  136.248   16.159   15.138   3.3041   7.9036   5.1960   20.049   4.2813   92.459   31.076  155.754   18.307 -63.29553 36.06765 
1 1 1   21   10   51 o   47.083   21.063  -0.6973   3.1163   2.0385   4.8476  -2.6242   4.0683   66.435   27.976   48.383   22.535 18.05189 35.92331 
1 1 1   21   10   52 o   89.823   23.969   7.3039   3.3566   3.9500   5.3766   9.4461   4.2968   74.338   30.201  100.294   27.271 -25.95598 40.69205 
1 1 1   21   11    0 o  132.569   12.310   13.810   2.4484   13.810   2.4484   13.810   2.4484  132.569   12.310  132.569   12.310 0.000000 0.000000 
1 1 1   21   11    1 o  594.771   6.2744  270.895   5.7121  273.689   9.8953  269.499   6.9952  597.473   10.820  593.145   7.7050 4.328308 13.28330 
1 1 1   21   11    2 o  589.055   6.4198  265.723   5.7883  263.016   6.9578  271.807   10.431  585.961   7.7577  595.348   11.447 -9.386597 13.82809 
1 1 1   21   11    3 o  180.720   8.2481   25.022   2.2816   23.989   2.6274   28.188   4.6007  176.646   9.7552  190.887   15.891 -14.24083 18.64620 
1 1 1   21   11    4 o  486.545   6.2381  181.281   4.6456  181.592   5.5087  180.514   8.6446  486.902   7.3916  485.144   11.641 1.757568 13.78970 
1 1 1   21   11    5 o  500.603   8.5530  192.016   6.5536  192.749   9.4517  191.338   9.0950  501.241   12.319  499.443   11.897 1.798004 17.12645 
1 1 1   21   11    6 o  244.632   16.669   46.220   6.2043   46.220   6.2043   0.0000   0.0000  244.632   16.669  ?   ?  0.000000 16.66896 
1 1 1   21   11    7 o  126.951   16.211   12.588   3.0782   11.332   3.8678   14.757   5.0836  119.352   21.982  135.997   25.354 -16.64558 33.55676 
1 1 1   21   11    8 o  216.727   10.835   36.021   3.5944   33.481   4.5334   40.319   5.8983  208.304   14.305  228.332   16.999 -20.02875 22.21707 
1 1 1   21   11    9 o  520.427   7.6102  207.497   6.0621  206.098   7.5327  210.067   10.213  518.521   9.4910  523.149   12.754 -4.627808 15.89807 
1 1 1   21   11   10 o  478.861   7.8877  175.695   5.7813  180.510   7.2581  167.338   9.5624  485.229   9.7725  466.828   13.383 18.40100 16.57090 
1 1 1   21   11   11 o  269.256   9.9745   55.591   4.1108   61.598   5.2408   45.985   6.6273  283.303   12.086  243.731   17.890 39.57208 21.58946 
1 1 1   21   11   12 o  163.368   14.841   20.683   3.6706   22.624   4.6141   17.336   6.0580  170.459   17.955  147.020   27.942 23.43858 33.21331 
1 1 1   21   11   13 o  609.617   9.4665  284.951   8.8332  292.512   12.684  277.830   12.308  617.067   13.429  601.391   13.371 15.67584 18.95101 
1 1 1   21   11   14 o  528.677   8.0896  214.212   6.5462  223.773   8.2920  198.396   10.665  540.138   10.030  508.103   13.713 32.03452 16.98942 
1 1 1   21   11   15 o  604.267   13.697  280.654   12.668   0.0000   0.0000  280.654   12.668  ?   ?   604.267   13.697 0.000000 13.69661 
1 1 1   21   11   16 o  335.669   11.986   86.531   6.1580  103.339   10.230   76.977   7.7119  365.989   18.261  315.772   16.008 50.21735 24.28403 
1 1 1   21   11   17 o  445.453   7.6297  152.085   5.2021  153.659   6.1739  148.232   9.6593  447.621   9.0112  438.946   14.377 8.674591 16.96750 
1 1 1   21   11   18 o  227.688   9.9242   39.780   3.4586   42.504   4.4636   35.689   5.4713  234.847   12.462  214.491   16.800 20.35640 20.91706 
1 1 1   21   11   19 o  527.997   6.7037  213.627   5.4177  222.537   6.4890  193.126   9.8431  538.765   7.8688  501.172   12.831 37.59354 15.05201 
1 1 1   21   11   20 o   80.850   22.988   5.2111   2.9797   1.2602   5.0331   7.3430   3.6972   70.144   28.940   95.336   25.021 -25.19192 38.25695 
1 1 1   21   11   21 o  228.834   7.8368   40.154   2.7449   43.887   4.1922   37.352   3.6317  238.971   11.461  220.517   10.760 18.45461 15.72014 
1 1 1   21   11   22 f  361.363   6.2494  100.067   3.4566  103.796   5.2211   97.158   4.6122  367.746   9.2756  355.876   8.4672 11.86978 12.55905 
1 1 1   21   11   23 o  280.436   7.1278   60.296   3.0596   68.749   4.7918   54.477   3.9754  299.140   10.465  266.354   9.7511 32.78586 14.30408 
1 1 1   21   11   24 o  151.909   12.809   17.893   2.9506   23.586   4.3364   12.985   4.0263  173.913   16.487  127.528   21.384 46.38584 27.00168 
1 1 1   21   11   25 o   92.227   18.493   6.8262   2.5197   12.504   4.6989   4.5347   2.9852  124.063   25.594   76.070   23.377 47.99361 34.66358 
1 1 1   21   11   26 o  308.991   6.9915   73.220   3.3066   72.459   5.1498   73.753   4.3132  306.919   10.962  309.893   9.0932 -2.974426 14.24271 
1 1 1   21   11   27 o  184.609   9.9375   26.273   2.7977   29.516   4.7395   24.539   3.4659  194.619   16.054  177.958   12.810 16.66165 20.53806 
1 1 1   21   11   28 o  121.209   15.207   11.540   2.7591   15.958   4.9517   9.5512   3.3227  140.703   23.844  108.891   20.692 31.81161 31.57043 
1 1 1   21   11   29 o   84.624   23.241   5.8117   3.1026   2.3004   5.0245   7.9756   3.9443   73.293   29.399   98.610   25.826 -25.31676 39.13166 
1 1 1   21   11   30 o  169.174   14.752   22.327   3.7817   23.005   5.2578   21.600   5.4434  170.257   20.595  164.428   22.196 5.829178 30.27845 
1 1 1   21   11   31 o  279.511   9.6006   60.116   4.1074   62.422   5.8541   57.880   5.7645  284.082   13.463  273.132   13.834 10.94983 19.30350 
1 1 1   21   11   32 o  191.349   11.723   28.368   3.4169   31.009   8.1670   27.807   3.7620  194.760   28.219  189.162   13.073 5.597458 31.09984 
1 1 1   21   11   33 f  274.312   8.5918   57.872   3.6074   68.040   6.4809   53.307   4.3423  296.153   14.297  262.899   10.791 33.25415 17.91241 
1 1 1   21   11   34 o  234.913   7.8816   42.417   2.8340   53.302   6.4122   39.774   3.1593  261.075   16.125  227.318   9.0799 33.75639 18.50590 
1 1 1   21   11   35 o  231.297   8.3965   41.154   2.9726   42.087   6.5528   40.913   3.3356  230.865   18.704  230.458   9.4560 0.4074860 20.95878 
1 1 1   21   11   36 o  218.926   8.9896   36.910   3.0124   41.979   6.9240   35.727   3.3456  229.934   19.869  215.203   10.157 14.73134 22.31420 
1 1 1   21   11   37 o   51.820   21.160   0.8936   2.6562  -5.4183   8.5081   1.5752   2.7960   71.194   32.963   56.366   22.149 14.82704 39.71304 
1 1 1   21   11   38 o   64.925   24.823   2.4991   3.4404   1.4251   7.6500   2.7714   3.8519   81.634   34.793   68.355   26.235 13.27882 43.57513 
1 1 1   21   11   39 o  176.172   11.050   24.107   2.9647   9.5240   6.9949   27.300   3.2733  106.727   36.055  187.417   11.466 -80.69027 37.83440 
1 1 1   21   11   40 o   93.499   20.364   7.2037   2.8318   1.2995   6.9546   8.3772   3.1005   77.783   33.163  100.873   20.773 -23.09003 39.13187 
1 1 1   21   11   41 o  127.001   16.072   12.850   3.0544   8.3081   7.5000   13.753   3.3443  102.018   37.105  131.134   17.066 -29.11682 40.84153 
1 1 1   21   11   42 o  189.729   12.859   28.156   3.7124   28.669   7.7858   28.006   4.2234  184.106   28.554  188.582   14.749 -4.475983 32.13797 
1 1 1   21   11   43 o  167.351   13.388   22.004   3.4006   24.845   7.8498   21.347   3.7730  168.885   31.526  164.216   15.183 4.668823 34.99176 
1 1 1   21   11   44 o  262.592   11.295   53.601   4.5397   56.507   11.450   53.059   4.9450  257.023   29.647  260.853   12.385 -3.829407 32.13046 
1 1 1   21   11   45 o  281.703   9.3625   61.447   4.0370   46.723   6.5080   70.656   5.1468  241.479   17.732  301.340   11.159 -59.86189 20.95050 
1 1 1   21   11   46 o  144.185   16.061   16.690   3.4843   13.143   5.5969   18.935   4.4522  120.973   30.293  152.038   19.587 -31.06484 36.07432 
1 1 1   21   11   47 o  121.645   18.381   12.149   3.3157   7.6668   5.4462   14.789   4.1795   93.446   31.813  133.043   21.238 -39.59640 38.25106 
1 1 1   21   11   48 o   71.002   25.010   3.9942   3.3775   16.873   6.3696  -1.0433   3.9836  135.467   31.341   52.886   23.726 82.58090 39.30883 
1 1 1   21   11   49 o  221.120   11.955   38.537   4.0313   34.449   5.5892   42.970   5.8200  205.320   17.966  230.486   16.608 -25.16579 24.46641 
1 1 1   21   11   50 o  106.133   20.979   9.6781   3.2872   9.1680   5.1785   10.022   4.2542   98.331   30.884  104.962   26.481 -6.630898 40.68298 
1 1 1   21   11   51 o  137.821   16.592   15.649   3.4299   14.704   5.7913   16.160   4.2567  123.487   30.756  137.360   20.906 -13.87290 37.18816 
1 1 1   21   11   52 o   94.005   22.157   7.8540   3.1360   12.912   4.8931   4.3279   4.0854  117.121   27.725   72.486   27.201 44.63431 38.84039 
1 1 1   21   12    0 o  795.569   8.9123  484.893   10.850  484.893   10.850  484.893   10.850  795.569   8.9123  795.569   8.9123 0.000000 0.000000 
1 1 1   21   12    1 o  261.728   6.8152   52.466   2.7302   60.620   5.0193   49.040   3.2537  281.122   11.665  252.987   8.4025 28.13557 14.37607 
1 1 1   21   12    2 o  172.803   9.6424   22.960   2.5402   21.844   2.9633   26.051   4.9332  168.362   11.569  183.159   17.822 -14.79707 21.24816 
1 1 1   21   12    3 o  249.030   7.5811   47.508   2.8897   46.652   3.3360   50.079   5.7832  246.735   8.8335  254.895   14.888 -8.160400 17.31104 
1 1 1   21   12    4 f   40.285   17.870  -0.7868   2.1948  -0.7021   2.4692  -1.1059   4.7898   43.455   19.131   61.109   26.780 -17.65402 32.91159 
1 1 1   21   12    5 o  419.349   6.4861  134.682   4.1632  134.309   4.8567  135.715   8.0846  418.711   7.5780  420.529   12.560 -1.817352 14.66906 
1 1 1   21   12    6 o  732.379   13.105  411.757   14.690  411.757   14.690   0.0000   0.0000  732.379   13.105  ?   ?  0.000000 13.10480 
1 1 1   21   12    7 o   84.758   26.880   5.4812   3.9142   4.0235   5.7034   6.7792   5.3817   84.535   32.046   95.483   31.616 -10.94800 45.01731 
1 1 1   21   12    8 o  383.335   9.6684  112.657   5.6728  112.657   8.0205  112.657   8.0247  382.999   13.682  382.998   13.689 0.7019043E-03 19.35369 
1 1 1   21   12    9 o  565.332   9.3121  245.005   8.0579  257.407   11.910  234.537   10.942  578.939   13.441  552.693   12.935 26.24591 18.65365 
1 1 1   21   12   10 o  464.978   9.9172  165.790   7.0582  171.667   10.146  160.279   9.8250  472.684   14.024  456.733   14.054 15.95123 19.85403 
1 1 1   21   12   11 o  290.651   12.229   64.853   5.4405   61.834   7.7652   67.763   7.6248  282.730   18.038  296.214   16.887 -13.48352 24.70907 
1 1 1   21   12   12 o  221.622   14.988   37.942   5.0544   50.757   7.9105   29.101   6.5706  255.594   20.390  192.641   22.721 62.95386 30.52839 
1 1 1   21   12   13 o  521.168   13.697  208.749   10.926   0.0000   0.0000  208.749   10.926  ?   ?   521.168   13.697 0.000000 13.69662 
1 1 1   21   12   14 o  564.508   10.095  244.466   8.7224  249.595   12.931  240.184   11.815  569.613   14.832  558.962   13.809 10.65131 20.26522 
1 1 1   21   12   15 o  198.598   9.2205   30.248   2.8029   31.323   3.0997   25.430   6.5638  202.057   10.022  179.374   24.552 22.68324 26.51839 
1 1 1   21   12   16 o  686.437   6.6961  361.030   7.0354  367.631   8.1067  340.888   14.161  692.562   7.6474  665.742   13.897 26.81934 15.86196 
1 1 1   21   12   17 o  190.089   10.182   27.810   2.9517   28.608   3.2686   24.282   6.8725  192.700   11.129  174.594   26.554 18.10548 28.79141 
1 1 1   21   12   18 o  269.758   9.2350   55.827   3.8131   55.827   3.8131   0.0000   0.0000  269.758   9.2350  ?   ?  0.000000 9.234952 
1 1 1   21   12   19 o  198.141   11.132   30.253   3.3625   38.314   5.5484   25.573   4.2272  222.255   16.426  181.519   15.359 40.73573 22.48795 
1 1 1   21   12   20 o  136.837   12.455   14.518   2.5802   20.268   3.4859   7.5494   3.8372  161.605   14.238   96.608   25.556 64.99747 29.25425 
1 1 1   21   12   21 o  309.795   7.0705   73.572   3.3527   79.992   4.4835   65.428   5.0496  322.856   9.0728  291.770   11.307 31.08536 14.49701 
1 1 1   21   12   22 o  369.761   6.1269  104.774   3.4676  107.918   5.0656  102.002   4.7568  375.003   8.8253  364.611   8.5235 10.39188 12.26926 
1 1 1   21   12   23 o  205.729   8.5091   32.479   2.6795   37.578   4.1380   28.796   3.5162  220.631   12.302  193.100   11.955 27.53130 17.15451 
1 1 1   21   12   24 o  287.607   6.9216   63.424   3.0470   63.524   4.6743   63.350   4.0181  287.467   10.623  287.238   9.1392 0.2288818 14.01350 
1 1 1   21   12   25 o   80.456   20.503   5.2324   2.5322   2.4684   4.2105   6.7984   3.1693   69.908   27.264   91.499   22.731 -21.59063 35.49677 
1 1 1   21   12   26 o  342.811   6.7149   90.119   3.5234   93.372   5.3525   87.632   4.6805  348.515   10.034  337.772   9.0532 10.74249 13.51435 
1 1 1   21   12   27 o  129.807   15.081   13.203   2.9406   18.119   4.5919   9.7852   3.8287  151.117   20.371  109.665   23.515 41.45216 31.11201 
1 1 1   21   12   28 o  151.048   13.885   17.775   3.1743   18.981   4.8002   16.838   4.2317  154.506   20.828  145.732   19.457 8.774490 28.50231 
1 1 1   21   12   29 o  204.682   9.9943   32.235   3.1311   33.378   5.2571   31.606   3.8979  206.634   16.766  201.963   12.674 4.671356 21.01724 
1 1 1   21   12   30 o  294.862   10.392   66.952   4.6901   68.971   5.8209   63.218   7.9185  298.813   12.727  284.128   18.305 14.68457 22.29468 
1 1 1   21   12   31 o  287.802   8.1203   63.648   3.5771   63.146   5.9127   63.938   4.4926  285.643   13.524  288.123   10.187 -2.480774 16.93115 
1 1 1   21   12   32 o  213.162   11.275   35.159   3.6655   28.215   8.5064   36.742   4.0620  184.112   31.306  217.712   12.239 -33.60059 33.61341 
1 1 1   21   12   33 o  109.726   18.555   9.6720   3.0052   17.558   5.6676   6.5877   3.5446  146.098   26.312   89.514   24.941 56.58462 36.25458 
1 1 1   21   12   34 o   67.776   23.621   3.3276   3.0085   10.536   5.7415   0.5993   3.5322  111.699   31.963   57.090   23.952 54.60923 39.94192 
1 1 1   21   12   35 f  227.092   10.491   39.796   3.6466   38.780   6.4340   40.277   4.4262  221.285   19.186  227.668   12.753 -6.383453 23.03762 
1 1 1   21   12   36 o  245.807   10.508   46.646   3.9536   60.110   7.9122   42.165   4.5643  275.807   18.855  232.863   12.856 42.94432 22.82084 
1 1 1   21   12   37 o  174.114   14.354   23.752   3.7912   12.580   8.1888   26.800   4.2772  120.499   38.949  184.745   15.262 -64.24628 41.83284 
1 1 1   21   12   38 o  101.688   18.324   8.3744   2.7471   7.7304   7.5315   8.4733   2.9504  100.850   37.106  101.938   19.622 -1.088371 41.97467 
1 1 1   21   12   39 o  145.572   13.197   16.609   2.9086   7.4636   7.6721   18.144   3.1433   99.859   37.314  152.080   13.649 -52.22048 39.73221 
1 1 1   21   12   40 o  125.603   15.697   12.542   2.9518   0.3331   7.3423   14.895   3.2238   76.889   33.437  137.049   15.649 -60.16077 36.91735 
1 1 1   21   12   41 o  272.805   8.5616   57.389   3.5750   54.963   8.0735   57.980   3.9872  261.769   20.309  273.966   9.5083 -12.19778 22.42449 
1 1 1   21   12   42 o   90.170   22.481   6.8117   3.0919   24.308   7.6179   3.3610   3.3831  167.767   30.801   68.741   24.933 99.02642 39.62790 
1 1 1   21   12   43 o  181.072   13.360   25.751   3.6766   36.391   8.0301   22.929   4.1356  208.905   25.652  169.817   16.103 39.08789 30.28778 
1 1 1   21   12   44 o  141.928   20.351   16.502   4.2945   10.696   10.110   17.780   4.7437  111.477   42.570  146.744   21.781 -35.26714 47.81823 
1 1 1   21   12   45 o  137.231   15.237   15.040   3.1464   19.863   5.7035   12.931   3.7724  152.977   25.239  125.075   20.409 27.90194 32.45785 
1 1 1   21   12   46 o  126.520   17.507   13.025   3.2995   6.1947   5.4809   16.907   4.1321   87.172   31.717  143.571   19.291 -56.39952 37.12355 
1 1 1   21   12   47 o   94.621   23.313   7.7241   3.3544   8.7488   5.4160   7.0864   4.2725   98.385   31.663   89.839   28.026 8.545799 42.28468 
1 1 1   21   12   48 o  255.659   11.973   51.294   4.6852   0.0000   0.0000   51.294   4.6852  ?   ?   255.659   11.973 0.000000 11.97271 
1 1 1   21   12   49 o   92.043   25.469   7.5723   3.7096   12.709   5.0830   1.7185   5.4261  117.687   28.517   68.613   29.274 49.07365 40.86797 
1 1 1   21   12   50 o   86.406   23.905   6.6570   3.2682   1.3104   5.5925   9.4299   4.0275   67.419   29.250  101.898   25.798 -34.47909 39.00109 
1 1 1   21   12   51 o   89.104   22.797   7.0802   3.1218   8.6053   4.9724   6.0880   4.0107   94.519   30.330   81.823   27.303 12.69537 40.80896 
1 1 1   21   12   52 o   43.043   20.160  -2.4959   3.3315  -8.3999   4.8206   2.9018   4.6093   42.521   20.938   67.787   27.799 -25.26635 34.80237 
1 1 1   21   13    0 o  839.467   13.357  540.602   17.152  540.602   17.152  540.602   17.152  839.467   13.357  839.467   13.357 0.000000 0.000000 
1 1 1   21   13    1 o  414.198   12.470  131.668   7.9059   0.0000   0.0000  131.668   7.9059  ?   ?   414.198   12.470 0.000000 12.47026 
1 1 1   21   13    2 o  341.887   7.1792   89.539   3.7569   90.522   4.4414   87.067   7.0436  343.696   8.4426  336.718   13.666 6.978699 16.06396 
1 1 1   21   13    3 o  213.804   9.3338   35.040   3.0545   37.326   3.5496   28.517   5.9964  220.620   10.511  191.166   20.831 29.45438 23.33243 
1 1 1   21   13    4 o  320.915   7.4917   78.899   3.6799   80.550   4.2844   74.257   7.1858  324.198   8.6339  310.833   15.104 13.36435 17.39715 
1 1 1   21   13    5 o  786.729   9.0465  474.422   10.894  474.422   10.894   0.0000   0.0000  786.729   9.0465  ?   ?  0.000000 9.046463 
1 1 1   21   13    6 o  156.351   12.380   18.881   2.9384   19.259   3.3385   17.581   6.1903  157.723   13.973  148.038   28.352 9.684601 31.60819 
1 1 1   21   13    7 o  372.053   7.2114  106.047   4.1067  104.916   4.7387  109.457   8.2306  369.999   8.3674  377.424   14.247 -7.425720 16.52276 
1 1 1   21   13    8 o  340.111   6.6616   88.608   3.4679   88.920   3.8738   87.349   7.7827  340.672   7.4290  337.060   15.085 3.612274 16.81539 
1 1 1   21   13    9 o  177.608   9.6158   24.259   2.6043   23.315   2.8515   29.007   6.3953  173.999   10.760  192.476   22.109 -18.47694 24.58809 
1 1 1   21   13   10 o  226.305   11.506   39.408   3.9723   43.447   4.8179   30.832   7.0198  237.441   13.310  198.177   23.607 39.26384 27.10042 
1 1 1   21   13   11 o  193.955   12.902   29.024   3.8084   30.042   4.6318   26.898   6.6915  196.999   15.486  184.745   24.249 12.25430 28.77213 
1 1 1   21   13   12 o  214.358   14.782   35.510   4.8204   31.256   6.4824   40.771   7.2095  199.900   21.526  228.747   20.819 -28.84700 29.94639 
1 1 1   21   13   13 o  705.909   6.6557  381.770   7.1914  383.757   8.1729  374.958   15.135  707.635   7.5457  698.268   14.161 9.367798 16.04568 
1 1 1   21   13   14 o  554.530   5.3922  235.509   4.5768  241.861   5.0291  204.890   11.042  561.922   5.8472  516.148   13.976 45.77454 15.15030 
1 1 1   21   13   15 o  566.660   6.4405  246.013   5.5862  250.652   6.3490  230.113   11.754  571.893   7.2530  546.923   14.041 24.97070 15.80386 
1 1 1   21   13   16 o  312.366   7.1640   74.780   3.4252   77.668   3.7987   62.220   7.9220  318.299   7.7970  283.235   18.372 35.06427 19.95844 
1 1 1   21   13   17 o  274.431   7.7810   57.738   3.2684   57.773   3.5906   57.571   7.8949  274.463   8.5469  272.196   19.070 2.267059 20.89748 
1 1 1   21   13   18 o  236.916   15.659   43.461   5.6466   43.461   5.6466   0.0000   0.0000  236.916   15.659  ?   ?  0.000000 15.65945 
1 1 1   21   13   19 f  255.758   12.061   50.292   4.7216   49.311   5.7696   52.281   8.2157  252.499   14.996  258.764   20.922 -6.265396 25.74105 
1 1 1   21   13   20 o  322.044   6.9489   79.500   3.4253   79.745   4.3321   79.092   5.5948  322.385   8.7793  320.781   11.395 1.603760 14.38456 
1 1 1   21   13   21 o  211.151   8.7121   34.212   2.8157   37.790   3.7528   29.605   4.2590  221.736   11.057  195.463   14.335 26.27245 18.10447 
1 1 1   21   13   22 o  243.368   7.3934   45.420   2.7541   49.439   3.9932   41.774   3.8034  253.667   10.285  233.141   10.658 20.52536 14.81125 
1 1 1   21   13   23 o  362.258   6.0965  100.579   3.3804  106.491   5.0027   95.612   4.5857  372.461   8.7752  352.959   8.4880 19.50211 12.20863 
1 1 1   21   13   24 f  136.811   11.612   14.507   2.4088   16.709   3.7273   12.927   3.1564  145.935   17.005  128.232   16.462 17.70277 23.66781 
1 1 1   21   13   25 o  137.093   13.820   14.647   2.8604   12.447   4.0787   16.777   4.0124  124.427   22.232  145.883   18.377 -21.45592 28.84398 
1 1 1   21   13   26 o  108.686   17.219   9.3805   2.7691   12.373   3.9041   6.3509   3.9282  124.201   21.303   89.031   26.704 35.17014 34.16047 
1 1 1   21   13   27 o  309.948   7.1374   73.708   3.3861   83.509   5.3468   67.145   4.3753  329.410   10.604  295.515   9.6729 33.89438 14.35339 
1 1 1   21   13   28 f  280.735   7.7058   60.506   3.3112   60.025   5.2317   60.827   4.2768  278.951   12.253  281.187   9.9369 -2.236084 15.77601 
1 1 1   21   13   29 o  386.548   7.8301  114.748   4.6328  127.227   6.4125  101.124   6.7004  406.511   10.306  362.013   12.092 44.49765 15.88820 
1 1 1   21   13   30 o  183.310   11.647   26.029   3.2508   21.994   5.0409   28.902   4.2535  166.357   20.212  192.580   14.537 -26.22256 24.89689 
1 1 1   21   13   31 o  482.282   7.3640  178.628   5.4361  179.880   10.280  178.142   6.4048  481.817   13.940  481.297   8.6941 0.5199585 16.42870 
1 1 1   21   13   32 o  140.119   14.270   15.382   3.0177   25.206   5.3910   10.899   3.6417  178.029   20.138  115.901   21.314 62.12764 29.32251 
1 1 1   21   13   33 o  137.461   15.114   14.860   3.1276   14.351   5.5387   15.099   3.7896  131.008   28.437  137.694   18.444 -6.686188 33.89454 
1 1 1   21   13   34 o  209.911   11.259   34.132   3.6044   35.566   6.8553   33.585   4.2374  211.012   21.527  207.696   13.400 3.315948 25.35685 
1 1 1   21   13   35 o   63.888   23.844   2.5807   3.1308   2.2182   6.4044   2.6945   3.5889   78.784   32.587   66.849   25.402 11.93593 41.31796 
1 1 1   21   13   36 o  285.290   9.5864   62.756   4.1861   57.316   7.6598   65.072   4.9986  269.259   18.702  290.099   11.257 -20.84033 21.82830 
1 1 1   21   13   37 o  150.383   15.557   17.843   3.5291   12.101   6.2428   20.539   4.2783  118.322   33.147  160.792   17.675 -42.46935 37.56494 
1 1 1   21   13   38 o  196.542   12.458   30.094   3.7285   27.265   6.5726   31.437   4.5275  182.683   24.093  200.154   14.885 -17.47116 28.32049 
1 1 1   21   13   39 o  149.508   17.138   17.795   3.8511   23.023   7.5618   15.964   4.4748  163.846   31.294  139.935   21.586 23.91101 38.01667 
1 1 1   21   13   40 o  117.476   22.218   11.400   3.8487   0.0939   7.6681   15.207   4.4498   77.650   33.960  136.164   22.109 -58.51435 40.52269 
1 1 1   21   13   41 o   80.415   27.305   5.1132   4.0119   8.1005   7.0800   3.7004   4.8691  100.164   36.109   76.439   29.455 23.72530 46.59910 
1 1 1   21   13   42 o  372.586   7.4419  106.911   4.2440  109.836   8.6556  105.986   4.8696  373.998   15.120  370.585   8.5849 3.412842 17.38737 
1 1 1   21   13   43 o  143.402   20.319   16.804   4.3351   16.791   11.031   16.806   4.7145  131.384   45.261  142.501   22.350 -11.11693 50.47821 
1 1 1   21   13   44 o  219.937   10.372   37.550   3.4918   31.066   6.4304   40.261   4.1583  194.317   22.008  226.895   12.016 -32.57761 25.07495 
1 1 1   21   13   45 o  111.497   18.927   10.240   3.1146   17.634   5.5623   6.8630   3.7592  143.071   26.372   89.151   25.967 53.92016 37.00996 
1 1 1   21   13   46 o   72.095   24.069   4.2324   3.1167   7.8298   5.4530   2.4870   3.7982   94.304   31.835   65.209   25.754 29.09515 40.94770 
1 1 1   21   13   47 o  106.196   20.561   9.4976   3.2214   5.3828   5.4681   11.685   3.9866   83.047   31.403  116.809   23.116 -33.76225 38.99384 
1 1 1   21   13   48 o  102.257   22.735   9.0534   3.4663   14.581   6.3094   6.6640   4.1484  123.817   32.777   86.704   27.690 37.11321 42.90827 
1 1 1   21   13   49 o   72.732   27.405   4.0955   4.1551   4.3413   5.8197   3.8399   5.9344   78.355   31.566   76.961   31.550 1.394226 44.62973 
1 1 1   21   13   50 o  167.889   12.891   22.512   3.2875   13.506   5.1147   28.852   4.2913  120.377   28.245  188.852   14.968 -68.47542 31.96644 
1 1 1   21   13   51 o   54.187   22.395   1.3160   3.0214   2.4981   4.8214   0.5516   3.8771   67.346   28.099   56.092   24.345 11.25334 37.17850 
1 1 1   21   14    0 o   59.918   28.305   4.0533   2.9364   4.0533   2.9364   4.0533   2.9364   59.918   28.305   59.918   28.305 0.000000 0.000000 
1 1 1   21   14    1 o  345.296   9.8514   91.423   5.2067   85.147   7.0384   99.010   7.7379  332.923   13.812  358.977   14.083 -26.05426 19.72553 
1 1 1   21   14    2 o  858.226   9.8036  564.774   12.878  565.731   17.924  563.754   18.516  858.183   13.645  856.570   14.122 1.613159 19.63761 
1 1 1   21   14    3 o   43.861   19.667  -1.2591   2.7334  -1.0465   3.0438  -2.1449   6.2124   47.520   21.064   67.536   30.007 -20.01580 36.66221 
1 1 1   21   14    4 o  331.685   8.8755   84.331   4.5059   84.331   4.5059   0.0000   0.0000  331.685   8.8755  ?   ?  0.000000 8.875450 
1 1 1   21   14    5 o  281.169   9.7577   60.622   4.1994   60.622   4.1994   0.0000   0.0000  281.169   9.7577  ?   ?  0.000000 9.757678 
1 1 1   21   14    6 o  236.587   9.4679   42.918   3.4286   46.258   3.9378   32.451   6.9707  245.569   10.476  203.586   22.759 41.98271 25.05455 
1 1 1   21   14    7 o  135.993   14.405   14.374   2.9527   16.622   3.3252   5.9914   6.4211  146.255   15.069   95.109   34.372 51.14542 37.53061 
1 1 1   21   14    8 o  412.908   8.1189  130.671   5.1312  136.917   6.3281  118.680   8.7675  422.523   9.7849  392.873   14.580 29.64954 17.55901 
1 1 1   21   14    9 o  544.771   7.8531  227.444   6.5482  228.840   7.9364  224.466   11.590  546.264   9.4918  540.369   14.012 5.895386 16.92469 
1 1 1   21   14   10 o  587.198   7.9605  264.273   7.1548  275.392   8.8635  243.478   12.122  599.214   9.6639  562.738   14.073 36.47528 17.07147 
1 1 1   21   14   11 o  427.272   8.4129  139.956   5.5020  146.799   6.6823  125.551   9.6950  437.441   9.9801  403.833   15.685 33.60773 18.59065 
1 1 1   21   14   12 o   87.637   11.796   6.0036   1.5421   6.6406   1.5826  -5.9557   6.8572   92.299   11.448   63.104   29.346 29.19523 31.50019 
1 1 1   21   14   13 o  284.211   5.5916   61.869   2.4325   62.538   2.5484   55.020   8.1585  285.732   5.8268  265.978   20.191 19.75455 21.01462 
1 1 1   21   14   14 o  415.174   5.3672  132.020   3.4107  132.247   3.6357  130.350   9.8489  415.509   5.7166  411.338   15.643 4.171112 16.65473 
1 1 1   21   14   15 o  130.730   11.529   13.230   2.2833   12.779   2.3909   17.901   7.6982  128.361   12.321  147.621   34.662 -19.25977 36.78671 
1 1 1   21   14   16 o   82.947   18.613   5.5270   2.3051   3.9751   2.4240   20.197   7.4529   71.025   20.899  157.428   32.020 -86.40260 38.23616 
1 1 1   21   14   17 o  219.368   16.041   37.315   5.3489   37.315   5.3489   0.0000   0.0000  219.368   16.041  ?   ?  0.000000 16.04142 
1 1 1   21   14   18 o  409.455   9.3758  128.671   5.8760  131.356   7.2380  123.480   10.063  413.421   11.438  399.942   16.439 13.47888 20.02695 
1 1 1   21   14   19 o  614.165   6.8219  289.128   6.4130  293.657   7.2880  273.595   13.499  618.824   7.6944  595.711   14.804 23.11292 16.68431 
1 1 1   21   14   20 f  517.782   6.8859  205.523   5.4573  209.331   6.1506  191.432   11.832  522.448   7.6914  498.015   15.522 24.43289 17.32287 
1 1 1   21   14   21 o   42.252   19.105  -1.4196   2.6418  -1.8498   2.8191   1.6828   7.5700   42.503   19.420   84.492   35.227 -41.98923 40.22543 
1 1 1   21   14   22 o  121.190   13.353   11.453   2.4358   9.8301   3.1648   13.812   3.8152  110.982   19.333  132.010   19.466 -21.02863 27.43515 
1 1 1   21   14   23 o   46.978   19.541   0.4114   2.3217  -0.7947   3.0994   1.9531   3.5043   48.684   21.433   63.453   24.838 -14.76926 32.80697 
1 1 1   21   14   24 o  173.794   10.842   23.324   2.8697   25.579   3.9142   20.703   4.2197  181.477   14.205  162.546   17.223 18.92998 22.32474 
1 1 1   21   14   25 o  223.477   8.1614   38.339   2.7917   42.669   4.0842   34.542   3.8246  235.421   11.334  211.433   11.866 23.98845 16.40935 
1 1 1   21   14   26 o  110.907   15.143   9.6898   2.5034   10.533   3.8588   9.0770   3.2896  113.933   22.922  105.994   21.019 7.939026 31.09949 
1 1 1   21   14   27 o  433.004   6.3301  143.792   4.1954  152.784   6.3591  136.862   5.5827  445.792   9.3196  422.059   8.6417 23.73297 12.70957 
1 1 1   21   14   28 o  153.895   14.252   18.482   3.3190   21.480   4.5306   15.009   4.8761  165.060   18.237  135.951   24.326 29.10957 30.40296 
1 1 1   21   14   29 o  338.979   7.6820   88.249   3.9858   97.193   5.7644   80.055   5.5173  355.181   10.603  322.226   11.186 32.95419 15.41312 
1 1 1   21   14   30 o  226.596   9.4959   39.519   3.2935   40.772   4.9859   38.550   4.3868  228.910   14.302  222.902   12.913 6.008713 19.26885 
1 1 1   21   14   31 o  283.239   9.3056   61.749   4.0343   53.958   8.4580   64.044   4.5901  260.812   21.375  288.247   10.404 -27.43549 23.77220 
1 1 1   21   14   32 o  224.382   9.5322   38.773   3.2738   39.994   5.3475   38.042   4.1404  226.213   15.538  221.476   12.261 4.737213 19.79359 
1 1 1   21   14   33 o  335.427   8.0246   86.508   4.1199   89.770   7.0410   84.810   5.0805  340.242   13.520  331.692   10.007 8.549988 16.82042 
1 1 1   21   14   34 f  182.860   11.925   25.974   3.3193   22.556   5.6075   27.818   4.1184  167.165   22.486  188.650   14.371 -21.48489 26.68585 
1 1 1   21   14   35 o  131.536   16.459   13.723   3.2412   14.696   5.7901   13.279   3.9114  131.792   29.445  128.106   20.650 3.685349 35.96444 
1 1 1   21   14   36 o   97.226   23.050   7.8407   3.3780   7.6186   6.7739   7.9142   3.8972   99.050   35.361   97.264   25.766 1.785896 43.75307 
1 1 1   21   14   37 o  152.679   14.891   18.351   3.4357   19.147   6.1962   17.998   4.1285  151.136   27.810  150.121   18.349 1.014908 33.31757 
1 1 1   21   14   38 o   56.837   23.550   0.9202   3.3531  -0.6759   6.2902   1.5538   3.9631   69.339   30.530   63.383   25.860 5.955315 40.01041 
1 1 1   21   14   39 o  191.366   13.274   28.640   3.8639   43.167   6.9395   22.113   4.6517  232.376   19.696  166.256   18.598 66.12036 27.08903 
1 1 1   21   14   40 o  200.964   13.484   31.622   4.1238   17.653   7.6910   37.259   4.8854  140.337   35.715  217.744   14.745 -77.40723 38.63927 
1 1 1   21   14   41 o  126.299   26.626   13.566   4.9851   6.4708   7.8591   18.343   6.4483   95.812   37.281  145.702   29.916 -49.88948 47.79996 
1 1 1   21   14   42 o   92.084   32.095   6.9411   5.5546   3.7192   6.8082   13.355   9.6059   83.344   33.937  120.581   42.197 -37.23689 54.15062 
1 1 1   21   14   43 o  275.183   12.063   59.033   5.0808   52.973   10.031   61.124   5.8926  251.033   26.508  279.234   13.787 -28.20111 29.87900 
1 1 1   21   14   44 o   57.778   24.581   0.6031   3.8059   1.9137   5.6400  -0.4927   5.1572   72.070   30.253   62.347   27.538 9.722374 40.90968 
1 1 1   21   14   45 o   72.696   26.312   4.0167   3.7648  -0.7705   5.5635   8.0606   5.1134   63.520   28.299   95.520   30.768 -32.00044 41.80344 
1 1 1   21   14   46 o  145.281   18.466   17.264   4.0136   10.491   5.8275   23.376   5.5359  106.636   32.644  167.150   22.186 -60.51361 39.46946 
1 1 1   21   14   47 o  180.304   12.792   25.713   3.5073   17.050   6.3662   29.488   4.2026  135.971   31.245  192.344   14.379 -56.37300 34.39450 
1 1 1   21   14   48 o  108.508   20.813   10.033   3.3310   12.096   6.0155   9.1201   4.0003  112.052   32.908  100.876   25.804 11.17574 41.81873 
1 1 1   21   14   49 o  260.018   14.512   54.273   5.7528   54.273   5.7528   0.0000   0.0000  260.018   14.512  ?   ?  0.000000 14.51245 
1 1 1   21   14   50 o   48.593   21.423  -0.2150   3.1071  -4.5958   4.8462   2.8426   4.0486   49.037   23.366   66.008   26.421 -16.97129 35.27076 
1 1 1   21   14   51 o   64.138   23.614   3.2402   3.0510   6.4327   5.0150   1.3643   3.8442   83.511   30.346   58.771   24.840 24.73973 39.21626 
1 1 1   21   15    0 o   55.509   27.822   3.4948   2.8957   3.4948   2.8957   3.4948   2.8957   55.509   27.822   55.509   27.822 0.000000 0.000000 
1 1 1   21   15    1 o  522.006   13.074  209.314   10.446   0.0000   0.0000  209.314   10.446  ?   ?   522.006   13.074 0.000000 13.07351 
1 1 1   21   15    2 o  598.986   7.1743  274.891   6.5776  273.142   7.8127  279.148   12.190  596.937   8.5507  602.799   13.211 -5.861572 15.73710 
1 1 1   21   15    3 o  360.733   12.854   99.951   7.0974   99.951   7.0974   0.0000   0.0000  360.733   12.854  ?   ?  0.000000 12.85420 
1 1 1   21   15    4 o  369.312   12.604  104.751   7.1249  104.751   7.1249   0.0000   0.0000  369.312   12.604  ?   ?  0.000000 12.60421 
1 1 1   21   15    5 o  286.492   8.5677   62.919   3.7571   63.919   4.3225   59.829   7.5978  288.687   9.7823  278.026   17.950 10.66174 20.44223 
1 1 1   21   15    6 o  532.975   7.1702  217.653   5.8494  222.004   6.9039  206.584   11.012  538.159   8.3813  518.408   13.878 19.75146 16.21250 
1 1 1   21   15    7 o   92.427   27.679   6.7316   4.2228   7.1490   5.2959   6.0027   6.9976   96.822   31.325   97.054   35.758 -0.2322235 47.53864 
1 1 1   21   15    8 o  460.934   8.0005  162.849   5.6445  161.471   6.7025  166.209   10.468  458.832   9.5436  464.817   14.713 -5.985382 17.53691 
1 1 1   21   15    9 o   76.815   20.809   4.7148   2.5072   3.9788   2.6623   10.485   7.4544   71.704   22.084  116.021   37.126 -44.31779 43.19757 
1 1 1   21   15   10 o  251.996   7.8794   48.676   3.0392   51.127   3.3034   35.162   7.7553  258.240   8.3574  211.413   24.415 46.82623 25.80588 
1 1 1   21   15   11 o  379.875   7.4383  110.599   4.3250  110.323   4.8727  111.621   9.3893  379.326   8.3925  380.611   16.117 -1.284851 18.17104 
1 1 1   21   15   12 f  162.488   10.384   20.347   2.5692   22.471   2.7440   5.2526   7.3152  170.772   10.549   95.270   36.251 75.50148 37.75449 
1 1 1   21   15   13 o  529.153   5.4514  214.469   4.4153  218.494   4.7854  191.432   11.450  534.060   5.8540  498.559   15.004 35.50140 16.10585 
1 1 1   21   15   14 o   95.314   11.242   7.0742   1.6085   6.9278   1.6454   10.230   7.6397   94.248   11.654  114.954   37.651 -20.70578 39.41292 
1 1 1   21   15   15 o  399.733   9.1140  122.595   5.5763  127.315   6.7520  112.468   9.8898  407.144   10.835  381.694   16.928 25.44998 20.09835 
1 1 1   21   15   16 o  141.945   19.768   15.898   4.1783   19.285   4.9055   6.9467   7.9748  156.311   21.038  103.183   38.144 53.12785 43.56096 
1 1 1   21   15   17 o  285.672   8.1642   62.593   3.5699   62.593   3.5699   0.0000   0.0000  285.672   8.1642  ?   ?  0.000000 8.164201 
1 1 1   21   15   18 o  235.544   8.4636   42.565   3.0514   41.874   3.2356   48.121   9.1746  233.583   9.0498  247.062   24.588 -13.47859 26.20036 
1 1 1   21   15   19 o  220.685   9.1666   37.385   3.0964   38.374   3.3100   30.456   8.7610  223.547   9.6736  194.168   30.483 29.37915 31.98070 
1 1 1   21   15   20 o   85.909   19.617   5.9539   2.5228   5.5140   2.6530   10.108   8.1531   82.624   20.949  114.754   38.925 -32.12989 44.20449 
1 1 1   21   15   21 o  442.988   7.1136  150.486   4.8233  151.180   5.3363  147.385   11.275  443.911   7.8536  436.382   16.881 7.529846 18.61819 
1 1 1   21   15   22 o  173.399   11.354   23.232   2.9968   22.820   3.2373   25.703   7.9235  171.688   12.402  177.712   30.211 -6.024628 32.65731 
1 1 1   21   15   23 o  138.940   11.042   14.945   2.3288   14.977   3.2371   14.912   3.3528  138.311   15.561  137.880   16.195 0.4305420 22.45950 
1 1 1   21   15   24 o  195.787   8.8837   29.444   2.6622   27.648   3.8763   31.047   3.6627  188.801   13.503  200.393   11.996 -11.59181 18.06194 
1 1 1   21   15   25 o   83.002   18.210   5.5616   2.2499   8.2191   3.2857   3.2151   3.0874  100.576   21.959   67.835   23.909 32.74039 32.46325 
1 1 1   21   15   26 o  369.599   6.4657  104.773   3.6578  109.473   5.3420  100.624   5.0188  377.369   9.2484  361.828   9.0621 15.54071 12.94816 
1 1 1   21   15   27 o  171.055   12.363   22.697   3.2151   24.396   4.1320   20.090   5.1186  176.733   15.429  158.630   21.646 18.10265 26.58236 
1 1 1   21   15   28 o   70.247   21.443   3.9026   2.5167   2.0384   3.8786   5.2582   3.3074   65.722   26.004   81.038   24.548 -15.31551 35.76009 
1 1 1   21   15   29 o   81.674   21.127   5.4416   2.6611   8.9258   4.0377   2.7659   3.5383  103.905   25.563   67.265   25.300 36.63947 35.96619 
1 1 1   21   15   30 o   79.911   23.978   5.1411   3.1666   6.5896   7.3775   4.8140   3.5060   97.813   36.583   78.537   25.495 19.27630 44.59047 
1 1 1   21   15   31 o  199.024   12.298   30.740   3.7280   42.145   11.009   29.263   3.9621  224.624   33.003  193.905   13.432 30.71979 35.63166 
1 1 1   21   15   32 o  387.019   7.2468  115.061   4.2929  124.132   6.7499  108.901   5.5629  401.009   10.997  375.968   9.6667 25.04120 14.64166 
1 1 1   21   15   33 o  250.649   9.1575   48.384   3.5133   54.505   5.7999   44.836   4.4156  264.448   14.383  240.748   11.983 23.69951 18.72047 
1 1 1   21   15   34 o  315.544   8.2416   76.607   3.9805   77.117   6.2624   76.261   5.1561  315.360   12.974  314.255   10.719 1.105316 16.82922 
1 1 1   21   15   35 o  355.449   7.9837   97.202   4.3436   95.813   6.9781   98.081   5.5499  351.393   12.974  356.471   10.172 -5.078308 16.48601 
1 1 1   21   15   36 o  131.852   18.204   13.919   3.5758   7.4205   6.5832   16.639   4.2588   97.704   34.862  143.795   19.881 -46.09158 40.13280 
1 1 1   21   15   37 o  326.170   8.5795   81.968   4.2833   84.869   6.8624   80.116   5.4822  330.236   13.576  321.730   11.133 8.506165 17.55716 
1 1 1   21   15   38 o  158.262   14.776   19.729   3.5379   18.682   5.9677   20.296   4.3931  149.177   27.136  159.350   18.347 -10.17299 32.75568 
1 1 1   21   15   39 o  128.060   18.254   13.204   3.4768   17.791   6.2243   11.124   4.1917  144.283   29.187  115.182   24.528 29.10080 38.12451 
1 1 1   21   15   40 o   61.007   25.232   1.2235   3.8393   0.1836   6.3128   1.8339   4.8365   71.264   30.997   68.923   28.395 2.340523 42.03716 
1 1 1   21   15   41 o  243.847   16.323   47.085   6.0572   51.712   7.8213   40.150   9.5745  253.303   20.344  217.033   29.593 36.27072 35.91182 
1 1 1   21   15   42 o   77.387   26.956   4.6849   3.9177   10.664   6.9589   1.9104   4.7402  109.294   35.940   68.267   28.116 41.02658 45.63161 
1 1 1   21   15   43 o  220.043   13.888   38.149   4.6535   45.622   9.0350   35.450   5.4290  233.004   25.765  210.596   16.987 22.40720 30.86051 
1 1 1   21   15   44 o  197.089   13.868   30.701   4.1568   28.930   6.1068   32.230   5.6742  187.081   21.731  199.371   18.817 -12.28946 28.74537 
1 1 1   21   15   45 o   83.422   26.957   5.9383   3.9228  -1.9571   5.7153   12.971   5.3940   61.266   27.860  120.126   29.542 -58.85927 40.60624 
1 1 1   21   15   46 o  123.902   21.421   12.931   3.9155   7.6564   5.5605   18.119   5.5146   93.024   32.130  144.394   25.903 -51.37032 41.27106 
1 1 1   21   15   47 o  111.781   26.844   11.209   4.5351   7.7439   8.0385   12.827   5.4928   95.117   37.498  117.570   30.324 -22.45310 48.22555 
1 1 1   21   15   48 o  206.648   12.826   33.921   4.0367   22.574   5.4035   48.251   6.0724  162.462   22.319  243.900   16.361 -81.43840 27.67358 
1 1 1   21   15   49 o  209.766   12.510   34.991   3.9985   21.895   5.1099   55.672   6.4216  160.004   21.401  261.640   16.113 -101.6360 26.78879 
1 1 1   21   15   50 o  112.952   24.355   11.490   4.0868   8.4909   5.3367   15.744   6.3552   93.375   31.493  125.437   32.748 -32.06217 45.43405 
1 1 1   21   16    0 o  295.383   16.437   67.603   7.3789   67.603   7.3789   67.603   7.3789  295.383   16.437  295.383   16.437 0.000000 0.000000 
1 1 1   21   16    1 o  248.186   8.9996   47.231   3.4188   47.307   3.9074   46.983   7.0602  248.314   10.281  246.025   18.893 2.288727 21.50885 
1 1 1   21   16    2 o  309.433   9.3274   73.430   4.4177   73.430   4.4177   0.0000   0.0000  309.433   9.3274  ?   ?  0.000000 9.327416 
1 1 1   21   16    3 o   50.047   21.875  -0.6660   3.1774  -0.6660   3.1774   0.0000   0.0000   50.047   21.875  ?   ?  0.000000 21.87506 
1 1 1   21   16    4 o  342.214   8.0472   89.767   4.2151   90.419   4.9100   87.942   8.2193  343.360   9.3424  337.949   15.890 5.410614 18.43266 
1 1 1   21   16    5 o  434.613   14.567  145.315   9.6903   0.0000   0.0000  145.315   9.6903  ?   ?   434.613   14.567 0.000000 14.56682 
1 1 1   21   16    6 o  306.047   17.677   72.479   8.2452   0.0000   0.0000   72.479   8.2452  ?   ?   306.047   17.677 0.000000 17.67655 
1 1 1   21   16    7 o  206.696   15.000   33.054   4.7133   26.785   5.9682   43.444   7.6832  184.791   21.502  235.923   21.513 -51.13155 30.41665 
1 1 1   21   16    8 o  522.661   6.4447  209.291   5.1557  204.597   5.6912  230.772   12.175  516.698   7.1961  547.618   14.525 -30.92023 16.21014 
1 1 1   21   16    9 o  268.163   7.8327   55.126   3.2150   56.304   3.4756   48.140   8.4620  270.982   8.3796  248.143   22.525 22.83946 24.03302 
1 1 1   21   16   10 o  108.602   16.723   9.3031   2.6907   7.6062   2.8882   20.451   7.4031   97.413   20.039  158.689   31.589 -61.27599 37.40911 
1 1 1   21   16   11 o  273.665   8.5552   57.436   3.5836   60.127   3.9636   45.383   8.3872  279.956   9.2499  240.655   23.051 39.30125 24.83806 
1 1 1   21   16   12 o  500.844   6.5759  192.219   5.0411  189.021   5.5230  208.184   12.340  496.591   7.2661  519.728   15.513 -23.13730 17.12993 
1 1 1   21   16   13 o  670.801   6.7814  344.851   6.9628  351.195   7.8871  322.441   14.823  676.821   7.6133  646.900   14.970 29.92126 16.79503 
1 1 1   21   16   14 o   53.611   17.261   2.1601   1.6095   2.2957   1.6425  -1.1115   8.0694   54.962   17.410   80.026   34.922 -25.06399 39.02168 
1 1 1   21   16   15 o  131.952   11.356   13.479   2.2712   13.939   2.3627   7.8756   8.2420  134.167   11.620  107.184   38.911 26.98318 40.60852 
1 1 1   21   16   16 o  219.030   8.6278   36.807   2.8925   36.807   2.8925   0.0000   0.0000  219.030   8.6278  ?   ?  0.000000 8.627789 
1 1 1   21   16   17 o  214.792   8.7190   35.403   2.8665   35.784   3.0475   32.479   8.4443  215.910   9.2215  201.440   28.157 14.46991 29.62830 
1 1 1   21   16   18 o  420.512   6.8371  135.563   4.4007  138.248   4.8361  122.633   10.612  424.589   7.4414  398.089   17.417 26.50043 18.93967 
1 1 1   21   16   19 o  301.103   7.8046   69.548   3.5969   72.887   3.9155   51.500   9.1034  308.199   8.3003  255.692   23.524 52.50691 24.94567 
1 1 1   21   16   20 o  123.871   14.171   11.988   2.6385   11.843   2.7864   13.252   8.2096  122.932   15.128  127.010   38.720 -4.078148 41.56987 
1 1 1   21   16   21 o  195.713   10.041   29.516   2.9978   30.191   3.1928   24.489   8.7119  197.871   10.580  171.971   34.300 25.90018 35.89442 
1 1 1   21   16   22 o  123.845   15.543   12.044   2.8814   14.557   3.0675  -6.8093   8.4014  136.453   14.930   69.739   32.449 66.71453 35.71886 
1 1 1   21   16   23 o   82.392   22.808   5.4846   2.9743   7.9588   3.1795 -11.8492   8.4157   99.060   21.580   62.195   29.940 36.86577 36.90636 
1 1 1   21   16   24 o   72.444   21.630   4.1643   2.5815   5.9890   3.0677  -0.2635   4.7786   85.851   22.917   62.895   27.162 22.95576 35.53836 
1 1 1   21   16   25 o  352.120   6.4755   95.099   3.4901  106.448   5.0719   84.891   4.8100  372.177   8.9033  332.275   9.4575 39.90204 12.98896 
1 1 1   21   16   26 o   55.474   21.847   1.4339   2.7259   1.2476   3.3238   1.8165   4.7636   58.710   23.784   69.916   28.419 -11.20562 37.05788 
1 1 1   21   16   27 o  361.152   6.6351  100.079   3.6678  100.758   5.3191   99.465   5.0644  361.862   9.6035  359.611   9.2009 2.250275 13.29973 
1 1 1   21   16   28 o  216.386   8.8718   36.010   2.9384   38.087   4.3536   34.271   3.9822  221.577   12.892  210.249   12.430 11.32863 17.90835 
1 1 1   21   16   29 o  213.363   13.640   35.400   4.4312   0.0000   0.0000   35.400   4.4312  ?   ?   213.363   13.640 0.000000 13.63985 
1 1 1   21   16   30 o  183.796   12.279   26.229   3.4344   29.576   7.5842   25.366   3.8520  190.447   26.756  180.329   14.067 10.11783 30.22820 
1 1 1   21   16   31 o  267.770   8.3537   55.144   3.4238   62.510   5.2870   49.823   4.4933  284.317   12.149  253.955   11.559 30.36249 16.76950 
1 1 1   21   16   32 o  348.756   7.4134   93.466   3.9574  101.631   6.1527   87.704   5.1683  362.762   11.081  337.271   10.011 25.49106 14.93373 
1 1 1   21   16   33 o   98.318   20.241   7.8912   2.9446   12.112   4.6789   5.1235   3.7891  120.564   26.110   80.742   26.519 39.82202 37.21548 
1 1 1   21   16   34 o   53.995   22.247   0.8569   2.9690  -1.2556   4.8532   2.1205   3.7533   59.668   26.516   64.898   25.611 -5.229816 36.86511 
1 1 1   21   16   35 o   75.091   24.527   4.4307   3.2428   9.5518   5.8328   2.1397   3.9013  106.192   32.684   65.724   26.056 40.46776 41.79906 
1 1 1   21   16   36 o  241.562   10.336   45.087   3.8216   45.434   6.1404   44.867   4.8823  240.075   16.816  239.858   13.351 0.2175598 21.47213 
1 1 1   21   16   37 o  249.318   10.135   48.033   3.8677   52.787   6.4014   45.299   4.8539  258.960   16.232  240.970   13.211 17.99010 20.92832 
1 1 1   21   16   38 o  110.615   23.061   10.179   3.7780   8.1403   5.7463   11.731   5.0140   98.737   32.669  117.092   28.292 -18.35541 43.21640 
1 1 1   21   16   39 o  114.360   23.836   10.941   4.0371   16.374   6.3206   7.1972   5.2468  137.338   30.824   93.393   31.228 43.94529 43.87865 
1 1 1   21   16   40 o  311.072   12.429   75.335   5.9177   72.460   7.0867   81.956   10.756  303.397   15.310  317.920   22.244 -14.52286 27.00320 
1 1 1   21   16   41 o  134.929   23.313   15.177   4.6407   8.6874   6.1214   23.946   7.1162  100.521   33.730  167.023   28.881 -66.50178 44.40499 
1 1 1   21   16   42 o   60.221   25.787   0.4867   4.2381   31.190   12.165  -3.7544   4.5213  177.046   44.843   50.241   23.517 126.8048 50.63523 
1 1 1   21   16   43 o   62.086   26.378   0.8648   4.3721   0.3582   11.194   0.9560   4.7493   88.651   39.771   64.490   27.448 24.16129 48.32343 
1 1 1   21   16   44 o  107.425   24.209   9.9330   3.8854   10.143   5.7507   9.7569   5.2701  105.544   32.448  104.019   30.870 1.524918 44.78667 
1 1 1   21   16   45 o   97.697   26.067   8.3936   3.9704   9.3496   5.8520   7.5783   5.4045  101.188   32.943   92.836   31.691 8.352013 45.71171 
1 1 1   21   16   46 o  232.084   13.286   42.647   4.7000   39.558   7.3057   44.828   6.1390  217.068   22.306  235.382   17.158 -18.31371 28.14143 
1 1 1   21   16   47 o   76.914   26.998   4.9747   3.9338   7.2687   5.7113   2.9042   5.4261   89.994   32.433   72.469   29.987 17.52468 44.17139 
1 1 1   21   16   48 o  183.080   14.494   26.977   4.0284   19.442   5.3467   36.870   6.1265  148.817   24.313  210.448   19.232 -61.63164 30.99964 
1 1 1   21   16   49 o  206.399   13.166   34.069   4.1377   31.983   5.6034   36.571   6.1360  195.537   18.960  208.747   19.427 -13.21054 27.14594 
1 1 1   21   17    0 o  717.531   13.548  395.381   14.868  395.381   14.868  395.381   14.868  717.531   13.548  717.531   13.548 0.000000 0.000000 
1 1 1   21   17    1 o  440.480   8.5773  148.772   5.7829  148.772   5.7829   0.0000   0.0000  440.480   8.5773  ?   ?  0.000000 8.577328 
1 1 1   21   17    2 f  610.550   7.3159  285.686   6.8369  291.004   8.2756  274.254   12.134  616.018   8.7768  597.255   13.273 18.76282 15.91234 
1 1 1   21   17    3 o  224.665   12.896   38.924   4.4160   39.124   5.5216   38.569   7.3564  224.762   16.158  222.051   21.931 2.710251 27.24018 
1 1 1   21   17    4 o  456.924   9.4014  160.157   6.5752  158.868   8.5988  161.973   10.203  454.693   12.355  458.761   14.530 -4.068085 19.07309 
1 1 1   21   17    5 o  402.259   9.8299  124.159   6.0524  131.856   8.0037  113.880   9.2494  414.191   12.625  384.472   15.717 29.71912 20.15983 
1 1 1   21   17    6 o  175.996   12.558   23.927   3.3606   26.061   3.7644   15.548   7.4586  183.590   13.490  137.631   35.250 45.95923 37.74343 
1 1 1   21   17    7 o  236.691   11.915   43.152   4.3029   42.324   5.1186   45.147   7.9453  234.061   14.357  240.342   21.836 -6.280792 26.13290 
1 1 1   21   17    8 f  323.368   8.3358   80.185   4.1258   82.308   4.6916   72.940   8.6669  327.536   9.3581  306.676   18.551 20.86099 20.77751 
1 1 1   21   17    9 o  241.192   9.6953   44.643   3.5793   43.782   3.9554   48.536   8.4093  238.774   10.823  249.082   22.293 -10.30820 24.78099 
1 1 1   21   17   10 o  309.631   8.4717   73.529   4.0150   76.752   4.5078   61.157   8.8316  316.274   9.3117  280.152   20.743 36.12234 22.73722 
1 1 1   21   17   11 o  403.997   6.8241  125.088   4.2198  125.970   4.6382  120.845   10.167  405.362   7.4754  395.666   16.788 9.696167 18.37673 
1 1 1   21   17   12 o   61.594   21.552   2.6213   2.5058   4.0469   2.6406 -10.2869   7.9457   72.018   21.960   62.213   29.720 9.805229 36.95319 
1 1 1   21   17   13 o  344.900   7.3029   91.197   3.8553   89.720   4.1646  100.045   10.194  342.041   7.9548  359.077   18.611 -17.03641 20.24012 
1 1 1   21   17   14 o  142.878   12.262   15.816   2.6556   17.346   2.8168   3.5821   7.9640  149.658   12.408   92.010   36.975 57.64813 39.00189 
1 1 1   21   17   15 o  283.632   12.997   61.930   5.6427   61.930   5.6427   0.0000   0.0000  283.632   12.997  ?   ?  0.000000 12.99748 
1 1 1   21   17   16 o  142.108   11.086   15.617   2.3922   15.908   2.4671   11.040   9.7826  143.400   11.332  121.447   42.579 21.95356 44.06095 
1 1 1   21   17   17 o  267.352   7.8712   54.830   3.2210   56.820   3.4389   40.602   9.1956  272.129   8.2561  225.726   27.160 46.40230 28.38740 
1 1 1   21   17   18 o  482.881   6.8493  178.781   5.0624  179.083   5.5598  177.314   12.244  483.198   7.5174  478.715   16.710 4.483093 18.32312 
1 1 1   21   17   19 f  249.762   8.4213   47.881   3.2194   48.725   3.4253   41.486   9.4265  251.913   8.8835  227.780   27.601 24.13362 28.99548 
1 1 1   21   17   20 o  398.268   7.3350  121.674   4.4714  124.951   4.9060  105.598   10.866  403.515   7.9433  368.014   19.359 35.50128 20.92489 
1 1 1   21   17   21 o  269.386   8.6264   55.725   3.5569   58.888   3.8351   36.263   9.5129  276.879   9.0493  211.485   30.249 65.39417 31.57388 
1 1 1   21   17   22 o  360.118   7.8290   99.539   4.3154  102.026   4.7228   86.963   10.621  364.500   8.4652  333.017   20.943 31.48270 22.58920 
1 1 1   21   17   23 o  208.729   11.087   33.642   3.5295   37.654   3.8341   11.360   9.0354  220.807   11.383  119.813   40.976 100.9933 42.52759 
1 1 1   21   17   24 o  186.585   10.535   26.884   2.9963   31.281   3.5747   16.496   5.4942  201.120   11.662  142.228   26.203 58.89233 28.68140 
1 1 1   21   17   25 o  143.805   13.653   16.130   2.9692   19.581   3.5423   7.9788   5.4448  158.326   14.789   99.674   31.712 58.65121 34.99069 
1 1 1   21   17   26 o  205.125   9.3385   32.367   2.9320   33.646   4.3845   31.333   3.9435  208.054   13.847  200.955   12.889 7.099060 18.91713 
1 1 1   21   17   27 o  158.764   11.415   19.545   2.7555   11.197   4.0528   26.722   3.7578  117.060   23.437  185.371   13.333 -68.31151 26.96382 
1 1 1   21   17   28 o  107.560   16.268   9.1969   2.5946   13.417   3.7255   5.2218   3.6157  129.518   19.389   81.259   25.841 48.25864 32.30594 
1 1 1   21   17   29 o  179.896   12.208   25.127   3.3416   27.063   6.9038   24.535   3.8188  182.622   25.385  177.308   14.190 5.313431 29.08162 
1 1 1   21   17   30 o  251.980   8.4136   48.834   3.2450   61.230   5.1088   40.451   4.2014  281.466   11.858  228.431   12.059 53.03484 16.91264 
1 1 1   21   17   31 o  127.219   14.743   12.744   2.8176   14.275   4.3915   11.673   3.6733  132.504   22.455  120.058   20.739 12.44643 30.56690 
1 1 1   21   17   32 o  197.039   10.456   30.044   3.1423   29.246   4.8302   30.630   4.1376  192.812   16.526  198.176   13.725 -5.363861 21.48236 
1 1 1   21   17   33 o  176.133   11.985   24.124   3.2120   27.075   5.0561   22.127   4.1590  184.852   18.102  167.474   16.436 17.37770 24.45078 
1 1 1   21   17   34 o  189.204   11.557   27.805   3.3310   21.485   5.2984   31.935   4.2833  163.069   21.772  202.172   13.926 -39.10284 25.84469 
1 1 1   21   17   35 o  193.858   12.229   29.253   3.6101   22.891   6.1634   32.576   4.4541  166.909   24.886  203.980   14.358 -37.07103 28.73067 
1 1 1   21   17   36 o  300.805   8.7554   69.742   4.0312   70.212   6.2538   69.409   5.2728  300.315   13.605  299.314   11.509 1.000977 17.82008 
1 1 1   21   17   37 o   84.107   24.913   5.8593   3.4348   4.9500   5.1183   6.6044   4.6329   82.997   30.581   89.797   29.315 -6.800079 42.36270 
1 1 1   21   17   38 o   72.202   24.965   3.9585   3.3575  -0.8492   5.3593   7.0645   4.3076   63.437   28.043   91.753   28.063 -28.31587 39.67284 
1 1 1   21   17   39 o  142.414   20.674   16.532   4.3748   15.599   5.7803   17.783   6.6935  134.611   28.917  142.610   31.504 -7.999084 42.76336 
1 1 1   21   17   40 o   65.092   27.454   1.0653   4.6802   0.0754   5.6776   3.1642   8.2671   67.390   29.354   86.905   36.562 -19.51474 46.88726 
1 1 1   21   17   41 o  167.747   15.211   22.328   3.8632   19.151   6.0967   24.460   4.9936  149.336   27.692  173.932   19.070 -24.59621 33.62308 
1 1 1   21   17   42 o  207.038   14.500   33.899   4.5659   45.950   9.4527   30.232   5.2145  232.551   27.062  193.898   17.768 38.65404 32.37373 
1 1 1   21   17   43 o   99.188   25.574   8.5510   3.9076   6.7668   6.4925   9.5643   4.8930   91.602   34.307  103.576   29.462 -11.97385 45.22127 
1 1 1   21   17   44 o  277.275   11.139   59.990   4.7275   58.205   7.4837   61.175   6.0984  268.232   18.338  277.892   14.387 -9.659851 23.30782 
1 1 1   21   17   45 o   73.777   27.225   4.1584   4.0589   1.1216   6.4011   6.2005   5.2491   71.911   31.246   85.982   31.077 -14.07102 44.06905 
1 1 1   21   17   46 o  106.498   25.052   10.040   4.0154   12.200   6.0870   8.3763   5.3427  112.752   33.100   95.288   31.499 17.46398 45.69270 
1 1 1   21   17   47 o   73.479   26.163   4.4683   3.7057   8.6162   5.1304  -0.0566   5.3584   95.693   30.819   62.797   27.887 32.89545 41.56259 
1 1 1   21   17   48 o  128.286   20.112   13.998   3.8193   8.8346   5.1626   20.240   5.6767   95.941   30.917  150.484   25.559 -54.54330 40.11408 
1 1 1   21   17   49 o   73.481   26.498   4.5934   3.8131   8.1519   5.3642   0.9587   5.4214   91.781   31.566   64.983   28.484 26.79798 42.51758 
1 1 1   21   18    0 f  427.970   15.301  141.174   9.9943  141.174   9.9943  141.174   9.9943  427.970   15.301  427.970   15.301 0.000000 0.000000 
1 1 1   21   18    1 o  305.861   16.420   72.347   7.6590   0.0000   0.0000   72.347   7.6590  ?   ?   305.861   16.420 0.000000 16.41978 
1 1 1   21   18    2 o  462.551   9.2694  164.143   6.5627  175.055   8.9017  151.150   9.7134  477.254   12.186  443.116   14.321 34.13867 18.80418 
1 1 1   21   18    3 o  221.063   13.476   37.733   4.5379   34.625   5.5964   43.698   7.7540  211.075   17.479  236.410   21.670 -25.33546 27.84070 
1 1 1   21   18    4 o  269.614   9.2811   55.771   3.8301   57.180   4.3807   51.199   7.8909  272.905   10.487  256.352   20.276 16.55231 22.82756 
1 1 1   21   18    5 o  194.336   11.753   29.125   3.4796   26.342   3.8908   40.244   7.7767  184.492   13.880  226.519   22.736 -42.02663 26.63824 
1 1 1   21   18    6 o  402.279   7.8081  124.074   4.8077  121.922   5.4776  131.292   10.033  398.659   8.9768  412.644   15.884 -13.98477 18.24543 
1 1 1   21   18    7 o  663.492   7.6086  337.497   7.7270  340.219   9.0962  330.441   14.645  665.944   8.9238  654.987   14.608 10.95782 17.11805 
1 1 1   21   18    8 o  158.516   13.919   19.491   3.3429   21.482   3.6764   9.9857   8.0330  166.370   14.584  114.618   38.639 51.75189 41.29952 
1 1 1   21   18    9 o  469.326   7.8101  168.896   5.6105  167.918   6.4983  171.762   11.120  467.808   9.0753  471.990   15.392 -4.182068 17.86831 
1 1 1   21   18   10 o  406.293   8.0221  126.595   4.9888  130.377   5.6874  113.974   10.390  412.206   9.0142  383.983   17.677 28.22311 19.84308 
1 1 1   21   18   11 o  259.835   9.5173   51.824   3.7851   52.844   4.1492   46.766   9.2404  262.309   10.334  243.453   25.160 18.85645 27.19997 
1 1 1   21   18   12 o  341.160   7.4427   89.243   3.8865   87.472   4.1930  100.045   10.356  337.698   8.1119  358.899   18.918 -21.20087 20.58417 
1 1 1   21   18   13 o  420.408   6.9557  135.494   4.4759  135.506   4.9026  135.433   10.970  420.356   7.6198  418.521   17.124 1.834961 18.74274 
1 1 1   21   18   14 o  390.123   7.7451  116.731   4.6248  116.731   4.6248   0.0000   0.0000  390.123   7.7451  ?   ?  0.000000 7.745055 
1 1 1   21   18   15 o  366.628   11.531  103.385   6.4710  103.385   6.4710   0.0000   0.0000  366.628   11.531  ?   ?  0.000000 11.53121 
1 1 1   21   18   16 o   49.018   22.712  -3.3253   4.0499  -4.8897   4.6251   1.8164   8.3851   49.873   23.484   88.460   36.995 -38.58717 43.81898 
1 1 1   21   18   17 o  369.004   7.0435  104.418   3.9782  104.349   4.2858  104.845   10.695  368.822   7.5917  366.943   19.107 1.879913 20.56022 
1 1 1   21   18   18 o  190.908   9.4491   27.998   2.7611   28.386   2.8900   23.934   9.3507  191.943   9.8701  169.025   37.156 22.91902 38.44437 
1 1 1   21   18   19 o  280.858   8.0658   60.542   3.4674   61.580   3.7019   53.119   9.8997  283.207   8.5399  258.685   25.327 24.52164 26.72831 
1 1 1   21   18   20 o  315.891   7.7980   76.584   3.7704   75.016   4.0388   87.217   10.518  312.565   8.4420  333.688   20.695 -21.12204 22.35104 
1 1 1   21   18   21 o  367.262   7.6755  103.522   4.3147  105.536   4.6695   91.763   11.286  370.737   8.2287  341.740   21.688 28.99634 23.19629 
1 1 1   21   18   22 f  357.488   8.5744   98.172   4.6918  100.505   5.1603   87.048   11.269  361.587   9.3237  332.387   22.279 29.20081 24.15123 
1 1 1   21   18   23 o  213.855   10.942   35.316   3.5696   36.273   3.8377   29.176   9.7216  216.619   11.617  186.555   35.339 30.06398 37.19971 
1 1 1   21   18   24 o  283.245   9.7361   61.729   4.2210   61.542   4.5712   62.813   10.996  282.681   10.565  280.143   25.939 2.538422 28.00775 
1 1 1   21   18   25 o  209.715   10.204   33.868   3.2754   31.017   3.9323   40.328   5.9195  199.920   12.920  226.955   17.167 -27.03528 21.48547 
1 1 1   21   18   26 o  177.431   11.108   24.372   3.0015   24.542   3.5695   23.962   5.5456  177.632   13.223  173.304   21.358 4.328339 25.12014 
1 1 1   21   18   27 o  140.478   12.141   15.357   2.5849   13.639   3.4043   17.697   3.9724  131.143   17.388  149.577   17.694 -18.43474 24.80763 
1 1 1   21   18   28 o   64.422   24.104   2.5741   3.2035   2.2210   6.4639   2.6890   3.6884   79.509   32.800   67.558   25.732 11.95149 41.68914 
1 1 1   21   18   29 o  178.395   10.501   24.627   2.8546   20.403   4.0473   28.809   4.0269  160.908   16.675  192.270   13.774 -31.36235 21.62848 
1 1 1   21   18   30 o  169.056   11.334   22.175   2.9159   23.132   4.2684   21.338   3.9927  171.414   16.472  164.693   16.042 6.721695 22.99283 
1 1 1   21   18   31 o   59.070   21.931   2.2055   2.6417   1.4756   4.1066   2.7208   3.4504   64.286   26.287   66.300   24.975 -2.013954 36.25937 
1 1 1   21   18   32 o  338.523   7.6062   88.109   3.9412   83.854   5.7459   91.890   5.4160  329.304   11.400  345.061   10.254 -15.75714 15.33326 
1 1 1   21   18   33 o   71.452   23.706   3.9421   3.0250  -0.0608   4.6889   6.7959   3.9591   62.179   26.880   90.584   26.724 -28.40445 37.90361 
1 1 1   21   18   34 o  101.113   20.870   8.3948   3.1230   5.8781   5.1605   9.8491   3.9228   87.688   30.911  108.736   24.194 -21.04797 39.25334 
1 1 1   21   18   35 o   36.981   18.069  -6.1051   3.3774  -5.4321   4.9066  -6.7112   4.6561   50.018   23.741   45.899   22.139 4.119072 32.46167 
1 1 1   21   18   36 o  127.730   19.743   13.220   3.7354   8.4348   5.2951   17.960   5.2704   99.881   31.207  147.490   24.184 -47.60990 39.48159 
1 1 1   21   18   37 o  100.830   22.598   8.4725   3.4013   9.5498   5.5488   7.8241   4.3049  105.296   31.773   96.096   27.730 9.199738 42.17204 
1 1 1   21   18   38 o  161.165   18.073   20.803   4.3815   23.467   5.7308   17.056   6.7976  169.235   22.695  139.210   32.494 30.02507 39.63490 
1 1 1   21   18   39 o  171.563   19.146   23.722   4.9419   25.603   6.0189   19.830   8.6573  176.523   22.810  146.466   38.214 30.05714 44.50401 
1 1 1   21   18   40 o  142.964   16.707   16.376   3.5869   22.831   5.9586   12.708   4.4920  165.447   24.249  122.443   24.818 43.00356 34.69818 
1 1 1   21   18   41 o  224.969   11.739   39.548   4.0283   34.266   6.2432   43.316   5.2728  205.290   20.128  234.080   14.793 -28.78966 24.97880 
1 1 1   21   18   42 o  104.025   26.747   9.4622   4.2825   10.629   9.4472   9.1603   4.8045  109.019   41.264  101.629   29.285 7.389725 50.60017 
1 1 1   21   18   43 o  263.660   11.148   54.221   4.4988   49.887   7.1099   57.114   5.8099  248.000   18.872  268.715   14.176 -20.71529 23.60276 
1 1 1   21   18   44 o  242.463   12.443   46.261   4.6023   40.977   7.1131   50.065   6.0361  222.493   21.141  250.160   15.846 -27.66670 26.42012 
1 1 1   21   18   45 o  125.759   22.053   13.472   4.0903   11.746   6.4382   14.640   5.2966  110.401   34.398  127.575   27.902 -17.17432 44.29118 
1 1 1   21   18   46 o  176.313   16.219   25.245   4.3279   18.988   6.6273   29.898   5.7147  142.040   31.325  189.234   20.035 -47.19405 37.18351 
1 1 1   21   18   47 o   60.889   24.705   2.0401   3.5923   2.9744   4.9296   0.9821   5.2456   70.199   28.764   64.906   28.244 5.293663 40.31259 
1 1 1   21   18   48 o   51.978   23.111  -0.3826   3.6917  -1.0857   5.0985   0.3922   5.3523   58.140   26.390   63.272   27.995 -5.132763 38.47266 
1 1 1   21   19    1 o  344.756   15.762   91.659   8.3173   91.659   8.3173   0.0000   0.0000  344.756   15.762  ?   ?  0.000000 15.76156 
1 1 1   21   19    2 o  170.066   13.403   22.394   3.4605   22.648   3.9597   21.571   7.1202  170.737   15.315  163.365   29.563 7.372391 33.29443 
1 1 1   21   19    3 o  432.004   9.7834  143.254   6.4692  149.080   8.7114  136.092   9.6594  440.212   12.929  420.220   15.018 19.99252 19.81627 
1 1 1   21   19    4 f  218.543   14.047   36.928   4.6741   35.510   5.8642   39.397   7.7398  213.565   18.110  223.942   22.902 -10.37720 29.19734 
1 1 1   21   19    5 o  560.746   7.5283  241.075   6.4615  233.216   7.4648  264.560   12.904  551.342   8.8456  586.030   14.386 -34.68817 16.88767 
1 1 1   21   19    6 o  230.126   10.283   40.667   3.6222   37.133   4.0280   55.604   8.2809  219.436   12.039  267.010   20.417 -47.57391 23.70157 
1 1 1   21   19    7 o  443.981   9.3392  151.288   6.3466  145.127   7.7871  163.479   10.953  434.492   11.709  460.364   15.544 -25.87216 19.46091 
1 1 1   21   19    8 o  675.811   8.0480  350.289   8.3250  350.721   9.9231  349.264   15.297  675.920   9.5914  673.079   14.848 2.841736 17.67685 
1 1 1   21   19    9 o  174.022   11.252   23.372   2.9811   23.784   3.1895   20.527   8.3860  175.461   11.947  157.492   35.622 17.96877 37.57178 
1 1 1   21   19   10 o  332.173   7.5034   84.610   3.8150   83.882   4.1351   88.770   9.8889  330.681   8.1697  337.883   19.200 -7.201538 20.86612 
1 1 1   21   19   11 o  186.133   10.783   26.713   3.0589   25.287   3.2640   37.006   8.7675  180.935   11.851  215.501   27.185 -34.56606 29.65609 
1 1 1   21   19   12 o  456.342   7.9121  159.743   5.5265  154.853   6.2446  177.408   11.870  449.139   9.0835  479.161   16.184 -30.02161 18.55931 
1 1 1   21   19   13 o  100.231   19.960   8.0706   2.9545   7.6537   3.1337   11.407   8.8642   97.294   21.605  120.872   40.589 -23.57751 45.98138 
1 1 1   21   19   14 f   42.737   19.203  -1.2228   2.6208  -1.2228   2.6208   0.0000   0.0000   42.737   19.203  ?   ?  0.000000 19.20325 
1 1 1   21   19   15 o  174.574   16.575   23.789   4.3760   26.365   4.9817   15.087   9.1565  183.563   17.961  134.839   40.844 48.72452 44.61878 
1 1 1   21   19   16 o  161.133   17.922   20.376   4.3453   19.788   4.9731   22.277   8.9349  158.011   21.088  163.130   36.675 -5.119492 42.30574 
1 1 1   21   19   17 f   71.257   27.639   2.6656   4.3090   6.1651   4.8722  -9.9010   9.2327   90.069   30.093   69.266   32.787 20.80249 44.50341 
1 1 1   21   19   18 o  234.637   8.6930   42.279   3.1220   43.368   3.2966   32.809   9.7220  237.603   9.0645  199.926   32.916 37.67743 34.14111 
1 1 1   21   19   19 o   82.473   19.294   5.5054   2.3923   5.4507   2.4780   6.2549   9.1742   82.015   19.934  103.470   40.274 -21.45457 44.93764 
1 1 1   21   19   20 o  278.594   9.2483   59.653   3.9437   62.407   4.2846   44.385   10.088  284.875   9.8263  234.534   28.701 50.34128 30.33631 
1 1 1   21   19   21 o  287.891   9.9900   63.760   4.4021   64.385   4.8263   60.667   10.738  289.155   10.905  275.759   25.738 13.39536 27.95242 
1 1 1   21   19   22 o  204.928   10.922   32.440   3.4136   33.214   3.6235   26.334   10.178  207.268   11.466  175.404   38.927 31.86441 40.58034 
1 1 1   21   19   23 o  267.847   8.7490   55.147   3.5869   54.265   3.8059   62.164   10.728  265.610   9.3615  278.835   25.416 -13.22501 27.08547 
1 1 1   21   19   24 o  103.889   18.177   8.6558   2.7851   8.3822   2.9076   11.699   9.6978  101.922   19.345  120.997   42.395 -19.07481 46.60037 
1 1 1   21   19   25 o  384.859   7.1395  113.718   4.2057  116.722   5.0446  106.872   7.6161  389.658   8.4581  371.606   13.390 18.05145 15.83761 
1 1 1   21   19   26 o  219.376   9.8898   37.065   3.3208   34.714   3.9052   43.207   6.3109  211.635   12.106  234.602   17.705 -22.96794 21.44810 
1 1 1   21   19   27 o  202.274   16.518   32.086   5.0693   29.836   6.8539   34.804   7.5322  192.544   23.760  208.007   24.105 -15.46341 33.84644 
1 1 1   21   19   28 o  266.883   7.7723   54.742   3.1750   56.435   4.3989   52.901   4.5872  270.482   10.625  261.710   11.451 8.771240 15.62135 
1 1 1   21   19   29 o  312.699   7.3517   75.129   3.5187   78.598   4.9321   71.532   5.0215  319.282   10.092  304.434   10.776 14.84805 14.76423 
1 1 1   21   19   30 o  371.283   7.0223  105.896   3.9907  107.914   5.6858  103.936   5.6027  374.105   9.9295  367.133   9.9701 6.971924 14.07120 
1 1 1   21   19   31 f  240.649   8.9258   44.602   3.2877   48.411   4.8022   41.242   4.5107  249.625   12.609  230.285   12.848 19.34048 18.00185 
1 1 1   21   19   32 o  172.356   11.662   23.093   3.0585   22.374   4.4601   23.731   4.2021  167.987   17.608  173.568   15.997 -5.581238 23.78950 
1 1 1   21   19   33 o  115.759   19.511   10.855   3.3341   12.283   4.5858   9.2542   4.8559  121.276   25.513  104.460   29.223 16.81581 38.79313 
1 1 1   21   19   34 o  174.722   14.333   23.951   3.7994   18.519   5.5728   28.669   5.1934  149.564   25.242  189.952   18.081 -40.38803 31.04924 
1 1 1   21   19   35 o  141.385   15.228   15.804   3.2434   13.930   4.7904   17.391   4.4073  129.188   25.130  146.724   20.157 -17.53581 32.21570 
1 1 1   21   19   36 o  174.052   13.304   23.724   3.5175   23.996   5.4793   23.533   4.5876  172.115   21.250  171.868   17.692 0.2476501 27.65058 
1 1 1   21   19   37 o  300.875   11.303   70.221   5.2055   72.744   6.8231   66.708   8.0521  304.859   14.622  289.637   18.256 15.22156 23.39026 
1 1 1   21   19   38 o  147.065   19.354   17.507   4.2508   16.781   5.3968   18.692   6.8993  141.024   25.958  145.921   31.789 -4.897156 41.04122 
1 1 1   21   19   39 o  201.305   12.785   31.749   3.9188   35.623   5.8522   28.600   5.2764  210.787   18.321  188.628   18.514 22.15849 26.04636 
1 1 1   21   19   40 o  342.889   8.8200   90.898   4.6290   91.701   7.1225   90.311   6.0908  342.027   13.605  340.483   11.687 1.544128 17.93570 
1 1 1   21   19   41 o  142.027   22.052   16.803   4.6385  -1.0739   13.115   19.358   4.9590   91.680   41.888  152.740   21.833 -61.06062 47.23604 
1 1 1   21   19   42 o   84.405   26.296   6.1008   3.7627   5.2009   6.1552   6.6378   4.7545   84.803   32.994   88.156   29.726 -3.352814 44.40995 
1 1 1   21   19   43 o  146.260   17.591   17.398   3.8592   24.095   5.7536   11.921   5.2032  169.331   22.777  114.880   29.452 54.45039 37.23179 
1 1 1   21   19   44 o   78.914   25.863   5.3177   3.6047   0.0366   5.3055   9.8458   4.9128   63.611   28.022  103.723   29.527 -40.11196 40.70743 
1 1 1   21   19   45 o   93.079   27.160   7.8438   4.1094   8.8572   7.1655   7.3471   5.0162   97.320   36.121   89.994   30.532 7.326141 47.29651 
1 1 1   21   19   46 o   63.028   25.460   2.2812   3.7972   4.4690   5.7768   0.6169   5.0385   78.407   31.498   63.024   27.547 15.38332 41.84391 
1 1 1   21   19   47 o  178.970   14.963   25.945   4.0612   21.389   5.6396   30.853   5.8532  155.503   24.505  190.997   20.334 -35.49434 31.84312 
1 1 1   21   20    0 f  161.792   30.240   22.258   6.7220   22.258   6.7220   22.258   6.7220  161.792   30.240  161.792   30.240 0.000000 0.000000 
1 1 1   21   20    1 f  330.077   11.145   83.729   5.6306   79.876   7.4066   89.005   8.6668  321.845   15.035  339.444   16.681 -17.59958 22.45667 
1 1 1   21   20    2 o  364.540   14.246  102.398   7.9488  102.398   7.9488   0.0000   0.0000  364.540   14.246  ?   ?  0.000000 14.24583 
1 1 1   21   20    3 o   86.353   25.919   5.9037   3.6997   5.9037   3.6997   0.0000   0.0000   86.353   25.919  ?   ?  0.000000 25.91922 
1 1 1   21   20    4 f  705.339   7.8685  381.553   8.4949  392.116   10.319  359.334   14.965  714.705   9.4324  682.826   14.318 31.87903 17.14609 
1 1 1   21   20    5 o   63.467   23.652   2.4211   3.0783   0.6472   3.4944   8.5674   6.5046   57.634   23.974  105.427   34.751 -47.79279 42.21831 
1 1 1   21   20    6 o  249.264   21.281   48.639   8.0414   0.0000   0.0000   48.639   8.0414  ?   ?   249.264   21.281 0.000000 21.28062 
1 1 1   21   20    7 o  238.260   14.108   43.903   5.1221   41.063   6.4054   48.940   8.5303  229.547   18.385  249.661   22.566 -20.11433 29.10761 
1 1 1   21   20    8 o   80.172   26.050   4.8971   3.6601   6.0719   4.1783   1.0230   7.5876   88.191   27.749   82.796   34.940 5.395378 44.61871 
1 1 1   21   20    9 o  382.693   9.0945  112.427   5.3272  113.669   6.2617  109.174   10.136  384.584   10.637  375.534   17.634 9.050018 20.59428 
1 1 1   21   20   10 o  280.848   10.884   60.636   4.6786   64.754   5.4145   48.498   9.2953  290.064   12.195  247.696   24.853 42.36786 27.68364 
1 1 1   21   20   11 o  423.218   9.1097  137.521   5.9012  131.714   6.8589  154.068   11.578  413.912   10.826  446.192   16.953 -32.27933 20.11531 
1 1 1   21   20   12 o  197.180   16.720   30.296   4.9987   30.296   4.9987   0.0000   0.0000  197.180   16.720  ?   ?  0.000000 16.71997 
1 1 1   21   20   13 o  200.489   17.124   31.351   5.2044   31.351   5.2044   0.0000   0.0000  200.489   17.124  ?   ?  0.000000 17.12368 
1 1 1   21   20   14 f  376.045   19.308  110.210   11.076   0.0000   0.0000  110.210   11.076  ?   ?   376.045   19.308 0.000000 19.30805 
1 1 1   21   20   15 o  441.451   17.491  151.150   11.819   0.0000   0.0000  151.150   11.819  ?   ?   441.451   17.491 0.000000 17.49135 
1 1 1   21   20   16 o  149.484   40.375   19.002   9.4554   0.0000   0.0000   19.002   9.4554  ?   ?   149.484   40.375 0.000000 40.37499 
1 1 1   21   20   17 o  571.141   11.388  251.184   9.9557  254.960   13.433  246.584   14.829  574.010   15.290  563.687   17.187 10.32281 23.00349 
1 1 1   21   20   18 o  179.352   22.737   25.613   6.1017   27.962   7.7233   21.713   9.9531  185.750   28.038  159.107   40.704 26.64220 49.42593 
1 1 1   21   20   19 o  112.226   27.744   10.399   4.7388   8.4461   5.4019   16.922   9.8717  102.134   31.457  140.835   42.353 -38.70052 52.75711 
1 1 1   21   20   20 o  110.558   15.797   9.6631   2.5972   10.931   2.7009  -5.9161   9.4658  117.819   15.341   76.225   35.106 41.59387 38.31170 
1 1 1   21   20   21 o   51.592   20.408   1.1844   2.3885   1.6702   2.4570  -7.1660   10.187   54.937   20.984   77.446   35.932 -22.50916 41.61065 
1 1 1   21   20   22 o  132.351   13.382   13.681   2.6736   13.648   2.7625   14.164   10.628  132.094   13.870  130.637   44.442 1.458008 46.55582 
1 1 1   21   20   23 o  153.774   11.911   18.361   2.7817   18.451   2.8792   17.101   10.777  154.077   12.311  140.427   44.608 13.64995 46.27535 
1 1 1   21   20   24 o  434.980   7.7437  145.353   5.1557  149.261   5.5867  122.915   13.386  440.669   8.2827  394.045   22.285 46.62393 23.77444 
1 1 1   21   20   25 o   67.057   22.794   3.3303   2.7957   3.7108   2.8941  -1.9793   10.812   69.885   23.187   88.535   39.447 -18.65026 45.75733 
1 1 1   21   20   26 o  266.308   13.762   55.113   5.5904   57.475   7.5208   52.197   8.3572  270.425   18.277  256.359   21.497 14.06622 28.21622 
1 1 1   21   20   27 o  132.651   14.517   13.822   2.8994   16.104   3.3118   6.3348   5.9997  143.089   15.362   92.669   33.258 50.42040 36.63470 
1 1 1   21   20   28 o  275.208   9.0774   58.315   3.8238   51.620   4.4408   77.510   7.5195  258.520   11.223  315.452   15.574 -56.93198 19.19596 
1 1 1   21   20   29 o  150.707   12.052   17.683   2.7568   18.192   3.7771   17.103   4.0329  151.765   16.527  146.558   18.382 5.207214 24.71964 
1 1 1   21   20   30 o  241.595   8.6854   44.938   3.2118   44.656   4.4452   45.246   4.6458  239.856   12.148  241.305   12.622 -1.449097 17.51811 
1 1 1   21   20   31 o  145.911   14.364   16.723   3.1664   14.224   4.1134   20.359   4.9605  132.486   20.984  159.040   20.882 -26.55397 29.60394 
1 1 1   21   20   32 o  252.668   9.8079   49.267   3.7931   48.015   4.9832   50.993   5.8486  248.281   13.160  255.211   15.039 -6.930573 19.98357 
1 1 1   21   20   33 f  179.917   12.394   25.232   3.3924   27.289   5.4139   23.903   4.3529  184.779   19.433  173.851   16.558 10.92868 25.53085 
1 1 1   21   20   34 o  232.155   9.8400   41.627   3.4966   44.215   5.2571   39.573   4.6825  237.576   14.527  225.017   13.660 12.55890 19.94033 
1 1 1   21   20   35 o  184.659   12.468   26.613   3.5033   27.197   4.9831   26.043   4.9263  184.845   17.834  180.763   18.046 4.082092 25.37134 
1 1 1   21   20   36 o  192.334   15.006   29.145   4.3828   27.445   5.4177   32.365   7.4557  184.826   19.442  197.871   25.188 -13.04475 31.81888 
1 1 1   21   20   37 o  184.184   15.374   26.818   4.2946   26.707   5.3535   27.019   7.1930  182.059   19.516  179.185   27.070 2.874130 33.37164 
1 1 1   21   20   38 o  189.465   13.367   28.193   3.8515   32.432   5.5685   24.305   5.3328  201.119   18.289  172.840   20.561 28.27908 27.51830 
1 1 1   21   20   39 o   95.673   23.702   7.7876   3.4531   9.4242   5.1545   6.4550   4.6510  103.410   30.489   87.897   29.402 15.51387 42.35592 
1 1 1   21   20   40 o   47.896   22.486  -3.6709   4.1859  -4.6474   12.578  -3.5492   4.4390   85.116   39.637   49.971   23.363 35.14447 46.00973 
1 1 1   21   20   41 o  104.450   26.663   9.5595   4.2773   7.8243   9.8633   9.9613   4.7468  101.104   40.966  105.890   28.610 -4.785728 49.96725 
1 1 1   21   20   42 o   96.221   24.915   8.0627   3.6984   5.4802   5.5246   10.160   4.9786   83.941   31.606  106.156   29.552 -22.21481 43.26944 
1 1 1   21   20   43 o   83.174   26.071   6.0082   3.6922   2.0679   5.5479   9.1410   4.9468   70.981   29.912  100.113   29.953 -29.13199 42.33083 
1 1 1   21   20   44 o  151.767   16.695   18.763   3.8142   14.092   5.5311   22.999   5.2667  123.543   29.631  165.226   21.323 -41.68267 36.50586 
1 1 1   21   20   45 o   86.268   26.795   6.7095   3.9101   5.4406   5.9981   7.6473   5.1564   82.626   32.450   90.940   30.956 -8.314110 44.84663 
1 1 1   21   20   46 o  166.438   16.325   22.663   4.1052   15.434   6.0758   28.735   5.5686  126.239   31.536  184.715   20.016 -58.47546 37.35170 
1 1 1   21   21    0 o  472.913   14.063  172.232   10.159  172.232   10.159  172.232   10.159  472.913   14.063  472.913   14.063 0.000000 0.000000 
1 1 1   21   21    1 f  126.745   24.696   12.976   4.6188   12.141   6.1804   14.033   6.9512  121.492   32.570  130.265   34.366 -8.773026 47.34780 
1 1 1   21   21    2 o  375.688   10.490  108.456   6.0324  107.951   8.1107  109.080   9.0243  374.192   14.161  375.831   15.687 -1.639282 21.13362 
1 1 1   21   21    3 o  377.294   8.1570  109.212   4.7106  109.503   5.5104  108.422   9.0788  377.627   9.5335  374.654   15.832 2.972870 18.48055 
1 1 1   21   21    4 o  404.188   13.130  125.833   8.1231  125.833   8.1231   0.0000   0.0000  404.188   13.130  ?   ?  0.000000 13.13007 
1 1 1   21   21    5 o  422.342   12.489  137.315   8.0736  137.315   8.0736   0.0000   0.0000  422.342   12.489  ?   ?  0.000000 12.48916 
1 1 1   21   21    6 o  447.295   7.7821  153.473   5.3279  155.796   6.1457  146.444   10.690  450.505   8.9125  435.300   16.044 15.20520 18.35352 
1 1 1   21   21    7 f  128.856   16.633   13.049   3.2039   12.043   3.5001   18.249   7.9582  123.170   19.191  148.021   35.568 -24.85146 40.41504 
1 1 1   21   21    8 o  348.422   8.4227   93.168   4.4918   90.102   4.9676  106.916   10.518  342.513   9.4755  371.258   18.510 -28.74506 20.79423 
1 1 1   21   21    9 f  286.116   9.0721   62.858   3.9730   60.979   4.3864   71.443   9.3751  281.687   10.173  302.364   20.376 -20.67709 22.77443 
1 1 1   21   21   10 o  189.382   11.785   27.710   3.3993   27.486   3.6980   28.931   8.6343  188.435   12.899  188.554   30.995 -0.1188507 33.57150 
1 1 1   21   21   11 o  304.849   9.9182   71.418   4.6280   71.418   4.6280   0.0000   0.0000  304.849   9.9182  ?   ?  0.000000 9.918247 
1 1 1   21   21   12 o  137.812   15.140   14.851   3.1410   14.851   3.1410   0.0000   0.0000  137.812   15.140  ?   ?  0.000000 15.13998 
1 1 1   21   21   13 o  121.339   16.113   11.591   2.9186   12.843   3.0968   1.6367   8.7305  127.816   16.192   89.144   37.542 38.67113 40.88503 
1 1 1   21   21   14 o  500.063   7.2598  191.844   5.5568  193.924   6.1439  182.491   13.025  502.640   7.9858  484.874   17.550 17.76617 19.28183 
1 1 1   21   21   15 o   75.403   27.931   3.6231   4.2803   2.4363   4.8577   7.7439   9.0517   73.063   29.040  107.724   40.476 -34.66028 49.81606 
1 1 1   21   21   16 o  324.319   14.261   81.308   7.0794   89.401   9.4364   70.888   10.707  338.527   18.279  299.416   23.553 39.11185 29.81390 
1 1 1   21   21   17 o  343.693   14.227   91.341   7.4844   86.841   9.8444   97.504   11.521  333.126   19.391  352.189   21.475 -19.06305 28.93424 
1 1 1   21   21   18 o  314.967   15.172   76.856   7.3144   75.603   9.5614   78.624   11.357  310.309   20.242  315.006   23.729 -4.697296 31.18970 
1 1 1   21   21   19 o  240.697   14.847   45.047   5.4434   48.713   6.3001   34.249   10.812  249.865   16.567  201.782   36.343 48.08253 39.94098 
1 1 1   21   21   20 o  139.763   30.636   16.306   6.3731   21.647   7.9505   6.7058   10.660  160.480   33.452  108.282   43.025 52.19806 54.49889 
1 1 1   21   21   21 o  110.566   15.171   9.6543   2.4998   8.7020   2.5718   25.938   10.635  104.540   16.630  172.574   40.888 -68.03392 44.14025 
1 1 1   21   21   22 o   75.489   20.124   4.6268   2.3676   4.4009   2.4236   9.3448   11.076   73.787   20.647  116.155   44.508 -42.36794 49.06361 
1 1 1   21   21   23 o  399.681   7.9902  122.754   4.8881  124.206   5.2277  112.657   13.786  401.931   8.4975  376.086   24.076 25.84525 25.53122 
1 1 1   21   21   24 o  307.699   13.294   73.302   6.2613   65.039   7.2008   98.916   12.677  288.542   16.372  352.376   23.642 -63.83392 28.75698 
1 1 1   21   21   25 o  372.294   14.197  107.542   8.0899  107.542   8.0899   0.0000   0.0000  372.294   14.197  ?   ?  0.000000 14.19664 
1 1 1   21   21   26 o   81.668   22.151   5.4588   2.8391   4.8346   2.9273   15.341   11.648   77.387   23.016  133.734   46.485 -56.34711 51.87093 
1 1 1   21   21   27 o   47.423   20.293   0.0096   2.6214  -1.5236   2.9138   6.5187   6.0037   44.140   20.002   93.314   33.293 -49.17401 38.83900 
1 1 1   21   21   28 o   79.582   22.978   5.1652   2.9552   6.0356   3.2854   1.4766   6.7635   85.650   24.064   78.243   33.002 7.406975 40.84396 
1 1 1   21   21   29 o  166.605   14.261   21.737   3.6016   21.790   3.7718   21.195   12.123  166.623   14.948  151.371   47.209 15.25186 49.51897 
1 1 1   21   21   30 o  137.568   18.226   15.119   3.7432   13.430   3.9220   32.395   12.541  128.780   20.591  187.893   44.323 -59.11319 48.87267 
1 1 1   21   21   31 o  220.698   9.6568   37.579   3.2621   36.502   4.5048   38.767   4.7302  216.225   13.682  222.777   13.942 -6.551270 19.53383 
1 1 1   21   21   32 o   86.214   21.126   6.1428   2.7660   8.7006   4.0205   3.8442   3.8113  101.698   25.791   73.431   26.490 28.26717 36.97116 
1 1 1   21   21   33 o   56.627   22.454   1.5311   2.8977  -1.0580   4.4009   3.5125   3.8500   56.970   25.287   71.776   26.509 -14.80549 36.63568 
1 1 1   21   21   34 o  128.561   15.063   13.096   2.9078   11.458   4.2663   14.518   3.9738  116.973   24.608  133.809   20.017 -16.83578 31.72163 
1 1 1   21   21   35 o   70.964   26.514   3.3811   3.8733   6.2068   4.7992  -1.8985   6.5600   87.782   29.864   67.397   30.323 20.38519 42.56021 
1 1 1   21   21   36 o  204.808   11.312   32.655   3.5324   29.783   5.2569   35.019   4.7698  193.072   17.996  210.840   14.875 -17.76837 23.34812 
1 1 1   21   21   37 f  143.593   15.327   16.390   3.3166   17.830   4.9437   15.211   4.4723  146.764   22.743  135.524   22.338 11.24028 31.87833 
1 1 1   21   21   38 o  233.593   11.504   42.470   4.1132   45.210   5.9274   39.924   5.7125  238.497   16.336  223.820   16.797 14.67635 23.43064 
1 1 1   21   21   39 o  179.939   13.822   25.572   3.7777   19.708   5.6880   30.200   5.0532  152.369   25.275  194.047   17.191 -41.67801 30.56728 
1 1 1   21   21   40 o  240.494   13.330   45.547   4.8877   39.802   10.209   47.256   5.5672  210.743   32.709  244.085   14.974 -33.34232 35.97348 
1 1 1   21   21   41 o  105.492   23.456   9.5529   3.6895   5.5669   5.3765   13.100   5.0721   84.056   31.271  121.645   27.843 -37.58867 41.86984 
1 1 1   21   21   42 o   97.901   32.438   8.7473   5.6647   4.9561   9.0777   11.165   7.2495   90.337   38.175  107.994   36.705 -17.65782 52.95816 
1 1 1   21   21   43 o  120.890   19.724   12.249   3.5238   12.643   5.0063   11.861   4.9607  117.980   28.121  113.959   28.511 4.021248 40.04560 
1 1 1   21   21   44 o   43.590   20.555  -3.2050   3.5666  -8.0038   5.4912   0.2967   4.6908   47.773   23.275   60.517   26.511 -12.74326 35.27857 
1 1 1   21   21   45 o  118.856   20.457   12.063   3.5874   12.376   4.9165   11.705   5.2462  115.423   28.094  110.749   30.142 4.673988 41.20432 
1 1 1   21   21   46 o   84.501   25.962   6.5067   3.6821   4.9071   5.2157   8.0962   5.1990   77.948   30.359   91.983   31.084 -14.03544 43.45009 
1 1 1   21   22    0 o   53.307   33.837   0.8785   6.0008   0.8785   6.0008   0.8785   6.0008   53.307   33.837   53.307   33.837 0.000000 0.000000 
1 1 1   21   22    1 o   78.497   28.421   4.1174   4.3930   8.7283   6.1524  -0.6787   6.2746  105.171   33.736   71.073   30.909 34.09789 45.75456 
1 1 1   21   22    2 o  231.547   14.135   41.511   4.9857   48.517   6.8731   33.731   7.2432  249.510   18.120  206.469   23.329 43.04092 29.53954 
1 1 1   21   22    3 f  241.778   13.433   45.200   4.9516   49.326   6.6689   40.131   7.3919  251.756   17.413  225.887   21.644 25.86958 27.77956 
1 1 1   21   22    4 f  103.514   21.804   8.6611   3.3455   9.5528   3.8256   5.7627   6.8974  108.470   23.704   94.795   35.389 13.67505 42.59401 
1 1 1   21   22    5 o  497.119   7.7839  189.602   5.9228  189.692   6.9387  189.361   11.370  497.006   9.1210  495.133   15.002 1.872894 17.55741 
1 1 1   21   22    6 o  257.354   11.040   50.945   4.3487   50.945   4.3487   0.0000   0.0000  257.354   11.040  ?   ?  0.000000 11.03982 
1 1 1   21   22    7 o  378.188   8.3173  109.781   4.8146  109.781   4.8146   0.0000   0.0000  378.188   8.3173  ?   ?  0.000000 8.317284 
1 1 1   21   22    8 o  114.738   18.480   10.470   3.1353   10.470   3.1353   0.0000   0.0000  114.738   18.480  ?   ?  0.000000 18.48045 
1 1 1   21   22    9 o  234.837   9.5634   42.376   3.4376   41.246   3.7257   48.846   8.9143  231.587   10.511  248.528   23.722 -16.94061 25.94596 
1 1 1   21   22   10 o  114.524   18.598   10.443   3.1482   10.443   3.1482   0.0000   0.0000  114.524   18.598  ?   ?  0.000000 18.59776 
1 1 1   21   22   11 o   77.666   22.942   4.8081   2.9161   6.4785   3.0986  -8.1297   8.6237   89.257   22.645   68.685   32.255 20.57262 39.41043 
1 1 1   21   22   12 o   76.566   23.021   4.6507   2.9167   2.8811   3.1086   17.675   8.4333   66.011   23.907  144.517   37.722 -78.50610 44.65941 
1 1 1   21   22   13 o  110.320   18.527   9.7144   3.0176   9.5927   3.1858   10.776   9.4108  109.328   19.765  118.549   41.748 -9.221214 46.19013 
1 1 1   21   22   14 o   68.253   23.321   3.3963   2.9268   4.2538   3.1004  -3.6235   8.8709   74.318   23.960   77.696   35.081 -3.378433 42.48276 
1 1 1   21   22   15 o  426.370   10.059  139.859   6.5646  136.529   7.6796  148.891   12.650  420.819   11.923  437.037   18.910 -16.21799 22.35486 
1 1 1   21   22   16 o  462.353   9.8189  164.450   6.9488  173.032   8.2410  143.339   12.925  473.849   11.362  428.319   19.715 45.53055 22.75507 
1 1 1   21   22   17 o  323.930   11.598   80.908   5.7504   84.487   6.6409   70.182   11.496  330.673   13.121  296.482   25.583 34.19083 28.75183 
1 1 1   21   22   18 o  474.422   10.080  173.264   7.3196  175.993   8.6529  166.397   13.725  477.616   11.836  461.282   19.439 16.33441 22.75894 
1 1 1   21   22   19 f  258.139   18.465   52.282   7.2477   48.611   9.2568   58.098   11.651  246.406   24.885  267.620   28.901 -21.21481 38.13831 
1 1 1   21   22   20 o  361.216   14.999  101.234   8.2928   97.881   10.669  106.351   13.180  352.876   19.834  365.865   23.663 -12.98840 30.87581 
1 1 1   21   22   21 o  300.874   16.953   70.744   7.7753   71.942   10.019   68.930   12.329  301.374   21.868  291.891   27.936 9.482941 35.47731 
1 1 1   21   22   22 o  178.665   20.163   25.363   5.4175   24.058   6.0584   30.569   12.102  172.824   23.513  185.737   43.358 -12.91252 49.32328 
1 1 1   21   22   23 o  360.951   12.242  100.713   6.7636  107.841   7.8767   80.704   13.197  373.004   13.796  315.749   27.583 57.25565 30.84131 
1 1 1   21   22   24 o  179.314   11.953   24.959   3.2619   24.959   3.2619   0.0000   0.0000  179.314   11.953  ?   ?  0.000000 11.95329 
1 1 1   21   22   25 o  196.988   11.492   30.078   3.4501   30.078   3.4501   0.0000   0.0000  196.988   11.492  ?   ?  0.000000 11.49242 
1 1 1   21   22   26 o  187.885   11.660   27.392   3.3368   28.470   3.4707   14.221   12.130  191.507   11.899  130.335   47.221 61.17252 48.69754 
1 1 1   21   22   27 o  286.734   9.5610   63.367   4.1962   62.909   4.4219   67.509   13.304  285.577   10.116  285.309   30.962 0.2683716 32.57253 
1 1 1   21   22   28 o  147.696   14.114   17.108   3.1518   18.450   3.5902   12.597   6.5819  153.049   15.541  120.818   34.102 32.23123 37.47606 
1 1 1   21   22   29 o  127.438   17.186   12.947   3.2668   13.670   3.7410   10.625   6.7043  130.346   19.337  111.633   35.154 18.71306 40.12141 
1 1 1   21   22   30 o  218.951   11.037   37.170   3.6869   36.586   4.2744   38.868   7.2868  216.692   12.947  219.830   21.949 -3.138245 25.48322 
1 1 1   21   22   31 o  198.268   12.397   30.618   3.7433   32.092   4.4349   26.967   6.9805  202.394   14.410  180.762   25.976 21.63138 29.70519 
1 1 1   21   22   32 o  164.681   12.999   21.212   3.2499   25.616   5.1041   18.209   4.2147  179.050   18.910  150.751   18.665 28.29890 26.57017 
1 1 1   21   22   33 o  102.371   18.899   8.5409   2.8522   14.401   4.1270   3.1828   3.9463  132.896   20.985   70.450   26.669 62.44607 33.93530 
1 1 1   21   22   34 o  168.202   15.575   22.378   3.9644   23.224   4.7223   20.358   7.2963  170.307   18.408  152.718   32.226 17.58939 37.11352 
1 1 1   21   22   35 o  123.471   16.886   12.237   3.1076   10.211   4.6865   13.827   4.1516  108.840   27.977  129.571   21.701 -20.73032 35.40718 
1 1 1   21   22   36 o  118.608   18.356   11.426   3.2247   10.121   4.8617   12.451   4.3090  107.805   28.881  121.667   23.991 -13.86179 37.54587 
1 1 1   21   22   37 o  257.160   10.616   51.342   4.1787   47.590   5.8357   55.291   5.9863  245.102   15.637  264.697   14.835 -19.59479 21.55438 
1 1 1   21   22   38 o  176.745   13.358   24.622   3.5870   37.128   5.4877   15.294   4.7397  215.553   16.765  134.612   23.878 80.94072 29.17547 
1 1 1   21   22   39 o  109.989   26.122   10.527   4.3323 -14.2272   9.4670   17.084   4.8724   61.471   30.080  142.555   23.122 -81.08444 37.93957 
1 1 1   21   22   40 o  132.946   18.157   14.437   3.5981   16.082   5.1118   12.822   5.0656  136.652   25.373  120.263   28.036 16.38881 37.81314 
1 1 1   21   22   41 o  202.717   12.266   32.365   3.7879   37.827   5.5611   27.638   5.1737  216.538   16.913  183.889   18.639 32.64903 25.16835 
1 1 1   21   22   42 f   39.615   19.030  -4.3102   3.3579  -2.6929   4.8976  -5.7448   4.6128   54.153   25.050   46.111   22.189 8.041882 33.46469 
1 1 1   21   22   43 o  108.975   21.503   10.209   3.4593   10.711   4.8680   9.6958   4.9166  107.418   28.952  101.854   29.705 5.563866 41.48007 
1 1 1   21   22   44 o   66.402   25.362   3.2073   3.5891   0.7553   5.3139   5.2642   4.8669   64.622   28.266   79.349   29.706 -14.72678 41.00514 
1 1 1   21   22   45 o  128.374   20.747   14.121   3.9376   19.015   5.0848   6.7895   6.2235  147.400   23.313   86.969   33.354 60.43092 40.69386 
1 1 1   21   23    0 o  574.997   13.651  254.489   11.999  254.489   11.999  254.489   11.999  574.997   13.651  574.997   13.651 0.000000 0.000000 
1 1 1   21   23    1 f  212.498   14.808   35.055   4.7862   32.178   6.6125   38.220   6.9364  201.871   21.744  220.466   20.801 -18.59494 30.09101 
1 1 1   21   23    2 o  252.355   12.984   49.227   4.9982   52.686   6.7522   45.034   7.4338  260.179   17.050  239.548   20.471 20.63042 26.64103 
1 1 1   21   23    3 o  166.082   18.186   21.663   4.5476   19.378   5.7776   25.383   7.3729  155.136   25.196  177.083   28.143 -21.94748 37.77351 
1 1 1   21   23    4 o  432.982   8.2290  143.911   5.4537  142.141   6.3814  148.703   10.503  430.060   9.6943  438.402   15.652 -8.341980 18.41078 
1 1 1   21   23    5 o  420.000   8.2190  135.414   5.2837  132.650   6.0515  144.280   10.838  415.477   9.5158  431.572   16.407 -16.09573 18.96696 
1 1 1   21   23    6 o  211.031   11.430   34.385   3.6782   34.575   4.1339   33.665   8.0587  211.372   12.838  205.002   26.288 6.369781 29.25550 
1 1 1   21   23    7 o  513.464   7.1981  202.258   5.6572  200.521   6.3152  209.314   12.729  511.096   8.0726  519.888   15.996 -8.791229 17.91715 
1 1 1   21   23    8 o  339.808   8.9931   88.708   4.6775   88.708   4.6775   0.0000   0.0000  339.808   8.9931  ?   ?  0.000000 8.993069 
1 1 1   21   23    9 f   49.185   21.612  -0.7279   3.1378  -0.7279   3.1378   0.0000   0.0000   49.185   21.612  ?   ?  0.000000 21.61184 
1 1 1   21   23   10 o  402.031   8.4100  124.127   5.1752  124.127   5.1752   0.0000   0.0000  402.031   8.4100  ?   ?  0.000000 8.410020 
1 1 1   21   23   11 o  119.282   17.212   11.268   3.0516   11.069   3.2496   12.753   8.8786  117.876   18.630  124.725   40.576 -6.849640 44.64835 
1 1 1   21   23   12 f   95.134   21.344   7.3581   3.0315   5.8188   3.2127   19.858   9.1554   84.746   23.792  152.355   39.073 -67.60867 45.74636 
1 1 1   21   23   13 o  314.931   8.5059   76.197   4.1002   75.949   4.4634   77.542   10.377  314.302   9.2778  313.688   21.747 0.6140137 23.64375 
1 1 1   21   23   14 o  289.367   8.9822   64.366   3.9783   66.016   4.2853   54.070   10.704  292.969   9.5564  259.262   27.387 33.70676 29.00640 
1 1 1   21   23   15 o   93.089   28.486   6.9938   4.4378   6.8187   5.0156   7.6253   9.5238   93.164   30.506  107.885   41.288 -14.72122 51.33575 
1 1 1   21   23   16 o  242.618   13.890   45.698   5.1367   44.966   5.8560   48.140   10.697  240.096   16.027  243.315   29.314 -3.218674 33.40871 
1 1 1   21   23   17 o  227.942   15.315   40.493   5.3123   39.821   6.0140   42.879   11.333  225.396   17.571  227.246   33.594 -1.849411 37.91160 
1 1 1   21   23   18 o  111.536   33.924   10.338   6.3073   9.9857   7.8251   10.993   10.657  111.831   38.133  120.253   44.154 -8.421333 58.34180 
1 1 1   21   23   19 o  144.062   24.143   16.856   5.1352   18.748   5.7483   9.3777   11.427  151.574   25.695  116.975   45.111 34.59879 51.91537 
1 1 1   21   23   20 f  127.038   27.702   13.409   5.2348   15.480   5.8308   4.8027   11.886  136.336   28.842  106.549   44.259 29.78664 52.82687 
1 1 1   21   23   21 f  229.389   16.780   41.228   5.8509   40.714   6.5832   43.162   12.764  227.169   19.110  224.389   38.554 2.779694 43.03047 
1 1 1   21   23   22 o  427.515   14.498  141.893   9.4873  139.762   12.292  145.033   14.921  422.133   19.024  427.157   22.904 -5.024109 29.77471 
1 1 1   21   23   23 f  170.035   12.467   22.485   3.2221   23.328   3.3222   9.1292   13.221  173.177   12.620  119.275   47.743 53.90202 49.38324 
1 1 1   21   23   24 o   77.586   22.274   4.8927   2.7840   4.8927   2.7840   0.0000   0.0000   77.586   22.274  ?   ?  0.000000 22.27416 
1 1 1   21   23   25 o  165.913   12.552   21.435   3.1640   21.045   3.2671   27.322   12.696  164.261   13.103  171.914   46.933 -7.653168 48.72781 
1 1 1   21   23   26 o  401.838   8.4795  124.273   5.2154  125.005   5.5693  119.057   14.869  402.868   9.0316  384.100   25.435 18.76746 26.99126 
1 1 1   21   23   27 o  330.483   9.1892   84.162   4.6483   84.269   4.9231   83.283   14.110  330.556   9.7303  317.868   29.333 12.68823 30.90441 
1 1 1   21   23   28 o  162.669   13.158   20.676   3.2482   21.184   3.6639   18.811   7.0203  164.248   14.731  148.146   31.903 16.10204 35.13917 
1 1 1   21   23   29 o  281.859   9.2413   61.256   3.9869   62.662   4.6857   57.566   7.5884  284.703   10.753  269.664   18.497 15.03864 21.39502 
1 1 1   21   23   30 o  125.276   18.046   12.596   3.3604   10.976   3.8448   17.837   6.9161  115.334   22.588  143.588   32.256 -28.25423 39.37811 
1 1 1   21   23   31 o  198.242   13.002   30.684   3.9233   32.772   4.6590   25.592   7.2740  204.246   15.008  174.697   28.161 29.54953 31.91013 
1 1 1   21   23   32 o  309.044   9.4286   73.745   4.4600   78.818   5.3317   61.920   8.1395  319.019   10.919  278.762   19.193 40.25735 22.08175 
1 1 1   21   23   33 f  174.608   13.901   23.950   3.6844   19.583   4.2700   36.676   7.2895  156.314   18.187  212.142   22.808 -55.82829 29.17103 
1 1 1   21   23   34 o  348.157   10.245   93.859   5.4595  105.890   7.1162   76.645   8.5117  368.697   12.610  310.413   17.992 58.28445 21.97062 
1 1 1   21   23   35 o  254.905   9.8772   50.309   3.8537   57.163   6.0139   45.533   5.0198  269.494   14.634  240.873   13.672 28.62140 20.02688 
1 1 1   21   23   36 o  138.705   16.642   15.440   3.4627   15.294   4.8786   15.588   4.9157  134.558   24.594  135.903   24.534 -1.344650 34.73856 
1 1 1   21   23   37 o  248.903   9.9924   48.063   3.8069   52.604   5.5293   43.971   5.2491  258.352   14.035  235.854   14.612 22.49797 20.26099 
1 1 1   21   23   38 o   93.759   26.882   7.6583   4.0574   5.6418   9.2362   8.1405   4.5166   94.349   39.088   96.244   28.581 -1.894302 48.42312 
1 1 1   21   23   39 o  143.724   15.509   16.565   3.3577   16.814   4.8943   16.344   4.6151  140.869   23.529  139.476   22.374 1.392303 32.46858 
1 1 1   21   23   40 o   91.846   23.971   7.3383   3.4058   9.0362   4.9151   5.7701   4.7236   99.810   29.856   83.174   29.546 16.63615 42.00399 
1 1 1   21   23   41 o  189.159   14.628   28.627   4.2024   31.257   5.2061   23.708   7.1197  195.883   17.550  161.540   29.896 34.34306 34.66619 
1 1 1   21   23   42 o   82.263   24.351   5.9603   3.2825   6.8043   4.6838   5.1457   4.6017   87.051   29.503   78.901   29.008 8.149864 41.37549 
1 1 1   21   23   43 o  125.484   21.316   13.499   3.9476   9.0769   5.4632   18.330   5.7105   97.361   31.836  142.235   27.222 -44.87370 41.88762 
1 1 1   21   23   44 o   90.476   25.551   7.4561   3.6940   8.0950   4.8666   6.5874   5.6742   92.481   30.038   85.722   32.079 6.758965 43.94698 
1 1 1   21   24    0 o  222.248   20.411   39.115   6.8088   39.115   6.8088   39.115   6.8088  222.248   20.411  222.248   20.411 0.000000 0.000000 
1 1 1   21   24    1 o  207.371   15.510   33.471   4.8875   38.766   6.6653   27.312   7.1882  222.144   19.811  184.230   26.232 37.91377 32.87208 
1 1 1   21   24    2 o   56.921   25.154  -1.1486   4.3084  -5.0465   5.5383   4.8263   6.8569   55.861   26.110   90.813   34.966 -34.95148 43.63833 
1 1 1   21   24    3 o  219.821   15.145   37.564   5.0646   34.145   6.5081   42.813   8.0643  208.105   20.707  232.520   22.959 -24.41454 30.91703 
1 1 1   21   24    4 o   85.450   28.855   5.4998   4.4801   5.0766   5.6208   6.2371   7.4185   87.200   32.060   97.737   36.659 -10.53709 48.70016 
1 1 1   21   24    5 o  252.499   10.599   49.064   4.0963   47.006   4.6465   56.244   8.6783  246.910   12.295  267.284   21.392 -20.37387 24.67319 
1 1 1   21   24    6 o  120.544   19.792   11.617   3.5250   9.6050   3.9341   19.811   7.9391  108.400   24.310  153.605   34.599 -45.20499 42.28549 
1 1 1   21   24    7 o   69.472   24.870   3.2966   3.3530   3.2966   3.3530   0.0000   0.0000   69.472   24.870  ?   ?  0.000000 24.87049 
1 1 1   21   24    8 o  338.015   8.3502   87.756   4.3202   85.265   4.7745   99.010   10.147  333.027   9.3666  356.013   18.687 -22.98508 20.90314 
1 1 1   21   24    9 o  482.043   7.3951  178.346   5.4563  181.751   6.1443  165.644   11.867  486.451   8.2521  461.805   16.788 24.64630 18.70687 
1 1 1   21   24   10 o  222.329   10.442   38.052   3.5536   41.023   3.8630   21.703   9.0621  230.780   10.936  159.494   37.714 71.28590 39.26747 
1 1 1   21   24   11 o  194.995   12.426   29.463   3.6895   29.463   3.6895   0.0000   0.0000  194.995   12.426  ?   ?  0.000000 12.42641 
1 1 1   21   24   12 o  201.390   12.356   31.421   3.7902   31.421   3.7902   0.0000   0.0000  201.390   12.356  ?   ?  0.000000 12.35556 
1 1 1   21   24   13 o  404.923   8.0691  125.954   5.0011  132.591   5.4379   89.551   12.736  415.358   8.5534  335.256   24.998 80.10214 26.42074 
1 1 1   21   24   14 o  109.276   19.446   9.6031   3.1334   9.3331   3.3186   11.821   9.5112  107.325   20.953  121.311   42.015 -13.98598 46.94970 
1 1 1   21   24   15 o  351.095   11.001   95.023   5.9116   90.944   6.8240  107.292   11.834  342.987   12.999  369.004   21.040 -26.01743 24.73150 
1 1 1   21   24   16 o  157.509   27.929   20.398   6.4867   25.778   8.2998   11.953   10.398  175.826   32.020  122.819   43.815 53.00620 54.26807 
1 1 1   21   24   17 o  100.507   34.514   7.8522   6.4116   2.6023   7.9570   17.571   10.827   87.388   36.249  141.895   44.671 -54.50687 57.52811 
1 1 1   21   24   18 o  180.822   19.206   25.880   5.2342   27.743   5.8497   18.400   11.723  186.759   20.818  144.618   46.587 42.14108 51.02694 
1 1 1   21   24   19 o  124.960   27.972   13.014   5.2167   11.905   5.7903   17.797   12.021  118.763   31.381  142.442   47.257 -23.67896 56.72718 
1 1 1   21   24   20 o  439.294   11.009  148.908   7.4024  147.214   8.4274  154.632   15.487  436.226   12.622  441.078   23.019 -4.851776 26.25204 
1 1 1   21   24   21 o  193.076   19.192   29.526   5.5967   28.716   6.3335   32.414   11.956  189.289   22.287  191.447   41.960 -2.158310 47.51135 
1 1 1   21   24   22 o  355.038   12.812   97.610   6.9627   98.493   7.8874   94.492   14.820  356.067   14.472  340.424   28.710 15.64267 32.15146 
1 1 1   21   24   23 o  281.101   16.533   61.904   7.0824   61.904   7.0824   0.0000   0.0000  281.101   16.533  ?   ?  0.000000 16.53346 
1 1 1   21   24   24 o  126.660   35.948   13.915   7.2931   11.388   8.9337   18.964   12.628  117.262   40.713  144.582   48.447 -27.32001 63.28205 
1 1 1   21   24   25 o  217.061   11.626   36.547   3.8487   34.680   4.0326   55.622   12.891  211.199   12.531  256.713   33.614 -45.51387 35.87379 
1 1 1   21   24   26 o  116.507   19.094   10.953   3.2870   10.927   3.4137   11.284   12.177  116.118   19.924  121.094   46.604 -4.976646 50.68448 
1 1 1   21   24   27 o  189.190   12.821   27.900   3.6909   27.015   3.8412   38.540   13.323  185.945   13.590  205.560   43.692 -19.61484 45.75677 
1 1 1   21   24   28 o  204.494   12.572   32.569   3.9159   34.692   4.0934   9.6751   13.441  211.030   12.732  118.535   47.895 92.49512 49.55814 
1 1 1   21   24   29 o  172.254   12.687   23.163   3.3215   22.359   3.7526   26.072   7.1373  168.659   14.683  177.008   27.215 -8.349625 30.92297 
1 1 1   21   24   30 o  265.313   10.780   54.473   4.3776   60.186   5.2829   41.954   7.8205  278.383   12.398  227.575   22.756 50.80751 25.91444 
1 1 1   21   24   31 o  136.872   17.553   15.000   3.5926   16.514   4.1743   10.678   7.0549  142.974   19.590  110.877   36.174 32.09697 41.13809 
1 1 1   21   24   32 o   74.218   25.543   4.2411   3.5128   6.4072   4.1280  -1.4447   6.6880   87.768   27.576   69.075   30.882 18.69299 41.40214 
1 1 1   21   24   33 f  158.800   15.566   20.003   3.7348   25.425   4.4645   7.3609   6.8167  178.838   16.496   96.387   35.326 82.45098 38.98757 
1 1 1   21   24   34 o  147.683   14.290   17.250   3.1899   21.881   4.6515   13.138   4.3827  164.688   18.789  125.115   23.754 39.57254 30.28714 
1 1 1   21   24   35 o   61.488   23.264   2.4269   3.0018  -4.5719   4.1824   9.8625   4.3110   46.039   21.872  106.791   26.499 -60.75231 34.35966 
1 1 1   21   24   36 o   80.770   24.913   5.4874   3.3868   11.535   4.7163  -0.9518   4.8664  115.031   27.212   59.390   26.463 55.64077 37.95761 
1 1 1   21   24   37 o   69.194   26.420   3.1965   3.8941   0.8471   8.8795   3.7559   4.3331   81.890   36.154   73.486   27.915 8.403755 45.67629 
1 1 1   21   24   38 o   62.573   23.683   2.6061   3.1118   1.5684   4.4837   3.5704   4.3222   64.889   27.088   72.309   27.781 -7.419952 38.80105 
1 1 1   21   24   39 o   75.412   24.616   4.7710   3.2666   0.6281   4.7072   8.6195   4.5368   62.476   26.970   97.930   28.527 -35.45465 39.25774 
1 1 1   21   24   40 o  253.458   10.619   50.201   4.1198   46.120   5.3572   56.108   6.4452  240.330   14.633  264.086   16.021 -23.75549 21.69745 
1 1 1   21   24   41 o   57.225   23.284   1.6001   3.2017   1.1213   4.5210   2.0817   4.5348   62.421   26.679   65.894   27.352 -3.472195 38.20845 
1 1 1   21   24   42 o   48.396   22.143  -1.6451   3.6816  -0.0216   5.2079  -3.2670   5.2053   62.031   27.522   54.187   25.322 7.844219 37.39892 
1 1 1   21   25    0 o  164.505   32.126   23.378   7.2060   23.378   7.2060   23.378   7.2060  164.505   32.126  164.505   32.126 0.000000 0.000000 
1 1 1   21   25    1 o  193.975   17.097   29.457   5.0242   31.689   7.1218   27.247   7.0889  199.221   23.828  183.834   25.912 15.38779 35.20220 
1 1 1   21   25    2 o  145.031   22.704   16.899   4.8747   18.381   6.4843   14.974   7.3924  149.261   29.428  133.093   35.596 16.16835 46.18513 
1 1 1   21   25    3 o  119.066   26.433   11.664   4.6918   16.696   6.0097   3.8108   7.5078  142.345   28.576   89.664   35.947 52.68169 45.92155 
1 1 1   21   25    4 o  311.991   12.126   75.085   5.7906   77.683   7.5683   71.415   8.9932  316.525   15.621  301.780   19.575 14.74429 25.04417 
1 1 1   21   25    5 o  321.429   10.813   79.572   5.3197   79.572   5.3197   0.0000   0.0000  321.429   10.813  ?   ?  0.000000 10.81273 
1 1 1   21   25    6 o  304.582   11.436   71.508   5.3315   71.508   5.3315   0.0000   0.0000  304.582   11.436  ?   ?  0.000000 11.43609 
1 1 1   21   25    7 o  152.867   14.675   18.258   3.3914   16.468   3.7194   27.087   8.2601  144.553   17.145  181.244   30.882 -36.69144 35.32198 
1 1 1   21   25    8 o  133.163   16.614   13.985   3.3126   14.413   3.6182   11.764   8.2359  134.889   17.972  119.686   39.087 15.20237 43.02037 
1 1 1   21   25    9 o  123.765   17.649   12.157   3.2487   11.257   3.5076   17.590   8.6153  118.396   20.073  143.110   38.492 -24.71368 43.41114 
1 1 1   21   25   10 o   61.445   23.679   2.0472   3.1468   0.9905   3.3554   9.7598   9.0648   57.730   23.702  113.527   40.866 -55.79706 47.24216 
1 1 1   21   25   11 o  107.912   20.125   9.3990   3.2018   9.7352   3.4294   7.1152   8.9373  109.604   21.209  104.487   39.995 5.117538 45.27007 
1 1 1   21   25   12 o  104.189   20.953   8.8107   3.2258   10.433   3.4630  -1.8287   8.8684  113.676   20.664   80.819   35.883 32.85629 41.40788 
1 1 1   21   25   13 o   90.577   23.947   6.7282   3.3705   6.7282   3.3705   0.0000   0.0000   90.577   23.947  ?   ?  0.000000 23.94666 
1 1 1   21   25   14 o  327.476   9.4846   82.529   4.7541   82.529   4.7541   0.0000   0.0000  327.476   9.4846  ?   ?  0.000000 9.484577 
1 1 1   21   25   15 o   88.564   26.675   6.3578   3.9137   6.3578   3.9137   0.0000   0.0000   88.564   26.675  ?   ?  0.000000 26.67504 
1 1 1   21   25   16 o   66.387   27.772   0.9816   4.7275   0.8793   5.2276   1.4409   11.076   68.943   29.043   96.408   41.495 -27.46461 50.64884 
1 1 1   21   25   17 o  189.419   18.124   28.296   5.1905   27.971   5.7931   29.618   11.688  187.551   20.515  182.950   42.543 4.601349 47.23050 
1 1 1   21   25   18 o  193.586   18.366   29.581   5.3769   28.004   5.9887   36.140   12.211  187.342   21.261  203.509   40.624 -16.16722 45.85101 
1 1 1   21   25   19 o  275.335   14.221   58.985   5.9728   56.633   6.7490   67.481   12.828  269.024   16.469  287.061   29.621 -18.03677 33.89138 
1 1 1   21   25   20 o  259.458   15.215   52.545   6.0159   53.997   6.7426   46.879   13.321  262.446   16.874  233.165   38.680 29.28117 42.20074 
1 1 1   21   25   21 o  323.111   14.849   81.201   7.3440   81.201   7.3440   0.0000   0.0000  323.111   14.849  ?   ?  0.000000 14.84942 
1 1 1   21   25   22 o   96.729   32.814   7.4325   5.7939   7.4325   5.7939   0.0000   0.0000   96.729   32.814  ?   ?  0.000000 32.81379 
1 1 1   21   25   23 o  118.119   31.081   11.896   5.6953   10.834   6.2746   16.866   13.570  112.776   33.733  138.512   49.983 -25.73655 60.30059 
1 1 1   21   25   24 o  199.415   19.905   31.692   5.9944   27.881   6.6235   48.940   14.092  185.302   23.911  235.526   40.552 -50.22427 47.07644 
1 1 1   21   25   25 o  248.176   17.183   48.518   6.4871   44.249   7.3602   63.378   13.732  235.476   20.629  273.730   33.473 -38.25366 39.31862 
1 1 1   21   25   26 o   97.678   21.727   7.8755   3.1645   9.1107   3.2554 -13.3362   13.490  105.443   20.909   81.142   38.752 24.30058 44.03333 
1 1 1   21   25   27 o  103.738   21.921   8.8839   3.3717   8.6966   3.5017   11.266   12.487  102.348   22.923  120.602   46.975 -18.25381 52.26933 
1 1 1   21   25   28 o  240.423   12.142   44.955   4.4537   46.510   4.7343   32.988   13.132  244.375   12.701  186.703   46.203 57.67206 47.91732 
1 1 1   21   25   29 o  238.121   11.719   43.978   4.2713   46.983   5.2130   37.841   7.4506  245.068   13.955  215.867   22.899 29.20146 26.81639 
1 1 1   21   25   30 o  205.505   13.539   33.064   4.2348   35.162   5.0721   28.237   7.6944  211.102   15.812  183.036   28.383 28.06551 32.49075 
1 1 1   21   25   31 o  173.908   13.807   23.763   3.6451   23.429   4.1897   24.804   7.3935  171.873   16.114  170.421   29.406 1.451065 33.53204 
1 1 1   21   25   32 o  287.365   9.8673   63.908   4.3401   67.116   5.2348   56.854   7.7625  293.851   11.639  266.371   19.167 27.47986 22.42409 
1 1 1   21   25   33 o   88.540   24.799   6.6543   3.4947   7.9200   4.0980   3.2798   6.6914   95.982   26.844   81.311   33.437 14.67129 42.87952 
1 1 1   21   25   34 o  170.636   14.480   23.046   3.7461   27.089   4.5063   14.002   6.7397  184.384   16.129  123.724   34.363 60.65990 37.96033 
1 1 1   21   25   35 o   45.244   20.638  -1.6733   3.1675   1.7139   4.2245  -6.0225   4.7870   64.499   26.551   47.436   22.769 17.06313 34.97717 
1 1 1   21   25   36 o   81.660   27.738   5.5123   4.1402   7.7943   8.8842   4.8792   4.6794   99.558   39.367   79.705   29.260 19.85324 49.04998 
1 1 1   21   25   37 o  117.271   18.339   11.299   3.1840   12.076   4.6095   10.589   4.4034  117.493   26.288  109.774   26.507 7.718880 37.33221 
1 1 1   21   25   38 o  153.551   14.563   18.851   3.3818   19.977   5.0556   17.939   4.5495  154.070   22.069  146.576   20.867 7.494278 30.37217 
1 1 1   21   25   39 o  134.701   16.788   14.805   3.3861   17.340   4.9379   12.555   4.6522  142.001   23.543  118.798   26.281 23.20294 35.28439 
1 1 1   21   25   40 o   73.047   25.456   4.4257   3.4941   7.4602   4.8883   1.2556   4.9962   90.410   30.141   65.166   27.954 25.24368 41.10897 
1 1 1   21   25   41 o   67.986   25.269   3.5481   3.5091   7.5854   4.8215  -0.9992   5.1169   90.524   29.923   58.984   26.637 31.53953 40.06153 
1 1 1   21   26    0 o  282.595   19.484   62.634   8.3357   62.634   8.3357   62.634   8.3357  282.595   19.484  282.595   19.484 0.000000 0.000000 
1 1 1   21   26    1 o  338.807   11.984   88.572   6.2147   91.170   8.6971   85.862   8.8835  342.462   16.592  331.596   17.565 10.86652 24.16257 
1 1 1   21   26    2 o  187.651   24.224   28.263   6.7951   28.263   6.7951   0.0000   0.0000  187.651   24.224  ?   ?  0.000000 24.22356 
1 1 1   21   26    3 o  237.092   20.012   44.300   7.1946   44.300   7.1946   0.0000   0.0000  237.092   20.012  ?   ?  0.000000 20.01235 
1 1 1   21   26    4 o  315.040   12.329   76.625   5.9452   74.060   7.5843   80.714   9.5751  308.367   16.124  320.651   19.603 -12.28345 25.38296 
1 1 1   21   26    5 o  160.855   19.990   20.549   4.8156   11.868   6.0918   35.011   7.8630  118.915   32.528  208.763   25.111 -89.84786 41.09333 
1 1 1   21   26    6 o  473.448   8.4503  172.266   6.1237  170.966   7.2134  175.620   11.587  471.266   10.000  475.515   15.920 -4.249786 18.79991 
1 1 1   21   26    7 o  131.895   17.522   13.778   3.4498   14.052   3.7711   12.376   8.5415  132.810   19.100  122.131   39.801 10.67896 44.14713 
1 1 1   21   26    8 o  298.262   9.2137   68.427   4.2063   65.798   4.6491   80.290   9.8758  292.276   10.392  319.399   20.306 -27.12317 22.81112 
1 1 1   21   26    9 o  160.927   14.068   20.203   3.4305   18.043   3.7370   31.774   8.6484  151.484   16.378  196.784   29.632 -45.30038 33.85664 
1 1 1   21   26   10 o  273.101   9.7447   57.411   4.0734   59.124   4.4801   49.241   9.7845  277.005   10.567  247.297   26.251 29.70793 28.29754 
1 1 1   21   26   11 o  156.491   14.921   19.165   3.5307   17.123   3.7827   32.978   9.8364  147.315   17.094  198.587   33.556 -51.27255 37.65924 
1 1 1   21   26   12 o  435.295   8.2910  145.643   5.5241  144.059   6.0875  153.032   13.148  432.707   9.1912  441.922   19.438 -9.214417 21.50126 
1 1 1   21   26   13 o  362.500   8.7265  101.062   4.8419  100.616   5.2773  103.433   12.173  361.528   9.5368  361.354   22.116 0.1738892 24.08456 
1 1 1   21   26   14 f   49.499   22.420  -1.8625   3.6560  -1.5048   3.9305  -4.1590   9.9584   52.732   23.618   80.914   36.787 -28.18282 43.71576 
1 1 1   21   26   15 o  229.818   11.356   40.771   3.9947   41.270   4.2318   36.686   12.102  230.798   12.021  205.638   39.889 25.16011 41.66134 
1 1 1   21   26   16 o   81.200   31.101   4.0115   5.4069   4.0115   5.4069   0.0000   0.0000   81.200   31.101  ?   ?  0.000000 31.10149 
1 1 1   21   26   17 o  406.938   12.758  128.181   7.9465  128.181   7.9465   0.0000   0.0000  406.938   12.758  ?   ?  0.000000 12.75778 
1 1 1   21   26   18 o  102.885   32.060   8.7606   5.5925   8.7606   5.5925   0.0000   0.0000  102.885   32.060  ?   ?  0.000000 32.05973 
1 1 1   21   26   19 o  338.479   12.571   88.703   6.5130   84.907   7.3288  102.963   14.204  330.533   14.486  357.066   26.172 -26.53314 29.91344 
1 1 1   21   26   20 o  151.619   27.161   19.042   6.0718   19.042   6.0718   0.0000   0.0000  151.619   27.161  ?   ?  0.000000 27.16109 
1 1 1   21   26   21 o  206.564   20.794   34.060   6.4851   34.060   6.4851   0.0000   0.0000  206.564   20.794  ?   ?  0.000000 20.79394 
1 1 1   21   26   22 o  282.996   14.492   62.483   6.2565   66.947   7.0672   46.305   13.453  292.417   15.849  229.698   39.700 62.71825 42.74710 
1 1 1   21   26   23 o  123.676   30.253   13.050   5.6797   8.0061   6.2755   35.896   13.355   99.755   34.149  197.521   45.158 -97.76572 56.61593 
1 1 1   21   26   24 o  318.761   14.710   79.203   7.1770   83.518   8.1017   63.472   15.469  326.696   16.202  269.650   38.579 57.04642 41.84271 
1 1 1   21   26   25 o  246.403   18.624   48.135   6.9721   47.484   7.8375   50.606   15.264  243.462   21.245  235.637   43.937 7.825150 48.80370 
1 1 1   21   26   26 o   93.672   36.603   5.6658   7.6006  -3.6451   9.2598   24.894   13.307   77.381   35.293  160.336   49.370 -82.95537 60.68755 
1 1 1   21   26   27 o   90.325   42.349  -8.6624   14.764   0.0000   0.0000  -8.6624   14.764  ?   ?    90.325   42.349 0.000000 42.34896 
1 1 1   21   26   28 o   89.259   24.631   6.6759   3.4749   6.3079   3.5945   11.934   13.586   86.956   25.410  122.465   48.600 -35.50869 54.84199 
1 1 1   21   26   29 o  372.403   10.274  107.314   5.8560  111.572   6.3659   83.885   14.933  379.430   10.961  314.024   31.493 65.40594 33.34564 
1 1 1   21   26   30 o   88.706   24.248   6.6292   3.3864   7.3754   3.8645   4.1615   7.0282   93.204   26.069   85.855   34.653 7.349289 43.36352 
1 1 1   21   26   31 o  173.480   27.229   25.471   6.9921   0.0000   0.0000   25.471   6.9921  ?   ?   173.480   27.229 0.000000 27.22891 
1 1 1   21   26   32 o  239.048   14.565   45.050   5.3037   45.050   5.3037   0.0000   0.0000  239.048   14.565  ?   ?  0.000000 14.56456 
1 1 1   21   26   33 o   46.798   21.379  -1.8465   3.4147  -0.9438   4.0786  -3.9623   6.2441   54.446   24.245   60.459   28.079 -6.012539 37.09789 
1 1 1   21   26   34 o   79.301   32.883   3.0423   6.5450   5.0234   8.8945   0.7029   9.6656   92.280   38.305   84.609   37.519 7.670837 53.61856 
1 1 1   21   26   35 o  179.730   21.195   26.646   5.7185   24.617   9.3578   27.856   7.2245  160.011   38.644  179.936   27.070 -19.92471 47.18150 
1 1 1   21   26   36 o   49.453   21.605  -0.2111   3.0964  -3.2627   4.3235   3.0021   4.4365   49.534   23.124   70.170   27.796 -20.63669 36.15739 
1 1 1   21   26   37 o   89.964   23.155   7.0167   3.2073   8.9824   4.5590   5.0904   4.5130   99.757   28.460   79.353   28.795 20.40405 40.48628 
1 1 1   21   26   38 o   65.018   24.358   3.0435   3.2732   0.3474   4.5130   6.0361   4.7546   60.104   26.176   83.821   29.657 -23.71698 39.55658 
1 1 1   21   26   39 o  169.812   20.874   24.272   5.3113   24.272   5.3113   0.0000   0.0000  169.812   20.874  ?   ?  0.000000 20.87386 
1 1 1   21   26   40 o   61.319   24.047   2.4074   3.2894   4.7736   4.9358   0.5167   4.4120   77.555   29.713   59.551   25.908 18.00333 39.42236 
1 1 1   21   27    2 o  119.071   27.299   11.756   4.8692   9.2714   6.6819   14.569   7.1101  107.199   35.216  130.895   34.864 -23.69528 49.55499 
1 1 1   21   27    3 o  141.496   22.507   16.144   4.7112   16.216   6.2330   16.047   7.1956  139.383   30.097  137.408   34.315 1.974487 45.64363 
1 1 1   21   27    4 o  255.798   14.348   50.859   5.5949   57.975   7.4520   41.665   8.4701  271.996   18.001  227.952   24.669 44.04387 30.53897 
1 1 1   21   27    5 o  282.482   13.560   61.760   5.8630   61.476   7.6177   62.173   9.1830  280.151   17.858  280.280   21.571 -0.1286621 28.00390 
1 1 1   21   27    6 o  209.128   16.522   34.238   5.2456   34.249   6.6268   34.221   8.5842  207.700   21.139  204.873   28.116 2.826904 35.17633 
1 1 1   21   27    7 o   63.715   24.410   2.2929   3.3309   0.9930   3.6642   8.4789   7.9933   59.772   24.680  106.372   38.364 -46.60016 45.61720 
1 1 1   21   27    8 o   86.381   24.681   6.0865   3.4260   6.3142   3.7128   4.7811   8.8894   88.062   25.851   96.979   39.032 -8.916634 46.81612 
1 1 1   21   27    9 o  269.922   10.172   56.131   4.2025   55.041   4.6012   61.618   10.321  267.090   11.255  277.452   24.558 -10.36224 27.01392 
1 1 1   21   27   10 o   64.786   24.843   2.3792   3.4521   4.1441   3.7628  -7.0050   8.6765   75.495   26.410   70.012   32.709 5.483383 42.04060 
1 1 1   21   27   11 o  422.442   8.2685  137.193   5.3464  139.282   5.9172  127.904   12.476  425.448   9.0866  402.893   20.297 22.55536 22.23775 
1 1 1   21   27   12 o  143.610   20.933   16.553   4.4661   15.371   4.9177   22.117   10.669  137.218   24.304  157.647   43.017 -20.42859 49.40763 
1 1 1   21   27   13 o  139.427   21.178   15.645   4.3775   14.887   4.7642   19.755   11.093  135.068   23.920  148.699   44.937 -13.63113 50.90682 
1 1 1   21   27   14 o  229.809   11.627   40.900   4.0765   41.197   4.3720   38.926   11.280  230.447   12.441  214.105   35.676 16.34195 37.78290 
1 1 1   21   27   15 o   76.086   25.673   4.4022   3.5465   2.6098   3.7728   18.014   10.397   67.515   25.952  142.364   43.606 -74.84953 50.74412 
1 1 1   21   27   16 o  173.571   20.015   24.010   5.2200   28.270   5.9350   9.4586   10.970  188.165   20.963  115.058   44.246 73.10751 48.96081 
1 1 1   21   27   17 o   61.144   26.937  -0.9102   4.9030  -2.3435   5.4373   5.3260   11.342   60.707   27.433  105.124   43.414 -44.41743 51.35493 
1 1 1   21   27   18 o  152.236   24.090   18.908   5.4266   23.219   6.0075  -0.2087   12.649  169.107   23.873   97.599   43.117 71.50818 49.28511 
1 1 1   21   27   19 o  195.341   20.931   30.510   6.1607   30.510   6.1607   0.0000   0.0000  195.341   20.931  ?   ?  0.000000 20.93075 
1 1 1   21   27   20 o  383.325   13.838  114.187   8.1189  114.187   8.1189   0.0000   0.0000  383.325   13.838  ?   ?  0.000000 13.83764 
1 1 1   21   27   21 o  358.241   29.253  105.692   15.900   0.0000   0.0000  105.692   15.900  ?   ?   358.241   29.253 0.000000 29.25252 
1 1 1   21   27   22 o  190.213   26.085   29.727   7.3944   34.428   8.8738   19.049   13.375  203.146   29.393  143.569   49.818 59.57646 57.84241 
1 1 1   21   27   23 f   85.627   35.173   3.2528   7.3937  -4.2324   8.6802   23.040   14.113   73.864   33.870  154.681   51.198 -80.81703 61.38714 
1 1 1   21   27   24 o  139.476   35.683   17.182   7.6489   15.595   9.0067   21.289   14.486  131.641   40.631  149.002   51.838 -17.36040 65.86350 
1 1 1   21   27   25 o   68.406   30.164  -0.7646   6.1626  -0.1628   6.8584  -3.2875   14.042   73.525   32.138   95.369   43.483 -21.84354 54.07059 
1 1 1   21   27   26 o  224.694   20.146   40.459   6.8550   36.222   7.7676   55.378   14.576  210.219   24.606  248.802   39.603 -38.58347 46.62458 
1 1 1   21   27   27 o  151.007   38.449   20.790   8.9105   28.028   11.518   10.005   14.062  172.195   43.645  118.418   48.558 53.77689 65.28984 
1 1 1   21   27   28 f  202.360   13.610   32.103   4.1912   32.843   4.4587   26.484   12.285  204.424   14.340  164.214   46.673 40.20990 48.82608 
1 1 1   21   27   29 o  119.846   20.561   11.798   3.6358   14.130   3.8641  -6.2107   10.738  131.710   19.778   78.093   36.452 53.61635 41.47217 
1 1 1   21   27   30 o  238.404   11.719   44.223   4.2762   46.752   4.6981   32.009   10.324  244.512   12.596  187.225   37.335 57.28677 39.40244 
1 1 1   21   27   31 o  102.932   22.989   8.9532   3.5304   7.7092   4.1301   12.328   6.8027   94.558   27.125  116.259   35.203 -21.70068 44.44085 
1 1 1   21   27   32 o  155.284   15.600   19.228   3.6577   22.738   4.3958   11.328   6.5946  168.229   17.319  111.517   34.824 56.71237 38.89329 
1 1 1   21   27   33 o   96.598   35.171   7.8636   6.7408   5.6457   9.1368   10.513   9.9857   94.393   38.973  109.484   42.184 -15.09092 57.43163 
1 1 1   21   27   34 o  276.588   11.070   59.631   4.6866   64.829   5.9585   51.198   7.5893  287.089   13.560  250.570   19.953 36.51907 24.12484 
1 1 1   21   27   35 o   77.342   26.570   4.9269   3.8001   2.7078   4.5532   10.020   6.8983   69.343   27.926  103.908   35.793 -34.56448 45.39795 
1 1 1   21   27   36 o  102.173   27.206   9.3626   4.3305   9.6653   4.9774   8.4196   8.7842  102.698   29.870   98.785   39.118 3.912514 49.21838 
1 1 1   21   27   37 o  144.294   16.287   16.919   3.5343   16.873   4.7832   16.975   5.2453  140.202   23.093  138.980   25.601 1.222229 34.47726 
1 1 1   21   27   38 o   93.306   22.949   7.6362   3.2548   7.2869   4.6138   7.9821   4.5923   89.459   29.257   93.149   29.056 -3.690239 41.23384 
1 1 1   21   27   39 o   95.536   22.979   8.0429   3.3192   1.3950   4.6570   14.907   4.7321   63.693   27.146  129.820   24.717 -66.12617 36.71347 
1 1 1   21   28    0 o  174.074   28.665   25.515   7.0151   25.515   7.0151   25.515   7.0151  174.074   28.665  174.074   28.665 0.000000 0.000000 
1 1 1   21   28    1 o  219.087   15.994   37.529   5.3264   38.936   7.4135   36.028   7.6578  221.062   22.210  211.852   24.042 9.210693 32.73059 
1 1 1   21   28    2 o  371.474   11.569  106.522   6.5779  105.598   8.8398  107.669   9.8466  368.542   15.671  371.497   17.317 -2.954254 23.35440 
1 1 1   21   28    3 o  543.925   15.441  229.925   12.855   0.0000   0.0000  229.925   12.855  ?   ?   543.925   15.441 0.000000 15.44093 
1 1 1   21   28    4 o   80.582   33.877   1.5830   7.0892   0.0000   0.0000   1.5830   7.0892  ?   ?    80.582   33.877 0.000000 33.87717 
1 1 1   21   28    5 o  152.371   35.277   19.877   8.0651   0.0000   0.0000   19.877   8.0651  ?   ?   152.371   35.277 0.000000 35.27699 
1 1 1   21   28    6 o  385.251   18.455  116.139   10.882   0.0000   0.0000  116.139   10.882  ?   ?   385.251   18.455 0.000000 18.45493 
1 1 1   21   28    7 o  142.877   16.932   16.130   3.6308   17.046   4.0652   12.517   8.0722  146.491   18.546  121.655   38.603 24.83566 42.82660 
1 1 1   21   28    8 o  277.675   10.143   59.418   4.3111   57.843   4.7860   66.192   9.9262  273.718   11.424  288.341   22.674 -14.62329 25.38889 
1 1 1   21   28    9 o  301.078   9.7098   69.820   4.4747   69.476   4.9127   71.500   10.841  300.129   10.694  299.049   23.884 1.080292 26.16838 
1 1 1   21   28   10 o  159.490   18.548   20.178   4.4433   19.671   5.0027   22.070   9.6705  156.542   21.442  158.408   39.904 -1.865982 45.30015 
1 1 1   21   28   11 o  197.050   15.781   30.418   4.7197   30.742   5.3378   29.261   10.104  197.471   17.853  184.241   37.113 13.22987 41.18377 
1 1 1   21   28   12 o  356.576   9.3086   97.908   5.0805   99.752   5.6030   89.382   12.048  359.702   10.177  334.378   23.694 25.32397 25.78662 
1 1 1   21   28   13 o  494.963   8.1865  188.404   6.2021  190.137   6.8646  180.702   14.471  496.976   9.0242  479.203   19.729 17.77292 21.69460 
1 1 1   21   28   14 o  232.117   12.029   41.783   4.2592   40.769   4.5928   48.009   11.384  228.981   13.159  240.070   31.759 -11.08971 34.37767 
1 1 1   21   28   15 o  307.441   10.172   72.904   4.7867   76.433   5.2417   55.180   11.746  314.618   10.885  258.324   30.282 56.29456 32.17842 
1 1 1   21   28   16 o  188.566   22.850   28.667   6.4605   23.971   7.9754   37.628   11.018  168.137   32.162  209.596   35.619 -41.45911 47.99032 
1 1 1   21   28   17 o  206.982   21.513   34.307   6.7160   41.383   8.2680   20.583   11.515  226.223   24.256  149.788   45.893 76.43488 51.90873 
1 1 1   21   28   18 o   84.085   35.106   2.4094   7.5326   2.4094   7.5326   0.0000   0.0000   84.085   35.106  ?   ?  0.000000 35.10587 
1 1 1   21   28   19 o   87.560   33.838   4.8337   6.4402   7.1707   7.6959  -0.6270   11.764   99.584   37.340   93.248   41.369 6.335381 55.72852 
1 1 1   21   28   20 o  107.103   35.180   9.6109   6.6683   12.677   7.7675   1.0174   13.003  120.650   37.814  100.082   43.985 20.56733 58.00484 
1 1 1   21   28   21 o  159.423   27.834   21.242   6.5448   21.242   6.5448   0.0000   0.0000  159.423   27.834  ?   ?  0.000000 27.83369 
1 1 1   21   28   22 o   93.221   34.240   6.4490   6.4088   6.4490   6.4088   0.0000   0.0000   93.221   34.240  ?   ?  0.000000 34.23969 
1 1 1   21   28   24 o  139.819   30.164   16.792   6.2659   19.440   7.0079   6.2361   13.992  150.019   31.521  111.180   47.211 38.83900 56.76695 
1 1 1   21   28   25 o  163.221   27.318   22.383   6.5837   23.044   7.4379   19.990   14.149  163.790   30.799  143.322   51.113 20.46725 59.67520 
1 1 1   21   28   26 o  144.573   37.419   19.025   8.3443   24.075   11.474   13.355   12.157  157.787   45.195  123.522   46.797 34.26465 65.05791 
1 1 1   21   28   27 o  111.716   33.676   11.035   6.2356   17.892   7.9518   0.0847   10.049  140.117   36.656   86.425   38.293 53.69207 53.00942 
1 1 1   21   28   28 o  231.190   19.302   42.965   6.7678   54.099   8.6601   25.496   10.847  257.684   22.173  162.528   42.955 95.15591 48.33987 
1 1 1   21   28   29 o  250.973   11.423   48.993   4.3883   57.946   4.9370   15.294   9.5780  272.788   11.824  126.600   42.191 146.1875 43.81608 
1 1 1   21   28   30 o   72.723   25.504   4.0768   3.5101   2.7951   3.7776   12.179   9.4974   67.101   25.920  115.316   41.783 -48.21464 49.16986 
1 1 1   21   28   31 o  149.630   29.837   19.689   6.5937   29.488   8.8831   7.6639   9.8400  181.335   33.229  101.657   41.013 79.67870 52.78468 
1 1 1   21   28   32 o  117.743   34.696   12.878   6.6768   13.520   8.7658   11.990   10.305  118.578   40.361  113.732   43.085 4.846657 59.03638 
1 1 1   21   28   33 o   41.934   19.939  -3.8657   3.4905  -3.7144   3.8222  -4.6258   8.5667   44.889   21.201   69.765   32.563 -24.87555 38.85653 
1 1 1   21   28   34 f  139.954   19.243   16.165   4.0131   18.441   4.4959   7.2413   8.9018  149.078   20.225   96.209   38.941 52.86849 43.87966 
1 1 1   21   28   35 o   32.327   16.187  -8.9713   3.3962  -9.7377   4.0149  -7.0432   6.3680   36.009   17.965   54.598   26.222 -18.58930 31.78559 
1 1 1   21   28   36 o  180.817   14.371   26.169   3.9445   28.072   4.8647   22.516   6.7395  185.510   17.333  157.661   28.996 27.84846 33.78203 
1 1 1   21   28   37 o   62.445   25.610   1.9639   3.9120  -0.0770   4.9492   5.3625   6.3866   60.804   26.911   83.413   33.253 -22.60986 42.77742 
1 1 1   21   29    0 o   96.821   42.868   10.833   6.6953   10.833   6.6953   10.833   6.6953   96.821   42.868   96.821   42.868 0.000000 0.000000 
1 1 1   21   29    1 o   82.761   29.230   5.0171   4.6167   6.9768   6.4476   2.9552   6.6136   96.598   34.498   82.451   33.497 14.14754 48.08442 
1 1 1   21   29    2 o  308.667   12.668   73.722   5.9853   80.507   8.1433   65.749   8.8269  320.885   16.637  288.470   20.117 32.41522 26.10514 
1 1 1   21   29    3 o  207.294   16.195   33.674   5.0977   34.522   6.6878   32.498   7.8753  208.169   21.289  199.843   26.392 8.326340 33.90762 
1 1 1   21   29    4 o  200.694   16.867   31.642   5.1332   24.950   6.6091   41.816   8.1494  175.114   25.399  228.273   23.668 -53.15881 34.71696 
1 1 1   21   29    5 o  163.700   20.164   21.378   4.9455   21.938   6.2896   20.470   8.0046  163.778   25.955  154.543   34.690 9.235107 43.32512 
1 1 1   21   29    6 o  386.531   11.716  115.447   6.9317  112.751   8.7475  119.998   11.364  380.825   15.007  391.045   18.986 -10.22003 24.20036 
1 1 1   21   29    7 o  270.367   17.912   57.448   7.3704   57.448   7.3704   0.0000   0.0000  270.367   17.912  ?   ?  0.000000 17.91169 
1 1 1   21   29    8 o   96.459   29.640   7.6443   4.7992   3.3957   5.6777   18.277   8.9820   79.821   31.500  144.115   39.530 -64.29474 50.54553 
1 1 1   21   29    9 o  149.380   25.696   18.325   5.6634   20.640   6.8756   13.440   9.9877  157.118   29.678  125.960   43.081 31.15839 52.31378 
1 1 1   21   29   10 o   84.524   32.575   4.3712   5.9556   12.762   7.5491  -9.4586   9.6917  121.882   37.124   70.903   33.570 50.97878 50.05109 
1 1 1   21   29   11 o  167.665   24.945   22.928   6.2067   27.454   7.8493   15.379   10.139  181.851   29.187  132.527   43.372 49.32446 52.27816 
1 1 1   21   29   12 o  142.613   28.320   17.001   5.9638   9.3052   7.4304   30.936   9.9982  107.439   37.140  189.703   35.745 -82.26321 51.54647 
1 1 1   21   29   13 o  303.017   15.429   71.740   7.1325   67.152   9.1705   78.766   11.348  290.748   20.743  313.199   23.850 -22.45096 31.60819 
1 1 1   21   29   14 o  202.701   14.475   32.118   4.4615   29.032   4.8933   47.321   10.862  191.954   16.825  238.617   30.433 -46.66312 34.77406 
1 1 1   21   29   15 f  251.418   11.923   48.928   4.5882   50.392   5.0251   41.590   11.251  254.583   12.938  221.014   34.375 33.56873 36.72944 
1 1 1   21   29   16 o  209.455   20.379   35.007   6.4508   35.007   6.4508   0.0000   0.0000  209.455   20.379  ?   ?  0.000000 20.37926 
1 1 1   21   29   17 o  238.960   18.721   45.232   6.7925   45.232   6.7925   0.0000   0.0000  238.960   18.721  ?   ?  0.000000 18.72062 
1 1 1   21   29   18 o  191.289   19.804   29.218   5.7146   31.121   6.4303   22.070   12.464  196.672   21.723  153.066   47.888 43.60611 52.58480 
1 1 1   21   29   19 o  110.500   31.781   10.466   5.6632   10.682   6.3121   9.5716   12.824  111.519   33.941  117.245   46.989 -5.726967 57.96516 
1 1 1   21   29   20 o  246.630   17.092   47.995   6.4125   50.131   7.2737   40.545   13.586  251.173   19.062  210.158   43.660 41.01453 47.64017 
1 1 1   21   29   21 o  142.532   28.233   17.183   5.9416   15.619   6.5588   24.338   14.030  134.001   32.346  157.337   50.994 -23.33679 60.38783 
1 1 1   21   29   22 o  167.579   23.359   22.990   5.8287   23.971   6.5357   19.181   12.885  169.935   25.950  141.889   48.915 28.04575 55.37169 
1 1 1   21   29   23 o  158.490   25.107   20.848   5.8877   28.140   6.7519  -2.2945   12.029  184.921   24.454   89.751   40.657 95.17020 47.44505 
1 1 1   21   29   24 o  302.660   17.734   72.670   8.1798   72.670   8.1798   0.0000   0.0000  302.660   17.734  ?   ?  0.000000 17.73443 
1 1 1   21   29   25 o  149.504   45.650   21.844   11.405   21.844   11.405   0.0000   0.0000  149.504   45.650  ?   ?  0.000000 45.65008 
1 1 1   21   29   26 o   65.841   30.588  -4.6421   7.4197  -4.6421   7.4197   0.0000   0.0000   65.841   30.588  ?   ?  0.000000 30.58812 
1 1 1   21   29   27 o  175.189   24.573   25.602   6.4079   31.371   8.3478   17.327   9.9980  190.961   29.511  133.794   43.015 57.16704 52.16561 
1 1 1   21   29   28 o   88.476   33.317   5.9027   6.1396   5.8410   7.9760   5.9924   9.6181   92.935   37.124   97.443   40.082 -4.507545 54.63295 
1 1 1   21   29   29 o  150.997   28.764   19.829   6.4051   24.951   8.8217   14.117   9.3148  164.593   36.017  121.620   41.604 42.97332 55.02871 
1 1 1   21   29   30 o  180.714   24.291   27.423   6.5488   41.557   9.1692   12.706   9.3563  220.132   27.835  116.017   41.544 104.1154 50.00681 
1 1 1   21   29   31 o  144.063   19.211   17.009   4.1305   17.009   4.1305   0.0000   0.0000  144.063   19.211  ?   ?  0.000000 19.21059 
1 1 1   21   29   32 o  300.697   10.617   70.472   4.8864   83.833   5.7141   34.117   9.4257  327.514   11.399  193.221   33.059 134.2936 34.96881 
1 1 1   21   29   33 o   73.101   25.170   4.3617   3.4110   5.6159   4.0018   1.0300   6.5224   81.154   27.272   72.021   31.414 9.132797 41.60049 
1 1 1   21   29   34 o  108.636   22.705   10.187   3.6538   15.417   4.4794  -0.2095   6.3159  134.346   22.585   67.591   30.130 66.75546 37.65447 
1 1 1   21   29   35 o  110.671   22.238   10.567   3.6362   11.911   4.4606   7.9057   6.2781  115.536   25.868   93.158   33.938 22.37800 42.67249 
1 1 1   21   29   36 o   61.953   24.802   2.2394   3.5686   6.0072   4.4262  -4.7597   6.0326   82.666   28.660   56.044   26.521 26.62173 39.04753 
1 1 1   21   30    0 o  102.888   43.016   11.972   6.7859   11.972   6.7859   11.972   6.7859  102.888   43.016  102.888   43.016 0.000000 0.000000 
1 1 1   21   30    1 o  160.549   20.720   20.648   4.9729   18.484   6.7604   23.200   7.3407  147.979   30.847  166.665   29.873 -18.68527 42.94109 
1 1 1   21   30    2 o  141.575   23.133   16.303   4.8398   20.254   6.5199   11.454   7.2230  156.110   28.329  116.220   36.471 39.88976 46.18089 
1 1 1   21   30    3 o  328.663   12.397   83.606   6.2362   79.067   8.1948   89.852   9.6125  317.663   16.915  337.854   18.661 -20.19101 25.18596 
1 1 1   21   30    4 o  172.730   20.469   23.837   5.3065   20.282   7.0124   28.602   8.1174  155.232   30.601  185.544   29.576 -30.31183 42.55740 
1 1 1   21   30    5 f  104.880   29.841   9.2357   5.0190   8.1062   6.2262   11.332   8.4814  100.574   34.016  116.718   39.701 -16.14456 52.28058 
1 1 1   21   30    6 o  462.706   9.7058  165.012   6.8739  162.746   8.2268  170.256   12.512  458.780   11.715  466.303   17.530 -7.523376 21.08417 
1 1 1   21   30    7 o  364.883   10.821  102.799   6.0435   96.324   7.0449  120.845   11.760  352.496   13.057  391.194   19.704 -38.69781 23.63730 
1 1 1   21   30    8 o  266.026   13.093   54.873   5.3311   61.089   6.2891   39.002   10.049  279.839   14.735  216.059   31.298 63.78065 34.59320 
1 1 1   21   30    9 o   85.674   26.080   5.9813   3.7264   7.7979   4.0891  -2.9185   9.0508   96.728   26.730   78.519   35.445 18.20895 44.39440 
1 1 1   21   30   10 o  197.562   13.821   30.459   4.1531   31.689   4.5912   24.922   9.7428  201.183   15.018  168.075   38.675 33.10834 41.48823 
1 1 1   21   30   11 o   68.502   26.451   2.6847   3.9329   2.8468   4.2810   1.8080   9.9568   70.964   27.542   92.023   39.469 -21.05920 48.12856 
1 1 1   21   30   12 o   64.235   25.757   1.8395   3.8551   4.2041   4.2194 -10.1081   9.4844   77.039   27.860   68.737   32.735 8.302048 42.98523 
1 1 1   21   30   13 o  259.859   11.889   52.279   4.7289   53.436   5.2257   47.049   11.112  262.422   13.010  236.981   31.408 25.44057 33.99560 
1 1 1   21   30   14 o  135.180   21.643   14.848   4.3271   14.848   4.3271   0.0000   0.0000  135.180   21.643  ?   ?  0.000000 21.64326 
1 1 1   21   30   15 o  289.715   12.271   65.060   5.4416   65.060   5.4416   0.0000   0.0000  289.715   12.271  ?   ?  0.000000 12.27114 
1 1 1   21   30   16 o  189.113   20.504   28.665   5.8399   28.673   6.6729   28.639   12.071  187.732   23.754  175.531   44.782 12.20189 50.69218 
1 1 1   21   30   17 o  185.602   21.726   27.800   6.0552   32.824   6.8766   10.456   12.776  201.400   22.703  119.064   47.168 82.33540 52.34767 
1 1 1   21   30   18 o  259.477   16.165   52.960   6.3884   45.927   7.1464   80.940   14.253  240.018   19.624  311.158   30.312 -71.13922 36.11010 
1 1 1   21   30   19 o   79.824   31.422   3.6902   5.6365   8.3398   6.2679 -15.9621   12.886  100.508   34.130   75.581   36.547 24.92722 50.00541 
1 1 1   21   30   20 o  153.886   25.921   19.740   5.8886   15.533   6.6029   36.093   13.017  133.224   32.637  196.172   44.388 -62.94789 55.09538 
1 1 1   21   30   21 o  105.576   32.273   9.6224   5.6980   9.6927   6.4707   9.3796   12.024  106.212   34.644  113.484   45.494 -7.272621 57.18276 
1 1 1   21   30   22 o  205.775   19.419   33.970   6.0439   36.646   7.3753   28.498   10.546  211.819   23.124  175.844   40.073 35.97540 46.26639 
1 1 1   21   30   23 o  122.735   31.164   13.228   5.8653   16.614   7.2966   7.0455   9.8600  135.910   34.896  102.192   41.116 33.71761 53.92768 
1 1 1   21   30   24 o  192.349   27.276   31.213   7.8056   42.663   12.335   23.567   10.080  216.129   38.710  157.506   41.304 58.62326 56.60774 
1 1 1   21   30   25 o  195.223   21.452   31.108   6.3044   24.492   7.9527   42.296   10.342  166.570   32.359  220.671   31.515 -54.10185 45.16921 
1 1 1   21   30   26 o  227.211   18.874   41.538   6.5046   49.987   8.3645   28.611   10.346  247.025   22.365  174.247   39.680 72.77760 45.54862 
1 1 1   21   30   27 o   79.637   34.393   1.5145   7.6618   1.5145   7.6618   0.0000   0.0000   79.637   34.393  ?   ?  0.000000 34.39331 
1 1 1   21   30   28 o  112.405   39.484   11.673   8.4142   11.673   8.4142   0.0000   0.0000  112.405   39.484  ?   ?  0.000000 39.48412 
1 1 1   21   30   29 o   75.651   34.031  -0.9353   8.2580  -0.9353   8.2580   0.0000   0.0000   75.651   34.031  ?   ?  0.000000 34.03119 
1 1 1   21   30   30 o  329.865   19.576   88.599   9.8396   88.599   9.8396   0.0000   0.0000  329.865   19.576  ?   ?  0.000000 19.57583 
1 1 1   21   30   31 o   77.293   25.641   5.0188   3.5392   5.9358   3.8868   0.5686   8.5625   82.977   26.835   78.845   35.119 4.132271 44.19770 
1 1 1   21   30   32 o  169.791   15.640   23.206   4.0188   25.103   4.4487   14.786   9.3707  176.048   16.710  119.225   41.680 56.82257 44.90456 
1 1 1   21   30   33 o   50.106   22.171  -0.4585   3.3576  -1.3163   3.9060   1.9686   6.5706   51.237   23.193   74.118   31.930 -22.88114 39.46485 
1 1 1   21   30   34 o   55.438   23.566   0.7765   3.4926   1.6595   4.1471  -1.3776   6.4773   62.488   26.065   65.151   29.639 -2.663792 39.46967 
1 1 1   21   31    0 o   51.066   33.778  -1.1172   6.8865  -1.1172   6.8865  -1.1172   6.8865   51.066   33.778   51.066   33.778 0.000000 0.000000 
1 1 1   21   31    1 o   82.690   29.600   4.9820   4.7494   13.684   6.4228  -5.5180   7.0550  126.164   32.914   63.520   29.615 62.64426 44.27631 
1 1 1   21   31    2 o  159.853   21.429   20.575   5.1112   15.981   6.8215   26.456   7.7179  136.300   33.041  178.151   29.324 -41.85133 44.17704 
1 1 1   21   31    3 o  178.067   20.256   25.336   5.4225   22.776   7.0537   29.035   8.4786  165.188   28.953  186.011   30.861 -20.82306 42.31682 
1 1 1   21   31    4 o  685.931   11.078  363.570   11.631  354.346   15.280  376.275   17.934  674.642   14.797  693.416   16.897 -18.77380 22.45992 
1 1 1   21   31    5 o  172.137   21.346   23.812   5.5035   27.576   6.9824   17.637   8.9426  183.655   25.529  140.797   39.753 42.85806 47.24423 
1 1 1   21   31    6 o  341.633   11.355   90.244   5.9375   93.956   7.1310   81.853   10.721  347.896   13.392  320.224   22.006 27.67249 25.76036 
1 1 1   21   31    7 o  319.492   11.645   78.975   5.6947   73.360   6.6565   94.304   10.998  307.130   14.160  344.404   20.963 -37.27438 25.29754 
1 1 1   21   31    8 o  203.372   16.024   32.502   4.9478   31.468   5.7697   35.378   9.6187  198.976   19.182  204.982   31.678 -6.005920 37.03336 
1 1 1   21   31    9 o  131.540   20.123   13.963   3.9227   16.110   4.3404   4.3896   9.1644  141.292   20.682   95.422   39.173 45.87038 44.29749 
1 1 1   21   31   10 o  240.526   11.900   44.798   4.3809   45.625   4.8957   41.477   9.8143  242.046   13.265  223.390   29.419 18.65656 32.27098 
1 1 1   21   31   11 o  122.920   22.089   12.361   4.0031   11.941   4.4160   14.296   9.4814  119.840   24.888  127.361   41.955 -7.520264 48.78154 
1 1 1   21   31   12 o  222.485   13.603   38.624   4.6103   40.924   5.0281   26.484   11.551  228.766   14.434  169.210   44.138 59.55643 46.43816 
1 1 1   21   31   13 o  253.599   13.550   50.151   5.2407   50.151   5.2407   0.0000   0.0000  253.599   13.550  ?   ?  0.000000 13.55013 
1 1 1   21   31   14 o  260.074   11.927   52.430   4.7480   52.870   5.2073   50.258   11.562  260.512   13.101  243.953   31.714 16.55891 34.31321 
1 1 1   21   31   15 o   98.604   26.793   8.2022   4.1492   7.0215   4.4512   16.028   11.460   91.983   28.592  132.881   46.112 -40.89814 54.25701 
1 1 1   21   31   16 o  431.286   9.3262  143.529   6.1566  142.024   6.6925  151.809   15.702  428.677   10.200  433.377   23.762 -4.700775 25.85825 
1 1 1   21   31   17 o  168.492   23.786   23.294   5.9637   18.405   6.6579   43.143   13.414  146.245   30.720  217.379   41.834 -71.13422 51.90187 
1 1 1   21   31   18 o   70.247   29.929   0.9136   5.6569   2.9166   6.3380  -6.9316   12.544   79.733   32.636   84.609   39.462 -4.876610 51.20899 
1 1 1   21   31   19 o  119.102   31.692   12.419   5.8789   15.041   6.7167   3.8343   12.156  130.343   33.488  101.086   43.489 29.25729 54.88848 
1 1 1   21   31   20 o  177.388   22.800   25.778   6.0471   36.013   7.2559   2.5016   10.942  209.973   22.950   94.553   40.968 115.4192 46.95829 
1 1 1   21   31   21 o   46.890   22.838  -8.5806   5.2759 -14.7887   6.2325   7.1161   9.9103   45.242   22.542  102.332   41.203 -57.09023 46.96634 
1 1 1   21   31   22 o  180.456   29.055   27.878   7.7529   23.077   11.486   31.896   10.507  152.567   45.642  186.607   38.077 -34.03992 59.43910 
1 1 1   21   31   23 o  284.353   19.614   65.053   8.4848   74.813   12.839   57.486   11.305  297.201   28.577  260.007   28.895 37.19403 40.63945 
1 1 1   21   31   24 o  164.855   25.683   22.923   6.2694   26.940   7.8113   15.651   10.510  176.144   30.051  127.310   44.162 48.83388 53.41644 
1 1 1   21   31   25 o   78.852   31.703   3.5782   5.8580   1.3632   7.4525   7.1594   9.4763   78.463   33.903  100.012   40.283 -21.54887 52.65152 
1 1 1   21   31   26 o  119.051   33.267   12.938   6.2964   12.597   7.8732   13.543   10.487  116.024   38.232  119.268   43.801 -3.243401 58.13987 
1 1 1   21   31   27 o  179.012   24.668   27.068   6.5796   30.063   8.5240   22.654   10.349  183.755   31.436  149.613   42.944 34.14291 53.22049 
1 1 1   21   31   28 o   78.376   32.040   3.4870   6.0984   2.6634   8.0351   4.6060   9.3659   82.588   35.440   91.209   38.673 -8.621658 52.45541 
1 1 1   21   31   29 o  104.506   38.613   10.120   8.1701   10.120   8.1701   0.0000   0.0000  104.506   38.613  ?   ?  0.000000 38.61346 
1 1 1   21   31   30 o  188.436   30.230   31.971   8.4243   31.971   8.4243   0.0000   0.0000  188.436   30.230  ?   ?  0.000000 30.22998 
1 1 1   21   31   31 o   92.849   37.171   7.0143   8.0153   7.0143   8.0153   0.0000   0.0000   92.849   37.171  ?   ?  0.000000 37.17110 
1 1 1   21   31   32 o   63.341   25.948   2.0174   4.0103   2.0174   4.0103   0.0000   0.0000   63.341   25.948  ?   ?  0.000000 25.94779 
1 1 1   21   32    0 o   61.147   38.671   1.8531   7.7584   1.8531   7.7584   1.8531   7.7584   61.147   38.671   61.147   38.671 0.000000 0.000000 
1 1 1   21   32    1 o  341.477   13.331   90.564   6.9678   87.189   9.4487   94.586   10.316  332.261   18.655  345.568   19.584 -13.30771 27.04671 
1 1 1   21   32    2 o  209.381   18.292   34.729   5.8035   40.131   7.6527   27.416   8.9035  223.225   22.714  178.697   33.790 44.52797 40.71449 
1 1 1   21   32    3 o  324.161   13.623   81.674   6.7592   72.225   8.8678   94.775   10.442  301.961   19.287  345.737   19.814 -43.77643 27.65128 
1 1 1   21   32    4 o   67.180   28.806   0.3781   5.3013  -2.8423   6.6942   5.7947   8.6818   66.664   30.251   97.730   38.830 -31.06673 49.22279 
1 1 1   21   32    5 o  176.446   21.538   25.085   5.6962   29.016   7.1856   18.437   9.3445  188.097   25.625  142.937   40.734 45.16003 48.12366 
1 1 1   21   32    6 o  157.700   21.502   20.104   5.0549   14.619   5.8666   35.915   9.9601  130.952   29.923  205.504   32.765 -74.55205 44.37254 
1 1 1   21   32    7 o   77.807   28.932   4.1071   4.6012   5.2349   5.3488   0.8975   9.0237   85.376   31.292   85.921   37.216 -0.5454254 48.62311 
1 1 1   21   32    8 o   73.935   28.366   3.3440   4.5022   2.8057   5.1975   4.9618   9.0105   74.869   29.947   96.064   39.071 -21.19424 49.22738 
1 1 1   21   32    9 o  343.514   11.530   91.381   6.0621   87.943   6.9962  101.739   12.144  336.220   13.595  356.103   22.394 -19.88272 26.19707 
1 1 1   21   32   10 o   96.378   28.046   7.8091   4.3870   7.8091   4.3870   0.0000   0.0000   96.378   28.046  ?   ?  0.000000 28.04560 
1 1 1   21   32   11 f  229.455   14.230   41.195   4.9732   41.195   4.9732   0.0000   0.0000  229.455   14.230  ?   ?  0.000000 14.23044 
1 1 1   21   32   12 o  308.134   10.752   73.455   5.0709   74.731   5.5750   67.340   12.204  310.480   11.731  284.950   28.357 25.53046 30.68761 
1 1 1   21   32   13 o  267.999   11.954   55.725   4.9036   58.841   5.4017   41.129   11.691  275.107   12.828  216.366   36.607 58.74062 38.79002 
1 1 1   21   32   14 o   67.936   26.626   2.5548   4.0311   5.0934   4.3122 -15.0303   11.350   81.272   28.282   70.300   34.068 10.97163 44.27728 
1 1 1   21   32   15 o  210.918   14.784   34.961   4.7426   35.499   5.1477   31.943   12.196  212.081   15.975  184.138   43.894 27.94249 46.71063 
1 1 1   21   32   16 o  324.439   10.680   81.520   5.3037   83.162   5.7936   73.025   13.179  327.358   11.563  294.579   29.630 32.77914 31.80595 
1 1 1   21   32   17 o  177.635   22.668   25.824   6.0227   22.123   6.9100   37.524   12.286  160.928   29.125  201.408   41.241 -40.47943 50.48853 
1 1 1   21   32   18 o  293.205   15.061   67.631   6.7365   72.619   8.0025   55.500   12.480  302.520   17.355  252.921   33.025 49.59862 37.30773 
1 1 1   21   32   19 o  125.889   30.209   13.873   5.7467   14.693   6.7516   11.717   10.948  127.896   33.930  116.585   44.351 11.31189 55.84164 
1 1 1   21   32   20 o   95.964   32.259   7.7927   5.5990   9.9641   6.7075   2.8028   10.168  106.474   35.298   91.984   39.674 14.48962 53.10336 
1 1 1   21   32   21 o  294.333   20.221   69.922   9.0548   77.589   13.323   63.340   12.344  301.949   29.191  271.696   30.193 30.25259 41.99681 
1 1 1   21   32   22 o  171.742   24.139   24.602   6.1703   31.848   7.6292   10.899   10.491  194.313   26.329  112.534   43.271 81.77937 50.65216 
1 1 1   21   32   23 o  110.700   32.772   11.032   5.9449   10.705   7.2784   11.689   10.304  108.893   36.779  114.121   43.119 -5.227859 56.67421 
1 1 1   21   32   24 o  132.857   30.841   15.776   6.1509   12.730   7.5038   22.014   10.739  116.671   37.240  147.371   44.141 -30.69932 57.75171 
1 1 1   21   32   25 o  217.872   20.260   38.801   6.6790   43.910   8.5025   30.569   10.793  228.456   24.709  176.959   40.696 51.49651 47.61014 
1 1 1   21   32   26 o   89.420   33.401   6.4953   6.1459   6.5610   7.6785   6.3782   10.253   92.698   36.616   97.460   40.844 -4.762619 54.85425 
1 1 1   21   32   27 o  262.257   22.294   57.296   8.8644   57.296   8.8644   0.0000   0.0000  262.257   22.294  ?   ?  0.000000 22.29405 
1 1 1   21   32   28 o   87.190   36.003   5.0107   7.7981   5.0107   7.7981   0.0000   0.0000   87.190   36.003  ?   ?  0.000000 36.00255 
1 1 1   21   32   29 o   53.737   25.774  -6.6576   6.1077  -6.1911   7.8423  -7.3768   9.7372   63.143   29.983   69.280   33.042 -6.137051 44.61782 
1 1 1   21   32   30 o  222.965   19.084   40.950   6.4503   48.482   8.5592   31.049   9.8132  238.214   23.793  177.315   37.337 60.89844 44.27366 
1 1 1   21   33    0 o  402.611   17.569  126.492   10.780  126.492   10.780  126.492   10.780  402.611   17.569  402.611   17.569 0.000000 0.000000 
1 1 1   21   33    1 o   59.221   26.963  -2.6262   5.3740  -6.0564   7.2046   1.6762   8.0687   63.000   29.552   83.749   35.714 -20.74922 46.35571 
1 1 1   21   33    2 o  172.537   22.360   24.158   5.7663   24.997   8.0099   23.256   8.3077  170.917   31.788  163.348   34.319 7.569595 46.77837 
1 1 1   21   33    3 o  289.058   15.387   65.507   6.7834   65.627   9.3285   65.373   9.8816  286.146   21.455  284.725   22.867 1.420837 31.35641 
1 1 1   21   33    4 o  440.653   12.079  150.610   8.1472  150.397   11.014  150.868   12.108  437.868   16.433  437.430   18.083 0.4380493 24.43464 
1 1 1   21   33    5 o  188.973   20.601   28.702   5.8624   20.574   7.4292   42.117   9.5437  154.211   32.499  224.949   28.348 -70.73776 43.12525 
1 1 1   21   33    6 o  322.700   12.432   80.857   6.1407   84.516   7.3886   72.686   11.042  328.993   14.672  299.127   24.329 29.86667 28.41059 
1 1 1   21   33    7 o   73.224   28.768   3.0043   4.7157   0.7568   5.5084   9.1716   9.1248   69.172   29.504  108.359   40.654 -39.18641 50.23157 
1 1 1   21   33    8 o  189.163   20.629   28.803   5.8761   28.803   5.8761   0.0000   0.0000  189.163   20.629  ?   ?  0.000000 20.62913 
1 1 1   21   33    9 o  333.170   14.108   86.617   7.1945   86.617   7.1945   0.0000   0.0000  333.170   14.108  ?   ?  0.000000 14.10807 
1 1 1   21   33   10 o  165.796   20.500   22.207   5.0914   20.643   5.8266   27.256   10.470  157.826   24.949  172.403   40.386 -14.57735 47.47102 
1 1 1   21   33   11 o   87.379   27.877   6.2955   4.2053   5.0485   4.5990   12.659   10.389   81.737   29.141  120.449   43.691 -38.71150 52.51773 
1 1 1   21   33   12 o   83.737   27.958   5.6423   4.2054   2.5993   4.5773   22.117   10.651   70.663   28.157  152.620   43.486 -81.95661 51.80566 
1 1 1   21   33   13 o  232.396   13.801   42.315   4.8872   46.071   5.3745   24.376   11.746  242.208   14.565  158.274   45.843 83.93448 48.10143 
1 1 1   21   33   14 o  149.785   19.501   18.147   4.3649   16.572   4.7420   26.879   11.169  141.755   22.615  167.888   43.210 -26.13298 48.77029 
1 1 1   21   33   15 o   57.314   25.032  -0.3059   4.1536  -0.5983   4.4763   1.5059   11.143   58.489   25.754   92.758   40.743 -34.26971 48.19975 
1 1 1   21   33   16 o  301.469   11.436   70.610   5.2770   69.759   5.7700   74.963   13.047  299.167   12.601  297.780   28.992 1.387024 31.61222 
1 1 1   21   33   17 o   61.072   27.751  -2.2958   5.6579  -5.8637   6.6169   7.4069   10.912   59.340   27.986  104.730   42.840 -45.39025 51.17163 
1 1 1   21   33   18 o  151.352   26.035   19.380   5.8139   24.458   6.8078   5.6978   11.175  169.763   27.112  100.958   42.493 68.80457 50.40553 
1 1 1   21   33   19 o  253.879   21.355   52.448   8.2215   49.251   11.292   56.055   11.994  237.729   31.832  254.064   31.519 -16.33472 44.79620 
1 1 1   21   33   20 o   93.785   36.583   6.4454   7.5822   15.736   11.277  -1.2197   10.243  127.007   45.595   83.476   37.693 43.53192 59.15841 
1 1 1   21   33   21 o  302.067   15.284   72.208   7.0438   74.779   8.6273   67.067   12.199  305.052   18.565  279.609   28.922 25.44327 34.36759 
1 1 1   21   33   22 o   99.098   32.801   8.6877   5.7928   7.4732   7.1681   10.974   9.8349   95.689   36.007  110.550   42.040 -14.86046 55.35224 
1 1 1   21   33   23 o   79.194   31.923   3.8008   5.9559   4.6974   7.5173   2.2889   9.7616   86.909   35.555   87.458   38.281 -0.5491867 52.24567 
1 1 1   21   33   24 f  152.561   26.339   20.154   5.9281   16.096   7.3232   27.868   10.097  129.870   35.723  168.313   39.815 -38.44386 53.49203 
1 1 1   21   33   25 o  220.130   19.942   39.806   6.6463   36.599   8.4505   45.006   10.762  204.828   27.661  222.437   32.573 -17.60904 42.73385 
1 1 1   21   33   26 o   94.966   36.782   7.6332   7.6232   7.6332   7.6232   0.0000   0.0000   94.966   36.782  ?   ?  0.000000 36.78247 
1 1 1   21   33   27 o   74.173   30.974   2.7635   5.8658   9.7352   7.4800  -8.3716   9.4532  101.690   37.045   66.925   32.090 34.76535 49.01112 
1 1 1   21   33   28 o   73.746   30.737   2.8328   5.7603  -4.5918   7.3029   15.059   9.3712   63.060   29.636  119.171   41.680 -56.11134 51.14165 
1 1 1   21   34    0 o  274.850   23.518   60.639   9.7271   60.639   9.7271   60.639   9.7271  274.850   23.518  274.850   23.518 0.000000 0.000000 
1 1 1   21   34    1 o  275.551   15.902   59.779   6.6784   61.175   9.2896   58.286   9.6079  275.148   22.248  267.589   23.703 7.559357 32.50876 
1 1 1   21   34    2 o  174.820   23.845   25.105   6.2140   26.437   8.4873   23.567   9.1230  174.384   33.006  161.643   37.585 12.74075 50.02047 
1 1 1   21   34    3 o  123.732   32.556   13.442   6.2490   9.3175   8.3675   18.644   9.3967  107.013   39.151  141.806   40.983 -34.79279 56.67793 
1 1 1   21   34    4 o  159.807   26.254   21.351   6.1988   24.734   8.0883   16.536   9.6498  168.753   32.493  133.522   42.190 35.23048 53.25174 
1 1 1   21   34    5 o  303.788   20.523   74.003   9.4869   74.003   9.4869   0.0000   0.0000  303.788   20.523  ?   ?  0.000000 20.52287 
1 1 1   21   34    7 o  100.423   32.941   8.5619   5.8473   8.5619   5.8473   0.0000   0.0000  100.423   32.941  ?   ?  0.000000 32.94117 
1 1 1   21   34    8 o  196.672   18.095   30.878   5.3860   28.625   6.2381   37.477   10.676  187.388   22.179  206.198   35.082 -18.81026 41.50496 
1 1 1   21   34    9 o   57.938   26.120  -1.7672   4.8959  -3.8858   5.5918   5.1905   10.134   57.319   26.604   98.202   40.835 -40.88352 48.73660 
1 1 1   21   34   10 o  103.186   30.615   9.2307   5.1839   7.2793   5.9037   15.802   10.834   94.460   33.079  129.551   44.842 -35.09144 55.72283 
1 1 1   21   34   11 o  290.437   14.213   66.039   6.3183   72.043   7.3808   49.571   12.223  302.053   16.022  237.344   34.669 64.70938 38.19244 
1 1 1   21   34   12 o   49.447   23.207  -3.9880   4.4531  -1.5838   4.8794 -15.9715   10.894   58.201   26.172   66.760   32.581 -8.558552 41.79152 
1 1 1   21   34   13 o  215.653   15.058   36.704   4.9391   34.426   5.4533   47.105   11.651  207.817   17.301  231.484   33.887 -23.66736 38.04807 
1 1 1   21   34   14 o  359.376   10.613  100.179   5.8381  100.470   6.4739   98.916   13.508  359.345   11.770  345.288   25.745 14.05719 28.30754 
1 1 1   21   34   15 o  106.627   27.553   9.8507   4.5291   9.4738   4.9270   11.906   11.504  104.115   29.546  116.950   45.216 -12.83506 54.01365 
1 1 1   21   34   16 o   95.462   28.407   7.8712   4.4582   9.8286   4.9369  -0.7797   10.379  105.857   29.414   84.995   38.201 20.86229 48.21277 
1 1 1   21   34   17 o  182.185   22.403   27.379   6.1156   28.260   7.3538   25.402   11.012  182.163   27.208  160.091   43.712 22.07130 51.48803 
1 1 1   21   34   18 o  141.077   34.378   18.241   7.3554   24.724   10.642   12.310   10.178  157.926   42.907  115.619   43.022 42.30707 60.76161 
1 1 1   21   34   19 o   70.697   30.119   1.3792   5.7283   0.7973   6.8325   2.7557   10.509   73.981   32.214   91.211   39.827 -17.23042 51.22410 
1 1 1   21   34   20 o  108.401   33.043   10.745   5.9791   14.926   7.4511   3.1858   10.020  125.313   36.575   90.276   39.159 35.03712 53.58287 
1 1 1   21   34   21 o  108.709   32.377   10.849   5.7897   4.7532   7.3276   20.978   9.4457   86.283   35.179  144.691   40.857 -58.40839 53.91507 
1 1 1   21   34   22 o  231.731   18.010   43.482   6.3378   46.233   8.2257   39.463   9.9423  234.883   23.182  208.984   32.109 25.89886 39.60275 
1 1 1   21   34   23 o   69.137   29.783   1.1741   5.7164   3.1289   7.1192  -2.3736   9.5905   80.194   33.844   76.920   35.393 3.274712 48.96990 
1 1 1   21   34   24 o  178.993   23.617   27.250   6.3125   29.680   7.8861   22.917   10.532  182.332   29.246  146.170   43.698 36.16234 52.58157 
1 1 1   21   34   25 o   89.153   35.482   6.2054   7.2607   6.2054   7.2607   0.0000   0.0000   89.153   35.482  ?   ?  0.000000 35.48204 
1 1 1   21   34   26 o   92.614   34.963   7.5341   6.7711   4.2286   10.112   10.221   9.1168   89.795   39.142  103.583   40.195 -13.78723 56.10484 
1 1 1   21   35    0 o   69.032   42.800   3.9256   9.0179   3.9256   9.0179   3.9256   9.0179   69.032   42.800   69.032   42.800 0.000000 0.000000 
1 1 1   21   35    1 o  105.427   34.219   9.6704   6.3161   10.005   8.5890   9.2770   9.3202  108.834   39.689  107.507   40.916 1.327484 57.00250 
1 1 1   21   35    2 f   89.269   37.138   3.8108   8.3874   3.8108   8.3874   0.0000   0.0000   89.269   37.138  ?   ?  0.000000 37.13794 
1 1 1   21   35    3 o  147.918   35.975   19.830   8.0666   19.830   8.0666   0.0000   0.0000  147.918   35.975  ?   ?  0.000000 35.97469 
1 1 1   21   35    4 o  117.529   34.318   12.356   6.5588   6.7415   8.2258   22.155   10.867   97.304   38.063  151.064   44.194 -53.75991 58.32555 
1 1 1   21   35    5 o  121.983   29.017   12.917   5.3389   12.246   6.2124   14.814   10.442  117.294   33.139  125.973   43.999 -8.678848 55.08297 
1 1 1   21   35    6 o   81.270   30.802   4.5925   5.2684   8.1653   6.2150  -4.5298   9.9310   98.556   33.972   77.419   35.763 21.13686 49.32690 
1 1 1   21   35    7 o  276.512   14.397   60.083   6.0725   59.076   7.0695   62.916   11.860  272.778   17.017  272.682   28.854 0.9597778E-01 33.49797 
1 1 1   21   35    8 o  362.284   12.146  102.199   6.7355   96.343   7.8839  118.021   12.960  350.360   14.701  381.107   22.314 -30.74692 26.72141 
1 1 1   21   35    9 o  164.594   22.235   22.276   5.4583   24.826   6.4002   15.473   10.453  172.413   24.980  127.569   44.053 44.84449 50.64280 
1 1 1   21   35   10 o  117.745   29.423   12.137   5.2878   15.195   6.1293   3.2385   10.456  131.193   31.013   93.659   40.314 37.53368 50.86294 
1 1 1   21   35   11 o   91.753   30.793   7.0680   5.1018   6.0324   5.8431   10.390   10.466   88.488   32.663  111.417   43.114 -22.92921 54.08942 
1 1 1   21   35   12 o   47.884   22.499  -3.8168   4.2060  -5.0548   4.6285   2.0498   10.076   48.310   22.967   89.558   39.055 -41.24879 45.30732 
1 1 1   21   35   13 o  104.410   28.058   9.5162   4.5801   12.390   5.1710  -0.9487   9.8670  118.900   28.733   82.654   37.189 36.24586 46.99557 
1 1 1   21   35   14 o  197.953   16.399   31.260   4.9240   32.845   5.5283   25.176   10.831  202.082   18.063  159.207   43.301 42.87549 46.91715 
1 1 1   21   35   15 o  113.927   26.911   11.306   4.6179   12.251   5.1348   7.3109   10.561  117.820   28.731  101.886   41.966 15.93307 50.85875 
1 1 1   21   35   16 o  176.405   20.876   25.592   5.5275   24.650   6.5849   27.839   10.170  169.875   26.165  169.785   39.823 0.9013367E-01 47.64985 
1 1 1   21   35   17 o   78.270   28.876   4.6678   4.5656   2.3740   5.1956   12.442   9.5652   71.287   29.407  114.324   41.854 -43.03686 51.15208 
1 1 1   21   35   18 o  126.454   30.268   14.436   5.7804   15.183   7.1259   12.997   9.8848  126.547   35.400  115.563   42.511 10.98383 55.32091 
1 1 1   21   35   19 o  228.223   17.865   42.131   6.1909   43.790   7.8622   39.425   10.043  228.983   22.733  208.594   32.517 20.38902 39.67518 
1 1 1   21   35   20 o  183.641   21.249   28.036   5.8624   31.445   7.6448   23.171   9.1339  190.217   27.016  152.995   38.913 37.22141 47.37212 
1 1 1   21   35   21 o  108.106   32.345   10.913   5.7684   12.443   7.2597   8.2935   9.5007  113.138   36.684   99.753   40.280 13.38480 54.48124 
1 1 1   21   35   22 o   74.721   32.266   1.7801   6.7412   6.8629   10.089  -2.3190   9.0604   96.507   40.485   74.631   34.362 21.87563 53.10187 
1 1 1   21   35   23 o  267.896   28.704   63.679   11.587   63.679   11.587   0.0000   0.0000  267.896   28.704  ?   ?  0.000000 28.70353 
1 1 1   21   36    1 o  216.056   32.117   40.799   10.298   0.0000   0.0000   40.799   10.298  ?   ?   216.056   32.117 0.000000 32.11654 
1 1 1   21   36    2 o  112.975   41.902   11.228   9.6393   0.0000   0.0000   11.228   9.6393  ?   ?   112.975   41.902 0.000000 41.90218 
1 1 1   21   36    3 o  176.537   40.005   29.355   10.560   0.0000   0.0000   29.355   10.560  ?   ?   176.537   40.005 0.000000 40.00454 
1 1 1   21   36    4 o   71.860   31.257   0.4615   6.4192   3.9002   8.4502  -4.2305   9.8708   88.913   37.157   77.148   35.644 11.76571 51.48930 
1 1 1   21   36    5 o  191.318   20.450   29.773   5.8957   22.079   7.0201   48.187   10.861  159.211   29.905  235.859   30.821 -76.64841 42.94473 
1 1 1   21   36    6 o  101.513   31.468   9.0559   5.3959   2.8253   6.3174   25.863   10.376   78.213   32.359  163.844   41.367 -85.63106 52.51972 
1 1 1   21   36    7 o   74.125   29.716   3.0551   5.1303   6.2844   5.9817  -5.9293   9.9773   89.519   33.047   74.664   34.945 14.85587 48.09607 
1 1 1   21   36    8 o   77.729   30.367   3.9077   5.2306   8.8123   6.2067  -8.1118   9.7164  100.414   33.963   70.350   33.396 30.06441 47.63210 
1 1 1   21   36    9 o  252.981   15.473   50.741   5.9627   48.602   7.0914   55.905   11.016  245.410   19.028  255.318   28.684 -9.907867 34.42128 
1 1 1   21   36   10 o  261.110   15.446   54.078   6.1457   50.775   7.2029   62.916   11.784  250.811   18.901  270.418   28.918 -19.60690 34.54741 
1 1 1   21   36   11 o  158.292   23.129   20.959   5.4385   14.663   6.4492   36.460   10.119  126.626   32.956  200.705   34.163 -74.07898 47.46794 
1 1 1   21   36   12 o  243.042   15.934   47.062   5.8947   58.212   7.3569   27.068   9.8518  268.995   17.972  167.830   39.080 101.1654 43.01446 
1 1 1   21   36   13 o  154.230   21.069   19.698   4.8437   17.589   5.6057   25.910   9.6225  142.474   26.686  163.766   38.955 -21.29272 47.21888 
1 1 1   21   36   14 o  158.969   23.106   21.252   5.4576   22.502   6.6119   18.578   9.6674  160.516   27.926  135.204   42.155 25.31230 50.56554 
1 1 1   21   36   15 o  133.722   24.027   15.271   4.7370   20.775   5.5801   1.0720   8.9620  156.394   24.084   81.878   36.226 74.51559 43.50139 
1 1 1   21   36   16 o   83.618   30.820   5.6170   5.1991   5.4969   6.2916   5.8757   9.2321   85.656   33.349   93.617   38.956 -7.961617 51.28113 
1 1 1   21   36   17 o  112.989   29.594   11.605   5.1789   16.273   6.3173   2.0367   9.0439  132.952   31.522   83.672   36.730 49.28002 48.40179 
1 1 1   21   36   18 o   75.681   32.808   1.6427   7.0247   10.616   10.584  -5.4230   9.3915  107.214   42.786   71.160   33.494 36.05327 54.33670 
1 1 1   21   36   19 o   67.380   30.472  -1.2101   6.7240   5.2564   9.8979  -6.7519   9.1630   92.477   39.499   68.148   32.374 24.32950 51.07131 
1 1 1   21   36   20 o   60.671   27.528  -1.5366   5.5413   0.2606   7.2022  -4.1439   8.6748   72.589   32.278   69.959   32.692 2.629906 45.94157 
1 1 1   21   37    0 o  198.988   34.093   34.945   9.4690   34.945   9.4690   34.945   9.4690  198.988   34.093  198.988   34.093 0.000000 0.000000 
1 1 1   21   37    1 o  421.854   13.812  139.924   8.9186  138.633   12.491  141.268   12.738  414.233   19.701  417.911   19.914 -3.678436 28.01220 
1 1 1   21   37    2 o  222.687   20.746   40.579   6.9900   29.101   9.4707   54.314   10.360  177.087   36.163  252.248   27.265 -75.16032 45.28962 
1 1 1   21   37    3 o  107.439   34.146   10.533   6.3140   6.5420   8.3768   15.783   9.6079   94.919   38.000  126.234   42.259 -31.31511 56.83123 
1 1 1   21   37    4 o   90.172   34.245   6.3469   6.5202   12.235   8.7706  -0.9279   9.7487  113.882   40.281   81.340   36.747 32.54222 54.52422 
1 1 1   21   37    5 o  111.502   34.803   11.508   6.5873   10.795   8.8464   12.395   9.8688  108.824   40.186  114.523   42.414 -5.699944 58.42771 
1 1 1   21   37    6 o   69.458   30.700  -0.1503   6.4204   1.1492   8.7179  -1.6903   9.4909   81.754   35.971   78.842   35.871 2.911804 50.79972 
1 1 1   21   37    7 o  210.463   33.043   39.952   10.294   0.0000   0.0000   39.952   10.294  ?   ?   210.463   33.043 0.000000 33.04329 
1 1 1   21   37    8 o  359.110   22.185  106.445   12.135   0.0000   0.0000  106.445   12.135  ?   ?   359.110   22.185 0.000000 22.18546 
1 1 1   21   37    9 o   68.669   32.629  -7.4540   9.3173   0.0000   0.0000  -7.4540   9.3173  ?   ?    68.669   32.629 0.000000 32.62876 
1 1 1   21   37   10 o  137.142   42.648   19.350   9.9021   0.0000   0.0000   19.350   9.9021  ?   ?   137.142   42.648 0.000000 42.64772 
1 1 1   21   37   11 o   99.078   40.258   7.6582   9.5550   0.0000   0.0000   7.6582   9.5550  ?   ?    99.078   40.258 0.000000 40.25814 
1 1 1   21   37   12 o  136.195   35.744   17.780   7.5452   14.249   11.933   20.131   9.7393  118.398   45.975  139.656   42.084 -21.25864 62.32742 
1 1 1   21   37   13 o  140.048   34.337   18.544   7.3039   19.011   11.062   18.183   9.7252  132.621   45.339  132.115   42.419 0.5053253 62.08841 
1 1 1   21   37   14 o  176.919   22.540   26.341   5.9651   29.022   7.4502   21.553   9.9566  181.920   27.624  143.541   42.389 38.37968 50.59581 
1 1 1   21   37   15 o  129.281   30.558   15.339   5.9514   6.8229   7.2792   32.508   10.336   91.706   35.825  182.260   38.268 -90.55348 52.41985 
1 1 1   21   37   16 o   92.256   32.106   7.5919   5.5571   5.6378   6.7171   11.830   9.8928   86.401   34.209  109.737   42.061 -23.33584 54.21609 
1 1 1   21   38    0 o  133.424   47.685   20.084   8.8916   20.084   8.8916   20.084   8.8916  133.424   47.685  133.424   47.685 0.000000 0.000000 
1 1 1   21   38    1 o   93.785   33.615   7.6394   6.1273   8.9608   8.4902   6.2032   8.8517  101.333   38.935   93.779   38.499 7.553749 54.75505 
1 1 1   21   38    2 o  208.732   21.435   36.114   6.7511   28.282   9.0800   45.797   10.095  173.592   35.374  227.809   29.655 -54.21651 46.15992 
1 1 1   21   38    3 o  212.289   22.252   37.572   7.1228   36.536   9.5992   38.842   10.625  200.752   32.338  204.196   35.271 -3.444275 47.85158 
1 1 1   21   38    4 o  142.674   27.674   17.933   5.8255   17.215   7.0091   19.538   10.476  135.398   33.898  135.967   44.066 -0.5689392 55.59554 
1 1 1   21   38    5 o   58.441   26.910  -2.7155   5.5579  -4.4662   6.7580   0.9430   9.7697   61.378   28.737   83.831   37.413 -22.45327 47.17590 
1 1 1   21   38    6 o  219.788   18.681   39.348   6.2251   39.102   7.5760   39.858   10.922  215.553   23.335  205.789   35.985 9.763535 42.88861 
1 1 1   21   38    7 o  197.626   19.511   32.048   5.8249   33.063   6.9644   29.684   10.626  197.904   23.447  171.702   40.999 26.20224 47.23027 
1 1 1   21   38    8 o  219.920   34.130   44.762   11.116   0.0000   0.0000   44.762   11.116  ?   ?   219.920   34.130 0.000000 34.13024 
1 1 1   21   38    9 o  133.765   27.443   15.857   5.4305   14.540   6.4148   19.190   10.202  124.247   33.126  134.313   43.480 -10.06538 54.66090 
1 1 1   21   38   10 o  178.792   21.598   26.730   5.7907   27.669   7.0070   24.705   10.284  178.348   26.471  153.920   42.332 24.42804 49.92700 
1 1 1   21   38   11 o  126.481   28.941   14.467   5.4817   11.616   6.4648   21.760   10.340  110.309   34.485  142.641   43.448 -32.33193 55.47063 
1 1 1   22    0    0 o  932.154   13.990  665.870   19.951  665.870   19.951  665.870   19.951  932.154   13.990  932.154   13.990 0.000000 0.000000 
1 1 1   22    0    1 o  354.438   7.8511   96.324   4.2546   96.324   4.2546   96.324   4.2546  354.438   7.8511  354.438   7.8511 0.000000 0.000000 
1 1 1   22    0    2 o   49.173   25.147   2.7196   2.3935   2.7196   2.3935   2.7196   2.3935   49.173   25.147   49.173   25.147 0.000000 0.000000 
1 1 1   22    0    3 o  725.310   12.395  403.381   13.752  403.381   13.752  403.381   13.752  725.310   12.395  725.310   12.395 0.000000 0.000000 
1 1 1   22    0    4 o  174.953   17.062   24.131   4.4692   24.131   4.4692   24.131   4.4692  174.953   17.062  174.953   17.062 0.000000 0.000000 
1 1 1   22    0    5 o  233.014   14.564   42.098   5.1479   42.098   5.1479   42.098   5.1479  233.014   14.564  233.014   14.564 0.000000 0.000000 
1 1 1   22    0    6 o  458.449   7.8553  161.062   5.5085  161.062   5.5085  161.062   5.5085  458.449   7.8553  458.449   7.8553 0.000000 0.000000 
1 1 1   22    0    7 o  610.725   8.2696  285.750   7.7272  285.750   7.7272  285.750   7.7272  610.725   8.2696  610.725   8.2696 0.000000 0.000000 
1 1 1   22    0    9 o   30.867   20.622  -0.9347   2.6768  -0.9347   2.6768  -0.9347   2.6768   30.867   20.622   30.867   20.622 0.000000 0.000000 
1 1 1   22    0   10 o  251.449   9.8268   48.647   3.7690   48.647   3.7690   48.647   3.7690  251.449   9.8268  251.449   9.8268 0.000000 0.000000 
1 1 1   22    0   11 o   59.030   32.143   3.7825   4.1105   3.7825   4.1105   3.7825   4.1105   59.030   32.143   59.030   32.143 0.000000 0.000000 
1 1 1   22    0   12 o  480.797   8.6105  177.199   6.3320  177.199   6.3320  177.199   6.3320  480.797   8.6105  480.797   8.6105 0.000000 0.000000 
1 1 1   22    0   13 o  260.443   11.040   52.248   4.3829   52.248   4.3829   52.248   4.3829  260.443   11.040  260.443   11.040 0.000000 0.000000 
1 1 1   22    0   14 o  337.980   9.8632   87.727   5.0926   87.727   5.0926   87.727   5.0926  337.980   9.8632  337.980   9.8632 0.000000 0.000000 
1 1 1   22    0   15 o  490.733   13.247  185.032   9.9340  185.032   9.9340  185.032   9.9340  490.733   13.247  490.733   13.247 0.000000 0.000000 
1 1 1   22    0   16 o  603.104   13.531  279.336   12.476  279.336   12.476  279.336   12.476  603.104   13.531  603.104   13.531 0.000000 0.000000 
1 1 1   22    0   17 o  232.385   14.226   41.885   5.0167   41.885   5.0167   41.885   5.0167  232.385   14.226  232.385   14.226 0.000000 0.000000 
1 1 1   22    0   18 o   46.818   25.572   2.3684   2.6095   2.3684   2.6095   2.3684   2.6095   46.818   25.572   46.818   25.572 0.000000 0.000000 
1 1 1   22    0   19 o  120.992   13.234   11.624   2.3764   11.624   2.3764   11.624   2.3764  120.992   13.234  120.992   13.234 0.000000 0.000000 
1 1 1   22    0   20 o  247.023   7.9111   46.883   2.9842   46.883   2.9842   46.883   2.9842  247.023   7.9111  247.023   7.9111 0.000000 0.000000 
1 1 1   22    0   21 o  187.351   10.299   27.146   2.9328   27.146   2.9328   27.146   2.9328  187.351   10.299  187.351   10.299 0.000000 0.000000 
1 1 1   22    0   22 o  432.295   6.5889  143.216   4.3575  143.216   4.3575  143.216   4.3575  432.295   6.5889  432.295   6.5889 0.000000 0.000000 
1 1 1   22    0   23 o  274.449   7.8726   57.845   3.3010   57.845   3.3010   57.845   3.3010  274.449   7.8726  274.449   7.8726 0.000000 0.000000 
1 1 1   22    0   24 o  390.799   7.6815  117.136   4.5908  117.136   4.5908  117.136   4.5908  390.799   7.6815  390.799   7.6815 0.000000 0.000000 
1 1 1   22    0   25 o   82.201   29.372   6.8971   3.3739   6.8971   3.3739   6.8971   3.3739   82.201   29.372   82.201   29.372 0.000000 0.000000 
1 1 1   22    0   26 o  512.454   8.2595  201.403   6.4747  201.403   6.4747  201.403   6.4747  512.454   8.2595  512.454   8.2595 0.000000 0.000000 
1 1 1   22    0   27 o  248.561   8.8293   47.539   3.3495   47.539   3.3495   47.539   3.3495  248.561   8.8293  248.561   8.8293 0.000000 0.000000 
1 1 1   22    0   28 o  306.345   9.6970   72.188   4.5366   72.188   4.5366   72.188   4.5366  306.345   9.6970  306.345   9.6970 0.000000 0.000000 
1 1 1   22    0   29 o  106.021   20.458   9.5714   2.9635   9.5714   2.9635   9.5714   2.9635  106.021   20.458  106.021   20.458 0.000000 0.000000 
1 1 1   22    0   30 o   30.561   21.399  -3.8017   3.7500  -3.8017   3.7500  -3.8017   3.7500   30.561   21.399   30.561   21.399 0.000000 0.000000 
1 1 1   22    0   31 o  122.385   17.672   12.245   3.1098   12.245   3.1098   12.245   3.1098  122.385   17.672  122.385   17.672 0.000000 0.000000 
1 1 1   22    0   32 o  199.561   13.519   31.056   4.0859   31.056   4.0859   31.056   4.0859  199.561   13.519  199.561   13.519 0.000000 0.000000 
1 1 1   22    0   33 o   42.321   25.690   1.3379   3.0938   1.3379   3.0938   1.3379   3.0938   42.321   25.690   42.321   25.690 0.000000 0.000000 
1 1 1   22    0   34 o   29.437   20.270  -2.1624   3.0150  -2.1624   3.0150  -2.1624   3.0150   29.437   20.270   29.437   20.270 0.000000 0.000000 
1 1 1   22    0   35 o  218.719   12.190   37.143   4.0520   37.143   4.0520   37.143   4.0520  218.719   12.190  218.719   12.190 0.000000 0.000000 
1 1 1   22    0   36 o  128.317   20.602   13.707   3.7336   13.707   3.7336   13.707   3.7336  128.317   20.602  128.317   20.602 0.000000 0.000000 
1 1 1   22    0   37 o  190.579   13.709   28.428   3.9514   28.428   3.9514   28.428   3.9514  190.579   13.709  190.579   13.709 0.000000 0.000000 
1 1 1   22    0   38 o   87.623   29.397   7.7349   3.5197   7.7349   3.5197   7.7349   3.5197   87.623   29.397   87.623   29.397 0.000000 0.000000 
1 1 1   22    0   39 o   41.303   26.430   0.3691   3.7525   0.3691   3.7525   0.3691   3.7525   41.303   26.430   41.303   26.430 0.000000 0.000000 
1 1 1   22    0   40 o  129.558   22.799   14.234   4.1029   14.234   4.1029   14.234   4.1029  129.558   22.799  129.558   22.799 0.000000 0.000000 
1 1 1   22    0   41 o   38.171   26.909  -6.7804   6.2415  -6.7804   6.2415  -6.7804   6.2415   38.171   26.909   38.171   26.909 0.000000 0.000000 
1 1 1   22    0   42 o   38.819   25.434  -0.3511   3.7635  -0.3511   3.7635  -0.3511   3.7635   38.819   25.434   38.819   25.434 0.000000 0.000000 
1 1 1   22    0   43 o   51.103   30.403   2.4411   4.1639   2.4411   4.1639   2.4411   4.1639   51.103   30.403   51.103   30.403 0.000000 0.000000 
1 1 1   22    0   44 o   35.048   24.156  -2.9399   4.3069  -2.9399   4.3069  -2.9399   4.3069   35.048   24.156   35.048   24.156 0.000000 0.000000 
1 1 1   22    0   45 o   36.658   24.967  -2.1562   4.3018  -2.1562   4.3018  -2.1562   4.3018   36.658   24.967   36.658   24.967 0.000000 0.000000 
1 1 1   22    0   46 o   34.078   23.561  -3.0067   4.1742  -3.0067   4.1742  -3.0067   4.1742   34.078   23.561   34.078   23.561 0.000000 0.000000 
1 1 1   22    0   47 o   93.951   36.909   9.9253   5.0888   9.9253   5.0888   9.9253   5.0888   93.951   36.909   93.951   36.909 0.000000 0.000000 
1 1 1   22    0   48 o   73.682   36.770   6.7937   5.0484   6.7937   5.0484   6.7937   5.0484   73.682   36.770   73.682   36.770 0.000000 0.000000 
1 1 1   22    0   49 o   47.989   29.830   1.6763   4.4094   1.6763   4.4094   1.6763   4.4094   47.989   29.830   47.989   29.830 0.000000 0.000000 
1 1 1   22    0   50 f   41.560   27.477  -0.4466   4.5486  -0.4466   4.5486  -0.4466   4.5486   41.560   27.477   41.560   27.477 0.000000 0.000000 
1 1 1   22    0   51 o   52.457   31.748   2.7603   4.6972   2.7603   4.6972   2.7603   4.6972   52.457   31.748   52.457   31.748 0.000000 0.000000 
1 1 1   22    0   52 o   50.881   31.944   2.0445   5.1863   2.0445   5.1863   2.0445   5.1863   50.881   31.944   50.881   31.944 0.000000 0.000000 
1 1 1   22    0   53 o   35.321   24.521  -3.1727   4.6428  -3.1727   4.6428  -3.1727   4.6428   35.321   24.521   35.321   24.521 0.000000 0.000000 
1 1 1   22    1    0 o  198.598   9.8161   30.425   2.9673   30.425   2.9673   30.425   2.9673  198.598   9.8161  198.598   9.8161 0.000000 0.000000 
1 1 1   22    1    1 o  335.896   6.4885   86.396   3.3359   92.685   6.1049   83.718   3.9832  347.701   11.471  330.606   7.8714 17.09482 13.91202 
1 1 1   22    1    2 o  639.885   6.7407  313.551   6.6020  331.664   12.194  306.038   7.8526  657.664   12.113  632.087   8.1165 25.57690 14.58095 
1 1 1   22    1    3 o  613.768   8.3092  288.571   7.8061  290.348   11.153  286.865   10.929  615.359   11.841  611.674   11.673 3.685059 16.62784 
1 1 1   22    1    4 o  861.873   9.6041  569.211   12.670  585.871   18.389  554.154   17.481  873.818   13.749  849.885   13.438 23.93292 19.22536 
1 1 1   22    1    5 o  168.455   9.1832   21.807   2.3589   16.574   4.7499   23.521   2.7177  145.050   22.092  174.886   10.197 -29.83603 24.33173 
1 1 1   22    1    6 o  473.375   5.5600  171.570   4.0285  171.553   5.8089  171.585   5.5917  473.240   8.0195  473.300   7.7186 -0.5966187E-01 11.13051 
1 1 1   22    1    7 o  369.675   5.6985  104.637   3.2244  108.891   4.7590  101.028   4.3840  377.017   8.2469  363.165   7.8867 13.85141 11.41097 
1 1 1   22    1    8 o  313.121   6.0019   75.076   2.8765   76.418   4.1977   73.888   3.9497  315.814   8.6839  310.557   8.3090 5.257324 12.01869 
1 1 1   22    1    9 o  587.205   5.9138  264.031   5.3153  267.613   7.7291  260.816   7.3214  591.002   8.5441  583.474   8.1979 7.527771 11.84095 
1 1 1   22    1   10 o  151.913   11.156   17.792   2.5760   18.893   3.4502   16.404   3.8722  156.178   14.602  144.962   17.827 11.21533 23.04423 
1 1 1   22    1   11 o  163.458   9.7314   20.553   2.4237   21.246   3.4964   19.912   3.3628  165.769   13.908  160.456   13.827 5.312439 19.61230 
1 1 1   22    1   12 o  111.289   26.615   9.9763   4.4725   9.9763   4.4725   0.0000   0.0000  111.289   26.615  ?   ?  0.000000 26.61495 
1 1 1   22    1   13 o  375.234   6.5861  107.843   3.7827  112.889   5.4268  103.074   5.2755  383.766   9.2387  366.692   9.3992 17.07361 13.17943 
1 1 1   22    1   14 o  379.733   7.7864  110.485   4.5257  111.189   5.5447  109.080   7.8333  380.831   9.5121  376.861   13.580 3.969360 16.57992 
1 1 1   22    1   15 o  566.271   7.5121  245.690   6.5111  250.510   8.0275  236.419   11.132  571.639   9.1747  554.835   13.108 16.80389 15.99975 
1 1 1   22    1   16 o  188.962   9.0747   27.375   2.6247   30.122   4.5857   26.037   3.2008  197.310   15.304  183.837   11.432 13.47264 19.10219 
1 1 1   22    1   17 o  233.714   10.774   41.913   3.8542   49.938   6.9184   38.302   4.6411  253.901   17.917  222.826   13.674 31.07481 22.53881 
1 1 1   22    1   18 o  234.538   8.0362   42.164   2.8849   41.639   3.6680   43.016   4.6712  232.957   10.287  236.251   12.967 -3.294907 16.55222 
1 1 1   22    1   19 o  472.383   6.2893  170.949   4.5474   0.0000   0.0000  170.949   4.5474  ?   ?   472.383   6.2893 0.000000 6.289284 
1 1 1   22    1   20 o  486.835   4.8649  181.502   3.6251  175.187   5.5557  186.185   4.7839  478.070   7.5924  492.964   6.3400 -14.89453 9.891414 
1 1 1   22    1   21 o  382.790   4.7812  112.214   2.8013  111.070   3.9996  113.316   3.9248  380.701   6.8638  384.544   6.6681 -3.843597 9.569483 
1 1 1   22    1   22 o  176.484   7.5187   23.878   2.0310   24.135   2.7892   23.588   2.9633  176.995   10.341  174.879   11.129 2.116409 15.19121 
1 1 1   22    1   23 o  429.587   4.7282  141.338   3.1090  139.068   4.3996  143.603   4.3939  425.961   6.7480  432.863   6.6317 -6.901306 9.461243 
1 1 1   22    1   24 o  220.024   7.6552   37.124   2.5781   38.128   4.0318   36.430   3.3532  222.348   11.890  217.797   10.059 4.551102 15.57373 
1 1 1   22    1   25 o  249.853   6.9322   47.860   2.6511   44.636   4.8358   49.246   3.1699  240.379   13.194  253.357   8.1742 -12.97850 15.52076 
1 1 1   22    1   26 o  110.749   11.428   9.5337   1.9094   8.5897   2.7708   10.387   2.6349  103.829   18.093  114.983   15.355 -11.15440 23.73028 
1 1 1   22    1   27 o  239.408   6.9549   43.954   2.5486   43.092   3.3657   45.112   3.9020  236.861   9.2834  242.227   10.524 -5.365997 14.03357 
1 1 1   22    1   28 o  212.042   7.5747   34.498   2.4584   33.118   3.2230   36.419   3.8018  207.546   10.145  217.207   11.476 -9.660889 15.31756 
1 1 1   22    1   29 o  209.399   8.7978   33.681   2.8198   33.251   5.9504   33.806   3.2022  205.816   19.107  209.676   9.9776 -3.859665 21.55484 
1 1 1   22    1   30 o   47.498   19.433   0.6537   2.2459  -1.7277   2.8986   4.2309   3.5527   43.534   19.813   75.587   25.695 -32.05333 32.44669 
1 1 1   22    1   31 o  141.371   10.482   15.471   2.2520   18.135   3.2962   13.138   3.0840  152.435   14.294  129.189   15.934 23.24599 21.40589 
1 1 1   22    1   32 f  165.841   9.4796   21.228   2.3963   21.684   3.4669   20.811   3.3160  166.860   13.695  163.516   13.366 3.343826 19.13636 
1 1 1   22    1   33 o  195.051   9.1871   29.273   2.7428   23.458   3.5351   38.067   4.3476  173.586   13.409  221.497   12.879 -47.91087 18.59235 
1 1 1   22    1   34 o   77.248   19.363   4.8624   2.2850   8.6567   3.5382   2.1476   2.9929  102.602   23.088   60.903   23.184 41.69867 32.71927 
1 1 1   22    1   35 o   83.430   19.095   5.6746   2.3858   6.7717   3.2724   4.4298   3.4857   90.620   23.422   76.053   25.453 14.56781 34.59023 
1 1 1   22    1   36 o   74.650   21.737   4.5118   2.6345   5.4542   3.4991   3.2785   4.0030   82.204   25.317   71.773   26.927 10.43069 36.95980 
1 1 1   22    1   37 o  118.109   14.608   11.013   2.5845   8.8714   3.8755   12.728   3.4684  103.209   24.834  126.021   18.535 -22.81210 30.98818 
1 1 1   22    1   38 o   91.187   19.154   6.7875   2.5884   6.4182   3.6864   7.1466   3.6352   88.132   25.727   92.642   25.039 -4.509827 35.90043 
1 1 1   22    1   39 o   79.880   20.836   5.2549   2.5742   6.1586   3.6524   4.3630   3.6286   86.381   25.713   75.689   25.966 10.69164 36.54319 
1 1 1   22    1   40 o  142.573   13.058   15.929   2.8180   18.543   4.1051   13.600   3.8752  152.438   17.937  129.499   20.211 22.93912 27.02226 
1 1 1   22    1   41 o  140.944   17.629   15.889   3.7201   17.535   6.6771   15.148   4.4797  142.225   31.502  135.862   22.317 6.362717 38.60632 
1 1 1   22    1   42 o   86.829   23.950   6.3127   3.2864   4.3315   4.2862   9.1390   5.1192   77.212   28.055  103.056   30.384 -25.84405 41.35555 
1 1 1   22    1   43 o  176.812   11.515   24.374   3.0992   24.308   4.3733   24.440   4.3927  174.892   16.533  175.357   16.562 -0.4656372 23.40178 
1 1 1   22    1   44 f  178.623   11.595   24.906   3.1530   27.227   4.4892   22.646   4.4294  185.205   15.993  168.208   17.458 16.99742 23.67631 
1 1 1   22    1   45 o  325.772   7.8856   81.864   3.9320   87.775   5.6182   76.189   5.5050  336.118   10.920  312.897   11.494 23.22052 15.85478 
1 1 1   22    1   46 o  138.011   15.290   15.214   3.1757   14.331   4.5967   16.020   4.3926  130.126   23.961  139.065   21.316 -8.938751 32.07074 
1 1 1   22    1   47 o  204.303   11.663   32.705   3.6320   25.719   5.3099   38.848   4.9790  177.127   19.932  221.197   14.791 -44.06995 24.82040 
1 1 1   22    1   48 o   66.499   28.261   1.3283   5.0213   1.3283   5.0213   0.0000   0.0000   66.499   28.261  ?   ?  0.000000 28.26144 
1 1 1   22    1   49 o  191.791   11.674   28.932   3.4108   30.264   4.8126   27.587   4.8346  193.692   16.387  184.311   17.341 9.380417 23.85875 
1 1 1   22    1   50 o   60.303   23.704   2.2261   3.2034   8.8269   4.7263  -3.3829   4.3568   97.764   29.284   48.955   22.970 48.80849 37.21780 
1 1 1   22    1   51 o   89.274   22.986   7.0591   3.1598   10.408   4.5149   3.8437   4.4238  106.013   27.566   71.990   27.982 34.02328 39.27955 
1 1 1   22    1   52 o  170.978   13.725   23.537   3.5615   19.747   5.5160   26.246   4.6639  148.296   25.203  178.070   17.331 -29.77386 30.58714 
1 1 1   22    1   53 o  120.705   19.555   12.497   3.4892   13.122   4.8339   11.817   5.0417  118.005   27.305  110.122   29.371 7.882141 40.10205 
1 1 1   22    2    0 f  673.093   11.888  347.382   12.239  347.382   12.239  347.382   12.239  673.093   11.888  673.093   11.888 0.000000 0.000000 
1 1 1   22    2    1 o  463.774   11.295  164.891   8.0176  164.891   8.0176   0.0000   0.0000  463.774   11.295  ?   ?  0.000000 11.29451 
1 1 1   22    2    2 o  276.152   8.9404   58.426   3.7790   58.201   5.5136   58.625   5.1897  275.452   13.077  276.490   12.263 -1.038879 17.92743 
1 1 1   22    2    3 o  601.655   6.6427  277.202   6.1174  278.018   10.960  276.833   7.3727  602.141   11.891  601.172   8.0123 0.9695435 14.33891 
1 1 1   22    2    4 o  304.045   6.7566   70.793   3.1444   72.930   6.1217   70.027   3.6648  308.341   12.971  302.360   7.9187 5.980316 15.19701 
1 1 1   22    2    5 o  302.442   5.5377   70.034   2.5635   65.072   6.1209   71.090   2.8231  291.207   13.732  304.700   6.0531 -13.49338 15.00719 
1 1 1   22    2    6 o  411.900   4.7853  129.887   3.0170  141.759   5.3948  124.485   3.6392  430.176   8.1933  403.209   5.8967 26.96677 10.09460 
1 1 1   22    2    7 o  153.837   8.1789   18.181   1.9189   17.279   3.2134   18.681   2.3924  149.363   14.228  155.793   10.087 -6.430481 17.44036 
1 1 1   22    2    8 o  675.461   6.0814  349.369   6.2875  352.241   9.1868  346.838   8.6235  678.019   8.8522  672.842   8.3734 5.177734 12.18506 
1 1 1   22    2    9 o  235.637   7.8171   42.534   2.8194   41.085   3.8277   44.253   4.1686  231.487   10.803  240.224   11.337 -8.737167 15.65988 
1 1 1   22    2   10 o  194.156   9.4543   28.891   2.8096   35.755   3.7620   20.235   4.2250  215.615   11.440  161.286   17.389 54.32922 20.81494 
1 1 1   22    2   11 o  160.410   10.280   19.809   2.5108   21.332   3.7286   18.544   3.3964  165.993   14.831  154.713   14.512 11.27979 20.75006 
1 1 1   22    2   12 o  626.371   8.8220  300.678   8.4580  322.441   12.117  279.995   11.812  648.235   12.212  603.987   12.777 44.24731 17.67426 
1 1 1   22    2   13 o  141.839   14.754   15.624   3.1563   15.694   3.9462   15.501   5.2585  141.541   18.670  139.349   25.597 2.192139 31.68303 
1 1 1   22    2   14 o  242.855   7.2004   45.183   2.6765   48.918   4.7193   43.411   3.2497  252.456   12.213  237.983   8.9214 14.47354 15.12435 
1 1 1   22    2   15 o  246.302   7.3125   46.479   2.7568   36.647   4.7167   51.579   3.3975  217.917   14.219  259.413   8.5565 -41.49609 16.59497 
1 1 1   22    2   16 o  669.387   7.6123  343.352   7.7994  370.158   14.968  333.360   9.1382  693.970   14.091  659.404   9.0539 34.56635 16.74898 
1 1 1   22    2   17 o  313.625   7.1840   75.366   3.4486   76.817   8.0161   75.036   3.8203  315.383   16.665  312.895   7.9767 2.487366 18.47552 
1 1 1   22    2   18 o  413.457   9.4137  131.110   5.9574   0.0000   0.0000  131.110   5.9574  ?   ?   413.457   9.4137 0.000000 9.413653 
1 1 1   22    2   19 o  317.582   5.9281   77.258   2.8817   84.216   4.5561   72.619   3.7203  331.380   8.9824  307.791   7.8969 23.58902 11.96013 
1 1 1   22    2   20 o  153.316   8.2802   18.075   1.9359   17.889   3.0749   18.198   2.4918  151.938   13.358  153.598   10.665 -1.660034 17.09278 
1 1 1   22    2   21 o  161.678   8.1796   20.095   2.0176   21.887   3.2209   18.938   2.5884  168.259   12.598  156.665   10.861 11.59457 16.63319 
1 1 1   22    2   22 o  442.817   5.5633  150.212   3.7707  149.569   7.5265  150.427   4.3569  441.233   11.144  443.064   6.4246 -1.829987 12.86358 
1 1 1   22    2   23 o  122.648   14.714   11.757   2.7070   7.0889   5.2254   13.469   3.1649   95.945   31.124  131.146   16.105 -35.20052 35.04358 
1 1 1   22    2   24 o   81.892   14.626   5.3237   1.7661   5.8228   2.6038   4.8985   2.4034   84.947   20.302   77.995   20.029 6.951904 28.51866 
1 1 1   22    2   25 o  180.680   7.7041   25.039   2.1306   28.172   3.3513   22.913   2.7602  191.051   11.514  172.362   10.513 18.68982 15.59134 
1 1 1   22    2   26 o  103.543   13.567   8.4026   2.0984   11.050   2.8355   5.1972   3.1201  118.515   16.044   80.768   23.695 37.74698 28.61533 
1 1 1   22    2   27 o  495.999   4.8424  188.465   3.6763  194.711   5.4082  183.100   5.0125  503.879   7.0123  488.667   6.7015 15.21161 9.699575 
1 1 1   22    2   28 o  200.935   7.9621   30.988   2.4488   30.378   3.2865   31.749   3.6716  198.413   10.863  202.693   11.887 -4.279419 16.10264 
1 1 1   22    2   29 o  155.477   11.382   18.713   2.6899   14.384   4.2019   21.719   3.5013  134.130   21.169  167.141   13.810 -33.01102 25.27529 
1 1 1   22    2   30 o  251.513   7.7736   48.564   2.9926   50.683   4.4900   46.870   4.0143  256.478   11.437  246.755   10.628 9.723267 15.61335 
1 1 1   22    2   31 f  110.942   13.046   9.6352   2.1731   7.7903   3.2448   11.136   2.9262   97.709   22.200  118.635   16.567 -20.92603 27.70056 
1 1 1   22    2   32 o   75.252   18.596   4.5944   2.1296  -0.4467   3.1445   8.8657   2.8945   50.158   21.847  105.069   18.683 -54.91082 28.74580 
1 1 1   22    2   33 o   36.656   16.911  -1.6961   2.2098  -8.7725   3.3980   3.4902   2.9090   33.182   16.550   68.539   23.251 -35.35755 28.53998 
1 1 1   22    2   34 o  157.222   10.025   19.123   2.4000   20.262   3.5564   18.171   3.2521  160.911   14.598  152.433   14.098 8.477783 20.29473 
1 1 1   22    2   35 o  195.887   8.5642   29.521   2.5678   25.638   3.7225   33.046   3.5467  181.362   13.507  206.560   11.260 -25.19803 17.58463 
1 1 1   22    2   36 o  208.031   9.5363   33.347   3.0365   37.595   3.9798   27.428   4.6976  220.170   11.853  186.691   16.613 33.47911 20.40778 
1 1 1   22    2   37 o  137.087   12.974   14.700   2.6900   21.159   4.3225   10.618   3.4365  163.407   17.558  114.350   20.381 49.05630 26.90112 
1 1 1   22    2   38 o  168.933   10.940   22.149   2.8135   22.273   4.1584   22.044   3.8208  167.976   16.382  167.496   15.064 0.4794312 22.25561 
1 1 1   22    2   39 o   67.663   21.768   3.5907   2.5600   5.6845   3.7945   1.8413   3.4683   83.699   26.457   61.816   24.548 21.88335 36.09112 
1 1 1   22    2   40 o   37.438   17.880  -3.6865   2.8720  -4.6203   4.2075  -2.8719   3.9298   46.563   22.067   48.507   22.439 -1.944546 31.47161 
1 1 1   22    2   41 o  124.688   18.542   12.541   3.4311   14.276   7.1916   12.030   3.9040  126.634   35.612  120.908   21.902 5.726112 41.80820 
1 1 1   22    2   42 o  226.382   11.824   39.899   4.0828   35.729   5.9561   43.596   5.6076  211.550   18.582  235.185   15.667 -23.63495 24.30574 
1 1 1   22    2   43 o   72.008   23.438   4.1343   2.9624   6.2386   4.6966   2.7440   3.8175   87.546   29.544   67.493   26.061 20.05366 39.39561 
1 1 1   22    2   44 o  105.663   19.194   9.1587   2.9899   8.5225   4.3169   9.7451   4.1449   99.463   27.455  106.777   25.676 -7.314865 37.59097 
1 1 1   22    2   45 o  115.155   17.383   10.746   2.9685   8.5943   4.3866   12.564   4.0321   99.493   27.755  122.708   22.289 -23.21489 35.59649 
1 1 1   22    2   46 o  156.384   14.160   19.383   3.3527   23.942   5.2058   16.152   4.3826  171.044   20.279  139.704   21.158 31.34061 29.30692 
1 1 1   22    2   47 o  150.655   14.999   18.126   3.4127   20.043   4.7070   16.001   4.9550  155.990   20.188  136.854   24.557 19.13628 31.79007 
1 1 1   22    2   48 f  162.604   15.261   21.175   3.7537   17.926   5.3671   24.287   5.2518  144.137   25.248  171.371   20.424 -27.23459 32.47449 
1 1 1   22    2   49 o   58.308   23.092   1.9114   3.0612   4.7309   4.6187  -0.2974   4.0880   77.801   28.976   55.742   24.574 22.05875 37.99323 
1 1 1   22    2   50 o  134.384   15.785   14.673   3.1850   9.2814   4.3877   20.679   4.6306  100.834   27.616  157.499   19.635 -56.66463 33.88467 
1 1 1   22    2   51 o  138.730   15.295   15.657   3.1938   10.023   4.4173   21.828   4.6232  104.088   27.364  161.583   19.060 -57.49536 33.34766 
1 1 1   22    2   52 o   69.189   25.452   3.8870   3.5432   4.7709   5.2338   3.1392   4.8141   77.118   30.304   69.719   28.480 7.398674 41.58634 
1 1 1   22    2   53 o  139.167   15.930   15.986   3.3321   16.843   4.3525   14.774   5.1793  139.306   21.071  124.992   27.791 14.31470 34.87607 
1 1 1   22    3    1 o  533.881   7.9876  218.327   6.5273  232.278   9.7198  206.867   8.8092  550.414   11.537  519.471   11.079 30.94281 15.99533 
1 1 1   22    3    2 o  331.716   8.2977   84.291   4.2130   87.791   6.4745   81.721   5.5483  338.330   12.502  326.497   11.102 11.83276 16.72045 
1 1 1   22    3    3 f  252.810   9.2227   48.971   3.5688   45.778   5.8088   50.907   4.5231  243.661   15.658  257.676   11.468 -14.01549 19.40851 
1 1 1   22    3    4 o  488.790   6.4564  182.953   4.8304  196.137   9.4322  178.265   5.6239  505.717   12.185  482.433   7.6161 23.28488 14.36956 
1 1 1   22    3    5 o  478.630   5.3483  175.395   3.9182  170.914   8.9654  176.453   4.3562  472.054   12.408  480.048   5.9287 -7.994049 13.75177 
1 1 1   22    3    6 o  358.108   5.3052   98.185   2.9079   93.626   7.2881   99.048   3.1713  349.294   13.632  359.665   5.7606 -10.37149 14.79902 
1 1 1   22    3    7 o  211.653   6.0568   34.303   1.9622   38.465   6.0734   33.817   2.0734  222.940   17.950  210.143   6.4460 12.79689 19.07239 
1 1 1   22    3    8 o  351.940   5.2840   94.834   2.8465  102.846   5.1618   91.333   3.4121  366.344   9.2054  345.346   6.4551 20.99863 11.24314 
1 1 1   22    3    9 o  218.488   6.1439   36.556   2.0547   31.501   4.0217   38.341   2.3902  202.187   13.065  223.741   6.9793 -21.55338 14.81248 
1 1 1   22    3   10 o   80.058   25.965   4.8037   3.6369   3.4597   6.0575   5.5613   4.5478   84.068   32.725   87.079   29.074 -3.010315 43.77456 
1 1 1   22    3   11 o  101.293   17.537   8.1176   2.6204   14.484   6.0428   6.6430   2.9081  133.939   30.197   91.010   21.260 42.92914 36.93022 
1 1 1   22    3   12 o  234.011   7.6047   41.953   2.7239   40.564   6.9252   42.208   2.9627  228.545   19.998  234.698   8.2471 -6.152466 21.63183 
1 1 1   22    3   13 o   50.550   20.088   1.0250   2.3239   0.0000   0.0000   1.0250   2.3239  ?   ?    50.550   20.088 0.000000 20.08763 
1 1 1   22    3   14 o  329.939   6.5536   83.383   3.3096   82.257   8.3126   83.595   3.6079  326.524   16.688  330.332   7.1357 -3.807465 18.14955 
1 1 1   22    3   15 o  307.457   6.1961   72.403   2.9159   75.103   5.3068   71.235   3.4899  312.863   11.082  304.912   7.4777 7.950958 13.36874 
1 1 1   22    3   16 o  151.365   9.8434   17.646   2.2682   17.501   4.4704   17.696   2.6321  149.258   20.077  151.414   11.442 -2.155823 23.10815 
1 1 1   22    3   17 o  375.313   5.8941  107.889   3.3860  105.610   6.0968  108.905   4.0716  370.980   10.737  377.010   7.0557 -6.030426 12.84781 
1 1 1   22    3   18 o  246.256   8.5077   46.493   3.2068   51.389   5.5566   44.048   3.9267  258.116   14.118  239.568   10.709 18.54811 17.71971 
1 1 1   22    3   19 o  399.167   4.7857  122.014   2.9240  122.363   4.6673  121.788   3.7514  399.555   7.6316  398.720   6.1468 0.8346558 9.799265 
1 1 1   22    3   20 o  329.771   5.4063   83.294   2.7289   77.832   4.6765   86.115   3.3603  318.498   9.5928  335.243   6.5486 -16.74591 11.61488 
1 1 1   22    3   21 o  424.639   6.7161  138.184   4.3652  144.280   10.488  136.906   4.8008  432.595   15.840  422.609   7.4217 9.985657 17.49219 
1 1 1   22    3   22 o  265.796   6.6387   54.142   2.7009   49.839   6.0741   55.203   3.0153  253.734   15.717  268.345   7.3413 -14.61082 17.34731 
1 1 1   22    3   23 o  363.524   5.5862  101.241   3.1083   98.302   4.7019  103.522   4.1425  357.957   8.5816  367.457   7.3653 -9.499908 11.30892 
1 1 1   22    3   24 o  335.895   6.7320   86.485   3.4611   85.333   4.6122   87.970   5.2365  333.438   9.0371  338.429   10.109 -4.991058 13.55951 
1 1 1   22    3   25 o  139.929   11.543   15.161   2.4502   18.393   4.1251   13.399   3.0457  153.098   17.943  130.837   15.510 22.26164 23.71779 
1 1 1   22    3   26 o  757.164   5.3857  439.260   6.2417  455.176   10.106  429.444   7.9364  770.077   8.5735  748.373   6.9284 21.70465 11.02308 
1 1 1   22    3   27 o   89.023   14.553   6.2747   1.9145   4.5637   2.8178   7.7418   2.6093   75.866   22.586   98.421   17.983 -22.55484 28.87064 
1 1 1   22    3   28 o  223.205   7.4028   38.223   2.5291   41.328   4.4272   36.719   3.0814  231.219   12.556  218.621   9.2085 12.59827 15.57113 
1 1 1   22    3   29 o  108.466   12.705   9.1954   2.0693   8.6017   3.1122   9.6658   2.7705  103.260   20.414  110.395   16.937 -7.135498 26.52542 
1 1 1   22    3   30 o   70.697   21.525   3.9428   2.5383   0.8606   3.1862   9.2965   4.1992   56.026   23.060  106.311   26.018 -50.28470 34.76632 
1 1 1   22    3   31 o  454.659   5.5818  158.477   3.8844  163.034   6.3352  155.732   4.9172  460.513   8.9877  450.457   7.1317 10.05585 11.47346 
1 1 1   22    3   32 o  260.939   6.7947   52.254   2.7138   52.026   4.3191   52.403   3.4885  259.811   10.861  261.076   8.7297 -1.264740 13.93426 
1 1 1   22    3   33 f  272.453   6.6456   56.972   2.7714   59.145   4.1736   55.258   3.7065  277.132   9.8390  268.000   9.0357 9.131592 13.35855 
1 1 1   22    3   34 o  338.902   5.8866   88.109   3.0536   90.077   4.5633   86.513   4.1091  342.182   8.7126  335.481   8.0023 6.700989 11.82990 
1 1 1   22    3   35 o  118.622   13.878   11.061   2.4722   10.415   3.5090   11.697   3.4835  113.203   21.025  120.565   19.546 -7.361374 28.70701 
1 1 1   22    3   36 o  256.759   7.3252   50.658   2.8788   53.182   4.3457   48.685   3.8430  262.451   10.818  251.273   9.9922 11.17865 14.72643 
1 1 1   22    3   37 o   79.647   21.589   5.2048   2.6978   7.2606   3.9154   3.3466   3.7224   93.433   26.277   70.732   26.077 22.70185 37.02052 
1 1 1   22    3   38 o  178.239   10.278   24.609   2.7920   28.107   4.2517   21.957   3.7021  189.362   14.786  167.281   14.605 22.08038 20.78324 
1 1 1   22    3   39 o   50.049   21.188   0.2917   2.8041   0.7101   4.0644  -0.0884   3.8738   60.772   25.605   56.587   24.447 4.184250 35.40183 
1 1 1   22    3   40 o  225.593   9.3479   39.269   3.2278   37.040   5.1630   40.699   4.1357  216.983   15.651  228.806   11.850 -11.82259 19.63049 
1 1 1   22    3   41 f   81.047   24.625   5.4024   3.3247   9.9356   7.3363   4.2307   3.7297  108.137   36.923   74.988   26.291 33.14879 45.32640 
1 1 1   22    3   42 o   94.592   22.979   7.4968   3.2941   9.6072   4.4646   4.9751   4.8803  105.985   27.341   82.104   29.921 23.88117 40.53107 
1 1 1   22    3   43 o   60.155   23.238   2.0911   3.0363   4.5995   4.9529   0.5807   3.8432   80.436   29.996   58.431   24.774 22.00507 38.90377 
1 1 1   22    3   44 o  144.287   14.617   16.493   3.1836   18.570   5.1593   15.217   4.0456  149.564   23.296  136.570   19.942 12.99408 30.66515 
1 1 1   22    3   45 o  262.610   9.2842   53.367   3.7319   58.538   5.8845   49.888   4.8266  272.727   14.145  252.788   12.474 19.93886 18.85988 
1 1 1   22    3   46 o   79.173   23.603   5.2826   3.0759   6.3541   4.4314   4.2864   4.2728   86.701   28.688   75.889   27.945 10.81203 40.04915 
1 1 1   22    3   47 o   83.714   24.178   6.0130   3.2715   10.932   4.4437   0.1911   4.8342  111.700   26.407   62.168   27.082 49.53144 37.82589 
1 1 1   22    3   48 o   71.127   25.281   3.9602   3.4588   0.0252   4.7942   8.2315   4.9949   61.169   26.800   95.726   30.365 -34.55648 40.49993 
1 1 1   22    3   49 o   40.894   19.208  -2.7423   3.0610   0.5878   4.3403  -6.0376   4.3175   60.121   25.926   43.653   21.120 16.46748 33.43928 
1 1 1   22    3   50 o  132.056   16.002   14.205   3.1684   12.838   4.5513   15.490   4.4135  120.148   25.536  134.458   22.222 -14.30964 33.85071 
1 1 1   22    3   51 o  118.260   19.091   11.801   3.3380   11.079   4.4747   12.706   5.0122  109.808   26.848  116.727   28.338 -6.919037 39.03654 
1 1 1   22    3   52 o  176.937   13.891   25.240   3.7319   20.209   5.4253   29.758   5.1414  150.658   24.358  189.078   17.982 -38.42027 30.27641 
1 1 1   22    3   53 o   66.910   24.557   3.6585   3.2957   1.5896   4.2718   6.7007   5.1802   61.386   26.077   84.302   30.810 -22.91664 40.36469 
1 1 1   22    4    0 o  379.041   12.048  110.398   6.9738  110.398   6.9738  110.398   6.9738  379.041   12.048  379.041   12.048 0.000000 0.000000 
1 1 1   22    4    1 o  666.379   11.829  340.511   12.066   0.0000   0.0000  340.511   12.066  ?   ?   666.379   11.829 0.000000 11.82934 
1 1 1   22    4    2 o  463.100   8.0814  164.281   5.7284  167.997   8.6750  161.409   7.6280  468.040   12.109  458.863   10.861 9.176605 16.26612 
1 1 1   22    4    3 o  603.708   8.2232  279.197   7.5987  277.736   11.382  280.371   10.207  601.763   12.357  604.745   11.027 -2.981506 16.56124 
1 1 1   22    4    4 o  349.781   8.2081   93.725   4.3945   88.121   7.2784   96.939   5.5127  338.847   14.033  355.639   10.127 -16.79193 17.30588 
1 1 1   22    4    5 o  238.169   6.3971   43.438   2.3321   45.044   6.5531   43.205   2.4954  241.387   17.863  237.519   6.8640 3.868301 19.13650 
1 1 1   22    4    6 o  467.167   6.4526  167.130   4.6140  177.503   9.4151  163.852   5.2932  481.007   12.788  462.513   7.4769 18.49420 14.81343 
1 1 1   22    4    7 o  304.489   9.6298   71.056   4.4881   71.056   4.4881   0.0000   0.0000  304.489   9.6298  ?   ?  0.000000 9.629834 
1 1 1   22    4    8 o  496.251   7.0177  188.617   5.3305  195.353   6.6838  176.844   8.8359  504.933   8.6480  480.153   12.023 24.78030 14.80991 
1 1 1   22    4    9 f  185.973   8.5643   26.501   2.4379   24.861   3.8550   27.594   3.1471  179.387   14.155  189.387   10.902 -10.00024 17.86698 
1 1 1   22    4   10 o  217.544   8.0330   36.258   2.6748   36.754   4.1297   35.901   3.5107  218.510   12.399  216.380   10.600 2.130402 16.31219 
1 1 1   22    4   11 o  202.021   8.5150   31.275   2.6330   32.747   4.1643   30.294   3.3985  206.111   13.271  198.419   11.236 7.692520 17.38861 
1 1 1   22    4   12 o  355.887   6.4951   97.007   3.5381  100.946   5.3811   94.007   4.6958  362.867   9.6885  350.230   8.7597 12.63779 13.06137 
1 1 1   22    4   13 o  523.769   6.9820  210.149   5.5974  217.125   9.8417  206.813   6.8053  531.892   12.089  519.472   8.5588 12.41962 14.81175 
1 1 1   22    4   14 o  395.162   5.2672  119.573   3.1859  118.046   5.9922  120.175   3.7615  392.345   9.9782  396.112   6.2041 -3.766663 11.74965 
1 1 1   22    4   15 o  286.784   5.8974   62.990   2.5887   51.454   5.0848   67.027   3.0077  258.837   12.834  295.801   6.6430 -36.96481 14.45169 
1 1 1   22    4   16 o  505.269   5.4625  195.514   4.2246  210.725   7.8750  189.367   5.0058  524.166   9.8155  497.189   6.5778 26.97733 11.81575 
1 1 1   22    4   17 o  353.690   4.9311   95.794   2.6696   99.730   3.9672   92.536   3.6089  360.767   7.1844  347.535   6.7842 13.23138 9.881341 
1 1 1   22    4   18 o  593.125   5.5054  269.440   4.9981  273.094   6.6592  264.726   7.5638  596.961   7.2879  587.615   8.4097 9.346008 11.12817 
1 1 1   22    4   19 o  720.364   6.7779  397.626   7.4734  413.408   11.593  386.404   9.7759  733.930   10.320  709.795   8.9981 24.13477 13.69165 
1 1 1   22    4   20 o  160.575   8.6133   19.831   2.1093   24.209   5.4298   19.053   2.2890  175.649   20.587  157.294   9.5528 18.35579 22.69513 
1 1 1   22    4   21 o  259.710   6.6282   51.688   2.6348   50.504   4.2356   52.435   3.3652  256.439   10.791  261.476   8.4084 -5.037201 13.68006 
1 1 1   22    4   22 o  434.132   5.5258  144.379   3.6718  143.132   6.0393  145.111   4.6248  431.888   9.1358  435.107   6.9443 -3.219269 11.47544 
1 1 1   22    4   23 o  211.989   7.4234   34.457   2.4087   33.783   3.7296   34.939   3.1549  209.297   11.689  213.330   9.6621 -4.032211 15.16521 
1 1 1   22    4   24 o  133.353   10.040   13.735   2.0344   14.176   3.5384   13.517   2.4864  134.243   17.648  131.958   12.458 2.284058 21.60223 
1 1 1   22    4   25 o  191.190   8.8783   28.059   2.5981   28.401   4.3804   27.873   3.2271  191.236   15.088  190.071   11.141 1.164749 18.75518 
1 1 1   22    4   26 o  546.111   5.1532  228.490   4.3075  239.863   7.2648  222.324   5.3493  559.021   8.4903  538.522   6.4897 20.49890 10.68653 
1 1 1   22    4   27 o  427.172   5.3484  139.824   3.4970  145.428   6.0579  137.023   4.2826  435.140   9.0954  422.733   6.6187 12.40710 11.24870 
1 1 1   22    4   28 o  166.478   9.0498   21.353   2.2974   21.497   4.3833   21.298   2.6976  165.538   17.568  166.049   10.670 -0.5114594 20.55440 
1 1 1   22    4   29 o  177.721   8.9736   24.329   2.4332   27.600   4.6527   23.098   2.8546  187.992   16.332  172.894   10.842 15.09798 19.60280 
1 1 1   22    4   30 o  260.997   7.6789   52.296   3.0677   47.738   5.0283   54.998   3.8717  248.253   13.281  267.440   9.4580 -19.18719 16.30457 
1 1 1   22    4   31 o   47.211   19.926   0.2209   2.4683  -2.2738   3.9609   1.8049   3.1562   50.859   23.152   60.277   23.578 -9.418789 33.04450 
1 1 1   22    4   32 o  334.409   6.2658   85.789   3.2072   92.521   4.6955   79.902   4.3910  346.872   8.8439  322.341   8.8998 24.53049 12.54676 
1 1 1   22    4   33 o  108.262   13.325   9.2054   2.1614   7.7126   3.4250   10.193   2.7862   96.813   23.377  113.273   16.559 -16.46043 28.64813 
1 1 1   22    4   34 o  152.744   10.141   18.060   2.3575   15.290   3.6194   20.101   3.1070  138.880   17.409  160.677   12.738 -21.79715 21.57134 
1 1 1   22    4   35 o  108.217   15.428   9.2902   2.4831   9.9396   3.4995   8.6317   3.5241  110.392   21.484  102.346   23.050 8.046097 31.50965 
1 1 1   22    4   36 o  305.386   6.6515   71.615   3.1091   75.237   4.7705   68.940   4.0994  312.358   9.9780  299.220   8.9507 13.13770 13.40431 
1 1 1   22    4   37 o  251.832   8.8349   48.842   3.4055   54.585   5.1167   44.275   4.5630  265.367   12.597  238.697   12.533 26.67001 17.76975 
1 1 1   22    4   38 o  117.611   15.733   10.987   2.7613   15.503   4.0239   6.9674   3.7960  138.895   19.462   91.497   25.923 47.39824 32.41575 
1 1 1   22    4   39 o  141.853   12.903   15.752   2.7708   19.584   4.4162   13.265   3.5584  156.488   18.814  128.458   18.642 28.03014 26.48609 
1 1 1   22    4   40 o  127.951   17.045   13.080   3.2551   14.312   7.4626   12.791   3.6173  126.869   36.481  125.739   19.421 1.130508 41.32830 
1 1 1   22    4   41 o   58.200   22.605   1.8604   2.8852   2.4915   4.4200   1.3917   3.8086   69.561   27.684   61.644   25.274 7.917549 37.48565 
1 1 1   22    4   42 o   72.208   23.987   4.0988   3.0970  -0.9112   4.1459   10.424   4.6583   55.464   24.584  110.270   27.650 -54.80623 36.99882 
1 1 1   22    4   43 o  133.319   15.802   14.160   3.1618   11.342   4.9798   16.064   4.0925  114.516   28.519  140.742   19.523 -26.22636 34.56107 
1 1 1   22    4   44 o  102.481   20.329   8.6959   3.0761   6.2554   4.7866   10.413   4.0151   87.414   29.824  110.864   24.329 -23.45069 38.48877 
1 1 1   22    4   45 o  143.629   14.846   16.398   3.2166   16.598   5.0282   16.260   4.1849  140.398   24.277  140.974   19.952 -0.5762482 31.42338 
1 1 1   22    4   46 o  165.334   12.681   21.515   3.1846   22.476   4.6032   20.632   4.4103  166.566   18.360  159.494   18.403 7.072449 25.99593 
1 1 1   22    4   47 o  225.547   10.630   39.621   3.6696   41.973   4.8743   36.544   5.5753  230.355   13.889  213.015   17.248 17.33989 22.14484 
1 1 1   22    4   48 o  132.442   16.876   14.256   3.3434   14.464   4.9840   14.085   4.5083  128.499   26.228  128.116   23.868 0.3829956 35.46226 
1 1 1   22    4   49 o   49.616   22.003  -0.5656   3.3252  -1.7623   4.1777   1.5030   5.4925   51.964   23.703   68.742   29.394 -16.77746 37.76039 
1 1 1   22    4   50 o   43.273   19.821  -1.5489   2.9611  -5.2059   4.1819   2.1284   4.1935   43.934   21.138   64.454   26.484 -20.51991 33.88522 
1 1 1   22    4   51 o   81.269   25.838   5.9244   3.6149   3.3267   5.1293   8.4879   5.0954   71.993   29.402   94.345   30.741 -22.35200 42.53783 
1 1 1   22    4   52 o  125.829   16.410   13.104   3.0853   14.072   4.3344   12.111   4.3926  125.942   23.344  115.022   25.608 10.92069 34.65197 
1 1 1   22    4   53 o  176.326   14.398   25.263   3.8519   20.918   5.4383   29.637   5.4567  152.815   24.044  186.856   19.360 -34.04083 30.86966 
1 1 1   22    5    0 o  302.439   14.232   70.568   6.5553   70.568   6.5553   70.568   6.5553  302.439   14.232  302.439   14.232 0.000000 0.000000 
1 1 1   22    5    1 o  498.059   11.488  190.208   8.7580   0.0000   0.0000  190.208   8.7580  ?   ?   498.059   11.488 0.000000 11.48825 
1 1 1   22    5    2 o  390.147   8.7137  116.621   5.2035  115.480   8.0019  117.457   6.8496  387.938   13.476  391.388   11.434 -3.449982 17.67294 
1 1 1   22    5    3 o  142.351   15.824   15.755   3.3895   24.517   6.0444   11.736   4.0938  176.872   22.862  121.423   22.866 55.44936 32.33444 
1 1 1   22    5    4 o  372.094   8.1468  106.065   4.6399  106.633   8.0872  105.786   5.6651  372.716   14.176  371.513   9.9623 1.202972 17.32638 
1 1 1   22    5    5 o  428.462   13.632  140.891   8.9401  140.891   8.9401   0.0000   0.0000  428.462   13.632  ?   ?  0.000000 13.63203 
1 1 1   22    5    6 f  275.142   17.391   58.437   7.2863   58.437   7.2863   0.0000   0.0000  275.142   17.391  ?   ?  0.000000 17.39076 
1 1 1   22    5    7 o  422.115   6.0650  136.444   3.9186  140.057   5.8877  133.571   5.2503  427.517   8.9975  417.545   8.2151 9.971680 12.18373 
1 1 1   22    5    8 o  192.711   8.3153   28.454   2.4528   26.808   3.9983   29.447   3.1058  186.328   14.124  195.707   10.406 -9.378983 17.54333 
1 1 1   22    5    9 o  106.260   13.805   8.8135   2.1923   11.365   3.6398   7.3611   2.7463  119.773   20.597   96.076   19.344 23.69715 28.25655 
1 1 1   22    5   10 o  403.183   6.2738  124.492   3.8717  144.023   6.1682  111.795   4.9735  433.478   9.2966  381.958   8.5071 51.51968 12.60149 
1 1 1   22    5   11 o  266.621   7.2827   54.456   2.9721   55.597   4.7267   53.711   3.8222  269.206   11.471  264.702   9.4338 4.503967 14.85193 
1 1 1   22    5   12 o  642.330   6.4410  316.008   6.3326  345.368   9.8359  295.222   8.2760  671.186   9.5741  620.642   8.7118 50.54382 12.94449 
1 1 1   22    5   13 o  162.504   11.008   20.351   2.7220   23.642   5.2664   19.152   3.1796  173.923   20.157  157.356   13.327 16.56703 24.16376 
1 1 1   22    5   14 o  122.437   13.963   11.667   2.5699   8.2885   4.2315   13.642   3.2348  101.502   26.830  132.154   16.340 -30.65258 31.41389 
1 1 1   22    5   15 o  463.105   6.5499  164.288   4.6428  179.025   7.2702  154.140   6.0333  483.144   9.8311  448.404   8.7905 34.73996 13.18803 
1 1 1   22    5   16 o  344.738   5.4498   91.016   2.8757  109.226   6.1717   85.966   3.2501  377.285   10.687  334.998   6.3384 42.28760 12.42542 
1 1 1   22    5   17 o  103.666   9.0720   8.3038   1.4250   7.1131   2.2217   9.1360   1.8574   94.860   15.861  108.503   11.352 -13.64223 19.50508 
1 1 1   22    5   18 o  293.423   6.0323   65.953   2.7092   67.893   5.8758   65.430   3.0531  297.208   12.916  292.218   6.8260 4.989746 14.60913 
1 1 1   22    5   19 o  375.071   6.5006  107.787   3.7320  106.116   6.5044  108.607   4.5566  371.705   11.433  376.391   7.9092 -4.686249 13.90173 
1 1 1   22    5   20 o  213.059   6.7629   34.787   2.2055   32.339   5.6171   35.233   2.3981  203.801   18.198  214.397   7.3075 -10.59639 19.61065 
1 1 1   22    5   21 o   87.325   14.906   6.0375   1.9209   6.5696   2.9055   5.6244   2.5602   90.244   21.366   83.558   20.233 6.685898 29.42569 
1 1 1   22    5   22 o  262.755   6.2927   52.905   2.5308   62.514   4.1186   47.076   3.2079  285.393   9.4284  247.729   8.4600 37.66417 12.66747 
1 1 1   22    5   23 o  194.419   7.3618   28.982   2.1907   32.907   4.3021   27.607   2.5455  206.250   13.705  189.679   8.7676 16.57127 16.26997 
1 1 1   22    5   24 o  174.902   7.9230   23.465   2.1211   33.183   3.9879   19.631   2.5047  207.248   12.632  159.523   10.313 47.72516 16.30722 
1 1 1   22    5   25 o  329.873   5.8320   83.388   2.9447  100.336   5.8890   77.738   3.4003  361.289   10.649  318.411   6.9768 42.87833 12.73106 
1 1 1   22    5   26 o  235.741   7.9036   42.641   2.8519   45.388   4.6146   40.944   3.6275  242.435   12.478  230.797   10.269 11.63847 16.15999 
1 1 1   22    5   27 o  147.793   9.8018   16.860   2.2047   11.293   4.1980   18.981   2.5908  117.961   24.066  156.706   10.869 -38.74529 26.40611 
1 1 1   22    5   28 o  367.840   5.7361  103.711   3.2296  110.849   5.7662  100.449   3.8984  379.704   9.9214  361.867   7.0384 17.83734 12.16438 
1 1 1   22    5   29 o  232.983   7.4697   41.658   2.6638   38.627   5.0825   42.806   3.1277  222.922   14.983  236.058   8.6565 -13.13609 17.30360 
1 1 1   22    5   30 o  143.353   11.324   15.933   2.4644   21.079   5.2556   14.482   2.7902  162.602   21.655  136.233   13.561 26.36899 25.55074 
1 1 1   22    5   31 o  333.968   6.9531   85.596   3.5543   82.685   6.1146   87.082   4.3680  327.296   12.206  336.626   8.4775 -9.330536 14.86080 
1 1 1   22    5   32 o  120.707   16.016   11.515   2.8860   2.4591   7.0695   13.327   3.1615   83.215   34.312  129.941   16.251 -46.72682 37.96582 
1 1 1   22    5   33 o  112.968   15.917   10.115   2.6759   11.971   5.3143   9.4845   3.0972  119.465   29.288  108.465   19.366 10.99999 35.11196 
1 1 1   22    5   34 o   94.556   17.039   7.1826   2.3753   8.0327   3.5185   6.4707   3.2197   98.654   23.615   88.671   23.387 9.983109 33.23569 
1 1 1   22    5   35 o  228.881   8.3640   40.298   2.9302   37.776   4.1783   42.738   4.1103  220.588   12.426  235.192   11.418 -14.60397 16.87495 
1 1 1   22    5   36 o  150.894   11.192   17.688   2.5665   20.495   3.9892   15.705   3.3525  161.201   16.396  141.070   15.797 20.13084 22.76787 
1 1 1   22    5   37 o   96.575   21.729   7.6847   3.1342   12.504   4.3350   2.4064   4.5368  123.140   23.861   70.309   28.027 52.83067 36.80866 
1 1 1   22    5   38 o  122.872   14.966   11.939   2.7566   13.947   4.4914   10.726   3.4915  130.246   23.389  114.733   20.641 15.51274 31.19425 
1 1 1   22    5   39 o  173.638   11.021   23.419   2.9140   26.981   4.8181   21.364   3.6590  184.549   17.257  164.873   14.652 19.67584 22.63816 
1 1 1   22    5   40 o   44.152   20.270  -2.0397   3.1220  -1.0291   7.4390  -2.2558   3.4395   74.154   32.897   46.220   21.241 27.93389 39.15856 
1 1 1   22    5   41 o  175.247   11.299   23.903   3.0146   23.499   4.6842   24.189   3.9387  171.541   18.114  175.256   14.822 -3.714478 23.40530 
1 1 1   22    5   42 o  196.035   11.473   29.923   3.4275   20.999   4.7808   39.361   4.9165  161.249   19.786  223.868   14.425 -62.61911 24.48563 
1 1 1   22    5   43 o  273.218   9.5417   57.720   3.9903   58.543   6.4455   57.209   5.0811  272.469   15.519  271.110   12.244 1.358826 19.76808 
1 1 1   22    5   44 o  200.111   11.234   31.213   3.4271   40.502   5.9812   26.672   4.1816  225.273   17.483  183.611   15.010 41.66251 23.04297 
1 1 1   22    5   45 o  239.538   9.2794   44.413   3.4022   48.555   5.1819   41.275   4.5106  248.474   13.678  229.379   12.900 19.09473 18.80111 
1 1 1   22    5   46 o  113.188   19.440   10.581   3.2465   9.7852   4.2964   11.639   4.9568  105.870   26.558  114.763   28.377 -8.893356 38.86661 
1 1 1   22    5   47 o  143.258   14.522   16.378   3.1403   18.555   4.3627   14.037   4.5237  150.275   19.421  128.158   23.942 22.11790 30.82834 
1 1 1   22    5   48 f  160.411   14.166   20.504   3.4424   16.539   5.1478   23.711   4.6299  138.160   25.274  170.598   18.003 -32.43837 31.03035 
1 1 1   22    5   49 o  192.057   12.368   29.138   3.6164   28.395   4.7596   30.152   5.5623  187.161   16.793  191.260   19.262 -4.099365 25.55478 
1 1 1   22    5   50 o   77.979   24.038   5.3143   3.1536   4.6939   4.1257   6.1865   4.8912   75.591   27.516   83.997   30.042 -8.406593 40.73851 
1 1 1   22    5   51 o   62.418   24.281   2.6492   3.3331  -0.1006   4.9962   4.8545   4.4743   60.378   26.864   76.386   28.505 -16.00816 39.16935 
1 1 1   22    5   52 o   49.481   21.401   0.3034   2.9755   1.3188   4.0532  -0.8834   4.3820   59.671   25.376   54.466   24.618 5.204933 35.35561 
1 1 1   22    6    0 o  325.480   13.446   81.598   6.6726   81.598   6.6726   81.598   6.6726  325.480   13.446  325.480   13.446 0.000000 0.000000 
1 1 1   22    6    1 o  441.639   8.4236  149.430   5.6942  147.291   8.5290  151.150   7.6485  438.169   12.717  443.988   11.255 -5.819183 16.98213 
1 1 1   22    6    2 o  322.280   11.241   79.641   5.5451   0.0000   0.0000   79.641   5.5451  ?   ?   322.280   11.241 0.000000 11.24101 
1 1 1   22    6    3 o  447.306   7.7547  153.267   5.3094  175.338   9.6940  143.809   6.3458  478.010   13.249  433.181   9.5707 44.82849 16.34459 
1 1 1   22    6    4 o  365.983   15.063  102.869   8.4378  102.869   8.4378   0.0000   0.0000  365.983   15.063  ?   ?  0.000000 15.06264 
1 1 1   22    6    5 o  478.555   8.4425  175.464   6.1840  181.173   10.285  172.232   7.7393  485.819   13.831  473.967   10.668 11.85126 17.46716 
1 1 1   22    6    6 o  490.641   8.5100  184.448   6.3909  198.208   10.756  176.938   7.9457  508.130   13.829  480.378   10.806 27.75128 17.55046 
1 1 1   22    6    7 o  640.931   9.2014  314.824   9.0268  314.824   9.0268   0.0000   0.0000  640.931   9.2014  ?   ?  0.000000 9.201421 
1 1 1   22    6    8 o  444.209   7.0592  151.141   4.7997  173.367   6.7337  128.186   6.8432  475.606   9.2498  408.846   10.935 66.76077 14.32271 
1 1 1   22    6    9 o  141.403   10.686   15.420   2.2958   12.982   3.9252   16.688   2.8304  128.166   20.716  146.912   12.712 -18.74634 24.30515 
1 1 1   22    6   10 o  456.844   6.2660  159.840   4.3816  174.164   6.9354  150.326   5.6525  476.653   9.5061  442.917   8.3378 33.73605 12.64452 
1 1 1   22    6   11 o   70.045   20.323   3.8594   2.3067   2.2399   4.0129   4.6586   2.8190   68.333   26.625   76.963   22.506 -8.630692 34.86312 
1 1 1   22    6   12 o  362.098   6.7192  100.434   3.7240  102.965   5.9003   98.758   4.8012  366.396   10.521  358.954   8.7385 7.442230 13.67664 
1 1 1   22    6   13 o  401.031   7.2695  123.216   4.4622  135.150   8.4239  118.562   5.2609  419.488   13.120  393.288   8.7394 26.20001 15.76400 
1 1 1   22    6   14 o  292.129   8.1613   65.405   3.6493   62.832   6.6644   66.508   4.3612  285.404   15.312  294.494   9.6752 -9.090973 18.11226 
1 1 1   22    6   15 o  279.678   7.7708   59.945   3.3265   63.267   5.3757   57.883   4.2347  287.033   12.236  274.699   10.071 12.33475 15.84777 
1 1 1   22    6   16 o  242.440   8.4849   45.060   3.1486   50.413   5.2130   41.986   3.9507  255.765   13.362  233.886   11.036 21.87895 17.33031 
1 1 1   22    6   17 o  366.861   7.1509  103.134   4.0154  109.149   6.5163   99.451   5.0985  377.046   11.291  360.096   9.2502 16.95007 14.59645 
1 1 1   22    6   18 o  282.654   5.0589   61.185   2.1887   66.236   3.4690   57.845   2.8210  293.958   7.7100  274.759   6.7078 19.19907 10.21948 
1 1 1   22    6   19 o  400.943   5.3230  123.127   3.2667  121.690   4.5611  124.640   4.6808  398.442   7.4788  403.234   7.5839 -4.791931 10.65121 
1 1 1   22    6   20 o  236.859   6.7488   42.994   2.4467   42.880   5.7419   43.019   2.7046  235.272   16.040  236.893   7.4589 -1.621048 17.68969 
1 1 1   22    6   21 f   83.555   13.672   5.5124   1.6880   7.5594   3.0124   4.5754   2.0380   96.904   20.922   75.446   17.915 21.45741 27.54453 
1 1 1   22    6   22 o  298.954   5.3590   68.464   2.4522   78.058   4.4358   64.242   2.9428  318.927   9.0867  289.515   6.6407 29.41266 11.25470 
1 1 1   22    6   23 o   90.478   13.243   6.4347   1.7798   7.0027   3.4196   6.2237   2.0843   92.983   23.897   88.457   15.982 4.526474 28.74914 
1 1 1   22    6   24 o  210.422   7.0179   33.948   2.2603   31.179   4.6268   34.816   2.5904  200.419   15.196  213.040   7.9441 -12.62114 17.14685 
1 1 1   22    6   25 o  456.066   5.6021  159.380   3.9106  176.185   8.8737  155.330   4.3565  478.413   12.118  450.157   6.3227 28.25632 13.66838 
1 1 1   22    6   26 o  174.738   10.268   23.552   2.7341   19.358   4.8608   25.493   3.3068  156.314   20.835  181.575   11.965 -25.26065 24.02643 
1 1 1   22    6   27 o  320.477   5.8746   78.724   2.8817   77.808   5.2119   79.127   3.4583  318.035   10.707  321.189   7.0346 -3.153503 12.81086 
1 1 1   22    6   28 o  182.175   8.5788   25.489   2.3921   22.824   5.2866   26.175   2.6824  169.759   20.780  184.290   9.5422 -14.53084 22.86598 
1 1 1   22    6   29 o  259.542   7.0621   51.685   2.8055   57.023   6.1289   50.271   3.1555  271.045   14.829  255.867   8.0573 15.17799 16.87687 
1 1 1   22    6   30 o  523.616   5.5232  210.181   4.4267  218.474   7.7917  206.229   5.3791  532.959   9.5514  518.450   6.7785 14.50885 11.71225 
1 1 1   22    6   31 o  122.838   13.928   11.824   2.5724   18.935   5.2550   9.5830   2.9500  153.363   23.103  109.450   18.252 43.91363 29.44302 
1 1 1   22    6   32 o  222.639   8.3837   38.104   2.8570   51.223   8.0799   36.229   3.0543  254.417   20.935  216.996   9.1957 37.42079 22.86518 
1 1 1   22    6   33 o   87.953   18.548   6.2743   2.4183   12.450   5.4693   4.7735   2.6962  121.702   29.637   76.740   21.884 44.96211 36.84102 
1 1 1   22    6   34 o  278.821   8.9042   59.831   3.8001   69.442   6.4293   54.670   4.7110  299.142   14.042  266.014   11.570 33.12796 18.19439 
1 1 1   22    6   35 o   51.054   20.954   0.7787   2.6216  -9.2370   5.5858   3.6080   2.9688   48.512   23.599   69.324   23.489 -20.81172 33.29646 
1 1 1   22    6   36 o  235.457   9.4701   42.727   3.4130   46.294   6.5638   41.406   3.9956  242.343   17.820  231.448   11.279 10.89441 21.08949 
1 1 1   22    6   37 o  146.038   14.743   16.773   3.2504   4.0771   9.2180   18.575   3.4734   94.768   39.138  153.699   14.954 -58.93026 41.89798 
1 1 1   22    6   38 f  299.383   8.1653   68.993   3.7417   70.632   5.6008   67.672   5.0285  301.870   12.122  295.778   11.107 6.092163 16.44086 
1 1 1   22    6   39 o   99.256   20.975   8.1122   3.0868   8.3609   7.9632   8.0682   3.3486  103.744   38.157   98.552   22.671 5.192322 44.38402 
1 1 1   22    6   40 o  119.479   15.581   11.356   2.7815   13.883   4.5916   9.8914   3.4960  129.316   24.084  109.522   21.622 19.79427 32.36586 
1 1 1   22    6   41 o   72.366   22.643   4.2212   2.7865   6.4884   4.4431   2.7514   3.5774   88.739   28.691   66.556   25.344 22.18299 38.28184 
1 1 1   22    6   42 o  144.484   14.976   16.525   3.2638   18.794   4.7960   14.568   4.4543  151.806   21.221  132.738   22.742 19.06844 31.10483 
1 1 1   22    6   43 o  173.151   11.914   23.425   3.1383   20.729   4.9489   25.239   4.0588  159.526   20.760  178.725   14.975 -19.19885 25.59713 
1 1 1   22    6   44 o   63.042   23.325   2.7028   2.9831   7.1120   4.7474  -0.1741   3.8348   91.576   29.662   55.417   24.132 36.15884 38.23846 
1 1 1   22    6   45 o   90.818   21.441   6.9469   2.9326   8.4277   4.3511   5.7142   3.9698   98.332   27.717   82.826   27.141 15.50653 38.79275 
1 1 1   22    6   46 o   82.058   23.435   5.7320   3.0895   6.4408   4.0666   4.7644   4.7513   86.651   27.389   79.331   29.419 7.319771 40.19523 
1 1 1   22    6   47 o  140.116   14.780   15.703   3.1219   16.212   4.3673   15.170   4.4644  139.417   21.128  134.035   22.562 5.382843 30.91013 
1 1 1   22    6   48 o   38.867   18.494  -3.4072   3.0142  -5.2940   4.4912  -1.8609   4.0659   46.309   22.182   51.095   23.336 -4.786209 32.19672 
1 1 1   22    6   49 o   44.769   20.670  -2.0535   3.3115  -0.3480   4.0391  -5.5499   5.7834   55.096   24.351   53.662   25.558 1.433796 35.30114 
1 1 1   22    6   50 o   70.024   24.154   4.0691   3.1418   0.3184   4.0881   9.4804   4.9105   57.137   24.897  100.359   29.801 -43.22168 38.83307 
1 1 1   22    6   51 o   88.114   24.033   6.9876   3.3310   3.8185   5.0069   9.5040   4.4616   73.222   29.356  100.598   27.965 -27.37578 40.54402 
1 1 1   22    6   52 o  130.942   15.791   14.122   3.1011   12.781   4.1908   15.745   4.6103  119.424   23.763  133.072   23.493 -13.64816 33.41561 
1 1 1   22    7    0 o   34.800   24.110  -3.7157   4.4292  -3.7157   4.4292  -3.7157   4.4292   34.800   24.110   34.800   24.110 0.000000 0.000000 
1 1 1   22    7    1 o  325.237   8.5044   81.046   4.2336   89.184   6.9366   76.215   5.3445  340.896   13.294  315.270   11.075 25.62607 17.30304 
1 1 1   22    7    2 o  159.370   13.498   19.633   3.2618   0.0000   0.0000   19.633   3.2618  ?   ?   159.370   13.498 0.000000 13.49835 
1 1 1   22    7    3 o  140.719   7.9359   15.218   1.7023   30.032   6.6238   14.170   1.7615  196.055   22.479  135.727   8.5223 60.32840 24.04025 
1 1 1   22    7    4 o  647.883   8.5994  321.626   8.5277  339.570   13.573  309.924   10.961  665.152   13.332  635.714   11.265 29.43817 17.45375 
1 1 1   22    7    5 o  233.338   10.267   41.741   3.6670   44.620   7.5616   40.856   4.1930  239.722   20.815  230.473   11.927 9.248856 23.98953 
1 1 1   22    7    6 f  104.868   19.110   8.7287   2.9544   6.1825   7.0590   9.2695   3.2530   98.356   35.963  107.927   20.440 -9.571426 41.36621 
1 1 1   22    7    7 o  194.469   14.638   29.213   4.3252   29.213   4.3252   0.0000   0.0000  194.469   14.638  ?   ?  0.000000 14.63802 
1 1 1   22    7    8 o  102.701   17.699   8.3449   2.6818   7.1733   3.9305   9.3655   3.6683   94.802   26.210  108.115   22.880 -13.31297 34.79162 
1 1 1   22    7    9 o  825.101   8.0172  521.634   10.125  559.617   13.414  471.332   15.437  854.292   10.258  783.581   12.871 70.71057 16.45850 
1 1 1   22    7   10 o  779.596   7.9039  465.687   9.4315  508.595   12.703  412.980   14.079  814.401   10.191  733.495   12.540 80.90607 16.15883 
1 1 1   22    7   11 o  356.108   6.7824   97.140   3.6969  102.674   5.8767   93.516   4.7558  365.880   10.494  349.288   8.8956 16.59192 13.75667 
1 1 1   22    7   12 o  224.739   8.5245   38.712   2.9324   41.327   4.9012   37.254   3.6596  231.507   13.896  220.365   10.850 11.14224 17.62985 
1 1 1   22    7   13 o  598.412   8.8144  274.514   8.0735   0.0000   0.0000  274.514   8.0735  ?   ?   598.412   8.8144 0.000000 8.814377 
1 1 1   22    7   14 o   85.981   20.327   5.9377   2.6329   3.2781   4.8617   7.0415   3.1319   77.362   29.525   93.554   22.205 -16.19255 36.94280 
1 1 1   22    7   15 o  184.024   10.436   26.067   2.9275   27.980   4.8629   24.979   3.6662  189.831   16.914  179.787   13.419 10.04361 21.59055 
1 1 1   22    7   16 o  251.799   8.3634   48.607   3.2233   47.579   5.1906   49.253   4.1124  248.386   13.706  253.332   10.606 -4.946091 17.32998 
1 1 1   22    7   17 f  123.109   9.3785   11.693   1.7539   12.304   2.0641   10.106   3.3268  126.145   10.794  112.689   20.021 13.45520 22.74521 
1 1 1   22    7   18 o  422.292   5.6561  136.599   3.6560  143.888   4.7624  126.141   5.7049  433.295   7.1808  405.511   9.1913 27.78400 11.66378 
1 1 1   22    7   19 o  387.841   7.4898  115.307   4.4463  115.307   4.4463   0.0000   0.0000  387.841   7.4898  ?   ?  0.000000 7.489803 
1 1 1   22    7   20 o  295.347   7.4531   66.873   3.3693   69.022   3.8869   60.375   6.7573  299.983   8.4652  279.352   15.869 20.63107 17.98569 
1 1 1   22    7   21 o  158.638   9.1808   19.377   2.2197   2.2433   5.4152   22.837   2.4336   75.762   30.474  172.256   9.2640 -96.49357 31.85121 
1 1 1   22    7   22 o  149.910   7.6772   17.279   1.7557   19.137   3.5801   16.690   2.0146  156.812   15.103  147.201   8.9843 9.611801 17.57279 
1 1 1   22    7   23 o  106.600   10.936   8.8249   1.7591   12.209   3.6467   7.7986   2.0081  123.935   19.897   99.728   13.503 24.20695 24.04614 
1 1 1   22    7   24 o  223.204   6.4455   38.189   2.2021   38.238   4.3372   38.172   2.5560  222.466   12.791  223.093   7.4853 -0.6267853 14.82045 
1 1 1   22    7   25 o  246.779   6.7513   46.694   2.5502   48.790   6.1455   46.258   2.8029  250.666   16.103  245.574   7.4567 5.091278 17.74535 
1 1 1   22    7   26 o  258.088   8.3961   51.133   3.3168   37.138   6.2055   56.730   3.9244  217.852   18.794  271.738   9.4352 -53.88548 21.02938 
1 1 1   22    7   27 o  292.902   6.3572   65.780   2.8501   69.220   5.9728   64.766   3.2431  299.572   13.026  290.550   7.2924 9.021484 14.92823 
1 1 1   22    7   28 o  282.831   6.8026   61.360   2.9449   66.792   7.7570   60.445   3.1832  292.754   17.389  280.655   7.4101 12.09912 18.90212 
1 1 1   22    7   29 o   75.894   18.483   4.6634   2.1272   9.6194   4.9344   3.5321   2.3575  107.871   29.180   67.200   20.795 40.67084 35.83155 
1 1 1   22    7   30 o  216.772   7.8644   36.088   2.6094   38.418   5.5801   35.435   2.9520  221.755   16.559  214.691   8.9834 7.064621 18.83903 
1 1 1   22    7   31 o  194.743   9.2069   29.173   2.7444   29.023   5.4451   29.224   3.1775  191.847   18.784  194.449   10.717 -2.602005 21.62637 
1 1 1   22    7   32 o  299.842   7.0690   69.028   3.2443   89.162   8.8890   65.934   3.4847  337.673   17.256  292.946   7.7715 44.72748 18.92514 
1 1 1   22    7   33 o   67.663   21.990   3.5269   2.6080   0.8017   5.5931   4.2841   2.9481   70.607   29.908   73.755   23.321 -3.147728 37.92608 
1 1 1   22    7   34 o   98.183   17.635   7.7566   2.5528   3.7105   5.9234   8.6796   2.8290   82.008   32.234  103.781   18.487 -21.77273 37.15928 
1 1 1   22    7   35 o  271.202   8.4358   56.591   3.5018   58.709   6.7645   55.815   4.0929  273.824   16.212  269.060   9.9383 4.763672 19.01563 
1 1 1   22    7   36 o  200.368   10.895   31.105   3.3287   20.162   6.3295   35.288   3.9137  155.745   27.560  213.176   12.044 -57.43068 30.07633 
1 1 1   22    7   37 o  108.259   18.177   9.4455   2.9053   6.0660   7.9164   9.9715   3.1232   96.410   37.444  111.045   19.062 -14.63471 42.01641 
1 1 1   22    7   38 o  199.070   12.338   30.849   3.7410   35.200   7.8731   29.580   4.2516  207.407   25.326  194.324   14.397 13.08287 29.13202 
1 1 1   22    7   39 f  165.574   12.521   21.403   3.1499   25.090   7.7781   20.679   3.4450  171.707   30.723  162.335   14.002 9.371643 33.76272 
1 1 1   22    7   40 f  125.163   17.089   12.540   3.1883   2.0515   7.8411   14.617   3.4899   83.415   35.378  135.239   17.252 -51.82392 39.36000 
1 1 1   22    7   41 o  109.130   20.717   9.7958   3.3339   11.734   8.2105   9.4132   3.6482  115.508   39.063  106.154   23.109 9.353554 45.38625 
1 1 1   22    7   42 o  158.126   13.592   19.658   3.2577   26.887   4.9162   13.998   4.3498  183.541   17.720  130.040   22.678 53.50165 28.78005 
1 1 1   22    7   43 o  141.009   13.733   15.691   2.9265   17.348   4.6671   14.617   3.7568  145.293   21.647  134.309   18.789 10.98404 28.66375 
1 1 1   22    7   44 o  202.294   10.814   31.868   3.3362   33.951   5.3442   30.538   4.2706  206.224   17.085  196.761   14.277 9.462692 22.26473 
1 1 1   22    7   45 o  154.803   12.859   18.876   3.0192   22.783   4.4249   15.473   4.1299  168.272   17.433  137.140   20.287 31.13181 26.74813 
1 1 1   22    7   46 o   97.383   21.524   8.0246   3.1229   8.3356   4.0723   7.5805   4.8658   97.566   26.557   93.036   30.019 4.530235 40.07998 
1 1 1   22    7   47 o  260.928   8.5316   52.722   3.4074   49.338   4.7706   56.246   4.8684  250.775   12.429  268.045   11.866 -17.27005 17.18357 
1 1 1   22    7   48 o  142.374   14.717   16.251   3.1608   11.699   4.6197   20.257   4.3340  114.713   26.795  157.251   18.352 -42.53804 32.47690 
1 1 1   22    7   49 o  122.109   18.384   12.373   3.3296   14.513   3.9997   7.5411   6.0091  131.209   20.594   91.626   33.230 39.58300 39.09407 
1 1 1   22    7   50 o  131.733   17.225   14.329   3.3899   18.979   5.2070   10.909   4.4659  147.329   23.910  109.160   26.902 38.16894 35.99180 
1 1 1   22    7   51 o   52.314   21.996   0.9171   2.9891   2.4418   4.0413  -0.9244   4.4414   64.252   26.153   54.929   24.810 9.322891 36.04888 
1 1 1   22    7   52 o   41.618   19.257  -1.7589   2.8970  -4.0973   3.8659   1.2361   4.3751   43.287   20.693   60.792   26.121 -17.50523 33.32433 
1 1 1   22    8    0 o   65.233   31.974   4.8281   3.7892   4.8281   3.7892   4.8281   3.7892   65.233   31.974   65.233   31.974 0.000000 0.000000 
1 1 1   22    8    1 o  660.797   11.876  334.958   12.012  334.958   12.012   0.0000   0.0000  660.797   11.876  ?   ?  0.000000 11.87632 
1 1 1   22    8    2 o  290.466   9.9293   64.676   4.4145   0.0000   0.0000   64.676   4.4145  ?   ?   290.466   9.9293 0.000000 9.929327 
1 1 1   22    8    3 o  364.205   7.9892  101.625   4.4537  118.210   8.0126   94.210   5.3575  392.424   13.340  350.561   9.9846 41.86285 16.66261 
1 1 1   22    8    4 o  330.692   8.6599   83.800   4.3833   94.681   8.1664   79.396   5.1952  351.038   15.199  321.786   10.548 29.25229 18.50012 
1 1 1   22    8    5 o  858.838   9.6876  565.420   12.735  603.094   19.734  538.531   16.671  886.083   14.550  837.621   13.003 48.46173 19.51363 
1 1 1   22    8    6 o  122.630   17.057   11.787   3.1150   9.6375   6.6762   12.386   3.5218  111.510   35.075  125.439   18.932 -13.92979 39.85784 
1 1 1   22    8    7 o  353.039   10.369   95.573   5.6032   95.573   5.6032   0.0000   0.0000  353.039   10.369  ?   ?  0.000000 10.36922 
1 1 1   22    8    8 o   62.592   22.166   2.6251   2.6566   1.2660   3.8347   3.8795   3.6839   62.921   25.526   74.892   26.136 -11.97068 36.53328 
1 1 1   22    8    9 o  269.460   8.8855   55.653   3.6648   55.234   4.8760   56.197   5.5558  268.284   11.874  270.509   13.418 -2.225739 17.91761 
1 1 1   22    8   10 o  320.135   8.3603   78.544   4.0966   77.444   5.4288   79.998   6.2432  317.712   11.163  322.797   12.636 -5.085052 16.86090 
1 1 1   22    8   11 o  445.703   7.7121  152.218   5.2612  153.511   6.7453  150.209   8.4072  447.419   9.8495  442.319   12.418 5.100159 15.84982 
1 1 1   22    8   12 o  329.150   7.1435   83.005   3.5989   99.189   5.7644   72.666   4.6072  359.583   10.473  307.822   9.7785 51.76147 14.32855 
1 1 1   22    8   13 o  564.489   6.6057  244.105   5.7075  266.704   9.0837  229.363   7.3365  589.659   10.064  546.975   8.7630 42.68384 13.34480 
1 1 1   22    8   14 o  436.787   7.3175  146.193   4.8922  165.550   9.1328  138.404   5.7935  464.197   12.854  424.863   8.9089 39.33411 15.63930 
1 1 1   22    8   15 o  178.152   10.681   24.445   2.8992   22.248   4.8221   25.689   3.6283  168.712   19.004  182.363   13.085 -13.65048 23.07362 
1 1 1   22    8   16 o  224.010   9.1289   38.487   3.1301   42.128   5.2766   36.509   3.8880  233.493   14.841  217.717   11.710 15.77550 18.90484 
1 1 1   22    8   17 o  336.920   7.5375   87.009   3.8871   92.084   6.2683   83.838   4.9548  346.217   11.829  330.547   9.7931 15.66968 15.35641 
1 1 1   22    8   18 o  189.540   8.4065   27.550   2.4388   26.557   2.7110   31.764   5.5851  185.793   9.5654  201.961   18.265 -16.16809 20.61819 
1 1 1   22    8   19 o  154.879   12.196   18.553   2.8678   18.553   2.8678   0.0000   0.0000  154.879   12.196  ?   ?  0.000000 12.19591 
1 1 1   22    8   20 o   69.870   19.637   3.8858   2.1873   3.8764   2.9227   3.8979   3.2978   71.666   23.278   73.147   24.756 -1.480637 33.98185 
1 1 1   22    8   21 o  337.207   7.9669   87.208   4.1120  103.346   6.9893   78.665   5.0852  366.522   12.458  320.027   10.381 46.49509 16.21680 
1 1 1   22    8   22 o   45.670   18.931   0.4212   2.1681   0.7515   3.4443   0.2044   2.7903   57.696   23.884   50.161   21.180 7.534615 31.92183 
1 1 1   22    8   23 o  161.278   9.8957   20.054   2.4310   22.061   3.9030   18.781   3.1074  168.371   15.312  155.602   13.171 12.76846 20.19707 
1 1 1   22    8   24 o  155.654   8.3391   18.646   1.9796   23.213   4.9239   17.766   2.1620  171.923   19.031  151.813   9.3496 20.10957 21.20319 
1 1 1   22    8   25 o  159.681   8.6929   19.634   2.1167   24.743   5.9406   18.891   2.2653  176.608   22.486  156.527   9.5002 20.08063 24.41047 
1 1 1   22    8   26 o  149.029   8.9644   17.120   2.0353   20.240   4.4533   16.296   2.2883  160.392   18.477  145.207   10.364 15.18451 21.18541 
1 1 1   22    8   27 o   62.788   21.665   2.8164   2.5278   1.3355   4.8359   3.3731   2.9652   68.755   28.368   68.308   23.470 0.4467850 36.81804 
1 1 1   22    8   28 o  409.074   5.5459  128.269   3.4725  128.175   6.5061  128.307   4.1063  408.119   10.415  409.006   6.5593 -0.8872986 12.30843 
1 1 1   22    8   29 o  211.408   7.7223   34.315   2.4988   32.206   5.4717   34.871   2.8089  202.658   17.821  213.029   8.6143 -10.37201 19.79352 
1 1 1   22    8   30 o  104.504   14.227   8.6058   2.2166   0.9286   5.3614   10.189   2.4343   70.064   29.458  113.851   14.284 -43.78671 32.73869 
1 1 1   22    8   31 o   56.738   20.622   2.1079   2.3159  -5.5866   5.3334   3.8960   2.5710   53.144   25.083   70.278   21.711 -17.13392 33.17415 
1 1 1   22    8   32 o  195.635   8.9528   29.447   2.6809   36.970   8.2203   28.551   2.8359  213.860   25.622  192.559   9.6219 21.30142 27.36944 
1 1 1   22    8   33 o  126.396   14.576   12.564   2.7683   14.551   6.0719   12.043   3.1103  131.221   30.765  123.131   16.953 8.089821 35.12695 
1 1 1   22    8   34 o  284.698   8.0595   62.324   3.5121   56.225   6.5672   64.768   4.1564  268.081   16.079  289.986   9.3641 -21.90570 18.60680 
1 1 1   22    8   35 o  166.467   10.941   21.492   2.7721   18.655   6.3089   22.171   3.0860  149.389   28.633  168.859   12.018 -19.46992 31.05275 
1 1 1   22    8   36 o  164.522   12.685   21.104   3.1696   25.905   6.5313   19.625   3.6251  178.256   24.593  157.984   15.178 20.27205 28.89950 
1 1 1   22    8   37 o  151.212   14.880   17.990   3.3994   16.086   8.4644   18.356   3.7119  134.396   38.913  152.390   16.160 -17.99335 42.13485 
1 1 1   22    8   38 o  317.086   8.9551   77.500   4.3463   81.145   8.1854   76.069   5.1291  321.227   16.706  313.672   10.683 7.554535 19.82929 
1 1 1   22    8   39 o   67.310   23.290   3.3733   2.9223   14.313   8.2078   1.7852   3.1273  126.452   38.747   59.378   23.395 67.07409 45.26187 
1 1 1   22    8   40 o   48.374   21.276  -0.5802   3.0477 -16.6097   8.1344   2.0375   3.2872   53.940   26.681   61.499   24.060 -7.559204 35.92703 
1 1 1   22    8   41 o  106.087   20.512   9.2635   3.2103   18.277   8.8209   7.8873   3.4467  140.816   39.384   96.916   23.482 43.90054 45.85314 
1 1 1   22    8   42 o   65.396   24.951   2.6611   3.4712   15.802   7.5462  -0.8656   3.9094  131.911   36.254   53.853   23.872 78.05714 43.40759 
1 1 1   22    8   43 o  333.011   8.2557   85.565   4.2081   94.032   8.9528   83.164   4.7675  344.620   16.973  327.875   9.4998 16.74493 19.45029 
1 1 1   22    8   44 o  115.982   20.739   11.140   3.5465   13.501   9.4177   10.749   3.8283  119.907   41.792  113.008   22.917 6.899864 47.66245 
1 1 1   22    8   45 o  273.117   10.085   57.904   4.2158   52.857   6.4601   61.649   5.5640  257.461   16.479  280.523   12.958 -23.06201 20.96394 
1 1 1   22    8   46 o   61.383   23.702   2.3370   3.1577   5.1279   5.2759   0.7793   3.9416   82.050   30.888   58.985   25.053 23.06498 39.77048 
1 1 1   22    8   47 o  173.305   11.414   23.577   3.0107   25.540   4.2946   21.679   4.2219  178.367   15.897  163.625   17.111 14.74248 23.35568 
1 1 1   22    8   48 o  127.254   17.127   13.237   3.2512   9.6934   4.4974   17.117   4.7054  103.670   27.780  142.039   22.384 -38.36968 35.67629 
1 1 1   22    8   49 o   85.438   22.155   6.3567   2.9216   5.8849   4.0637   6.8614   4.2033   81.931   27.483   87.342   27.871 -5.410820 39.14183 
1 1 1   22    8   50 o   58.554   24.228   1.5630   3.5420   0.7676   4.8933   2.4384   5.1336   62.584   27.256   69.017   28.912 -6.433144 39.73395 
1 1 1   22    8   51 o   55.189   22.121   1.7231   2.8425   0.3094   3.8323   3.4520   4.2381   55.057   24.045   69.121   27.235 -14.06395 36.33042 
1 1 1   22    8   52 o  125.808   15.832   13.074   2.9812   12.400   4.1513   13.792   4.2841  117.258   23.940  124.244   23.386 -6.985840 33.46631 
1 1 1   22    9    0 o  1224.57   16.550  1151.04   31.008  1151.04   31.008  1151.04   31.008  1224.57   16.550  1224.57   16.550 0.000000 0.000000 
1 1 1   22    9    1 o  329.991   5.7073   83.386   2.8827   83.744   3.6084   82.756   4.7928  330.644   7.1299  328.573   9.5298 2.071320 11.90178 
1 1 1   22    9    2 o  460.163   6.8227  162.189   4.8055   0.0000   0.0000  162.189   4.8055  ?   ?   460.163   6.8227 0.000000 6.822739 
1 1 1   22    9    3 o  287.383   8.5555   63.289   3.7634   66.192   6.4571   61.796   4.6313  293.548   14.371  283.871   10.659 9.677826 17.89237 
1 1 1   22    9    4 o  252.364   9.6986   48.824   3.7463   51.161   6.5695   47.698   4.5606  257.360   16.769  249.326   11.950 8.033646 20.59125 
1 1 1   22    9    5 o  289.530   9.7263   64.266   4.3103   58.954   7.3120   67.095   5.3361  276.241   17.382  295.713   11.789 -19.47141 21.00265 
1 1 1   22    9    6 o  212.694   11.727   34.816   3.8030   35.529   6.9558   34.512   4.5419  213.468   21.585  211.496   14.111 1.972229 25.78847 
1 1 1   22    9    7 o  535.549   9.3631  219.872   7.6752  219.872   7.6752   0.0000   0.0000  535.549   9.3631  ?   ?  0.000000 9.363095 
1 1 1   22    9    8 o  211.436   10.196   34.284   3.2997   31.551   4.4801   37.524   4.8783  202.100   14.581  220.495   14.536 -18.39490 20.58868 
1 1 1   22    9    9 o  173.176   12.276   23.137   3.2328   24.340   4.4845   21.835   4.6646  177.054   16.747  167.324   18.524 9.730606 24.97185 
1 1 1   22    9   10 o  258.312   9.4699   51.162   3.7442   51.449   5.0249   50.804   5.6143  258.842   12.683  256.697   14.346 2.144958 19.14883 
1 1 1   22    9   11 o  335.024   8.6442   86.040   4.4327   92.209   5.8511   77.730   6.7910  346.649   11.027  318.020   13.951 28.62912 17.78316 
1 1 1   22    9   12 o  381.348   8.2264  111.468   4.8018  117.049   6.2660  103.527   7.4740  390.591   10.481  367.060   13.303 23.53113 16.93564 
1 1 1   22    9   13 o  301.102   10.312   69.560   4.7526   63.340   6.8109   75.462   6.6350  286.446   15.593  313.302   13.836 -26.85641 20.84635 
1 1 1   22    9   14 o  497.942   6.7547  189.971   5.1482  196.520   7.9687  185.279   6.7448  506.077   10.287  491.545   8.9647 14.53235 13.64531 
1 1 1   22    9   15 o  172.152   11.210   22.850   2.9376   28.179   4.9957   20.034   3.6319  190.380   17.333  160.650   14.941 29.73073 22.88439 
1 1 1   22    9   16 o  404.027   7.0899  125.098   4.3845  132.361   6.9626  120.326   5.6442  415.197   10.956  396.051   9.3107 19.14682 14.37770 
1 1 1   22    9   17 o  101.085   22.863   8.2446   3.4546   5.8976   4.7913   10.786   4.9855   89.093   29.842  115.163   28.450 -26.07003 41.23017 
1 1 1   22    9   18 o  332.452   6.7751   84.702   3.4476   89.452   3.9648   69.975   6.9811  341.588   7.5831  300.963   15.204 40.62488 16.98989 
1 1 1   22    9   19 o  320.545   7.0071   78.757   3.4379   81.830   4.0506   70.841   6.5013  326.653   8.1014  303.308   14.004 23.34488 16.17837 
1 1 1   22    9   20 o  299.044   6.8288   68.546   3.1257   75.098   4.2328   60.687   4.6355  312.849   8.8395  281.058   10.775 31.79041 13.93707 
1 1 1   22    9   21 o   89.761   18.550   6.4645   2.4643   3.4776   5.3693   7.2616   2.7737   80.171   30.921   95.062   19.710 -14.89031 36.66831 
1 1 1   22    9   22 o   65.493   20.786   3.2823   2.3403   6.5129   4.2127   1.8401   2.8146   90.728   27.752   58.568   22.438 32.15972 35.68826 
1 1 1   22    9   23 o  317.056   7.7053   77.110   3.7393   90.529   5.7912   67.516   4.8970  343.125   11.027  296.348   10.796 46.77719 15.43179 
1 1 1   22    9   24 o   94.041   16.685   7.0437   2.3138   10.869   3.9828   5.0948   2.8427  115.931   23.254   79.658   22.386 36.27281 32.27792 
1 1 1   22    9   25 o   73.110   21.159   4.2609   2.5032   7.6252   4.8015   3.0052   2.9334   97.478   29.588   65.963   23.300 31.51479 37.66090 
1 1 1   22    9   26 o  345.167   6.5465   91.361   3.4586   98.421   5.5622   86.909   4.4162  357.759   10.158  336.415   8.5764 21.34375 13.29399 
1 1 1   22    9   27 o   46.800   19.879   0.0948   2.4819  -1.4135   4.3582   0.8187   3.0193   56.454   25.106   54.633   22.463 1.821091 33.68820 
1 1 1   22    9   28 o  169.784   8.7602   22.209   2.2688   13.695   5.6206   23.866   2.4798  128.530   29.230  175.958   9.2399 -47.42741 30.65596 
1 1 1   22    9   29 o  191.390   8.2747   28.141   2.4241   31.954   6.5475   27.535   2.6095  200.639   21.664  189.252   9.0083 11.38675 23.46216 
1 1 1   22    9   30 o  130.375   11.707   13.218   2.3113   14.578   5.3467   12.906   2.5632  132.914   27.197  128.531   13.217 4.383240 30.23903 
1 1 1   22    9   31 o  311.672   6.3925   74.537   3.0496   85.588   6.5199   71.442   3.4502  332.673   12.804  304.999   7.3906 27.67325 14.78407 
1 1 1   22    9   32 o   69.048   22.634   3.6565   2.7607   6.1059   5.7859   2.9344   3.1413   91.250   32.670   66.104   24.018 25.14582 40.54850 
1 1 1   22    9   33 o  438.323   7.0850  147.561   4.7534  159.973   10.768  144.557   5.2975  453.339   15.518  433.631   7.9814 19.70831 17.45007 
1 1 1   22    9   34 o   63.731   21.111   3.0816   2.3994   9.2470   6.2283   2.0071   2.6001  105.691   33.948   57.655   21.688 48.03677 40.28419 
1 1 1   22    9   35 o  256.873   7.7989   50.739   3.0663   59.425   7.1686   48.794   3.3923  275.014   17.115  251.737   8.8040 23.27739 19.24644 
1 1 1   22    9   36 o  160.848   11.219   20.099   2.7448   23.827   6.8821   19.394   2.9931  169.511   27.465  157.703   12.502 11.80754 30.17645 
1 1 1   22    9   37 o   75.856   23.527   4.6310   3.0157   0.1627   8.5943   5.2585   3.2205   82.503   36.021   80.292   24.201 2.210899 43.39565 
1 1 1   22    9   38 o   92.829   26.651   7.2131   3.9856   7.1081   7.1845   7.2597   4.7903   97.577   36.178   93.659   29.740 3.917885 46.83292 
1 1 1   22    9   39 o  154.650   12.648   18.704   2.9676   18.879   7.3816   18.670   3.2411  146.816   33.577  154.173   13.883 -7.357101 36.33438 
1 1 1   22    9   40 o  119.633   17.349   11.498   3.0842   9.4521   8.3867   11.818   3.3166  107.546   39.219  120.939   18.505 -13.39317 43.36528 
1 1 1   22    9   41 o  124.497   16.714   12.413   3.1046   15.348   7.7186   11.847   3.3910  130.067   37.005  120.827   18.960 9.240616 41.57965 
1 1 1   22    9   42 o  305.266   9.1698   72.003   4.2846   84.898   8.7495   67.935   4.9141  326.940   17.548  295.956   10.848 30.98431 20.63057 
1 1 1   22    9   43 o  149.023   14.898   17.617   3.3527   12.767   7.7941   18.718   3.7139  117.971   37.985  153.222   16.075 -35.25010 41.24657 
1 1 1   22    9   44 o  251.099   10.473   48.958   4.0253   31.017   9.4010   52.986   4.4542  185.463   34.383  260.973   11.151 -75.50929 36.14553 
1 1 1   22    9   45 o   53.115   23.032  -0.0080   3.4639  -1.1563   5.4176   0.7860   4.5051   61.873   27.719   62.485   26.667 -0.6128807 38.46416 
1 1 1   22    9   46 o   38.987   18.589  -3.6314   3.0770  -2.2740   4.9897  -4.4644   3.9087   56.276   25.759   43.903   20.937 12.37370 33.19486 
1 1 1   22    9   47 o  133.534   17.221   14.526   3.4378   16.330   5.3066   13.221   4.5129  136.642   26.327  123.528   24.731 13.11399 36.12117 
1 1 1   22    9   48 o  130.904   17.939   14.100   3.4999   8.4645   6.1120   16.850   4.2691   96.067   33.657  142.025   20.208 -45.95847 39.25743 
1 1 1   22    9   49 o  102.283   22.594   9.1293   3.4429   15.715   5.9747   5.8552   4.2127  129.173   30.675   81.681   27.979 47.49277 41.51839 
1 1 1   22    9   50 o   79.754   26.023   5.6763   3.6508  -0.2047   4.9585   12.638   5.3951   59.939   26.709  114.784   30.273 -54.84476 40.37127 
1 1 1   22    9   51 o   82.673   24.022   6.1810   3.2207   1.1494   4.9586   9.8525   4.2358   63.404   27.525  102.733   26.694 -39.32895 38.34339 
1 1 1   22   10    0 o  893.662   9.3466  611.905   12.782  611.905   12.782  611.905   12.782  893.662   9.3466  893.662   9.3466 0.000000 0.000000 
1 1 1   22   10    1 o  270.006   5.7543   55.829   2.3781   56.046   3.9610   55.706   2.9737  270.383   9.5709  269.662   7.2046 0.7211304 11.97949 
1 1 1   22   10    2 o  198.795   5.9525   30.265   1.8112   27.679   2.8323   32.054   2.3560  189.755   9.7848  204.546   7.5251 -14.79158 12.34380 
1 1 1   22   10    3 o  267.750   6.1769   54.905   2.5315   54.282   2.9790   56.526   4.8022  266.186   7.3115  271.426   11.559 -5.239990 13.67733 
1 1 1   22   10    4 o   53.920   21.959   0.8576   2.8510   2.4583   4.9631   0.0693   3.4829   74.606   29.448   55.437   23.548 19.16914 37.70566 
1 1 1   22   10    5 o  359.602   8.8996   99.119   4.8985   96.657   7.5704  100.892   6.4247  354.707   13.944  362.609   11.576 -7.901978 18.12242 
1 1 1   22   10    6 o  251.221   10.725   48.412   4.1241   57.119   6.8927   43.557   5.1470  271.939   16.640  237.665   14.214 34.27394 21.88403 
1 1 1   22   10    7 o  100.887   25.434   8.1971   3.9265   8.1971   3.9265   0.0000   0.0000  100.887   25.434  ?   ?  0.000000 25.43428 
1 1 1   22   10    8 o  325.362   8.1514   81.130   4.0595   79.807   5.4178   82.822   6.1297  322.517   10.975  328.455   12.193 -5.937836 16.40453 
1 1 1   22   10    9 o  584.315   7.5162  261.616   6.7222  261.599   8.5763  261.642   10.825  584.072   9.5932  583.776   12.115 0.2966309 15.45292 
1 1 1   22   10   10 o  328.066   8.3878   82.498   4.2119   86.867   5.6458   77.015   6.3250  336.454   10.963  316.624   13.051 19.83051 17.04462 
1 1 1   22   10   11 o  128.706   17.353   12.992   3.3314   13.814   4.3392   11.812   5.1993  131.838   22.298  120.732   28.579 11.10564 36.24858 
1 1 1   22   10   12 o  616.880   7.8176  291.660   7.3815  292.889   9.3215  289.595   12.087  617.911   9.8558  613.925   12.863 3.986145 16.20481 
1 1 1   22   10   13 o  330.982   10.222   84.058   5.1784   85.429   7.6145   82.878   7.0632  333.179   14.931  328.271   14.057 4.908142 20.50726 
1 1 1   22   10   14 o  298.885   9.6468   68.533   4.4132   69.124   5.7807   67.707   6.8330  299.916   12.592  296.177   15.123 3.738312 19.67932 
1 1 1   22   10   15 o  162.349   14.988   20.464   3.6824   21.679   4.7854   18.701   5.7660  166.415   19.135  153.023   25.517 13.39255 31.89426 
1 1 1   22   10   16 o  280.514   10.322   60.404   4.4321   65.211   5.8236   53.787   6.8324  291.197   13.066  263.482   17.033 27.71500 21.46697 
1 1 1   22   10   17 o  122.604   15.696   11.773   2.8778   15.590   5.0598   9.9483   3.4989  139.518   24.592  111.467   21.284 28.05138 32.52353 
1 1 1   22   10   18 o  528.664   6.4113  214.170   5.1880  227.666   6.2207  183.338   9.4023  544.943   7.4579  488.237   12.582 56.70633 14.62589 
1 1 1   22   10   19 o   46.097   20.079  -0.4655   2.6568   0.9578   3.5298  -2.3256   4.0352   59.240   24.314   51.644   23.455 7.595837 33.78376 
1 1 1   22   10   20 o  139.320   12.758   15.061   2.6903   11.232   3.9722   18.306   3.6567  118.186   22.784  153.206   15.821 -35.02086 27.73860 
1 1 1   22   10   21 o  337.193   9.1886   87.282   4.7424  109.645   10.957   82.128   5.2606  375.556   19.125  326.931   10.513 48.62552 21.82380 
1 1 1   22   10   22 f  197.653   8.4613   29.980   2.5598   28.478   4.0024   31.020   3.3300  191.729   13.729  200.581   10.887 -8.852783 17.52188 
1 1 1   22   10   23 o  185.329   9.0038   26.372   2.5541   26.347   4.1970   26.388   3.2187  184.107   15.025  184.850   11.432 -0.7424164 18.87955 
1 1 1   22   10   24 o   62.243   20.834   2.8528   2.3353   2.7326   4.0088   2.9145   2.8733   70.002   26.788   65.133   23.054 4.868851 35.34216 
1 1 1   22   10   25 o  192.386   9.5821   28.444   2.8217   25.339   5.0789   29.830   3.3936  179.607   18.751  196.535   11.329 -16.92769 21.90770 
1 1 1   22   10   26 f  229.378   8.2526   40.398   2.8974   56.366   4.9552   32.102   3.5717  270.456   11.970  203.843   11.494 66.61339 16.59510 
1 1 1   22   10   27 o  231.270   8.4731   41.084   2.9994   45.927   5.1006   38.525   3.7083  243.416   13.746  223.690   10.831 19.72577 17.50028 
1 1 1   22   10   28 o   68.807   21.751   3.6770   2.5647   9.8124   4.8083   1.2373   3.0320  108.855   28.517   56.649   22.797 52.20604 36.50945 
1 1 1   22   10   29 o  186.756   10.865   26.965   3.0923   23.632   6.3984   27.981   3.5322  170.970   25.206  190.005   12.210 -19.03499 28.00782 
1 1 1   22   10   31 o  185.041   10.606   26.484   2.9914   33.043   5.8096   24.118   3.4896  204.622   18.758  176.066   13.041 28.55589 22.84611 
1 1 1   22   10   32 o  261.559   7.2847   52.550   2.9164   51.415   6.3835   52.849   3.2786  256.337   16.355  262.179   8.1700 -5.841949 18.28202 
1 1 1   22   10   33 o  107.697   15.428   9.2020   2.4706   13.334   8.4784   8.8186   2.5827  124.596   39.565  105.098   16.606 19.49776 42.90869 
1 1 1   22   10   34 o  301.371   7.0042   69.769   3.2310   78.344   7.1651   67.580   3.6199  317.334   14.752  296.443   7.9778 20.89178 16.77062 
1 1 1   22   10   35 o  112.980   14.792   10.099   2.4965   8.4034   6.4222   10.401   2.7096  101.885   34.547  114.400   15.904 -12.51460 38.03233 
1 1 1   22   10   36 o  211.012   9.0738   34.312   2.9306   35.951   7.0387   33.968   3.2233  211.450   22.073  209.790   10.038 1.659332 24.24858 
1 1 1   22   10   37 o  206.804   10.109   33.027   3.2000   16.667   8.7813   35.532   3.4362  136.159   39.695  214.434   10.469 -78.27541 41.05260 
1 1 1   22   10   38 o  108.956   21.856   9.7898   3.5182   12.139   6.9962   8.9946   4.0703  117.726   35.712  103.302   25.815 14.42407 44.06493 
1 1 1   22   10   39 o  162.788   13.389   20.770   3.3066   9.2202   7.7951   23.304   3.6514  106.061   37.926  172.321   13.964 -66.26044 40.41483 
1 1 1   22   10   40 o   51.998   21.901   0.4738   2.9719  -0.6556   7.4943   0.6845   3.2373   74.956   33.147   54.854   22.968 20.10232 40.32692 
1 1 1   22   10   41 o  128.582   16.054   13.192   3.0908   5.4136   7.5196   14.773   3.3905   91.531   36.210  135.977   16.637 -44.44650 39.84887 
1 1 1   22   10   42 o   57.720   23.722   1.1925   3.3652   5.6722   7.7571   0.1539   3.7350   92.530   36.722   56.015   24.103 36.51491 43.92587 
1 1 1   22   10   43 o   67.300   24.059   3.3327   3.1366  -8.7218   7.2115   6.1452   3.4834   57.879   27.825   85.231   25.045 -27.35199 37.43648 
1 1 1   22   10   44 o  100.153   24.941   8.6301   3.8088   16.947   8.0542   6.2347   4.3226  133.723   37.716   86.064   28.327 47.65966 47.16956 
1 1 1   22   10   45 o   93.958   21.695   7.4864   3.0569   0.7056   5.1363   11.206   3.8040   65.497   28.224  115.144   22.390 -49.64700 36.02632 
1 1 1   22   10   46 o   50.737   21.921   0.0865   3.1152   2.4572   4.9510  -1.4672   4.0080   70.197   28.802   51.954   23.508 18.24314 37.17796 
1 1 1   22   10   47 o  120.728   17.860   11.978   3.2008   11.848   5.2301   12.055   4.0473  113.912   29.693  118.537   23.137 -4.625069 37.64312 
1 1 1   22   10   48 o   96.026   23.283   8.0639   3.3868   5.6807   6.1220   9.1149   4.0655   84.600   32.908  100.839   26.128 -16.23965 42.01905 
1 1 1   22   10   49 o  184.154   11.841   26.840   3.3200   16.151   4.9999   35.269   4.4402  134.931   25.134  209.933   13.897 -75.00162 28.72013 
1 1 1   22   10   50 o   48.032   21.812  -1.2131   3.4885  -5.0401   4.6992   3.4849   5.2065   47.318   22.672   72.547   29.625 -25.22924 37.30445 
1 1 1   22   10   51 o   57.902   22.920   2.1140   3.0145  -1.4371   4.6090   4.7686   3.9850   54.248   24.803   74.405   27.049 -20.15761 36.69960 
1 1 1   22   11    0 o  323.723   7.2066   80.363   3.5669   80.363   3.5669   80.363   3.5669  323.723   7.2066  323.723   7.2066 0.000000 0.000000 
1 1 1   22   11    1 o  459.280   5.7864  161.543   4.0678  162.256   7.0557  161.188   4.9785  459.983   10.021  458.698   7.0909 1.284882 12.27632 
1 1 1   22   11    2 o  283.462   11.405   61.655   4.9485   0.0000   0.0000   61.655   4.9485  ?   ?   283.462   11.405 0.000000 11.40547 
1 1 1   22   11    3 o  207.370   8.0413   32.954   2.5524   34.042   3.1279   30.785   4.4155  210.702   9.6987  199.609   14.552 11.09383 17.48805 
1 1 1   22   11    4 o  541.748   11.430  225.219   9.4777   0.0000   0.0000  225.219   9.4777  ?   ?   541.748   11.430 0.000000 11.42966 
1 1 1   22   11    5 o  330.019   9.1256   83.498   4.6097   75.274   6.8196   90.417   6.2551  312.954   14.237  343.211   11.907 -30.25613 18.55964 
1 1 1   22   11    6 o  336.015   14.081   86.775   7.2420   86.775   7.2420   0.0000   0.0000  336.015   14.081  ?   ?  0.000000 14.08094 
1 1 1   22   11    7 o  391.031   7.6162  117.169   4.5585  123.333   6.0211  108.892   6.9774  401.017   9.8094  376.603   12.104 24.41388 15.57999 
1 1 1   22   11    8 o  335.957   8.0449   86.504   4.1369   91.353   5.4324   79.810   6.3827  345.087   10.285  322.327   12.937 22.76001 16.52717 
1 1 1   22   11    9 o  472.706   7.5756  171.236   5.4813  178.268   7.1237  161.032   8.5816  482.115   9.6535  457.917   12.244 24.19778 15.59163 
1 1 1   22   11   10 o  361.094   8.2193   99.949   4.5428  103.782   5.9711   94.681   7.0000  367.757   10.608  351.024   13.028 16.73291 16.80061 
1 1 1   22   11   11 o  104.132   21.741   8.7013   3.3533   9.7020   4.3482   7.2328   5.2676  109.520   26.275   97.121   31.223 12.39828 40.80725 
1 1 1   22   11   12 f  174.426   13.174   23.519   3.4912   21.954   4.5008   25.882   5.5316  167.775   17.798  181.870   20.213 -14.09474 26.93226 
1 1 1   22   11   13 o  122.993   21.888   12.063   3.9696   7.1528   5.5138   17.346   5.7195   97.224   31.993  147.084   26.374 -49.86036 41.46235 
1 1 1   22   11   14 o  255.305   10.515   50.036   4.1090   49.851   5.3348   50.305   6.4428  254.193   13.763  254.884   16.605 -0.6918488 21.56719 
1 1 1   22   11   15 o  162.997   19.532   20.840   4.7759   29.251   8.3071   16.687   5.8370  191.109   29.336  143.833   27.516 47.27625 40.22095 
1 1 1   22   11   16 o  108.658   27.895   9.5933   4.6631   7.2846   8.1432   10.720   5.6880  104.994   38.591  114.802   31.444 -9.807655 49.77924 
1 1 1   22   11   17 o  751.615   6.8140  432.976   7.8392  452.076   11.213  414.718   10.964  767.476   9.5454  735.037   9.7448 32.43915 13.64093 
1 1 1   22   11   18 o  305.686   7.4769   71.645   3.4984   71.795   4.1584   71.283   6.4715  305.890   8.8816  304.230   13.897 1.659607 16.49306 
1 1 1   22   11   19 o  224.264   8.0776   38.577   2.7728   39.657   3.7340   37.251   4.1400  227.185   10.738  219.703   12.361 7.482407 16.37380 
1 1 1   22   11   20 f  179.296   9.7130   24.758   2.6557   22.712   3.6578   27.039   3.8618  171.090   14.093  186.856   13.596 -15.76579 19.58214 
1 1 1   22   11   21 o  142.112   14.118   15.723   3.0303   19.488   5.3672   13.961   3.6715  156.418   23.114  132.969   18.544 23.44904 29.63355 
1 1 1   22   11   22 o  187.340   8.9371   26.946   2.5627   25.865   4.0304   27.679   3.3204  182.503   14.549  189.329   11.512 -6.826401 18.55269 
1 1 1   22   11   23 o   90.404   17.397   6.5419   2.3199   8.2396   3.9222   5.6282   2.8772  100.482   25.468   83.424   22.158 17.05835 33.75843 
1 1 1   22   11   24 o  167.044   9.9708   21.525   2.5377   26.223   4.2963   19.008   3.1450  183.502   15.440  156.437   13.259 27.06499 20.35178 
1 1 1   22   11   25 o  207.400   8.9528   33.045   2.8421   40.017   5.1140   29.929   3.4186  227.025   14.798  196.828   11.396 30.19698 18.67755 
1 1 1   22   11   26 o   44.709   19.358  -0.2773   2.4394  -7.5916   4.2204   3.3924   2.9894   41.619   20.305   68.480   23.564 -26.86070 31.10493 
1 1 1   22   11   27 o   82.498   19.666   5.5240   2.4483   9.3186   4.4269   3.8520   2.9386  106.277   27.123   71.166   23.353 35.11073 35.79122 
1 1 1   22   11   28 o  349.317   6.8978   93.638   3.6881   96.152   5.9623   92.080   4.6938  353.236   11.028  346.095   8.8606 7.141022 14.14631 
1 1 1   22   11   29 o  238.238   10.013   43.702   3.6513   50.934   5.7076   38.691   4.7505  255.919   14.632  223.104   13.982 32.81517 20.23796 
1 1 1   22   11   30 o   92.994   33.181   6.3605   5.9638   6.3605   5.9638   0.0000   0.0000   92.994   33.181  ?   ?  0.000000 33.18150 
1 1 1   22   11   31 o  224.152   11.647   38.908   3.9823   41.451   6.6298   37.472   4.9809  229.183   19.073  219.138   14.939 10.04568 24.22690 
1 1 1   22   11   32 o  234.538   10.236   42.411   3.6747   37.695   8.7146   43.430   4.0526  215.005   27.081  237.176   11.163 -22.17097 29.29202 
1 1 1   22   11   33 o  102.346   21.843   8.5910   3.3176   9.3264   8.5023   8.4589   3.6032  109.538   39.558  101.135   23.692 8.403145 46.10984 
1 1 1   22   11   34 o   29.393   14.808  -9.5503   3.0682 -18.1651   6.0898  -6.6196   3.5520   41.682   20.981   37.650   18.424 4.032139 27.92205 
1 1 1   22   11   35 o  100.456   17.050   8.1092   2.5279  -4.8560   6.5278   10.397   2.7418   61.652   28.658  114.297   16.120 -52.64489 32.88088 
1 1 1   22   11   36 o  298.121   7.4435   68.342   3.3966   69.075   7.6853   68.165   3.7864  296.304   17.017  297.558   8.3136 -1.254181 18.93916 
1 1 1   22   11   37 o   64.253   22.226   3.0435   2.6614   31.726   9.6744   0.6951   2.7682  191.644   34.237   51.606   21.391 140.0383 40.37028 
1 1 1   22   11   38 o   71.934   25.567   3.7759   3.5373  -2.9592   7.2167   5.9058   4.0583   68.828   31.301   85.194   27.407 -16.36630 41.60422 
1 1 1   22   11   39 o  153.543   12.561   18.444   2.9263   18.399   7.1903   18.453   3.2036  144.843   33.149  153.235   13.807 -8.392075 35.90965 
1 1 1   22   11   40 o  195.361   11.707   29.734   3.4846   23.229   7.7523   31.381   3.9009  163.398   32.142  200.382   12.785 -36.98376 34.59122 
1 1 1   22   11   41 o  159.557   13.982   20.054   3.3803   19.998   7.7064   20.067   3.7615  149.585   34.379  159.045   15.654 -9.460175 37.77525 
1 1 1   22   11   42 o  100.472   21.149   8.4102   3.1496  -4.2027   7.6144   11.014   3.4594   67.502   31.229  115.671   20.279 -48.16837 37.23524 
1 1 1   22   11   43 o   78.492   25.490   5.0681   3.5044   0.2899   6.5219   7.0076   4.1552   71.714   31.343   90.431   27.542 -18.71722 41.72439 
1 1 1   22   11   44 o  127.230   18.243   13.194   3.4510   9.9537   7.7256   14.002   3.8573  105.546   37.755  130.386   19.963 -24.84045 42.70777 
1 1 1   22   11   45 o   46.651   20.988  -1.1173   3.1420  -0.0211   5.1469  -1.7685   3.9670   63.258   27.740   50.914   23.175 12.34373 36.14669 
1 1 1   22   11   46 o  112.790   19.113   10.554   3.1819   7.8910   5.3030   12.052   3.9774   94.115   31.395  118.981   22.668 -24.86576 38.72289 
1 1 1   22   11   47 o  160.995   13.340   20.596   3.2578   13.441   5.2810   24.992   4.1392  121.747   28.791  176.356   15.491 -54.60835 32.69433 
1 1 1   22   11   48 o   71.861   24.842   4.2764   3.3245  -1.3213   5.8636   6.9283   4.0359   62.363   28.305   87.770   27.216 -25.40662 39.26650 
1 1 1   22   11   49 o   53.248   22.304   0.9847   3.0548  -0.6932   4.6522   2.2564   4.0503   57.085   25.622   63.910   26.117 -6.825287 36.58670 
1 1 1   22   11   50 o   58.346   23.862   1.7807   3.3846   2.1554   4.6013   1.3390   4.9962   65.385   27.380   64.339   27.780 1.046242 39.00505 
1 1 1   22   11   51 o   43.411   20.201  -2.1336   3.2572   3.3621   5.6078  -4.9316   4.0013   72.527   30.286   42.597   20.541 29.92920 36.59462 
1 1 1   22   12    0 o  622.003   7.8972  296.433   7.5158  296.433   7.5158  296.433   7.5158  622.003   7.8972  622.003   7.8972 0.000000 0.000000 
1 1 1   22   12    1 o  144.844   8.9673   16.145   1.9783   16.884   3.5850   15.822   2.3722  147.247   16.173  143.187   10.906 4.059799 19.50630 
1 1 1   22   12    2 o  592.491   6.4659  268.904   5.8638  267.501   7.0385  272.089   10.602  590.822   7.7831  595.385   11.633 -4.563049 13.99682 
1 1 1   22   12    3 o  489.915   6.2253  183.844   4.6682  191.437   5.6613  167.714   8.2513  499.842   7.3998  467.448   11.532 32.39383 13.70231 
1 1 1   22   12    4 o  298.141   6.5290   68.092   2.9794   70.991   3.4799   60.131   5.7666  304.378   7.4694  279.741   13.468 24.63663 15.40039 
1 1 1   22   12    5 o  310.037   12.764   73.834   6.0572   0.0000   0.0000   73.834   6.0572  ?   ?   310.037   12.764 0.000000 12.76414 
1 1 1   22   12    7 o  178.328   15.100   24.640   4.0830   23.501   6.6007   25.345   5.1964  172.077   25.861  180.226   19.130 -8.149048 32.16707 
1 1 1   22   12    8 o  752.335   9.4983  434.110   10.938  449.968   16.098  420.510   14.907  765.051   13.747  739.722   13.166 25.32904 19.03478 
1 1 1   22   12    9 o  585.570   9.1531  262.961   8.2038  269.266   12.156  257.689   11.117  591.849   13.419  579.148   12.541 12.70038 18.36706 
1 1 1   22   12   10 o  629.407   9.3387  303.852   8.9968  316.323   13.376  293.547   12.158  641.396   13.625  618.033   12.852 23.36285 18.72994 
1 1 1   22   12   11 o  201.130   15.288   31.326   4.6714   35.783   7.1754   28.047   6.1543  213.738   22.259  189.089   21.654 24.64864 31.05451 
1 1 1   22   12   12 o  299.574   11.823   68.943   5.4212   82.031   8.8071   60.959   6.8789  325.535   17.742  280.795   16.072 44.73996 23.93924 
1 1 1   22   12   13 o  295.019   11.756   66.869   5.3085   73.796   7.8235   60.959   7.2266  308.891   16.608  280.603   16.905 28.28851 23.69806 
1 1 1   22   12   14 o  378.416   8.7206  109.836   5.0511  117.393   6.4729   98.069   8.0773  390.984   10.816  356.829   14.789 34.15451 18.32212 
1 1 1   22   12   15 o  203.653   12.996   32.032   4.0300   31.821   5.1174   32.376   6.5390  202.386   16.668  203.203   21.343 -0.8166199 27.08006 
1 1 1   22   12   16 o  108.043   23.264   9.4242   3.7334   12.088   4.7369   5.0559   6.0658  122.135   26.129   89.549   33.235 32.58609 42.27597 
1 1 1   22   12   17 o  307.476   7.5549   72.490   3.5556   74.776   4.0028   63.942   7.7407  312.218   8.3760  287.040   17.705 25.17819 19.58616 
1 1 1   22   12   18 o  462.315   7.7250  163.911   5.4665  163.911   5.4665   0.0000   0.0000  462.315   7.7250  ?   ?  0.000000 7.725013 
1 1 1   22   12   19 o  438.114   6.1675  147.100   4.1359  158.568   5.5278  132.515   6.2336  454.667   7.9431  415.394   9.8042 39.27322 12.61799 
1 1 1   22   12   20 o  264.799   9.0960   53.831   3.6867   56.991   6.0564   51.971   4.6468  271.401   14.633  259.921   11.680 11.48074 18.72314 
1 1 1   22   12   21 o  216.472   8.8236   35.974   2.9236   38.481   4.0763   33.319   4.1955  223.281   11.971  207.509   13.279 15.77222 17.87811 
1 1 1   22   12   22 o  433.960   6.4013  144.373   4.2519  149.823   5.7372  137.732   6.3332  441.788   8.4843  423.378   9.7729 18.40994 12.94193 
1 1 1   22   12   23 o  391.266   6.0817  117.353   3.6422  133.082   5.6602  106.238   4.7582  416.276   8.8835  372.005   8.3565 44.27103 12.19617 
1 1 1   22   12   24 o  248.072   7.6404   47.226   2.9011   48.636   4.5748   46.277   3.7520  251.262   11.895  245.331   9.9917 5.931000 15.53487 
1 1 1   22   12   25 o  180.435   12.172   25.211   3.3420   26.324   4.8629   24.215   4.6007  183.266   17.551  175.759   17.327 7.507050 24.66256 
1 1 1   22   12   26 o   92.695   18.308   6.9158   2.5054   9.1959   4.2960   5.7406   3.0842  105.657   26.586   84.104   23.203 21.55278 35.28725 
1 1 1   22   12   27 o  234.648   9.3450   42.343   3.3563   43.275   4.9724   41.563   4.5490  236.148   13.817  231.624   12.882 4.524521 18.89051 
1 1 1   22   12   28 o  137.606   14.587   14.833   3.0256   16.664   4.7033   13.540   3.9518  143.985   22.043  129.920   20.556 14.06493 30.14027 
1 1 1   22   12   29 o  110.496   20.556   9.8783   3.3487   7.4487   4.9518   11.926   4.5458   95.964   30.211  120.301   25.480 -24.33647 39.52126 
1 1 1   22   12   30 o  245.088   11.740   46.394   4.4043   44.558   5.5853   49.411   7.1619  238.953   15.352  250.496   18.817 -11.54277 24.28478 
1 1 1   22   12   31 o   67.588   23.218   3.3607   2.9018   3.6185   5.2596   3.2479   3.4792   78.968   30.562   69.381   25.266 9.586891 39.65376 
1 1 1   22   12   32 o  130.908   17.222   13.610   3.3671   8.0196   11.677   14.117   3.5164  112.827   44.968  133.236   17.680 -20.40876 48.31828 
1 1 1   22   12   33 o  128.110   16.369   13.011   3.1363   12.792   6.2190   13.086   3.6320  122.209   32.633  127.688   19.176 -5.478935 37.84979 
1 1 1   22   12   34 o  177.109   12.531   24.423   3.3751   25.315   6.4048   24.080   3.9712  176.319   24.385  175.224   14.950 1.095444 28.60275 
1 1 1   22   12   35 o  261.339   10.587   52.762   4.2351   50.037   10.333   53.312   4.6430  246.527   27.872  262.464   11.557 -15.93710 30.17357 
1 1 1   22   12   36 o  257.965   10.627   51.435   4.1959   52.865   9.9524   51.126   4.6272  254.318   25.930  256.903   11.767 -2.584412 28.47490 
1 1 1   22   12   37 o  105.799   22.340   9.2659   3.5042   11.708   7.0237   8.4565   4.0433  115.868   35.900  100.150   26.109 15.71800 44.38981 
1 1 1   22   12   38 o  198.066   12.687   30.614   3.8260   30.952   7.0093   30.471   4.5663  194.454   24.064  196.751   15.283 -2.296432 28.50654 
1 1 1   22   12   39 o   59.966   22.335   2.3230   2.7443   1.2591   7.0754   2.5114   2.9774   77.903   33.338   62.278   23.250 15.62506 40.64476 
1 1 1   22   12   40 o  133.262   14.885   14.076   2.9843   36.246   7.5471   9.9671   3.2491  210.129   23.890  110.257   19.988 99.87249 31.14900 
1 1 1   22   12   41 o  119.064   19.690   11.594   3.4629   12.892   7.5265   11.245   3.9003  119.106   37.205  116.051   22.771 3.054794 43.62013 
1 1 1   22   12   42 o   63.934   23.737   2.7705   3.0948   1.3982   6.9355   3.1117   3.4582   76.723   32.924   67.398   25.078 9.325378 41.38767 
1 1 1   22   12   43 o   91.062   23.438   7.0642   3.2860   5.6857   5.8372   7.7038   3.9759   86.550   32.507   94.392   26.456 -7.841309 41.91209 
1 1 1   22   12   44 o   75.841   24.936   4.7372   3.3499   3.1883   7.3087   5.1492   3.7692   82.049   34.441   78.977   26.468 3.071548 43.43627 
1 1 1   22   12   45 o  194.337   11.067   29.555   3.2784   12.640   5.4351   39.228   4.1103  118.211   29.991  223.535   12.058 -105.3236 32.32413 
1 1 1   22   12   46 o   60.299   23.139   2.3338   2.9961   3.2225   5.2452   1.9033   3.6502   73.896   29.898   61.578   24.931 12.31872 38.92867 
1 1 1   22   12   47 o  140.581   15.251   15.946   3.2290   6.1006   5.1456   22.341   4.1472   84.697   30.745  165.930   16.550 -81.23273 34.91624 
1 1 1   22   12   48 o  113.572   20.172   10.955   3.3781   14.708   5.9464   9.1660   4.1049  124.225   31.290  100.462   26.363 23.76325 40.91551 
1 1 1   22   12   49 o   43.695   19.902  -1.2654   2.9315  -0.0666   4.7032  -2.0271   3.7489   58.982   26.162   47.638   21.994 11.34433 34.17931 
1 1 1   22   12   50 o   77.631   26.209   5.3972   3.6961   5.4627   5.4134   5.3399   5.0588   80.032   30.997   78.951   30.121 1.081741 43.22108 
1 1 1   22   13    0 o  340.271   11.654   89.062   6.0537   89.062   6.0537   89.062   6.0537  340.271   11.654  340.271   11.654 0.000000 0.000000 
1 1 1   22   13    1 o  303.664   5.5901   70.622   2.5982   69.902   3.7067   71.318   3.6431  301.996   8.0189  305.050   7.8024 -3.054077 11.18841 
1 1 1   22   13    2 o  292.372   6.9696   65.495   3.1190   65.995   3.6641   64.178   5.9433  293.426   8.1583  288.973   13.437 4.452972 15.71978 
1 1 1   22   13    3 o  397.495   8.2690  121.116   5.0310  123.856   6.9080  118.021   7.3417  401.693   11.235  392.009   12.236 9.684662 16.61160 
1 1 1   22   13    4 o  488.589   8.2664  182.992   6.1820  191.243   8.6781  174.491   8.8088  499.122   11.359  476.665   12.074 22.45688 16.57713 
1 1 1   22   13    5 o  297.257   13.087   67.905   5.9545   67.905   5.9545   0.0000   0.0000  297.257   13.087  ?   ?  0.000000 13.08716 
1 1 1   22   13    6 o  490.060   6.5357  183.990   4.9024  184.025   5.7900  183.902   9.2141  490.005   7.7199  489.291   12.303 0.7145386 14.52459 
1 1 1   22   13    7 o  419.529   12.706  135.245   8.1593   0.0000   0.0000  135.245   8.1593  ?   ?   419.529   12.706 0.000000 12.70635 
1 1 1   22   13    8 o  145.727   18.632   16.657   4.0609   27.294   5.9122   7.1566   5.5875  186.642   21.064   97.458   32.212 89.18404 38.48782 
1 1 1   22   13    9 f  649.735   9.5080  323.852   9.4557  351.617   14.393  302.771   12.542  676.099   13.908  627.572   13.057 48.52740 19.07665 
1 1 1   22   13   10 o  129.573   18.087   13.207   3.4893   15.586   4.2435   8.2398   6.1312  140.521   20.320  103.625   33.719 36.89578 39.36812 
1 1 1   22   13   11 o  346.442   8.8895   92.058   4.7139   98.212   5.8745   80.930   7.8995  357.654   10.731  324.039   15.927 33.61487 19.20461 
1 1 1   22   13   12 f  418.493   10.194  134.437   6.5299  155.856   9.7166  116.798   8.8179  449.981   14.108  389.427   14.793 60.55402 20.44181 
1 1 1   22   13   13 o  619.262   6.4362  293.852   6.1007  302.471   7.0365  267.760   12.243  628.164   7.3184  589.873   13.560 38.29126 15.40866 
1 1 1   22   13   14 o   66.706   25.421   2.4564   3.6009   3.5179   4.4074   0.3251   6.2451   75.977   28.303   74.066   31.499 1.911438 42.34660 
1 1 1   22   13   15 f  143.193   7.9641   15.773   1.7386   16.237   1.8064   9.9292   6.4099  145.273   8.1566  111.510   34.253 33.76278 35.21089 
1 1 1   22   13   16 o  216.725   8.8408   36.041   2.9327   35.031   3.2054   41.232   7.2666  213.603   9.8039  229.531   20.913 -15.92880 23.09664 
1 1 1   22   13   17 o   60.619   21.794   2.4208   2.5775   4.4059   2.7920  -9.0285   6.7053   74.851   22.527   56.667   27.133 18.18496 35.26579 
1 1 1   22   13   18 o  370.926   8.0954  105.548   4.5962  105.548   4.5962   0.0000   0.0000  370.926   8.0954  ?   ?  0.000000 8.095400 
1 1 1   22   13   19 o  178.597   11.118   24.620   3.0241   23.698   3.3628   28.517   6.9142  174.988   12.640  189.440   24.413 -14.45161 27.49158 
1 1 1   22   13   20 o  276.640   8.8843   58.754   3.7619   56.888   6.0836   59.910   4.7868  271.078   14.717  279.086   11.206 -8.008698 18.49772 
1 1 1   22   13   21 o  781.884   6.4885  468.698   7.7653  496.339   10.476  434.983   11.569  804.098   8.5113  752.310   10.047 51.78833 13.16761 
1 1 1   22   13   22 o  198.874   9.2532   30.383   2.8167   29.192   3.8530   31.750   4.1280  194.149   13.041  202.449   13.397 -8.299484 18.69658 
1 1 1   22   13   23 o  111.447   13.865   9.7343   2.3140   11.799   3.6290   8.3195   3.0038  121.481   20.228  101.628   20.023 19.85349 28.46178 
1 1 1   22   13   24 f  374.171   6.5676  107.375   3.7614  114.637   6.0174  102.717   4.8188  386.043   10.184  365.687   8.6091 20.35565 13.33509 
1 1 1   22   13   25 o   50.445   20.639   0.7517   2.5332   2.5240   3.7651  -0.7140   3.4240   67.483   25.929   51.555   22.616 15.92839 34.40625 
1 1 1   22   13   26 o  211.249   9.6511   34.328   3.1206   32.004   4.4072   36.665   4.4193  202.871   14.284  217.417   13.344 -14.54619 19.54748 
1 1 1   22   13   27 o   96.268   18.275   7.4584   2.5944   5.9735   4.2441   8.3444   3.2782   87.066   28.030  101.176   21.811 -14.11083 35.51563 
1 1 1   22   13   28 o  165.297   13.284   21.272   3.3325   22.446   4.5932   19.967   4.8424  168.645   18.076  158.264   20.469 10.38036 27.30791 
1 1 1   22   13   29 o  334.231   9.2202   85.971   4.7169   81.784   5.8064   94.097   8.0887  325.450   11.656  348.019   15.185 -22.56873 19.14258 
1 1 1   22   13   30 o  114.294   17.720   10.436   2.9997   13.269   5.0813   8.9203   3.7163  126.359   27.086  104.000   23.853 22.35918 36.09213 
1 1 1   22   13   31 o   80.004   22.412   5.2221   2.8540   6.7093   5.1403   4.5594   3.4316   92.263   30.909   76.683   25.239 15.58004 39.90502 
1 1 1   22   13   32 o  240.773   10.636   44.742   3.9198   50.316   9.3709   43.560   4.3155  249.640   24.855  237.024   11.933 12.61588 27.57116 
1 1 1   22   13   33 o  270.723   9.4504   56.484   3.9160   63.497   7.3382   53.691   4.6305  284.393   16.935  263.510   11.480 20.88229 20.45922 
1 1 1   22   13   34 o   58.254   23.363   1.4573   3.1727   9.5854   6.7173  -0.8766   3.5995  107.228   35.313   51.961   22.976 55.26720 42.12981 
1 1 1   22   13   35 o  195.763   12.234   29.819   3.6475   40.642   7.4780   26.440   4.1782  224.858   22.010  183.521   15.006 41.33681 26.63820 
1 1 1   22   13   36 o  159.468   14.808   20.008   3.5732   26.669   8.0143   18.356   3.9919  177.358   30.629  151.858   17.494 25.49983 35.27296 
1 1 1   22   13   37 o  116.420   20.187   11.048   3.4668   9.1967   6.6361   11.743   4.0657  104.637   35.120  119.082   23.140 -14.44479 42.05758 
1 1 1   22   13   38 o  230.084   11.319   41.035   3.9861   41.864   7.2382   40.675   4.7755  228.074   20.969  227.995   13.749 0.7899475E-01 25.07431 
1 1 1   22   13   39 f  191.187   13.694   28.664   3.9809   30.807   7.4327   27.802   4.7140  192.613   25.865  187.216   16.623 5.397415 30.74604 
1 1 1   22   13   40 o  289.980   10.131   65.096   4.4965   68.276   8.1339   63.697   5.3959  292.757   18.243  286.065   12.323 6.691528 22.01504 
1 1 1   22   13   41 o   78.363   27.646   4.7471   4.1288  -0.5155   6.9323   7.6401   5.1399   72.003   31.859   94.755   30.875 -22.75226 44.36482 
1 1 1   22   13   42 o  172.264   20.830   24.273   5.3807   25.012   6.4994   22.663   9.5930  172.326   25.403  153.751   40.280 18.57425 47.62136 
1 1 1   22   13   43 o   38.567   18.332  -3.3718   2.9459  -4.8381   5.2887  -2.7122   3.5472   52.896   24.970   45.355   21.097 7.540306 32.68891 
1 1 1   22   13   44 o  164.410   13.682   21.412   3.4119   18.905   7.5005   22.066   3.8313  142.187   34.756  166.259   15.224 -24.07202 37.94407 
1 1 1   22   13   45 o  209.107   10.379   34.053   3.3221   33.511   5.6714   34.337   4.0988  202.982   18.456  208.632   12.899 -5.650146 22.51657 
1 1 1   22   13   46 o   58.514   23.028   1.9859   3.0266   5.4507   5.1093   0.1129   3.7566   82.179   30.502   55.024   23.923 27.15524 38.76387 
1 1 1   22   13   47 o  133.720   16.640   14.618   3.3322   12.136   6.0496   15.699   3.9924  112.110   33.023  137.033   19.592 -24.92236 38.39781 
1 1 1   22   13   48 o   37.966   18.377  -4.6811   3.2784  -9.0443   6.7201  -3.3184   3.7556   52.855   25.750   44.615   21.055 8.239960 33.26200 
1 1 1   22   13   49 o   98.263   25.546   8.8444   3.8780   1.7761   5.4825   15.922   5.4861   67.796   29.187  130.593   28.266 -62.79732 40.63042 
1 1 1   22   13   50 o   62.786   24.581   2.7380   3.4329   3.7573   4.6905   1.5621   5.0378   71.431   28.490   64.874   27.953 6.556831 39.91357 
1 1 1   22   14    1 o  448.643   7.9893  154.290   5.4863  147.762   7.1750  163.479   8.5130  438.773   10.683  461.339   12.056 -22.56604 16.10834 
1 1 1   22   14    2 o  263.532   9.5011   53.272   3.8325   49.053   4.8071   60.629   6.3487  252.678   12.429  280.297   14.851 -27.61865 19.36587 
1 1 1   22   14    3 o   40.557   18.979  -2.9206   2.9412  -0.0738   3.6389  -8.2850   4.9951   55.997   23.934   46.568   22.575 9.428745 32.90133 
1 1 1   22   14    4 o  125.440   16.615   12.335   3.1117   12.335   3.1117   0.0000   0.0000  125.440   16.615  ?   ?  0.000000 16.61541 
1 1 1   22   14    5 o  309.455   8.7417   73.434   4.1406   73.434   4.1406   0.0000   0.0000  309.455   8.7417  ?   ?  0.000000 8.741652 
1 1 1   22   14    6 o  326.514   7.5008   81.713   3.7487   82.411   4.3421   79.669   7.4284  327.825   8.6534  321.676   15.087 6.149841 17.39263 
1 1 1   22   14    7 f  115.208   15.775   10.413   2.7087   10.772   3.0700   9.1509   5.7553  116.857   17.720  107.268   32.357 9.589218 36.89100 
1 1 1   22   14    8 o  267.770   7.4375   54.958   3.0483   55.502   3.3832   52.611   7.0272  269.047   8.2154  260.472   17.731 8.574341 19.54211 
1 1 1   22   14    9 o   58.952   21.478   2.2024   2.5144   1.3428   2.7939   5.8653   5.7673   55.840   22.077   92.016   32.652 -36.17596 39.41515 
1 1 1   22   14   10 o  345.336   5.5591   91.351   2.9384   92.074   3.1525   86.568   8.1115  346.677   5.9411  335.107   15.814 11.56946 16.89344 
1 1 1   22   14   11 o  298.046   5.6127   68.048   2.5605   68.340   2.7167   65.731   7.6622  298.667   5.9426  291.268   17.264 7.398499 18.25787 
1 1 1   22   14   12 o  185.595   6.6466   26.398   1.8881   26.100   1.9701   29.750   6.6165  184.535   6.9748  194.374   22.665 -9.839478 23.71371 
1 1 1   22   14   13 o  272.931   5.5370   57.065   2.3131   58.073   2.4366   47.867   7.3590  275.319   5.7820  247.845   19.557 27.47453 20.39417 
1 1 1   22   14   14 o  559.797   5.3893  240.058   4.6178  244.842   5.0480  215.525   11.432  565.301   5.8340  528.943   14.120 36.35785 15.27782 
1 1 1   22   14   15 o   77.525   13.882   4.7680   1.5867   4.3515   1.6379   11.125   6.3986   73.808   15.009  116.910   33.827 -43.10258 37.00781 
1 1 1   22   14   16 o  304.205   7.1273   70.951   3.3187   74.984   3.6721   52.968   7.7530  312.689   7.6724  260.608   19.579 52.08133 21.02901 
1 1 1   22   14   17 o   60.848   21.297   2.5665   2.4469   2.5665   2.4469   0.0000   0.0000   60.848   21.297  ?   ?  0.000000 21.29712 
1 1 1   22   14   18 o  294.811   7.5977   66.665   3.4284   70.524   3.8061   50.060   7.8946  303.169   8.2020  252.902   20.573 50.26695 22.14728 
1 1 1   22   14   19 o  205.415   14.317   32.714   4.4733   31.446   5.6025   34.945   7.4300  200.513   18.462  210.134   23.503 -9.621338 29.88706 
1 1 1   22   14   20 o  219.501   9.5161   37.015   3.1972   37.568   3.5092   34.315   7.7559  221.055   10.371  207.677   24.895 13.37781 26.96929 
1 1 1   22   14   21 o  282.307   7.2507   61.136   3.1331   71.588   4.1869   47.834   4.7231  305.302   8.9596  249.158   12.385 56.14369 15.28576 
1 1 1   22   14   22 o  245.358   7.9479   46.208   2.9849   51.239   4.0200   40.026   4.4561  258.127   10.175  227.462   12.852 30.66528 16.39166 
1 1 1   22   14   23 o   58.583   21.109   2.2738   2.4192   0.0448   3.3274   4.7732   3.5235   53.684   22.915   78.732   25.559 -25.04783 34.32710 
1 1 1   22   14   24 o  167.019   10.422   21.551   2.6511   21.555   4.1787   21.549   3.4296  165.825   16.690  166.466   13.579 -0.6412048 21.51617 
1 1 1   22   14   25 o  191.662   9.1634   28.243   2.6882   28.009   4.0665   28.425   3.5827  189.765   14.101  191.545   12.285 -1.779266 18.70156 
1 1 1   22   14   26 o  111.602   14.627   9.8090   2.4385   10.825   3.8170   9.1083   3.1696  115.425   22.413  106.174   20.243 9.251129 30.20121 
1 1 1   22   14   27 o  215.263   10.381   35.699   3.4204   36.392   4.5178   34.768   5.2353  216.393   13.711  210.808   16.353 5.585464 21.34044 
1 1 1   22   14   28 o  222.219   10.171   38.046   3.4595   40.763   4.6387   34.642   5.1930  229.104   13.285  210.361   16.254 18.74318 20.99262 
1 1 1   22   14   29 o  440.255   7.0137  148.831   4.7263  156.046   6.6779  141.589   6.6902  450.122   9.6926  428.619   10.198 21.50290 14.06903 
1 1 1   22   14   30 o  120.229   15.871   11.442   2.8493   12.058   4.9228   11.132   3.4940  120.199   27.370  117.416   20.168 2.783043 33.99840 
1 1 1   22   14   31 o  273.059   8.5710   57.372   3.5822   61.667   5.9234   54.895   4.4980  281.909   13.727  266.631   11.021 15.27838 17.60444 
1 1 1   22   14   32 o  142.413   16.971   16.074   3.6265   1.1529   11.415   17.749   3.8247   95.939   41.706  149.736   16.988 -53.79701 45.03317 
1 1 1   22   14   33 o  239.584   10.326   44.307   3.7865   41.783   6.8687   45.409   4.5384  229.303   19.763  241.813   12.302 -12.50902 23.27941 
1 1 1   22   14   34 o  163.054   14.192   20.842   3.5067   18.673   6.6163   21.689   4.1353  148.367   30.162  165.675   16.528 -17.30786 34.39362 
1 1 1   22   14   35 o  182.794   13.009   26.081   3.6159   34.239   6.9535   23.057   4.2333  205.917   22.424  170.819   16.392 35.09798 27.77704 
1 1 1   22   14   36 o  125.439   18.749   12.681   3.4894   13.322   7.1259   12.479   4.0020  122.887   35.739  123.309   22.011 -0.4216232 41.97361 
1 1 1   22   14   37 f  243.770   10.469   45.966   3.9062   49.012   6.6287   44.346   4.8349  248.790   17.519  238.304   13.308 10.48521 22.00059 
1 1 1   22   14   38 o   57.717   23.791   1.0912   3.3975   5.4233   6.0075  -0.9459   4.1195   87.433   32.951   55.225   24.491 32.20847 41.05560 
1 1 1   22   14   39 o  162.871   15.364   20.992   3.7849   18.924   6.5714   22.019   4.6300  148.051   30.026  165.614   18.586 -17.56389 35.31261 
1 1 1   22   14   40 o  201.546   15.487   32.127   4.7411   26.985   6.9248   36.665   6.5047  179.452   25.966  213.061   20.187 -33.60916 32.88944 
1 1 1   22   14   41 o  105.163   34.355   9.7710   6.3624   9.7710   6.3624   0.0000   0.0000  105.163   34.355  ?   ?  0.000000 34.35498 
1 1 1   22   14   42 o  133.317   20.566   14.652   4.0617   18.859   6.0672   11.236   5.4676  147.618   27.874  112.115   30.879 35.50250 41.59874 
1 1 1   22   14   43 o  109.596   24.590   10.342   4.0235   12.859   5.8146   8.0290   5.5733  118.999   31.449   95.702   32.185 23.29724 44.99854 
1 1 1   22   14   44 o   96.432   29.215   8.2788   4.6844  -5.4451   7.4852   17.114   6.0059   63.476   29.885  138.561   29.237 -75.08512 41.80831 
1 1 1   22   14   45 o   49.990   22.589  -1.3201   3.6864   3.1677   5.2818  -5.5827   5.1475   73.849   29.959   50.135   23.942 23.71405 38.35015 
1 1 1   22   14   46 o   50.131   22.611  -1.1632   3.6739  -7.2831   5.1092   5.3895   5.2867   46.788   22.716   81.896   30.900 -35.10805 38.35117 
1 1 1   22   14   47 o   83.601   26.843   6.2378   3.8944   3.5960   5.7182   8.5232   5.3185   75.472   30.959   95.195   31.426 -19.72261 44.11359 
1 1 1   22   14   48 o   63.390   25.303   2.5170   3.7024   4.0006   5.2224   1.0179   5.2496   74.746   29.976   64.860   28.239 9.886726 41.18270 
1 1 1   22   14   49 o  103.123   23.254   9.5050   3.5829   9.4469   4.9323   9.5699   5.2133   98.687   29.996   98.757   30.983 -0.6912231E-01 43.12429 
1 1 1   22   15    0 o  425.904   10.584  139.292   6.8904  139.292   6.8904  139.292   6.8904  425.904   10.584  425.904   10.584 0.000000 0.000000 
1 1 1   22   15    1 o  509.036   11.016  198.961   8.5828  198.961   8.5828   0.0000   0.0000  509.036   11.016  ?   ?  0.000000 11.01572 
1 1 1   22   15    2 o  269.428   8.2384   55.658   3.3975   55.639   3.9219   55.717   6.8010  269.298   9.5146  268.301   16.643 0.9975586 19.17074 
1 1 1   22   15    3 o  308.424   8.9879   72.963   4.2430   72.963   4.2430   0.0000   0.0000  308.424   8.9879  ?   ?  0.000000 8.987926 
1 1 1   22   15    4 o  573.305   8.2940  252.023   7.2781  252.023   7.2781   0.0000   0.0000  573.305   8.2940  ?   ?  0.000000 8.294011 
1 1 1   22   15    5 o   84.128   21.467   5.6955   2.7734   4.8807   3.0972   8.9918   6.2293   78.859   23.725  107.185   33.901 -28.32595 41.37800 
1 1 1   22   15    6 o  476.078   7.1186  173.710   5.1873  174.950   6.0696  170.350   9.9908  477.650   8.3019  470.500   13.873 7.150085 16.16730 
1 1 1   22   15    7 f  388.745   7.3704  115.839   4.3856  114.342   5.0330  120.562   8.9385  386.122   8.5159  395.652   14.760 -9.529480 17.04037 
1 1 1   22   15    8 o  151.130   11.818   17.658   2.7120   17.823   2.9687   16.828   6.6676  151.689   12.909  143.588   31.227 8.101547 33.79029 
1 1 1   22   15    9 o  519.244   6.4046  206.597   5.0902  218.077   5.8732  171.950   10.204  533.388   7.1939  472.575   14.106 60.81329 15.83467 
1 1 1   22   15   10 o  260.899   7.8051   52.192   3.1169   53.121   3.4049   47.387   7.7441  263.168   8.4527  246.356   20.730 16.81155 22.38678 
1 1 1   22   15   11 o  455.541   7.2531  159.083   5.0573  166.402   5.9115  139.103   9.7671  465.783   8.2917  424.805   15.021 40.97772 17.15782 
1 1 1   22   15   12 o   65.764   14.897   3.4657   1.4648   3.3315   1.4986   6.3415   6.9354   64.449   15.401   97.569   35.652 -33.12034 38.83587 
1 1 1   22   15   13 o  315.084   5.8125   76.066   2.8033   77.585   2.9684   63.538   8.5238  318.197   6.0947  285.630   19.616 32.56650 20.54063 
1 1 1   22   15   14 o  142.214   7.9885   15.562   1.7319   15.606   1.7806   14.776   7.4540  142.398   8.2041  133.640   35.744 8.758072 36.67376 
1 1 1   22   15   15 o   60.295   16.375   2.9014   1.5503   2.6604   1.5866   7.9867   7.2891   58.078   16.856  104.726   36.752 -46.64768 40.43272 
1 1 1   22   15   16 o   94.284   15.717   7.0461   2.1883   7.9466   2.2860  -2.8159   7.5653  100.326   15.377   73.188   32.774 27.13821 36.20211 
1 1 1   22   15   17 o   68.985   28.184   1.5243   4.7154   1.5243   4.7154   0.0000   0.0000   68.985   28.184  ?   ?  0.000000 28.18409 
1 1 1   22   15   18 o  308.337   10.516   73.090   4.9632   81.429   6.1929   58.117   8.2984  325.158   12.443  272.635   20.026 52.52310 23.57680 
1 1 1   22   15   19 o  345.181   7.2887   91.395   3.8509   92.620   4.2300   85.467   9.3074  347.411   7.9547  331.283   18.428 16.12802 20.07174 
1 1 1   22   15   20 f  340.638   7.4103   89.021   3.8637   91.679   4.2950   77.749   8.8457  345.600   8.1193  315.839   18.377 29.76132 20.09082 
1 1 1   22   15   21 o  226.313   9.3284   39.358   3.2314   40.191   3.5206   34.908   8.1406  228.618   10.061  208.808   26.036 19.81035 27.91261 
1 1 1   22   15   22 o   45.740   20.155  -0.7200   2.7464  -0.0359   2.9517  -5.1321   7.4961   50.315   21.532   67.618   31.178 -17.30258 37.89073 
1 1 1   22   15   23 o  213.704   8.7757   35.092   2.8705   34.819   3.7790   35.464   4.4136  212.229   11.678  213.825   13.556 -1.596100 17.89229 
1 1 1   22   15   24 o  241.355   7.8389   44.732   2.8959   44.351   4.3457   45.035   3.8840  239.810   11.839  241.851   10.492 -2.040497 15.81913 
1 1 1   22   15   25 f  379.010   6.3097  110.191   3.6604  116.499   5.3412  104.604   5.0263  389.250   8.9648  368.855   8.9028 20.39471 12.63437 
1 1 1   22   15   26 o  186.660   10.975   26.953   3.1220   28.319   3.9556   24.697   5.0841  190.805   13.634  176.710   19.101 14.09479 23.46747 
1 1 1   22   15   27 o  415.441   6.3844  132.434   4.0597  147.922   6.1226  120.282   5.4234  438.462   9.1229  395.418   8.9608 43.04361 12.78762 
1 1 1   22   15   28 o   89.196   19.995   6.4870   2.6623  -1.3707   4.1792   11.854   3.4539   54.968   24.505  121.591   19.195 -66.62287 31.12819 
1 1 1   22   15   29 f  132.712   14.927   13.852   2.9795   15.830   4.5824   12.403   3.9217  139.919   22.133  123.715   21.490 16.20422 30.84923 
1 1 1   22   15   30 o  113.534   17.523   10.304   2.9471   6.3200   5.1482   12.245   3.5943   90.338   30.930  123.359   19.698 -33.02081 36.67000 
1 1 1   22   15   31 o  229.883   11.278   40.836   3.9684   49.816   11.776   39.686   4.2149  243.987   32.330  226.115   12.224 17.87268 34.56393 
1 1 1   22   15   32 o   85.459   21.941   6.0183   2.8848   4.2899   4.8819   6.9456   3.5758   79.929   29.786   91.491   24.878 -11.56168 38.80880 
1 1 1   22   15   33 o  326.599   8.0402   82.074   4.0193   87.652   6.5671   78.733   5.0824  336.147   12.764  319.307   10.399 16.83954 16.46355 
1 1 1   22   15   34 o  178.615   12.644   24.875   3.4344   21.243   5.9892   26.654   4.1921  160.612   25.191  184.249   14.995 -23.63689 29.31626 
1 1 1   22   15   35 o  213.516   11.968   35.455   3.8957   49.138   8.6317   31.955   4.3656  246.468   23.152  202.003   14.210 44.46521 27.16483 
1 1 1   22   15   36 o  180.342   13.479   25.459   3.6939   31.065   6.9141   23.219   4.3698  195.110   23.634  171.081   16.909 24.02879 29.05981 
1 1 1   22   15   37 o   81.606   25.251   5.4667   3.4763   13.440   6.0704   1.5761   4.2405  124.034   31.819   64.899   26.645 59.13461 41.50200 
1 1 1   22   15   38 o  105.131   22.542   9.2150   3.5185   6.4624   6.3812   10.417   4.2176   92.353   34.125  110.948   25.385 -18.59480 42.53138 
1 1 1   22   15   39 o   91.106   25.338   7.0325   3.6617  -7.7473   6.6036   13.594   4.4001   56.282   26.943  127.708   23.371 -71.42633 35.66695 
1 1 1   22   15   40 o  104.922   34.842   9.6495   6.5344   9.6495   6.5344   0.0000   0.0000  104.922   34.842  ?   ?  0.000000 34.84246 
1 1 1   22   15   41 o   55.420   24.893  -1.3541   4.3997  -3.3834   5.9585   1.0786   6.5241   60.073   27.733   73.813   31.808 -13.73976 42.20033 
1 1 1   22   15   42 o   95.258   25.238   7.8417   3.7387   10.660   5.7802   5.8148   4.9022  108.509   32.359   84.703   30.098 23.80547 44.19263 
1 1 1   22   15   43 o  171.585   17.420   23.784   4.5116   12.776   8.0645   28.798   5.4431  115.407   38.715  187.942   19.190 -72.53491 43.21064 
1 1 1   22   15   44 o   75.401   29.161   3.9607   4.7858   4.6398   7.8470   3.5586   6.0389   86.958   36.028   78.159   31.909 8.798729 48.12685 
1 1 1   22   15   45 o  100.318   26.519   8.9747   4.1338   14.516   5.5351   1.9857   6.2161  126.434   29.192   73.314   31.308 53.11955 42.80632 
1 1 1   22   15   46 o   57.981   24.315   1.1920   3.6373   3.3530   5.0719  -1.0964   5.2193   72.814   29.421   59.641   26.921 13.17275 39.87851 
1 1 1   22   15   47 o  169.135   17.763   23.609   4.5299   23.435   7.0994   23.729   5.8832  158.239   30.416  164.874   24.018 -6.634369 38.75606 
1 1 1   22   15   48 o   68.271   26.315   3.4720   3.8872   9.3177   4.9276  -6.1600   6.3252   98.403   29.998   54.592   26.196 43.81121 39.82555 
1 1 1   22   15   49 o   77.111   26.036   5.3260   3.6473   0.5107   5.0117   10.749   5.3182   61.663   27.196  104.166   31.033 -42.50344 41.26300 
1 1 1   22   16    0 o  197.124   21.488   30.974   6.2879   30.974   6.2879   30.974   6.2879  197.124   21.488  197.124   21.488 0.000000 0.000000 
1 1 1   22   16    1 o  161.275   12.085   20.102   2.9615   20.532   3.3324   18.484   6.4597  162.808   13.494  151.184   28.970 11.62451 31.95812 
1 1 1   22   16    2 o  334.238   9.1037   85.707   4.6574   85.707   4.6574   0.0000   0.0000  334.238   9.1037  ?   ?  0.000000 9.103654 
1 1 1   22   16    3 o   90.616   22.848   6.6273   3.1683   6.6273   3.1683   0.0000   0.0000   90.616   22.848  ?   ?  0.000000 22.84790 
1 1 1   22   16    4 o  391.893   7.4379  117.732   4.4616  119.215   5.2161  113.692   8.6122  394.238   8.6441  384.195   14.645 10.04266 17.00588 
1 1 1   22   16    5 o  475.636   7.2489  173.413   5.2773  176.836   6.2384  164.797   9.8962  480.166   8.4881  462.670   13.974 17.49585 16.35014 
1 1 1   22   16    6 o  588.551   7.3180  265.536   6.5924  264.119   7.7436  269.266   12.566  586.792   8.6216  591.409   13.882 -4.616638 16.34124 
1 1 1   22   16    7 o  300.352   8.3584   69.191   3.8426   68.482   4.3394   71.763   8.2702  298.716   9.4908  304.203   17.840 -5.486511 20.20707 
1 1 1   22   16    8 o  484.703   6.5405  180.045   4.8524  182.198   5.4281  171.479   10.827  487.513   7.2743  471.669   14.997 15.84454 16.66827 
1 1 1   22   16    9 o  281.969   7.6186   60.962   3.2881   60.186   3.5723   65.269   8.4123  280.116   8.3319  289.721   19.077 -9.605042 20.81676 
1 1 1   22   16   10 o  131.110   14.507   13.406   2.8624   13.185   3.0853   14.776   7.6704  129.771   15.863  133.786   36.461 -4.014816 39.76246 
1 1 1   22   16   11 o  497.549   7.3718  189.809   5.6141  191.437   6.4402  184.655   11.457  499.537   8.4229  489.251   15.300 10.28662 17.46500 
1 1 1   22   16   12 f  317.865   7.0690   77.462   3.4393   79.363   3.7204   66.286   9.0203  321.702   7.5555  291.507   20.344 30.19547 21.70163 
1 1 1   22   16   13 o  257.121   6.2152   50.667   2.4460   50.138   2.5550   56.470   8.4660  255.758   6.5267  268.783   20.739 -13.02444 21.74141 
1 1 1   22   16   14 o  189.251   9.9218   27.586   2.8641   28.964   3.0918   19.256   7.6040  193.863   10.458  152.703   33.458 41.15923 35.05400 
1 1 1   22   16   15 o  299.019   8.0440   68.601   3.6816   72.572   4.0749   50.954   8.5898  307.491   8.6579  254.671   22.260 52.81976 23.88423 
1 1 1   22   16   17 o  249.124   7.9004   47.622   3.0125   48.021   3.2332   44.997   8.2959  250.118   8.4455  238.815   22.979 11.30325 24.48162 
1 1 1   22   16   18 o  161.032   10.546   20.026   2.5850   19.918   2.7361   20.922   7.8879  160.502   11.207  158.798   33.506 1.703674 35.33053 
1 1 1   22   16   19 f  228.987   8.9314   40.275   3.1304   40.453   3.3629   39.124   8.5681  229.428   9.5762  221.417   25.763 8.011566 27.48532 
1 1 1   22   16   20 o  303.118   8.1183   70.539   3.7666   72.246   4.1081   61.533   9.4356  306.686   8.7514  279.442   22.244 27.24374 23.90392 
1 1 1   22   16   21 o  167.272   11.544   21.657   2.9374   22.075   3.1458   18.814   8.2078  168.764   12.262  149.139   36.299 19.62531 38.31376 
1 1 1   22   16   22 o  210.153   10.132   33.982   3.2592   34.787   3.5229   29.204   8.5858  212.266   10.880  188.609   30.804 23.65666 32.66886 
1 1 1   22   16   23 o  103.602   19.773   8.6556   3.0212   7.2493   3.2419   17.938   8.3292   94.161   22.749  144.925   37.322 -50.76437 43.70878 
1 1 1   22   16   24 o  308.716   7.2524   73.163   3.4270   75.370   4.4044   69.778   5.4556  313.045   9.1920  300.720   11.853 12.32492 14.99914 
1 1 1   22   16   25 o   45.039   19.706  -0.4958   2.5845   0.4621   3.0669  -2.8427   4.8008   53.221   22.324   55.489   25.349 -2.267323 33.77717 
1 1 1   22   16   26 o  100.694   16.051   8.0737   2.3908   5.8705   3.4033   10.220   3.3593   84.960   24.696  112.492   20.255 -27.53220 31.93974 
1 1 1   22   16   27 o  182.054   9.7535   25.598   2.7080   27.199   3.9398   24.165   3.7283  186.824   13.877  176.023   13.952 10.80096 19.67821 
1 1 1   22   16   28 o  132.892   14.520   13.868   2.9055   11.562   4.4641   15.563   3.8271  118.229   25.424  139.882   18.315 -21.65299 31.33345 
1 1 1   22   16   29 o  279.035   8.2607   59.882   3.5281   65.332   5.6603   56.420   4.5119  290.476   12.731  270.355   10.903 20.12024 16.76161 
1 1 1   22   16   30 o  274.299   8.1574   57.872   3.4249   65.839   5.2526   51.979   4.5172  291.785   11.761  259.346   11.379 32.43930 16.36494 
1 1 1   22   16   31 o  241.067   10.605   44.869   3.9130   45.434   8.5467   44.718   4.4013  237.368   23.846  240.376   11.963 -3.007568 26.67862 
1 1 1   22   16   32 o  157.637   13.021   19.409   3.1137   13.343   5.0302   23.176   3.9645  126.228   26.860  171.749   15.239 -45.52084 30.88191 
1 1 1   22   16   33 o   58.543   23.060   1.7037   3.0377   11.025   5.2946  -2.8702   3.7089  113.633   30.000   46.856   21.719 66.77760 37.03610 
1 1 1   22   16   34 o  214.798   10.614   35.671   3.4895   39.507   5.7332   33.413   4.3980  223.755   16.864  206.677   13.985 17.07822 21.90815 
1 1 1   22   16   35 o  141.326   16.263   15.858   3.4538   10.539   6.2351   18.213   4.1484  110.422   33.760  150.877   18.341 -40.45490 38.42064 
1 1 1   22   16   36 o  191.880   12.591   28.738   3.6773   29.868   6.6511   28.240   4.4132  191.345   23.183  189.307   15.363 2.037842 27.81108 
1 1 1   22   16   37 o   71.916   25.193   3.8776   3.4244   7.1008   6.1859   2.4534   4.1120   94.622   33.790   67.779   26.788 26.84301 43.12064 
1 1 1   22   16   38 o  155.786   17.984   19.465   4.2095   20.658   6.2722   18.487   5.6783  156.252   27.215  148.255   25.969 7.997559 37.61697 
1 1 1   22   16   39 o   58.635   24.895   0.5903   3.8898   4.9574   6.1119  -2.3827   5.0428   85.268   32.961   57.135   26.054 28.13308 42.01420 
1 1 1   22   16   40 o  109.867   28.757   10.575   4.8923   14.028   5.8447   2.4931   8.9421  125.818   30.636   86.834   37.328 38.98425 48.28966 
1 1 1   22   16   41 o   55.530   23.663   0.4685   3.5376  -0.1662   5.8322   0.8379   4.4497   66.891   29.426   62.503   26.585 4.387650 39.65657 
1 1 1   22   16   42 o  220.666   12.270   38.212   4.1279   39.101   6.3621   37.565   5.4247  219.427   19.134  216.652   16.482 2.774155 25.25421 
1 1 1   22   16   43 o  125.146   23.755   13.384   4.3840   7.8460   8.3099   15.520   5.1605   97.786   38.256  133.602   26.172 -35.81646 46.35129 
1 1 1   22   16   44 o   95.694   25.992   8.0921   3.9057   7.9028   5.7042   8.2592   5.3589   94.077   32.540   95.613   31.544 -1.536194 45.31934 
1 1 1   22   16   45 o  104.775   26.240   9.8336   4.1990   14.294   5.5989   4.0996   6.3479  124.470   29.786   79.768   32.658 44.70281 44.20084 
1 1 1   22   16   46 f  100.490   29.293   9.4455   4.7823   8.0121   6.7837   10.862   6.7429   93.215   35.037  104.520   35.400 -11.30495 49.80698 
1 1 1   22   16   47 o  236.616   11.992   44.369   4.3291   34.599   5.8859   55.881   6.3895  203.559   19.115  262.194   15.998 -58.63513 24.92595 
1 1 1   22   16   48 o   92.067   25.398   7.7863   3.6955   11.038   4.9642   3.7439   5.5346  107.082   29.394   74.098   30.433 32.98452 42.31069 
1 1 1   22   17    0 o  410.632   13.893  129.880   8.7092  129.880   8.7092  129.880   8.7092  410.632   13.893  410.632   13.893 0.000000 0.000000 
1 1 1   22   17    1 o  231.762   10.965   41.264   3.8899   41.264   3.8899   0.0000   0.0000  231.762   10.965  ?   ?  0.000000 10.96538 
1 1 1   22   17    2 o  252.432   9.4485   48.906   3.6507   49.968   4.1224   45.044   7.8597  255.070   10.559  239.898   21.638 15.17204 24.07645 
1 1 1   22   17    3 o  101.495   19.752   8.2476   2.9581   8.7045   3.2659   6.1608   6.9798  104.073   21.221   97.080   35.721 6.992714 41.54916 
1 1 1   22   17    4 o  165.175   14.925   21.197   3.7325   21.197   3.7325   0.0000   0.0000  165.175   14.925  ?   ?  0.000000 14.92461 
1 1 1   22   17    5 o  267.516   10.398   54.963   4.2575   54.963   4.2575   0.0000   0.0000  267.516   10.398  ?   ?  0.000000 10.39772 
1 1 1   22   17    6 o  276.444   8.9967   58.643   3.8068   59.623   4.3228   55.255   8.0345  278.645   10.136  266.262   19.857 12.38327 22.29420 
1 1 1   22   17    7 f  573.212   7.3508  251.916   6.4494  253.897   7.5712  246.678   12.312  575.269   8.5985  565.820   14.217 9.449524 16.61461 
1 1 1   22   17    8 o  137.452   13.436   14.685   2.7906   15.127   3.0039   11.896   7.5397  139.392   14.281  121.317   37.130 18.07450 39.78185 
1 1 1   22   17    9 o   68.411   21.834   3.5721   2.5794   4.4711   2.7540  -2.8508   7.3611   75.228   22.313   72.099   32.305 3.128868 39.26178 
1 1 1   22   17   10 o  324.196   8.3136   80.636   4.1254   84.812   4.6457   65.062   8.9712  332.400   9.1311  288.731   20.432 43.66931 22.37914 
1 1 1   22   17   11 o  456.477   6.6054  159.725   4.6152  158.130   5.0702  167.432   11.146  454.112   7.2945  465.649   15.639 -11.53668 17.25646 
1 1 1   22   17   12 o  232.062   8.5861   41.329   3.0498   41.474   3.2454   40.235   8.9205  232.427   9.1224  224.928   26.413 7.499344 27.94421 
1 1 1   22   17   13 o  547.495   6.7042  229.806   5.6182  237.023   6.2897  201.314   12.497  555.922   7.3917  510.342   15.998 45.57956 17.62285 
1 1 1   22   17   14 o  340.081   7.1378   88.694   3.7155   85.806   3.9869  107.763   10.245  334.433   7.7886  372.835   17.952 -38.40189 19.56907 
1 1 1   22   17   15 o   55.813   17.176   2.4124   1.6109   2.4124   1.6109   0.0000   0.0000   55.813   17.176  ?   ?  0.000000 17.17584 
1 1 1   22   17   16 o  238.598   8.4486   43.703   3.0855   43.731   3.3209   43.529   8.3437  238.616   9.0926  234.605   23.553 4.010391 25.24752 
1 1 1   22   17   17 o  506.770   7.5581  197.048   5.8626  202.600   6.7211  179.385   11.988  513.676   8.5484  481.292   16.273 32.38470 18.38179 
1 1 1   22   17   18 o  366.520   7.8224  103.104   4.3884  104.019   4.8985   99.386   9.8768  368.018   8.6961  357.193   18.125 10.82495 20.10287 
1 1 1   22   17   19 o   82.231   19.147   5.4737   2.3649   4.8981   2.4742   11.557   8.0441   77.807   20.492  119.289   38.608 -41.48167 43.70930 
1 1 1   22   17   20 o  144.357   12.736   16.202   2.7854   17.752   2.9534   3.7411   8.3766  151.123   12.891   92.996   37.727 58.12630 39.86899 
1 1 1   22   17   21 o  161.747   11.588   20.267   2.8499   19.548   3.0284   25.835   8.4256  158.665   12.573  176.495   32.382 -17.82935 34.73743 
1 1 1   22   17   22 o  305.973   8.4805   71.938   3.9717   75.788   4.3614   53.241   9.6118  313.962   9.0757  258.350   24.604 55.61133 26.22441 
1 1 1   22   17   23 o  503.561   8.2368  194.842   6.3486  203.709   7.3623  169.126   12.537  514.597   9.3471  465.857   17.583 48.73926 19.91277 
1 1 1   22   17   24 o  290.512   8.8090   64.901   3.9171   63.961   4.2206   70.738   10.520  288.278   9.5651  298.268   23.225 -9.990021 25.11776 
1 1 1   22   17   25 o  237.998   7.7935   43.519   2.8391   40.397   3.9285   46.933   4.1076  228.824   11.217  246.700   10.878 -17.87592 15.62497 
1 1 1   22   17   26 o  269.027   7.8440   55.617   3.2300   59.824   4.7581   52.022   4.3988  278.433   11.165  259.660   11.068 18.77298 15.72087 
1 1 1   22   17   27 o  292.432   7.7401   65.718   3.4645   68.179   5.2239   63.785   4.6289  297.124   11.487  287.600   10.515 9.524170 15.57280 
1 1 1   22   17   28 o   63.733   21.889   2.9758   2.5791   4.4106   3.7711   1.7151   3.5350   76.811   26.464   61.934   24.724 14.87721 36.21593 
1 1 1   22   17   29 f  253.853   8.3878   49.579   3.2591   53.007   4.8919   46.842   4.3702  261.715   12.212  246.158   11.599 15.55684 16.84239 
1 1 1   22   17   30 o   84.391   23.585   5.8582   3.1645   14.067   7.5464   4.1066   3.4858  127.093   36.726   74.014   25.446 53.07924 44.67991 
1 1 1   22   17   31 o  240.246   8.9652   44.463   3.2968   53.344   5.1218   38.180   4.3078  262.272   12.759  221.533   12.758 40.73897 18.04300 
1 1 1   22   17   32 o  107.626   18.826   9.3743   2.9884   8.9760   4.8120   9.6244   3.8128  103.048   29.184  107.650   23.775 -4.602318 37.64216 
1 1 1   22   17   33 o  215.253   10.380   35.802   3.4199   31.773   5.1578   38.964   4.5686  200.526   16.963  223.458   13.419 -22.93198 21.62954 
1 1 1   22   17   34 o   76.293   24.250   4.6708   3.1846   5.5559   5.0382   4.0818   4.1097   85.652   30.505   75.670   27.475 9.982567 41.05395 
1 1 1   22   17   35 o  169.261   15.039   22.575   3.8557   20.654   6.0910   23.859   4.9806  157.379   26.207  172.537   19.184 -15.15819 32.47860 
1 1 1   22   17   36 o  161.424   14.603   20.533   3.5691   22.540   5.5999   19.160   4.6317  166.036   22.624  153.915   20.144 12.12112 30.29214 
1 1 1   22   17   37 o   52.136   23.184  -0.9721   3.7161  -3.8100   6.0531   0.7444   4.7076   60.273   27.870   64.332   27.353 -4.058849 39.05044 
1 1 1   22   17   38 o  100.189   23.706   8.4788   3.5787   14.079   6.4650   6.0050   4.2971  125.540   33.153   85.480   28.249 40.06007 43.55598 
1 1 1   22   17   39 o   42.653   20.764  -7.0909   4.3467 -12.5535   5.7867  -0.0181   6.5846   44.843   22.238   71.419   31.346 -26.57523 38.43308 
1 1 1   22   17   40 o  187.517   14.346   27.802   4.0864   21.052   5.8979   34.034   5.6670  157.747   25.280  205.658   18.191 -47.91064 31.14476 
1 1 1   22   17   41 o   52.238   23.028  -0.5027   3.5894  -3.6800   5.5777   1.7432   4.6893   56.903   26.464   66.810   27.780 -9.906734 38.36747 
1 1 1   22   17   42 o   54.182   23.374   0.1956   3.5310   5.4926   5.6132  -3.2728   4.5422   84.369   31.838   51.087   23.800 33.28203 39.75031 
1 1 1   22   17   43 o   53.980   24.283  -1.1950   4.2047 -10.0455   8.3775   1.7853   4.8614   60.785   29.411   67.237   28.148 -6.451782 40.71049 
1 1 1   22   17   44 o   98.661   26.480   8.7046   4.0824   8.4520   6.4966   8.8694   5.2481   96.260   34.602   98.084   31.126 -1.823143 46.54164 
1 1 1   22   17   45 o  262.278   11.235   54.002   4.5102   52.599   6.5729   55.251   6.2001  254.313   16.983  261.923   15.535 -7.609451 23.01646 
1 1 1   22   17   46 o  161.617   17.092   21.474   4.1641   15.347   5.9750   27.261   5.8064  126.576   31.070  178.742   21.666 -52.16615 37.87851 
1 1 1   22   17   47 o   75.142   26.996   4.8361   3.9540   1.1270   5.0589   10.660   6.3389   64.067   27.808  102.421   34.324 -38.35385 44.17501 
1 1 1   22   18    1 o   80.571   32.520   2.5101   6.1898   0.0000   0.0000   2.5101   6.1898  ?   ?    80.571   32.520 0.000000 32.52032 
1 1 1   22   18    2 f  237.647   9.5769   43.358   3.4836   41.723   3.9671   48.865   7.2808  232.995   11.124  250.414   19.140 -17.41879 22.13819 
1 1 1   22   18    3 o  198.511   11.537   30.398   3.4904   30.076   3.9996   31.425   7.1481  197.194   13.329  199.345   23.903 -2.150833 27.36876 
1 1 1   22   18    4 o  363.731   8.1432  101.485   4.5336   97.442   5.1974  114.351   9.2714  356.260   9.5312  384.890   15.738 -28.62924 18.39881 
1 1 1   22   18    5 o  158.798   14.276   19.591   3.4328   18.264   3.8022   25.440   7.9844  152.888   16.510  177.155   30.549 -24.26707 34.72477 
1 1 1   22   18    6 o  188.351   13.198   27.450   3.7808   27.450   3.7808   0.0000   0.0000  188.351   13.198  ?   ?  0.000000 13.19767 
1 1 1   22   18    7 o  125.417   18.898   12.454   3.5152   12.454   3.5152   0.0000   0.0000  125.417   18.898  ?   ?  0.000000 18.89786 
1 1 1   22   18    8 o  333.953   7.6364   85.535   3.9034   89.746   4.3028   65.956   9.2774  342.017   8.2193  290.491   21.007 51.52600 22.55771 
1 1 1   22   18    9 o  389.548   8.1088  116.422   4.8349  117.266   5.5103  113.598   10.079  390.817   9.2115  383.143   17.187 7.674042 19.49956 
1 1 1   22   18   10 o  168.613   11.123   21.956   2.8545   22.282   3.0556   19.717   8.0008  169.768   11.833  154.138   34.743 15.62964 36.70285 
1 1 1   22   18   11 o  413.516   6.9715  131.117   4.4125  132.626   4.8289  123.480   10.863  415.815   7.5871  399.190   17.779 16.62515 19.32981 
1 1 1   22   18   12 o  105.367   16.758   8.7986   2.6121   9.5310   2.7543   2.2484   8.2372  109.720   16.946   88.890   36.877 20.83018 40.58462 
1 1 1   22   18   13 o  339.386   7.3668   88.351   3.8268   90.065   4.1306   77.966   10.168  342.606   7.8767  315.559   21.174 27.04745 22.59132 
1 1 1   22   18   14 o  289.337   8.4616   64.267   3.7474   64.267   3.7474   0.0000   0.0000  289.337   8.4616  ?   ?  0.000000 8.461597 
1 1 1   22   18   15 o  154.822   12.152   18.577   2.8566   18.577   2.8566   0.0000   0.0000  154.822   12.152  ?   ?  0.000000 12.15183 
1 1 1   22   18   16 o  107.896   13.979   9.1359   2.2543   10.066   2.3517  -1.3986   7.9160  113.362   13.841   77.836   34.261 35.52579 36.95098 
1 1 1   22   18   17 o  205.740   8.9620   32.520   2.8222   34.017   2.9831   19.764   8.7106  210.391   9.2636  152.736   37.529 57.65512 38.65499 
1 1 1   22   18   18 o  164.060   10.481   20.795   2.6182   20.334   2.7409   25.609   8.8523  162.125   11.112  175.256   34.228 -13.13039 35.98658 
1 1 1   22   18   19 o  229.004   9.3847   40.320   3.2895   42.421   3.5003   24.432   9.6249  234.855   9.7373  169.444   38.043 65.41092 39.26940 
1 1 1   22   18   20 o  382.339   18.930  114.068   11.078   0.0000   0.0000  114.068   11.078  ?   ?   382.339   18.930 0.000000 18.93045 
1 1 1   22   18   21 o  225.980   9.3631   39.279   3.2386   40.830   3.4673   28.668   9.0677  230.341   9.8345  185.472   33.158 44.86861 34.58561 
1 1 1   22   18   22 o  141.537   15.717   15.740   3.3474   15.322   3.6010   18.400   9.0816  139.251   17.265  145.760   39.653 -6.509125 43.24829 
1 1 1   22   18   23 o  250.160   10.152   48.202   3.8872   49.422   4.2034   40.997   10.216  253.191   10.846  223.255   30.708 29.93614 32.56738 
1 1 1   22   18   24 f   72.125   23.729   3.9870   3.0332   5.1933   3.2104  -6.0469   9.2590   80.338   24.151   74.489   34.453 5.849693 42.07433 
1 1 1   22   18   25 o  409.824   7.9863  129.086   5.0097  135.451   5.5055   98.445   12.080  419.670   8.5707  352.087   22.533 67.58310 24.10822 
1 1 1   22   18   26 o   72.910   22.687   4.2106   2.8016   4.2651   3.2910   4.0669   5.3394   74.548   24.726   81.129   30.947 -6.580963 39.61136 
1 1 1   22   18   27 o  321.696   7.3780   79.513   3.6329   83.251   4.8932   74.921   5.4230  328.697   9.7258  311.429   11.377 17.26797 14.96730 
1 1 1   22   18   28 o  321.786   7.2966   79.562   3.5938   82.949   5.0994   76.219   5.0656  327.952   10.159  314.278   10.531 13.67422 14.63191 
1 1 1   22   18   29 o  180.307   12.902   25.327   3.5372   20.615   7.4386   26.704   4.0209  155.528   32.303  184.794   14.328 -29.26633 35.33831 
1 1 1   22   18   30 o  221.613   9.2207   37.846   3.1277   44.674   4.7133   32.474   4.1810  239.654   12.896  204.068   13.461 35.58644 18.64185 
1 1 1   22   18   31 o  148.975   12.897   17.348   2.9119   20.512   4.3367   14.750   3.9296  160.618   17.947  135.404   19.524 25.21416 26.51952 
1 1 1   22   18   32 o  235.546   9.4587   42.799   3.4102   45.265   5.1634   40.891   4.5417  240.694   14.076  229.081   13.006 11.61391 19.16530 
1 1 1   22   18   33 o  122.755   17.209   12.058   3.1446   11.650   4.9083   12.343   4.0955  117.099   27.800  122.393   22.697 -5.294479 35.88880 
1 1 1   22   18   34 o  235.644   10.672   42.966   3.8491   41.737   6.1908   43.740   4.9146  229.417   17.768  236.573   13.630 -7.155609 22.39396 
1 1 1   22   18   35 o  259.619   10.737   52.187   4.2667   47.668   5.8715   57.244   6.2109  246.063   15.671  269.998   15.089 -23.93506 21.75470 
1 1 1   22   18   36 o  167.652   13.784   22.089   3.5059   18.901   5.4246   24.376   4.5943  150.881   24.315  174.863   17.396 -23.98256 29.89758 
1 1 1   22   18   37 o  158.137   14.657   19.763   3.5074   20.012   5.6965   19.610   4.4512  154.783   24.888  155.863   19.055 -1.080032 31.34449 
1 1 1   22   18   38 f   53.706   24.170  -1.4613   4.1708   1.5178   5.4650  -5.6167   6.4544   70.510   29.699   58.771   27.694 11.73932 40.60781 
1 1 1   22   18   39 o  290.537   10.695   65.576   4.7560   70.820   6.9788   61.028   6.4987  299.271   15.286  277.723   15.347 21.54739 21.66120 
1 1 1   22   18   40 o  164.357   14.957   21.492   3.7216   18.435   5.7017   23.762   4.9123  146.422   26.412  170.908   19.105 -24.48575 32.59776 
1 1 1   22   18   41 o  171.211   15.300   23.394   3.9673   16.515   6.0444   28.601   5.2585  135.946   29.864  187.707   18.545 -51.76051 35.15376 
1 1 1   22   18   42 o  150.613   19.797   18.712   4.4533   6.1574   9.1577   22.600   5.0965   94.282   38.980  165.248   20.597 -70.96609 44.08680 
1 1 1   22   18   43 o  148.391   18.396   18.084   4.0886   23.026   6.6141   15.028   5.2015  161.295   27.794  130.175   26.991 31.12006 38.74295 
1 1 1   22   18   44 o  142.204   17.985   16.669   3.8272   7.1619   5.2779   27.211   5.5579   89.296   31.277  180.361   20.496 -91.06474 37.39420 
1 1 1   22   18   45 f  157.774   15.692   20.226   3.7392   16.079   5.2591   24.464   5.3173  133.506   26.669  170.072   20.864 -36.56633 33.86065 
1 1 1   22   18   46 o  142.139   19.279   17.020   4.0861   13.724   6.1715   19.593   5.4523  117.338   32.987  148.443   24.877 -31.10473 41.31619 
1 1 1   22   19    0 o   43.175   29.217  -2.6889   5.7003  -2.6889   5.7003  -2.6889   5.7003   43.175   29.217   43.175   29.217 0.000000 0.000000 
1 1 1   22   19    1 o  251.772   12.575   48.796   4.8462   46.107   6.7481   51.660   6.9641  243.298   18.254  257.722   17.762 -14.42398 25.46957 
1 1 1   22   19    2 o   78.124   26.544   4.4706   3.7914   5.7702   4.6082   1.7477   6.6702   87.608   29.266   80.346   33.247 7.261734 44.29286 
1 1 1   22   19    3 o  386.174   9.9962  114.558   5.9086  110.586   7.6401  120.468   9.3204  378.903   13.173  395.000   15.416 -16.09790 20.27774 
1 1 1   22   19    4 o  264.463   9.6631   53.715   3.9116   51.947   4.4482   59.745   8.2147  259.920   11.181  276.764   19.517 -16.84406 22.49240 
1 1 1   22   19    5 o  234.226   10.258   42.155   3.6775   41.665   4.1807   43.830   7.7317  232.418   11.791  236.283   21.618 -3.865250 24.62425 
1 1 1   22   19    6 o  256.223   9.6686   50.424   3.7919   48.612   4.2494   57.505   8.4003  251.440   11.041  271.220   20.384 -19.77936 23.18251 
1 1 1   22   19    7 o  119.846   22.443   11.553   3.9657   11.906   4.6154   10.560   7.7519  120.993   25.714  115.695   37.928 5.298676 45.82270 
1 1 1   22   19    8 o  253.661   11.322   49.495   4.3957   49.495   4.3957   0.0000   0.0000  253.661   11.322  ?   ?  0.000000 11.32161 
1 1 1   22   19    9 o  576.196   7.5145  254.670   6.6274  254.670   6.6274   0.0000   0.0000  576.196   7.5145  ?   ?  0.000000 7.514519 
1 1 1   22   19   10 o  379.062   7.7933  110.244   4.5217  110.244   4.5217   0.0000   0.0000  379.062   7.7933  ?   ?  0.000000 7.793346 
1 1 1   22   19   11 o  337.772   7.4639   87.522   3.8589   88.399   4.1889   82.606   9.9183  339.393   8.0636  325.185   20.024 14.20862 21.58675 
1 1 1   22   19   12 o  342.418   7.4048   89.949   3.8810   92.659   4.2206   75.114   9.8748  347.476   7.9356  309.653   20.958 37.82352 22.41008 
1 1 1   22   19   13 o  184.249   10.655   26.200   2.9920   24.899   3.1468   38.446   9.6577  179.475   11.516  218.078   29.706 -38.60243 31.85995 
1 1 1   22   19   14 o   93.269   20.168   7.0356   2.7954   7.0356   2.7954   0.0000   0.0000   93.269   20.168  ?   ?  0.000000 20.16802 
1 1 1   22   19   15 o  455.054   7.0944  158.862   4.9414  162.384   5.4703  143.244   11.519  459.959   7.7700  429.460   17.524 30.49921 19.16937 
1 1 1   22   19   16 o  235.419   13.550   42.942   4.8621   45.950   5.6298   34.117   9.6443  243.172   15.202  203.936   31.945 39.23640 35.37787 
1 1 1   22   19   17 o   93.079   16.577   6.9184   2.2751   6.4657   2.3599   12.884   8.5673   89.665   17.823  124.795   39.787 -35.12953 43.59654 
1 1 1   22   19   18 o   94.512   17.590   7.1635   2.4509   7.4307   2.5546   4.0715   8.6893   96.210   18.009   94.937   38.456 1.273239 42.46441 
1 1 1   22   19   19 o  439.578   7.8772  148.397   5.3000  150.718   5.9131  138.915   11.953  442.827   8.7240  421.998   18.505 20.82980 20.45822 
1 1 1   22   19   20 o   53.742   20.656   1.5542   2.3900   1.7818   2.4766  -1.5284   9.1158   55.713   21.118   82.646   36.552 -26.93282 42.21434 
1 1 1   22   19   21 f  382.915   9.2710  112.803   5.4337  112.374   6.1012  114.445   11.948  381.921   10.437  381.306   20.548 0.6151733 23.04645 
1 1 1   22   19   22 o  390.930   8.3908  117.480   5.0208  117.298   5.4978  118.398   12.323  390.452   9.1992  387.524   20.852 2.928375 22.79116 
1 1 1   22   19   23 o  317.531   9.1477   77.584   4.4460   78.558   4.8040   71.773   11.736  319.384   9.8271  298.797   25.918 20.58716 27.71875 
1 1 1   22   19   24 o  405.137   7.9607  126.150   4.9366  128.058   5.4033  116.516   12.141  408.034   8.6516  384.176   20.724 23.85764 22.45770 
1 1 1   22   19   25 o  127.194   16.333   12.805   3.1063   12.049   3.2697   19.811   9.9488  122.910   17.906  149.429   41.838 -26.51857 45.50917 
1 1 1   22   19   26 o  138.756   15.484   15.166   3.2325   16.085   3.3870   5.7740   10.827  142.878   15.749  104.913   42.767 37.96513 45.57466 
1 1 1   22   19   27 o  256.069   9.8874   50.551   3.8753   49.704   4.3438   53.853   8.5787  253.656   11.188  259.877   21.767 -6.220444 24.47405 
1 1 1   22   19   28 o  211.812   11.482   34.787   3.7087   47.038   7.7055   31.094   4.2310  242.989   20.922  199.592   13.937 43.39673 25.13867 
1 1 1   22   19   29 o  113.564   16.112   10.264   2.7221   12.909   3.8475   7.6142   3.8517  126.244   20.623   95.542   25.754 30.70253 32.99348 
1 1 1   22   19   30 o  129.324   14.316   13.172   2.7863   14.778   4.0683   11.753   3.8239  135.292   20.270  119.935   21.626 15.35715 29.64025 
1 1 1   22   19   31 o   96.803   19.846   7.6701   2.8419   7.7914   4.1626   7.5641   3.8894   96.327   27.095   95.012   25.992 1.314445 37.54658 
1 1 1   22   19   32 o  218.956   10.184   37.042   3.4129   39.633   5.0284   34.828   4.6474  224.887   14.689  210.824   14.490 14.06279 20.63285 
1 1 1   22   19   33 o  270.777   9.8920   56.642   4.0998   51.388   5.4592   63.439   6.2089  256.368   13.965  285.142   14.226 -28.77383 19.93480 
1 1 1   22   19   34 o  164.823   13.980   21.342   3.4937   21.935   5.2605   20.874   4.6731  164.360   21.419  161.132   19.334 3.228256 28.85449 
1 1 1   22   19   35 o   78.604   24.423   5.0593   3.2481   8.2458   4.8798   2.5246   4.3524   98.270   29.829   69.208   27.494 29.06195 40.56693 
1 1 1   22   19   36 o  298.724   9.1246   68.937   4.1721   76.078   6.3008   63.362   5.5675  312.234   13.184  285.122   12.757 27.11127 18.34573 
1 1 1   22   19   37 o  103.234   25.944   9.1396   4.0946   10.667   5.2827   6.8417   6.4802  110.124   30.361   93.270   34.404 16.85394 45.88454 
1 1 1   22   19   38 o  129.661   17.844   13.613   3.4475   13.729   5.5480   13.541   4.4001  124.904   29.492  126.892   23.521 -1.988045 37.72272 
1 1 1   22   19   39 o  230.585   11.931   41.610   4.1964   40.661   5.8916   42.587   5.9785  225.272   17.217  230.667   17.054 -5.395157 24.23356 
1 1 1   22   19   40 o  169.471   15.015   22.878   3.8545   22.593   6.2879   23.050   4.8786  162.251   26.213  168.009   19.323 -5.757507 32.56514 
1 1 1   22   19   41 o  238.202   11.585   44.351   4.2238   42.937   6.9377   45.183   5.3242  228.989   19.994  238.537   14.653 -9.547821 24.78912 
1 1 1   22   19   42 o  134.982   23.276   15.562   4.6353   8.6794   11.795   16.819   5.0408  103.799   43.671  139.711   24.464 -35.91171 50.05624 
1 1 1   22   19   43 o   72.809   25.870   4.2944   3.6216   9.4768   5.4138   0.0969   4.8722  100.564   31.577   61.216   26.913 39.34782 41.49051 
1 1 1   22   19   44 o  134.820   18.353   15.104   3.6888   18.084   5.2387   12.173   5.1952  143.433   24.756  113.990   29.536 29.44254 38.53898 
1 1 1   22   19   45 o   89.743   26.225   7.3595   3.8287   12.251   6.0761   4.1383   4.9307  110.937   33.198   74.526   29.372 36.41082 44.32630 
1 1 1   22   19   46 o   66.426   25.742   3.2044   3.7354   1.6979   5.2952   4.6966   5.2702   66.738   28.708   77.065   30.369 -10.32642 41.78981 
1 1 1   22   20    0 o  122.738   38.089   14.673   6.2671   14.673   6.2671   14.673   6.2671  122.738   38.089  122.738   38.089 0.000000 0.000000 
1 1 1   22   20    1 o  593.284   9.5096  270.358   8.6357  270.583   11.956  270.113   12.487  592.545   13.182  591.838   13.784 0.7070313 19.07288 
1 1 1   22   20    2 o  441.211   9.9801  149.579   6.7398  146.256   9.0177  153.785   10.145  435.554   13.527  446.289   14.851 -10.73526 20.08757 
1 1 1   22   20    3 o  518.849   7.6079  206.509   6.0419  204.954   7.0901  210.631   11.546  516.657   8.9657  522.413   14.440 -5.755920 16.99662 
1 1 1   22   20    4 o  230.157   13.828   41.001   4.8489   36.235   5.9868   50.088   8.2671  215.370   18.336  252.566   21.593 -37.19553 28.32724 
1 1 1   22   20    5 o  521.277   9.8661  208.793   7.8719  212.796   10.548  203.761   11.827  525.446   13.115  513.599   15.044 11.84656 19.95826 
1 1 1   22   20    6 o  261.362   20.587   53.514   8.1693   0.0000   0.0000   53.514   8.1693  ?   ?   261.362   20.587 0.000000 20.58741 
1 1 1   22   20    7 o  458.261   9.6269  161.350   6.7525  157.644   8.5413  167.526   11.027  452.400   12.335  465.509   15.476 -13.10846 19.79025 
1 1 1   22   20    8 o  182.990   10.915   25.849   3.0433   24.463   3.2752   34.606   8.2342  177.822   12.105  208.015   26.461 -30.19246 29.09823 
1 1 1   22   20    9 o  412.699   7.1534  130.642   4.5187  129.833   4.9413  134.774   11.167  411.325   7.8486  416.843   17.503 -5.517700 19.18192 
1 1 1   22   20   10 o   70.588   23.148   3.7662   2.8874   3.7662   2.8874   0.0000   0.0000   70.588   23.148  ?   ?  0.000000 23.14777 
1 1 1   22   20   11 o  353.323   9.1962   95.913   4.9734   95.913   4.9734   0.0000   0.0000  353.323   9.1962  ?   ?  0.000000 9.196239 
1 1 1   22   20   12 o   59.426   23.237   1.7249   3.0647   1.7249   3.0647   0.0000   0.0000   59.426   23.237  ?   ?  0.000000 23.23683 
1 1 1   22   20   13 o   44.441   20.224  -1.7960   3.0188  -1.7960   3.0188   0.0000   0.0000   44.441   20.224  ?   ?  0.000000 20.22357 
1 1 1   22   20   14 o  169.663   12.852   22.337   3.3129   24.668   3.5888   8.9043   8.6155  178.269   13.247  110.284   39.821 67.98476 41.96672 
1 1 1   22   20   15 o  172.576   12.567   23.098   3.2968   24.076   3.5459   16.866   8.9538  176.080   13.254  140.581   39.808 35.49911 41.95613 
1 1 1   22   20   16 f   97.447   31.386   7.5464   5.3211   7.3119   6.6965   7.9481   8.7644   99.429   35.195  107.113   39.910 -7.683571 53.21177 
1 1 1   22   20   17 o  115.380   26.357   10.977   4.5528   12.161   5.2022   7.1039   9.4099  121.039   28.543  106.026   40.922 15.01357 49.89340 
1 1 1   22   20   18 o  308.683   11.856   73.519   5.6015   78.431   6.5296   59.829   10.900  318.472   13.395  273.005   26.416 45.46780 29.61774 
1 1 1   22   20   19 o   91.642   17.279   6.7471   2.3348   6.1384   2.4080   16.301   9.5403   87.061   18.633  137.449   41.704 -50.38802 45.67734 
1 1 1   22   20   20 o  157.492   12.159   19.268   2.9084   19.033   3.0410   21.788   9.9565  156.396   12.816  157.820   40.887 -1.423859 42.84853 
1 1 1   22   20   21 o  374.164   8.5083  107.639   4.8728  106.412   5.2884  114.539   12.539  371.860   9.2913  380.660   21.609 -8.800262 23.52208 
1 1 1   22   20   22 o   57.501   21.111   2.1232   2.4360   1.1744   2.5034   19.030   10.568   52.308   20.829  146.676   43.756 -94.36825 48.46038 
1 1 1   22   20   23 o  432.853   7.8998  143.997   5.2339  146.416   5.6760  130.256   13.528  436.328   8.4988  405.491   21.877 30.83752 23.46985 
1 1 1   22   20   24 o  221.994   11.183   38.142   3.7878   38.841   4.0036   32.178   11.693  223.901   11.723  191.081   41.194 32.82051 42.82922 
1 1 1   22   20   25 o  130.650   16.895   13.541   3.2994   15.270   3.4647  -3.2828   10.809  138.932   16.623   85.625   38.687 53.30622 42.10733 
1 1 1   22   20   26 f   46.393   20.967  -1.5435   3.1773  -1.5435   3.1773   0.0000   0.0000   46.393   20.967  ?   ?  0.000000 20.96674 
1 1 1   22   20   27 o   61.107   26.221   0.1414   4.3982   0.7201   6.9450  -0.2462   5.6831   76.905   32.973   67.658   29.420 9.247108 44.19015 
1 1 1   22   20   28 o   98.437   20.142   7.9177   2.9326   8.6206   3.3681   5.7144   5.9629  102.285   22.154   89.478   33.002 12.80618 39.74858 
1 1 1   22   20   29 f  179.755   10.808   25.061   2.9599   23.847   4.0393   26.469   4.3496  174.167   15.308  183.453   15.640 -9.286438 21.88423 
1 1 1   22   20   30 o   61.242   22.801   2.3986   2.8595   5.6086   3.7093  -2.3036   4.4894   83.117   26.144   54.196   24.663 28.92006 35.94145 
1 1 1   22   20   31 o  203.860   11.290   32.274   3.5092   37.050   4.7055   26.288   5.2676  217.575   14.207  181.345   19.273 36.22974 23.94340 
1 1 1   22   20   32 o   84.919   22.471   5.9917   2.9662   2.9767   4.3723   8.5625   4.0374   71.521   27.813  100.686   26.013 -29.16540 38.08180 
1 1 1   22   20   33 o  355.585   10.486   97.833   5.7074  110.774   7.8710   83.484   8.2880  376.954   13.642  325.374   16.698 51.57977 21.56197 
1 1 1   22   20   34 o  237.142   10.001   43.496   3.6301   48.153   5.4131   39.690   4.8936  247.759   14.335  224.877   14.291 22.88139 20.24218 
1 1 1   22   20   35 o  259.975   11.961   52.558   4.7598   56.699   6.1981   46.605   7.4310  268.351   15.152  240.479   20.380 27.87248 25.39539 
1 1 1   22   20   36 o   56.255   24.139   0.2452   3.7276   2.0537   4.6468  -3.0189   6.2429   68.426   27.969   62.733   28.750 5.692699 40.11081 
1 1 1   22   20   37 o   52.857   22.555   0.3152   3.2217   3.1242   5.0547  -1.6068   4.1811   74.132   29.573   53.267   24.065 20.86551 38.12718 
1 1 1   22   20   38 o   79.536   25.595   5.2675   3.5391   6.8848   5.2213   3.8929   4.8136   90.393   31.140   75.973   29.284 14.42001 42.74590 
1 1 1   22   20   39 o   57.635   23.997   1.0806   3.5060   6.3211   5.6508  -2.1992   4.4705   88.224   32.189   53.328   24.399 34.89584 40.39174 
1 1 1   22   20   40 o   95.627   25.275   7.9700   3.7555   7.1432   6.0489   8.4887   4.7906   91.903   33.339   97.552   29.542 -5.648827 44.54430 
1 1 1   22   20   41 o  143.424   21.101   17.205   4.4938   32.894   11.940   14.616   4.8505  177.125   44.185  129.622   25.356 47.50385 50.94400 
1 1 1   22   20   42 o   99.556   24.283   8.7184   3.6673  -0.6097   5.5828   15.799   4.8639   63.052   28.200  134.805   24.474 -71.75306 37.33971 
1 1 1   22   20   43 o   78.752   25.591   5.4123   3.5319   1.6181   5.2126   8.6330   4.8024   67.180   28.678   96.327   29.659 -29.14687 41.25638 
1 1 1   22   20   44 o  159.882   15.830   20.820   3.8230   23.795   5.5414   18.118   5.2811  166.346   22.328  142.887   25.061 23.45952 33.56447 
1 1 1   22   20   45 o   73.211   26.540   4.4934   3.8325   1.5139   6.0668   6.4720   4.9439   69.356   30.273   84.295   30.197 -14.93885 42.75894 
1 1 1   22   21    0 o   61.569   37.132   3.0710   6.3805   3.0710   6.3805   3.0710   6.3805   61.569   37.132   61.569   37.132 0.000000 0.000000 
1 1 1   22   21    1 o  492.436   9.7910  186.359   7.3799  190.208   10.424  182.491   10.450  496.502   13.716  486.230   14.041 10.27142 19.62850 
1 1 1   22   21    2 o  112.725   26.186   10.399   4.4318   11.567   5.6759   8.5740   7.0935  118.320   30.977  106.106   36.306 12.21386 47.72537 
1 1 1   22   21    3 o  308.350   9.1628   73.035   4.3246   72.051   5.0218   75.857   8.5070  306.059   10.720  312.154   17.879 -6.094299 20.84666 
1 1 1   22   21    4 o  199.471   11.783   30.744   3.5817   32.486   4.1000   25.129   7.3595  204.833   13.147  176.142   28.252 28.69089 31.16123 
1 1 1   22   21    5 o  210.052   14.409   34.237   4.6046   36.348   5.6143   29.901   8.0478  215.861   17.133  192.465   28.151 23.39583 32.95450 
1 1 1   22   21    6 o  309.999   8.9314   73.813   4.2379   73.902   4.7693   73.476   9.2388  310.038   10.050  306.528   19.797 3.509705 22.20202 
1 1 1   22   21    7 o  449.329   7.9831  154.969   5.4904  156.011   6.2874  151.621   11.267  450.637   9.1154  442.282   16.644 8.355011 18.97625 
1 1 1   22   21    8 o  369.499   7.5557  104.769   4.2732  103.854   4.7046  109.080   10.215  367.773   8.3575  374.748   17.809 -6.974823 19.67284 
1 1 1   22   21    9 o   48.651   22.352  -2.6681   3.8058  -0.8578   4.2932  -9.3109   8.2239   57.728   25.325   64.674   30.709 -6.946613 39.80398 
1 1 1   22   21   10 o   78.554   27.114   4.5013   3.9596   1.5866   4.4245   16.226   8.8740   67.258   27.369  138.358   39.780 -71.09950 48.28616 
1 1 1   22   21   11 o  227.191   15.433   40.151   5.3349   40.151   5.3349   0.0000   0.0000  227.191   15.433  ?   ?  0.000000 15.43287 
1 1 1   22   21   12 o   80.401   29.339   4.3398   4.6947   4.3398   4.6947   0.0000   0.0000   80.401   29.339  ?   ?  0.000000 29.33926 
1 1 1   22   21   13 o  271.267   14.086   57.055   5.8285   57.055   5.8285   0.0000   0.0000  271.267   14.086  ?   ?  0.000000 14.08606 
1 1 1   22   21   14 o  317.843   9.0247   77.659   4.3905   77.659   4.3905   0.0000   0.0000  317.843   9.0247  ?   ?  0.000000 9.024677 
1 1 1   22   21   15 o  159.494   12.820   19.772   3.1032   21.624   3.2808   4.0451   9.5601  166.816   12.951   97.835   40.069 68.98073 42.10979 
1 1 1   22   21   16 o  132.859   22.520   14.255   4.4159   11.570   4.9523   24.677   9.7562  118.090   27.851  169.499   38.484 -51.40918 47.50425 
1 1 1   22   21   17 o  459.422   9.8707  162.479   6.9411  164.496   8.1957  157.362   13.054  461.755   11.596  448.608   19.011 13.14630 22.26884 
1 1 1   22   21   18 o  283.461   12.514   62.086   5.4295   63.414   6.2702   58.107   10.855  285.690   14.385  268.530   26.767 17.16022 30.38768 
1 1 1   22   21   19 o  210.729   16.416   34.762   5.2533   32.323   6.0395   42.343   10.648  202.134   19.774  226.431   31.583 -24.29677 37.26272 
1 1 1   22   21   20 o  177.778   11.681   24.504   3.1608   25.452   3.3001   13.967   10.998  181.143   11.970  129.631   45.163 51.51167 46.72225 
1 1 1   22   21   21 o  335.409   7.9624   86.461   4.0878   84.311   4.2973  106.916   13.254  331.120   8.4789  366.253   23.772 -35.13315 25.23870 
1 1 1   22   21   22 o  321.159   8.4073   79.322   4.1328   78.697   4.3539   85.015   13.135  319.797   8.8948  324.478   26.684 -4.681274 28.12701 
1 1 1   22   21   23 o  120.905   15.057   11.534   2.7261   10.795   2.8158   22.588   10.890  116.628   16.212  158.507   43.547 -41.87922 46.46692 
1 1 1   22   21   24 o  165.286   12.231   21.249   3.0723   21.170   3.1791   22.371   11.957  164.874   12.695  156.417   46.516 8.456543 48.21704 
1 1 1   22   21   25 o  248.320   19.643   48.854   7.4050   48.854   7.4050   0.0000   0.0000  248.320   19.643  ?   ?  0.000000 19.64291 
1 1 1   22   21   26 o  141.005   29.266   16.749   6.1095   17.921   7.1893   13.703   11.591  144.335   33.230  127.610   46.171 16.72503 56.88591 
1 1 1   22   21   27 o  217.928   12.073   36.889   4.0113   37.386   4.2253   32.357   12.767  219.238   12.645  187.503   45.048 31.73441 46.78938 
1 1 1   22   21   28 o  181.300   14.248   25.741   3.9219   25.261   4.1605   29.562   11.749  179.281   15.308  179.693   43.241 -0.4127350 45.87075 
1 1 1   22   21   29 o  129.852   20.131   13.645   3.8716   14.382   4.0879   7.2337   12.061  133.173   20.729  109.966   45.018 23.20718 49.56136 
1 1 1   22   21   30 o  366.428   7.3462  103.270   4.1202  108.525   5.7800   97.842   5.8749  374.818   10.075  355.648   10.792 19.16998 14.76398 
1 1 1   22   21   31 o   82.406   21.948   5.6278   2.8180   5.4403   3.9781   5.8168   3.9924   82.429   27.177   84.572   27.181 -2.142860 38.43707 
1 1 1   22   21   32 o  239.362   9.8387   44.274   3.6046   39.930   5.2768   48.075   4.9357  225.265   15.396  248.197   13.038 -22.93288 20.17512 
1 1 1   22   21   33 o   67.461   23.495   3.3980   2.9764   1.0014   4.2756   5.6515   4.1460   62.790   26.348   83.618   27.753 -20.82809 38.26843 
1 1 1   22   21   34 o  388.458   8.8942  116.511   5.2884  119.672   6.6039  110.861   8.8296  392.785   10.984  375.662   15.356 17.12344 18.88016 
1 1 1   22   21   35 o  146.488   14.545   16.991   3.2181   23.023   4.8926   12.392   4.2722  168.771   19.286  121.411   23.840 47.36086 30.66445 
1 1 1   22   21   36 o  291.863   8.8431   65.846   3.9505   64.922   5.8511   66.621   5.3554  288.022   13.272  292.370   11.967 -4.347626 17.87085 
1 1 1   22   21   37 o   59.700   24.461   1.4453   3.5648 -11.8283   5.3263   12.216   4.7978   42.678   21.193  118.479   27.051 -75.80118 34.36473 
1 1 1   22   21   38 o  154.120   15.896   19.025   3.6961   15.270   5.6785   21.785   4.8686  131.369   29.015  163.058   19.921 -31.68942 35.19550 
1 1 1   22   21   39 o  192.159   13.046   29.127   3.8144   30.884   5.6431   27.649   5.1758  194.621   19.193  184.414   18.590 10.20659 26.72019 
1 1 1   22   21   40 o   96.376   27.090   8.2514   4.1625   4.3171   8.7567   9.3998   4.7312   88.198   37.395  102.056   28.950 -13.85820 47.29134 
1 1 1   22   21   41 o   57.662   24.946   0.3988   4.0445  -1.8272   8.5847   1.0338   4.5853   73.481   33.690   62.820   26.859 10.66085 43.08662 
1 1 1   22   21   42 o   60.447   24.702   1.8167   3.6232  -4.1540   5.8226   5.5893   4.6284   56.136   26.408   81.024   29.197 -24.88741 39.36814 
1 1 1   22   21   43 o   86.073   24.855   6.6424   3.4574   10.141   5.1751   3.8216   4.6466  103.035   30.593   72.671   28.554 30.36411 41.84843 
1 1 1   22   21   44 o  154.602   16.828   19.683   3.9178   22.109   6.1963   18.067   5.0569  156.066   26.911  143.165   23.921 12.90027 36.00579 
1 1 1   22   22    0 o   79.617   40.780   7.4022   6.3000   7.4022   6.3000   7.4022   6.3000   79.617   40.780   79.617   40.780 0.000000 0.000000 
1 1 1   22   22    1 o  555.071   9.7906  236.873   8.3181  231.807   11.361  242.725   12.212  547.966   13.546  560.468   14.235 -12.50195 19.65020 
1 1 1   22   22    2 o   80.676   28.903   4.5068   4.5292  -2.3934   6.1148   12.894   6.7415   65.479   29.384  124.320   34.307 -58.84038 45.17067 
1 1 1   22   22    3 o  496.108   9.8625  189.241   7.4891  190.208   10.069  188.044   11.204  496.445   13.251  493.086   14.846 3.358887 19.89905 
1 1 1   22   22    4 o   81.673   28.325   4.8564   4.3237   12.724   5.5211  -7.6215   6.9528  123.995   29.516   60.089   28.445 63.90567 40.99192 
1 1 1   22   22    5 o  273.286   9.9178   57.433   4.1486   55.310   4.7196   64.648   8.7013  267.967   11.507  287.223   19.915 -19.25592 23.00044 
1 1 1   22   22    6 o  320.422   9.1449   78.900   4.4851   77.442   5.1321   83.613   9.2276  317.229   10.569  327.279   18.496 -10.05023 21.30301 
1 1 1   22   22    7 o  429.239   7.4240  141.396   4.8776  141.929   5.4364  139.197   11.045  429.906   8.2617  423.404   17.044 6.502136 18.94037 
1 1 1   22   22    8 o  340.043   7.9427   88.777   4.1340   86.489   4.5047  100.986   10.406  335.515   8.7718  359.494   18.979 -23.97955 20.90790 
1 1 1   22   22    9 o  191.385   11.273   28.313   3.2876   28.153   3.5312   29.355   9.0068  190.688   12.162  188.530   32.379 2.157623 34.58734 
1 1 1   22   22   10 o  184.649   12.574   26.432   3.5326   26.432   3.5326   0.0000   0.0000  184.649   12.574  ?   ?  0.000000 12.57398 
1 1 1   22   22   11 o  179.678   12.659   25.044   3.4593   25.044   3.4593   0.0000   0.0000  179.678   12.659  ?   ?  0.000000 12.65929 
1 1 1   22   22   12 o  373.420   7.7608  107.077   4.4358  114.385   4.9127   74.822   10.321  385.857   8.3181  307.795   22.053 78.06149 23.56988 
1 1 1   22   22   13 o  350.471   7.9698   94.345   4.2753   95.589   4.6551   87.641   10.807  352.664   8.6238  333.477   21.283 19.18744 22.96370 
1 1 1   22   22   14 o  379.073   7.8411  110.370   4.5496  113.854   4.9735   92.507   11.262  384.899   8.4419  342.377   21.600 42.52200 23.19153 
1 1 1   22   22   15 o  224.869   10.829   38.972   3.7273   38.972   3.7273   0.0000   0.0000  224.869   10.829  ?   ?  0.000000 10.82926 
1 1 1   22   22   16 o  182.518   19.285   26.347   5.3060   26.347   5.3060   0.0000   0.0000  182.518   19.285  ?   ?  0.000000 19.28482 
1 1 1   22   22   18 o  199.618   16.770   31.253   5.0765   30.162   5.7402   35.171   10.876  195.261   19.466  203.610   36.226 -8.348831 41.12431 
1 1 1   22   22   19 o  142.366   31.610   17.098   6.7087   11.096   8.4821   27.124   10.964  116.595   39.702  175.513   41.469 -58.91812 57.41045 
1 1 1   22   22   20 o  293.791   13.439   66.871   6.0433   68.077   6.9076   62.935   12.477  295.514   15.324  277.135   29.887 18.37897 33.58689 
1 1 1   22   22   21 o  204.556   10.048   32.251   3.1461   31.400   3.2541   44.442   12.314  201.489   10.589  228.493   36.433 -27.00369 37.94072 
1 1 1   22   22   22 o   93.543   18.769   7.0964   2.5938   6.8896   2.6624   10.955   11.501   91.978   19.516  120.348   45.534 -28.37068 49.54036 
1 1 1   22   22   23 o  144.209   26.404   17.188   5.6134   19.797   6.3813   8.2615   11.803  154.353   28.043  113.473   45.214 40.88046 53.20459 
1 1 1   22   22   24 o   93.279   33.500   6.5028   6.0883   6.5028   6.0883   0.0000   0.0000   93.279   33.500  ?   ?  0.000000 33.50022 
1 1 1   22   22   25 o  102.590   19.374   8.5457   2.9307   8.5457   2.9307   0.0000   0.0000  102.590   19.374  ?   ?  0.000000 19.37386 
1 1 1   22   22   26 o  138.503   15.225   15.132   3.1745   15.967   3.3043   5.1190   11.438  142.264   15.421  104.054   43.335 38.20903 45.99752 
1 1 1   22   22   27 o  248.331   10.305   47.627   3.9171   47.895   4.1378   45.317   12.156  248.903   10.861  229.166   35.828 19.73741 37.43773 
1 1 1   22   22   28 o   55.453   22.906   0.9002   3.1584  -1.0745   3.2654   29.571   12.443   48.538   21.648  177.594   45.552 -129.0560 50.43482 
1 1 1   22   22   29 o   87.425   22.935   6.3549   3.1073   6.5737   3.5268   5.5958   6.5692   88.797   24.927   90.274   34.352 -1.476982 42.44308 
1 1 1   22   22   30 o  270.084   10.577   56.428   4.3725   62.914   5.3787   43.789   7.5082  284.635   12.346  233.339   21.255 51.29614 24.58064 
1 1 1   22   22   31 o  119.571   16.613   11.442   2.9584   10.813   4.2202   12.049   4.1484  113.371   24.993  120.426   23.348 -7.055443 34.20196 
1 1 1   22   22   32 o  201.335   10.995   31.512   3.3754   36.112   4.9256   27.439   4.6349  214.132   15.125  186.022   16.448 28.10995 22.34512 
1 1 1   22   22   33 o   99.338   23.031   8.2917   3.4337   7.4060   4.1161   10.318   6.2266   93.297   27.170  108.350   33.839 -15.05349 43.39746 
1 1 1   22   22   34 f  203.367   11.138   32.216   3.4538   37.956   5.0196   27.055   4.7597  219.260   15.048  184.110   17.085 35.14958 22.76678 
1 1 1   22   22   35 o  173.398   12.927   23.626   3.4063   27.894   5.0030   19.938   4.6508  186.436   17.746  156.429   19.872 30.00656 26.64269 
1 1 1   22   22   36 o  168.029   14.065   22.338   3.5840   26.871   5.4769   18.942   4.7397  181.505   20.049  151.627   20.985 29.87794 29.02266 
1 1 1   22   22   37 o  125.041   18.945   12.824   3.5123   14.699   4.8359   10.731   5.1096  131.056   25.020  109.576   29.716 21.47993 38.84607 
1 1 1   22   22   38 o  176.507   13.839   24.684   3.7088   22.094   5.1671   27.435   5.3266  163.286   21.173  183.323   19.272 -20.03720 28.62982 
1 1 1   22   22   39 o   82.990   24.762   5.9515   3.3842   6.0273   4.9258   5.8838   4.6574   84.815   30.168   83.696   29.377 1.119469 42.10793 
1 1 1   22   22   40 f  112.380   25.307   11.139   4.2484  -1.1131   8.4238   15.318   4.9199   74.294   33.799  132.375   25.202 -58.08166 42.16042 
1 1 1   22   22   41 o   36.162   17.668  -5.4735   3.2279 -10.1715   4.7365  -1.3992   4.4109   40.263   19.993   54.144   24.565 -13.88105 31.67218 
1 1 1   22   22   42 f  147.983   15.984   17.854   3.5630   15.877   5.2591   19.532   4.8442  132.468   26.857  151.295   21.525 -18.82629 34.41830 
1 1 1   22   22   43 o  135.915   18.047   15.398   3.6616   16.210   5.7418   14.841   4.7536  131.327   29.308  128.816   25.011 2.510117 38.52911 
1 1 1   22   23    0 o  366.458   15.741  103.998   8.7923  103.998   8.7923  103.998   8.7923  366.458   15.741  366.458   15.741 0.000000 0.000000 
1 1 1   22   23    1 o  261.189   13.439   52.834   5.3546   46.192   7.2418   60.846   7.9532  242.499   19.680  278.837   18.744 -36.33809 27.17791 
1 1 1   22   23    2 o  168.819   18.833   22.473   4.7835   20.781   6.2602   24.847   7.4155  159.994   26.490  174.456   28.774 -14.46262 39.11084 
1 1 1   22   23    3 o  467.686   10.101  168.292   7.2307  164.797   9.5514  172.985   11.066  461.835   13.512  472.538   15.300 -10.70264 20.41244 
1 1 1   22   23    4 o  166.180   15.195   21.564   3.8223   23.693   4.3944   14.946   7.7474  173.907   16.715  132.874   36.821 41.03262 40.43673 
1 1 1   22   23    5 o  226.579   11.796   39.686   4.0767   38.498   4.6439   43.679   8.5124  222.766   13.686  234.183   24.092 -11.41692 27.70763 
1 1 1   22   23    6 o  248.412   10.916   47.531   4.1504   47.823   4.6564   46.399   9.1551  248.974   12.219  240.953   25.196 8.021454 28.00260 
1 1 1   22   23    7 f  170.251   12.917   22.511   3.3410   23.486   3.6632   17.684   8.1474  173.726   13.892  144.072   36.811 29.65442 39.34499 
1 1 1   22   23    8 o  221.901   10.342   37.909   3.5127   37.980   3.8307   37.533   8.8058  221.695   11.327  215.535   27.304 6.159973 29.56042 
1 1 1   22   23    9 o  239.643   10.661   44.234   3.9105   44.234   3.9105   0.0000   0.0000  239.643   10.661  ?   ?  0.000000 10.66113 
1 1 1   22   23   10 o  206.324   11.071   32.902   3.4834   34.617   3.7625   22.607   9.2173  211.536   11.665  162.421   37.787 49.11459 39.54714 
1 1 1   22   23   11 o  138.182   15.063   14.976   3.1342   15.361   3.3579   12.367   8.7342  139.761   15.984  122.316   40.267 17.44528 43.32312 
1 1 1   22   23   12 o  261.906   9.3639   52.772   3.7538   51.524   4.0280   61.015   10.352  258.669   10.174  276.366   24.733 -17.69650 26.74333 
1 1 1   22   23   13 o  118.189   17.850   11.126   3.1284   11.859   3.3275   5.5462   9.1825  121.955   18.398  100.340   39.912 21.61468 43.94871 
1 1 1   22   23   14 o  252.423   9.7820   49.053   3.7794   50.573   4.0645   39.340   10.273  256.212   10.364  218.207   31.684 38.00529 33.33612 
1 1 1   22   23   15 o  108.189   19.791   9.4463   3.1566   9.1760   3.3320   11.812   9.8574  106.240   21.233  121.319   42.727 -15.07963 47.71163 
1 1 1   22   23   16 o  150.699   20.682   18.161   4.6448   19.378   5.1394   12.734   10.851  155.243   22.266  125.584   44.763 29.65952 49.99529 
1 1 1   22   23   17 o  183.084   18.201   26.455   5.0329   27.173   5.6871   23.858   10.809  184.862   20.441  163.945   42.662 20.91701 47.30655 
1 1 1   22   23   18 o  300.587   21.700   71.697   9.9167   71.697   9.9167   0.0000   0.0000  300.587   21.700  ?   ?  0.000000 21.69976 
1 1 1   22   23   19 o   86.356   31.714   5.1879   5.4979   5.1879   5.4979   0.0000   0.0000   86.356   31.714  ?   ?  0.000000 31.71383 
1 1 1   22   23   20 o   63.674   28.398  -1.6424   5.6182  -1.6424   5.6182   0.0000   0.0000   63.674   28.398  ?   ?  0.000000 28.39787 
1 1 1   22   23   21 o  132.732   25.963   14.576   5.0858   10.191   5.6169   34.531   11.982  109.865   31.666  197.841   40.919 -87.97622 51.74113 
1 1 1   22   23   22 o  154.345   23.561   19.375   5.3899   16.721   6.0032   30.409   12.241  141.232   28.747  183.062   44.188 -41.82909 52.71661 
1 1 1   22   23   23 o  116.988   15.839   10.862   2.7634   10.862   2.7634   0.0000   0.0000  116.988   15.839  ?   ?  0.000000 15.83946 
1 1 1   22   23   24 o  171.275   12.362   22.842   3.2191   22.842   3.2191   0.0000   0.0000  171.275   12.362  ?   ?  0.000000 12.36222 
1 1 1   22   23   25 f  180.452   12.675   25.376   3.4786   26.776   3.6254   9.1358   12.350  185.335   12.859  115.710   46.205 69.62547 47.96156 
1 1 1   22   23   26 o  254.268   10.275   49.934   3.9988   46.893   4.1807   82.624   13.708  246.219   11.093  316.474   28.609 -70.25519 30.68401 
1 1 1   22   23   27 o  112.018   19.692   10.199   3.2531   11.168   3.3671  -3.3957   12.613  117.428   19.411   90.890   41.352 26.53868 45.68137 
1 1 1   22   23   28 o  293.986   9.9078   66.751   4.4583   67.754   4.7284   58.719   13.384  296.038   10.435  261.548   34.256 34.49054 35.81052 
1 1 1   22   23   29 o  156.956   13.861   19.346   3.2959   17.803   3.7413   24.692   6.9646  149.683   16.610  171.801   27.406 -22.11736 32.04660 
1 1 1   22   23   30 o   45.273   20.314  -1.1338   2.9216  -0.2955   3.2678  -4.4732   6.5219   51.173   22.280   61.803   28.701 -10.62933 36.33381 
1 1 1   22   23   31 o  193.619   12.870   29.322   3.7925   30.617   4.5224   26.253   6.9621  197.076   15.107  177.154   26.489 19.92271 30.49411 
1 1 1   22   23   32 o  184.412   13.543   26.703   3.7961   28.070   4.5194   23.429   6.9955  188.238   15.833  165.665   28.623 22.57275 32.71004 
1 1 1   22   23   33 o  130.240   16.809   13.622   3.2727   17.317   5.2669   11.298   4.1770  143.517   24.878  115.549   24.384 27.96759 34.83496 
1 1 1   22   23   34 o   64.761   24.125   2.8466   3.2021   3.9105   4.9529   2.0826   4.1972   76.861   29.682   66.034   26.735 10.82758 39.94744 
1 1 1   22   23   35 o  222.335   10.982   38.460   3.7375   36.064   5.6050   40.379   5.0152  212.062   17.422  225.985   14.577 -13.92258 22.71578 
1 1 1   22   23   36 o  183.255   13.016   26.455   3.6271   24.193   4.9521   29.074   5.3273  172.409   19.086  189.426   18.614 -17.01770 26.65983 
1 1 1   22   23   37 o   54.492   22.518   1.0524   3.0537   7.9563   4.3423  -5.7022   4.2952   94.979   27.978   44.374   21.368 50.60582 35.20470 
1 1 1   22   23   38 o  167.604   13.919   22.334   3.5384   20.950   4.9758   23.750   5.0329  158.612   21.012  169.784   19.735 -11.17165 28.82675 
1 1 1   22   23   39 o   90.543   27.240   7.3204   4.0828   8.4195   8.1785   6.9555   4.7120   97.663   38.023   88.505   29.594 9.157509 48.18216 
1 1 1   22   23   40 o   44.989   20.602  -1.6297   3.1966   0.6222   4.5791  -3.7702   4.4644   61.117   26.492   48.811   23.011 12.30589 35.08991 
1 1 1   22   23   41 o   44.184   20.429  -2.0034   3.2516  -1.6917   4.8297  -2.2618   4.3976   55.648   25.423   51.611   23.826 4.036400 34.84264 
1 1 1   22   23   42 o  119.774   19.490   12.152   3.4503   8.4728   4.9178   15.718   4.8419   94.475   30.147  132.972   24.699 -38.49723 38.97257 
1 1 1   22   24    0 o   78.123   41.642   7.1086   6.7630   7.1086   6.7630   7.1086   6.7630   78.123   41.642   78.123   41.642 0.000000 0.000000 
1 1 1   22   24    1 f  179.510   18.394   25.379   4.9826   18.710   6.7572   33.326   7.3765  150.080   30.456  204.089   24.077 -54.00954 38.82375 
1 1 1   22   24    2 o  367.993   11.218  104.378   6.3189   99.575   8.4436  110.492   9.5265  358.306   15.396  377.064   16.506 -18.75809 22.57187 
1 1 1   22   24    3 o  347.418   11.848   93.112   6.3005   97.316   8.3781   87.641   9.5586  354.189   15.454  334.575   18.740 19.61365 24.29057 
1 1 1   22   24    4 o   77.926   29.119   3.8630   4.6722   0.3740   5.7877   10.390   7.9164   70.737   30.209  113.837   38.357 -43.10061 48.82468 
1 1 1   22   24    5 o  111.748   21.583   10.123   3.5581   11.505   4.0356   5.2987   7.5401  118.938   23.000   94.340   36.570 24.59777 43.20111 
1 1 1   22   24    6 o   71.318   25.190   3.5940   3.4287   1.1020   3.7380   16.809   8.6082   60.806   24.997  139.825   38.836 -79.01950 46.18480 
1 1 1   22   24    7 o  235.428   11.344   42.740   4.0878   42.740   4.0878   0.0000   0.0000  235.428   11.344  ?   ?  0.000000 11.34378 
1 1 1   22   24    8 o  381.392   8.8302  111.839   5.1548  111.839   5.1548   0.0000   0.0000  381.392   8.8302  ?   ?  0.000000 8.830194 
1 1 1   22   24    9 o  148.785   14.717   17.323   3.3076   19.143   3.5986   7.4182   8.3954  156.357   15.230  103.867   38.990 52.48990 41.85907 
1 1 1   22   24   10 o   66.439   23.716   3.0468   3.0468   3.7331   3.2511  -1.9030   8.7311   71.371   24.573   79.953   35.547 -8.581810 43.21334 
1 1 1   22   24   11 o  307.608   8.8807   72.769   4.1813   75.859   4.5363   55.312   10.783  313.972   9.4393  261.645   27.328 52.32687 28.91247 
1 1 1   22   24   12 o  469.012   7.6925  168.973   5.5223  173.820   6.1061  147.197   12.942  475.525   8.3892  433.418   19.508 42.10757 21.23545 
1 1 1   22   24   13 o  315.805   8.7687   76.701   4.2386   79.617   4.5664   58.549   11.393  321.659   9.2749  268.661   28.121 52.99756 29.61132 
1 1 1   22   24   14 o  411.327   8.0073  130.025   5.0413  129.599   5.5058  132.233   12.540  410.484   8.7631  410.368   19.964 0.1154175 21.80236 
1 1 1   22   24   15 o  208.580   11.399   33.682   3.6253   33.198   3.8708   37.138   10.345  206.882   12.279  210.688   33.175 -3.806793 35.37408 
1 1 1   22   24   16 o  167.679   15.047   22.017   3.8207   19.526   4.0695   40.536   11.096  157.274   17.185  219.602   34.117 -62.32832 38.20060 
1 1 1   22   24   17 f   85.664   33.488   4.2110   6.3640   6.4968   7.8120  -0.2987   10.973   98.459   37.462   92.061   40.434 6.398018 55.12107 
1 1 1   22   24   18 o  127.269   26.557   13.448   5.0060   18.383   5.5706  -7.2639   11.412  149.858   25.179   81.763   37.968 68.09463 45.55836 
1 1 1   22   24   19 f  137.680   25.345   15.605   5.1443   13.157   5.7198   25.967   11.768  124.657   30.278  169.023   44.773 -44.36603 54.04986 
1 1 1   22   24   20 o   95.725   31.908   7.3378   5.4781   7.3378   5.4781   0.0000   0.0000   95.725   31.908  ?   ?  0.000000 31.90771 
1 1 1   22   24   21 o  130.836   29.832   14.493   5.8416   14.493   5.8416   0.0000   0.0000  130.836   29.832  ?   ?  0.000000 29.83203 
1 1 1   22   24   22 o  288.128   16.238   65.069   7.1323   65.069   7.1323   0.0000   0.0000  288.128   16.238  ?   ?  0.000000 16.23848 
1 1 1   22   24   23 o  227.433   20.079   41.191   6.9179   41.191   6.9179   0.0000   0.0000  227.433   20.079  ?   ?  0.000000 20.07860 
1 1 1   22   24   24 f  238.404   10.171   43.882   3.7113   43.694   3.8674   46.079   13.199  237.795   10.625  228.854   39.082 8.941833 40.50091 
1 1 1   22   24   25 o  210.879   11.084   34.494   3.5653   34.986   3.7204   28.959   12.476  212.277   11.493  175.625   45.900 36.65196 47.31743 
1 1 1   22   24   26 o   58.986   22.964   1.8696   2.9832   0.9459   3.0649   18.503   13.006   54.969   22.620  140.879   49.112 -85.91010 54.07104 
1 1 1   22   24   27 o  119.298   18.673   11.490   3.2978   11.370   3.4069   13.280   13.138  118.399   19.477  126.045   48.433 -7.646500 52.20280 
1 1 1   22   24   28 o  174.999   13.805   24.018   3.6678   24.249   3.8179   21.251   13.208  175.684   14.323  147.770   49.547 27.91310 51.57590 
1 1 1   22   24   29 f   81.941   24.379   5.5616   3.2838   5.6839   3.4083   3.9792   12.262   82.828   24.881  101.768   43.728 -18.93958 50.31124 
1 1 1   22   24   30 o  176.321   14.071   24.450   3.7658   26.732   4.4870   19.015   6.9263  183.660   16.124  147.551   31.619 36.10896 35.49332 
1 1 1   22   24   31 o   71.429   24.849   3.8904   3.3287   3.2564   3.8544   5.7505   6.6022   70.008   26.391   89.732   34.368 -19.72446 43.33219 
1 1 1   22   24   32 o   79.881   25.576   5.2576   3.5372   8.5006   4.2537  -2.0115   6.3684   99.257   27.194   65.578   29.656 33.67904 40.23708 
1 1 1   22   24   33 o  148.951   16.725   17.796   3.7472   18.242   4.5383   16.840   6.6423  149.220   20.404  137.010   32.215 12.21042 38.13370 
1 1 1   22   24   34 o  125.831   16.573   12.766   3.1142   15.533   4.4554   10.123   4.3547  136.552   22.070  107.897   26.549 28.65487 34.52413 
1 1 1   22   24   35 o   70.588   24.839   3.8535   3.3309   2.3750   4.6972   5.3490   4.7241   69.198   28.184   82.013   29.504 -12.81441 40.80201 
1 1 1   22   24   36 o   48.863   21.687  -0.6844   3.2364   0.7738   4.9925  -1.7413   4.2504   64.816   27.878   52.935   24.054 11.88086 36.82050 
1 1 1   22   24   37 f  149.489   15.228   17.934   3.4357   21.704   5.2933   15.189   4.5164  160.771   22.095  133.659   22.900 27.11150 31.82102 
1 1 1   22   24   38 o   45.240   21.419  -3.8269   3.9446  -2.5694   11.658  -3.9895   4.1918   82.283   38.265   46.668   22.090 35.61573 44.18361 
1 1 1   22   24   39 o   69.011   24.039   3.8667   3.1158   0.4437   4.6136   6.7369   4.2247   60.730   26.457   86.703   27.971 -25.97287 38.50098 
1 1 1   22   24   40 o   74.369   24.862   4.7424   3.3256  -1.4953   4.7231   10.876   4.6834   55.544   25.284  108.461   28.014 -52.91717 37.73700 
1 1 1   22   24   41 o  156.981   15.977   20.117   3.7854   27.381   5.2307   12.129   5.4849  181.001   19.172  112.074   30.952 68.92692 36.40906 
1 1 1   22   25    0 o  458.132   15.148  162.256   10.596  162.256   10.596  162.256   10.596  458.132   15.148  458.132   15.148 0.000000 0.000000 
1 1 1   22   25    1 o  124.524   26.990   12.820   4.9959   17.421   6.7395   7.2074   7.4435  144.166   31.428  100.591   36.907 43.57476 48.47562 
1 1 1   22   25    2 o  171.949   19.867   23.448   5.1324   19.077   6.6853   29.722   8.0095  151.563   29.880  190.770   28.287 -39.20752 41.14556 
1 1 1   22   25    3 o  296.827   12.806   68.097   5.8183   71.735   7.6441   63.086   8.9708  303.238   16.532  282.702   20.879 20.53604 26.63159 
1 1 1   22   25    4 o  237.224   14.855   43.808   5.3668   40.329   6.8995   49.138   8.5397  225.957   20.161  248.602   22.692 -22.64522 30.35469 
1 1 1   22   25    5 o  275.503   11.730   58.576   4.9464   58.576   4.9464   0.0000   0.0000  275.503   11.730  ?   ?  0.000000 11.72977 
1 1 1   22   25    6 o  328.791   10.980   83.346   5.5259   83.346   5.5259   0.0000   0.0000  328.791   10.980  ?   ?  0.000000 10.98021 
1 1 1   22   25    7 o  248.135   10.207   47.425   3.8767   48.147   4.3085   44.357   8.8852  249.841   11.266  235.037   25.085 14.80409 27.49931 
1 1 1   22   25    8 o   63.848   24.065   2.4528   3.2045   2.3983   3.4655   2.7745   8.4177   65.009   24.900   89.723   37.256 -24.71355 44.81043 
1 1 1   22   25    9 o  266.833   9.8155   54.823   4.0089   52.373   4.3749   67.650   10.011  260.606   10.968  291.846   22.587 -31.23975 25.10902 
1 1 1   22   25   10 o  240.247   10.441   44.483   3.8393   43.867   4.1618   47.999   9.9475  238.419   11.404  243.434   27.160 -5.015411 29.45720 
1 1 1   22   25   11 o  161.089   14.377   20.281   3.5076   18.381   3.7471   33.731   9.9702  152.841   16.267  200.482   33.685 -47.64111 37.40755 
1 1 1   22   25   12 o  318.307   9.0858   77.969   4.4267   79.805   4.7877   67.152   11.620  321.907   9.7169  288.419   26.622 33.48764 28.34027 
1 1 1   22   25   13 o  419.991   8.1180  135.599   5.2187  136.825   5.7051  129.315   12.915  421.711   8.8386  404.600   20.927 17.11163 22.71668 
1 1 1   22   25   14 o  336.577   8.8557   87.167   4.5622   84.249   4.8775  107.575   12.899  330.732   9.6349  367.603   23.041 -36.87082 24.97453 
1 1 1   22   25   15 o  290.684   11.117   65.229   4.9463   64.601   5.3947   68.545   12.392  289.028   12.194  290.091   28.267 -1.062927 30.78478 
1 1 1   22   25   16 o   52.970   23.375  -0.8659   3.7073  -1.1024   3.9227   1.1115   11.342   53.827   23.884   96.052   41.663 -42.22545 48.02360 
1 1 1   22   25   17 o  139.046   24.508   15.845   5.0253   14.030   5.5722   23.755   11.632  129.190   28.902  161.454   45.252 -32.26430 53.69420 
1 1 1   22   25   18 o  147.946   23.251   17.799   5.0916   22.208   5.6567  -1.0221   11.687  165.718   22.914   92.853   41.211 72.86488 47.15319 
1 1 1   22   25   19 o  333.287   12.399   86.023   6.3251   83.918   7.1276   93.824   13.721  328.592   14.172  340.100   26.569 -11.50815 30.11212 
1 1 1   22   25   20 o  182.450   20.052   26.575   5.5074   27.977   6.1642   21.025   12.262  186.485   22.020  150.733   47.551 35.75169 52.40231 
1 1 1   22   25   21 o  104.130   32.903   9.0793   5.8693   9.0793   5.8693   0.0000   0.0000  104.130   32.903  ?   ?  0.000000 32.90326 
1 1 1   22   25   22 o  164.602   26.168   22.373   6.3723   22.373   6.3723   0.0000   0.0000  164.602   26.168  ?   ?  0.000000 26.16814 
1 1 1   22   25   23 o  129.326   32.615   14.485   6.4551   14.485   6.4551   0.0000   0.0000  129.326   32.615  ?   ?  0.000000 32.61507 
1 1 1   22   25   24 o  287.788   17.314   65.306   7.5912   65.306   7.5912   0.0000   0.0000  287.788   17.314  ?   ?  0.000000 17.31397 
1 1 1   22   25   25 o  132.609   16.331   13.981   3.2447   13.981   3.2447   0.0000   0.0000  132.609   16.331  ?   ?  0.000000 16.33059 
1 1 1   22   25   26 o   93.174   21.617   7.2005   3.0232   7.9795   3.0991  -8.1194   13.744   98.262   21.226   87.556   40.990 10.70628 46.15944 
1 1 1   22   25   27 o  182.181   12.566   25.922   3.4826   25.461   3.5900   33.279   14.344  180.392   13.091  183.122   49.841 -2.729950 51.53112 
1 1 1   22   25   28 o   68.786   24.881   3.3662   3.3656   2.9381   3.4758   9.7975   13.471   66.960   25.097  116.599   47.637 -49.63895 53.84390 
1 1 1   22   25   29 o   53.443   23.247  -0.2224   3.5509  -0.9637   3.7208   7.3439   11.887   52.163   23.198  107.355   44.399 -55.19229 50.09390 
1 1 1   22   25   30 o  147.017   17.100   17.315   3.7760   18.361   4.0308   9.8163   10.793  151.190   17.756  110.878   43.533 40.31139 47.01530 
1 1 1   22   25   31 o  117.635   19.730   11.361   3.4268   11.920   4.0000   9.8176   6.6432  119.340   22.728  105.456   35.137 13.88376 41.84684 
1 1 1   22   25   32 o  104.334   21.699   9.1308   3.3523   6.3027   3.8444   18.104   6.8478   86.153   26.538  142.078   32.229 -55.92449 41.74881 
1 1 1   22   25   33 o  135.141   18.669   14.887   3.7585   21.762   4.4978  -1.0261   6.8425  164.005   18.225   69.662   31.184 94.34358 36.11946 
1 1 1   22   25   34 o   63.260   24.678   2.3906   3.4506   4.8336   4.0651  -3.9069   6.5267   77.889   27.437   61.726   28.680 16.16312 39.69101 
1 1 1   22   25   35 o  118.428   19.563   11.622   3.4224   11.633   4.6449   11.609   5.0620  114.958   26.879  113.785   28.984 1.173233 39.52916 
1 1 1   22   25   36 o   70.554   24.608   3.9718   3.2654   6.9365   4.8351   1.4855   4.4278   88.939   29.977   63.912   26.816 25.02713 40.22079 
1 1 1   22   25   37 o   76.159   26.712   4.7978   3.8504   22.287   7.9839  -0.5028   4.3953  152.015   35.032   56.854   25.251 95.16144 43.18440 
1 1 1   22   25   38 o   91.861   22.980   7.3928   3.2231   13.688   5.0379   3.0311   4.1936  122.931   27.467   68.292   27.033 54.63860 38.53831 
1 1 1   22   25   39 o   67.565   25.344   3.4382   3.5460   5.0423   5.2592   2.1012   4.8015   79.437   30.612   66.806   27.972 12.63065 41.46678 
1 1 1   22   25   40 o   60.568   24.469   2.0679   3.5080   1.6867   5.0693   2.4181   4.8594   66.252   28.282   67.859   28.253 -1.607437 39.97594 
1 1 1   22   26    0 o  448.159   15.735  155.479   10.764  155.479   10.764  155.479   10.764  448.159   15.735  448.159   15.735 0.000000 0.000000 
1 1 1   22   26    1 o  196.098   17.992   30.270   5.3401   28.018   7.5475   32.526   7.5564  185.249   27.449  200.798   25.137 -15.54865 37.21954 
1 1 1   22   26    2 o  293.740   13.102   66.755   5.8907   65.128   7.8405   68.865   8.9263  288.287   17.856  295.672   19.839 -7.384888 26.69119 
1 1 1   22   26    3 o  149.058   29.380   18.475   6.4648   18.475   6.4648   0.0000   0.0000  149.058   29.380  ?   ?  0.000000 29.38010 
1 1 1   22   26    4 o   57.259   26.730  -4.9646   5.7764  -4.9646   5.7764   0.0000   0.0000   57.259   26.730  ?   ?  0.000000 26.72996 
1 1 1   22   26    5 o  312.306   12.486   75.399   5.9685   76.008   7.6263   74.436   9.5880  312.171   16.015  307.079   20.517 5.092010 26.02726 
1 1 1   22   26    6 o  279.460   10.685   60.216   4.5706   54.500   5.1548   81.231   9.8840  265.462   12.687  320.941   20.224 -55.47894 23.87371 
1 1 1   22   26    7 o  298.699   9.1723   68.661   4.1936   68.290   4.6458   70.295   9.7441  297.696   10.196  297.847   21.518 -0.1511536 23.81161 
1 1 1   22   26    8 o  192.077   12.672   28.657   3.7047   29.676   4.0668   23.689   8.9821  195.238   13.695  166.054   36.348 29.18434 38.84230 
1 1 1   22   26    9 o  179.019   13.522   24.964   3.6778   27.081   4.0236   14.212   9.0680  186.327   14.216  128.687   40.923 57.63982 43.32197 
1 1 1   22   26   10 o  143.537   16.343   16.249   3.5266   16.120   3.7843   17.101   9.7218  142.593   17.721  139.541   42.045 3.052063 45.62716 
1 1 1   22   26   11 o   95.552   23.537   7.5307   3.4198   6.2295   3.6559   16.640   9.6729   87.336   25.656  137.705   42.040 -50.36951 49.25038 
1 1 1   22   26   12 o  138.556   17.438   15.226   3.6163   14.922   3.8631   17.374   10.281  136.716   18.972  140.187   43.432 -3.470734 47.39528 
1 1 1   22   26   13 o   93.808   24.124   7.2747   3.4834   7.6580   3.6984   4.2625   10.367   96.136   24.926   99.841   41.391 -3.704552 48.31702 
1 1 1   22   26   14 o   48.665   22.366  -2.5680   3.8141  -2.9332   4.0876  -0.1094   10.607   49.839   22.995   90.813   39.823 -40.97413 45.98531 
1 1 1   22   26   15 o  200.403   12.683   31.224   3.8705   30.785   4.0991   34.832   11.755  198.764   13.554  199.231   39.937 -0.4665833 42.17424 
1 1 1   22   26   16 o  146.038   16.426   16.852   3.6079   16.893   3.8101   16.499   11.226  145.941   17.399  136.537   45.679 9.403458 48.88097 
1 1 1   22   26   17 o  241.791   15.138   45.710   5.5744   47.730   6.3182   38.616   11.842  246.480   16.848  210.736   38.116 35.74438 41.67319 
1 1 1   22   26   18 o  256.033   14.826   51.212   5.7853   53.767   6.5933   42.663   12.061  261.716   16.544  222.391   36.714 39.32466 40.26969 
1 1 1   22   26   19 o   57.749   26.261  -2.5303   5.0783  -3.2332   5.6947   0.1994   11.223   60.022   27.490   92.977   40.863 -32.95490 49.24928 
1 1 1   22   26   20 o   82.399   32.606   3.7670   6.0990   3.7670   6.0990   0.0000   0.0000   82.399   32.606  ?   ?  0.000000 32.60605 
1 1 1   22   26   21 o  165.604   26.424   22.697   6.4728   22.697   6.4728   0.0000   0.0000  165.604   26.424  ?   ?  0.000000 26.42397 
1 1 1   22   26   22 o  176.123   22.098   25.101   5.8259   27.255   6.4319   15.256   13.749  182.997   23.506  132.611   49.874 50.38593 55.13569 
1 1 1   22   26   23 o  217.821   18.698   37.719   6.1736   32.964   6.8643   57.844   14.122  201.792   22.613  257.754   36.842 -55.96254 43.22845 
1 1 1   22   26   24 o  187.671   23.631   28.752   6.6375   21.688   7.4937   54.474   14.300  158.578   31.977  247.736   39.000 -89.15881 50.43368 
1 1 1   22   26   25 o  191.677   27.524   30.690   7.8436   35.736   9.3336   18.560   14.471  205.113   30.671  139.920   51.442 65.19359 59.89114 
1 1 1   22   26   26 o  198.896   13.380   30.967   4.0497   30.967   4.0497   0.0000   0.0000  198.896   13.380  ?   ?  0.000000 13.38018 
1 1 1   22   26   27 o   70.045   24.287   3.7145   3.1785   3.7145   3.1785   0.0000   0.0000   70.045   24.287  ?   ?  0.000000 24.28661 
1 1 1   22   26   28 o  275.556   12.194   59.101   5.1432   59.101   5.1432   0.0000   0.0000  275.556   12.194  ?   ?  0.000000 12.19429 
1 1 1   22   26   29 o   43.455   20.297  -2.8588   3.3376  -3.8017   3.5403   4.6766   10.008   42.815   20.277   95.724   40.248 -52.90904 45.06694 
1 1 1   22   26   30 o   55.535   23.338   0.7280   3.3625   3.0142   3.6042 -14.6256   9.3402   67.439   25.497   61.009   29.859 6.429729 39.26369 
1 1 1   22   26   31 o   54.502   22.790   0.7975   3.1814   1.2060   3.6501  -0.4941   6.4900   59.265   24.565   69.423   30.766 -10.15712 39.36963 
1 1 1   22   26   32 o   61.165   24.356   1.9625   3.4227   4.8730   4.0149  -5.7786   6.5478   78.142   27.284   58.558   27.686 19.58411 38.87049 
1 1 1   22   26   33 o   83.614   25.059   5.9811   3.4601   4.5096   4.0528   9.9379   6.6458   76.112   27.333  104.483   35.145 -28.37125 44.52231 
1 1 1   22   26   34 o   94.836   25.983   7.8938   3.8831   9.5482   4.2859   0.3111   9.1755  103.929   26.777   80.885   36.166 23.04369 44.99993 
1 1 1   22   26   35 f   74.297   29.648   3.5320   5.0819  -1.9994   8.1984   6.9834   6.4761   72.123   33.015   90.949   34.224 -18.82582 47.55273 
1 1 1   22   26   36 o  113.934   22.981   11.219   3.8693   15.950   8.0344   9.7904   4.4150  125.083   38.337  104.055   27.358 21.02798 47.09733 
1 1 1   22   26   37 o  150.171   15.510   18.259   3.5137   21.786   4.9780   14.757   4.9603  160.933   20.688  128.672   26.079 32.26129 33.28781 
1 1 1   22   26   38 o  132.953   17.643   14.626   3.5017   14.994   4.9621   14.260   4.9422  129.363   25.963  125.676   26.525 3.687225 37.11654 
1 1 1   22   27    1 o  349.203   17.047   95.151   9.1118   95.151   9.1118   0.0000   0.0000  349.203   17.047  ?   ?  0.000000 17.04729 
1 1 1   22   27    2 o  352.779   15.776   96.845   8.5184   96.845   8.5184   0.0000   0.0000  352.779   15.776  ?   ?  0.000000 15.77556 
1 1 1   22   27    3 o  489.949   10.717  185.142   8.0368  168.279   10.438  209.690   12.594  465.546   14.649  519.044   15.852 -53.49884 21.58444 
1 1 1   22   27    4 o  240.144   14.506   44.923   5.3069   42.531   6.6913   48.978   8.7129  232.188   18.994  247.484   23.274 -15.29625 30.04132 
1 1 1   22   27    5 o  263.365   13.761   53.913   5.5281   51.557   6.9141   58.088   9.2043  256.229   17.739  270.031   22.473 -13.80188 28.63052 
1 1 1   22   27    6 o  253.874   14.359   50.181   5.5568   52.818   6.8820   45.242   9.4190  259.448   17.431  236.210   26.509 23.23827 31.72674 
1 1 1   22   27    7 f  205.634   12.354   32.820   3.8705   30.180   4.2504   45.637   9.3651  196.709   14.213  237.338   26.217 -40.62958 29.82183 
1 1 1   22   27    8 o  178.369   13.776   24.816   3.7320   23.320   4.0994   32.056   9.0194  172.389   15.709  196.174   31.073 -23.78468 34.81829 
1 1 1   22   27    9 o  112.997   21.451   10.396   3.5744   9.7704   3.9310   13.383   8.5881  108.744   24.237  124.910   39.837 -16.16582 46.63007 
1 1 1   22   27   10 o  328.479   9.1366   83.075   4.5937   84.061   5.0656   78.511   10.899  330.220   10.022  313.677   22.858 16.54355 24.95881 
1 1 1   22   27   11 o  190.763   13.595   28.364   3.9436   26.935   4.2366   37.637   10.790  185.486   15.052  210.608   34.680 -25.12248 37.80610 
1 1 1   22   27   12 o  212.557   14.583   35.282   4.7159   37.265   5.2234   26.541   10.967  218.120   15.752  172.228   41.984 45.89206 44.84127 
1 1 1   22   27   13 o  276.395   12.073   59.112   5.1075   59.114   5.6913   59.105   11.578  276.029   13.471  268.453   28.617 7.575958 31.62906 
1 1 1   22   27   14 o  176.057   14.290   24.247   3.8176   23.187   4.0395   33.110   11.680  171.802   15.529  193.205   40.776 -21.40277 43.63311 
1 1 1   22   27   15 o  245.295   11.141   46.501   4.1829   47.642   4.5089   39.453   11.205  248.123   11.872  214.688   35.328 33.43503 37.26957 
1 1 1   22   27   16 o  156.727   16.048   19.376   3.7954   20.490   4.0582   11.604   10.720  161.013   16.710  119.968   44.250 41.04513 47.30018 
1 1 1   22   27   17 o  242.518   15.677   46.104   5.7883   47.776   6.7003   41.185   11.491  246.013   17.917  218.919   35.511 27.09338 39.77491 
1 1 1   22   27   18 o  132.858   27.369   14.808   5.3803   14.444   6.1484   16.000   11.117  129.734   31.319  133.748   45.453 -4.013519 55.19786 
1 1 1   22   27   19 o  269.274   17.621   57.205   7.2226   57.205   7.2226   0.0000   0.0000  269.274   17.621  ?   ?  0.000000 17.62100 
1 1 1   22   27   20 o  225.057   21.987   40.757   7.4773   41.373   8.9656   39.350   13.551  224.279   26.638  206.898   44.138 17.38120 51.55270 
1 1 1   22   27   21 f   88.947   34.734   4.9662   6.8410   10.983   8.0086 -11.2751   13.157  113.527   38.578   81.989   38.905 31.53788 54.78923 
1 1 1   22   27   22 o  176.566   28.925   26.248   7.5465   32.028   8.9838   12.395   13.909  193.968   31.327  124.783   49.283 69.18480 58.39717 
1 1 1   22   27   23 o  104.897   36.731   9.1109   7.2788   16.574   8.3142 -15.3785   15.061  135.271   38.379   83.662   40.218 51.60878 55.59173 
1 1 1   22   27   24 o  144.634   29.105   17.880   6.2201   18.485   6.8811   15.181   14.544  145.787   31.737  130.940   50.780 14.84744 59.88244 
1 1 1   22   27   25 o  359.569   13.688  100.933   7.5332  105.895   8.9993   89.316   13.770  366.968   16.022  327.518   27.728 39.45013 32.02417 
1 1 1   22   27   26 o  112.001   32.889   11.076   6.0089   6.0073   7.2134   22.569   10.861   92.460   35.789  152.770   44.035 -60.31005 56.74419 
1 1 1   22   27   27 o   85.279   25.041   6.1212   3.4833   5.4081   3.7654   10.353   9.1722   81.235   26.424  110.225   40.876 -28.98983 48.67305 
1 1 1   22   27   28 o   67.752   24.642   3.2925   3.3079   3.1556   3.5491   4.1985   9.1284   68.003   25.385   91.758   38.502 -23.75471 46.11725 
1 1 1   22   27   29 o  171.748   16.150   23.529   4.1958   23.529   4.1958   0.0000   0.0000  171.748   16.150  ?   ?  0.000000 16.15034 
1 1 1   22   27   30 o  142.500   20.404   16.695   4.3233   16.695   4.3233   0.0000   0.0000  142.500   20.404  ?   ?  0.000000 20.40385 
1 1 1   22   27   31 o  197.873   15.035   31.099   4.5195   31.099   4.5195   0.0000   0.0000  197.873   15.035  ?   ?  0.000000 15.03487 
1 1 1   22   27   32 o   91.720   24.278   7.2689   3.4617   8.9666   4.0432   2.6074   6.6997  101.256   25.964   77.956   32.862 23.29986 41.88119 
1 1 1   22   27   33 o   60.462   25.252   1.2900   3.8993   0.1570   4.2124   8.0733   10.307   58.208   25.320  100.934   41.502 -42.72673 48.61550 
1 1 1   22   27   34 o  176.438   20.209   25.825   5.3592   29.589   8.4842   23.326   6.9129  179.323   32.088  161.267   29.075 18.05647 43.30183 
1 1 1   22   27   35 o  170.653   17.288   23.761   4.4534   30.520   5.2076   5.3655   8.5914  193.231   17.807   89.000   37.349 104.2310 41.37671 
1 1 1   22   27   36 o  141.786   19.774   16.848   4.1746   20.732   4.8842   6.3171   8.0423  156.755   20.875   89.764   36.756 66.99059 42.26995 
1 1 1   22   27   37 o  267.861   13.376   57.028   5.4842   38.311   8.7234   69.261   7.0521  205.548   28.493  292.702   15.799 -87.15492 32.58036 
1 1 1   22   28    0 o  211.042   25.120   36.225   7.8111   36.225   7.8111   36.225   7.8111  211.042   25.120  211.042   25.120 0.000000 0.000000 
1 1 1   22   28    1 o  100.745   36.375   7.6234   7.1885   0.0000   0.0000   7.6234   7.1885  ?   ?   100.745   36.375 0.000000 36.37453 
1 1 1   22   28    2 o  185.315   29.956   28.536   8.2072   0.0000   0.0000   28.536   8.2072  ?   ?   185.315   29.956 0.000000 29.95625 
1 1 1   22   28    3 f  401.521   17.525  126.115   10.770   0.0000   0.0000  126.115   10.770  ?   ?   401.521   17.525 0.000000 17.52484 
1 1 1   22   28    4 o  140.582   37.936   17.280   8.3521   0.0000   0.0000   17.280   8.3521  ?   ?   140.582   37.936 0.000000 37.93620 
1 1 1   22   28    5 o  327.760   12.045   83.084   6.0429   81.740   7.6367   85.335   9.8830  324.025   15.398  328.751   19.732 -4.725861 25.02870 
1 1 1   22   28    6 o  289.940   13.166   65.155   5.8428   71.867   7.4832   54.672   9.3516  303.133   16.187  261.033   23.663 42.09961 28.66953 
1 1 1   22   28    7 o  207.841   12.372   33.549   3.9181   31.546   4.3241   42.738   9.2623  201.069   14.140  228.922   26.950 -27.85291 30.43435 
1 1 1   22   28    8 o  144.175   17.347   16.483   3.7512   14.360   4.1139   26.955   9.1375  133.398   20.829  177.333   34.907 -43.93474 40.64870 
1 1 1   22   28    9 o  287.138   11.716   63.756   5.1494   65.217   5.9609   59.462   10.222  289.938   13.432  271.459   24.878 18.47858 28.27280 
1 1 1   22   28   10 o  472.257   8.2568  171.581   5.9684  168.382   6.6404  185.032   13.616  467.513   9.2796  485.469   18.324 -17.95599 20.53950 
1 1 1   22   28   11 o  253.551   12.894   49.963   4.9875   47.731   5.6418   57.947   10.670  247.146   14.985  266.865   26.471 -19.71918 30.41796 
1 1 1   22   28   12 o  245.636   11.624   46.672   4.3702   49.552   4.7651   31.425   10.964  252.939   12.308  188.823   39.216 64.11604 41.10189 
1 1 1   22   28   13 o   64.754   25.490   2.1399   3.7093   1.3307   3.9618   7.8879   10.559   62.727   25.754  108.952   42.969 -46.22491 50.09619 
1 1 1   22   28   14 o   93.092   27.007   7.2037   4.0737   5.4517   4.4622   15.971   9.9820   84.038   28.795  133.759   42.979 -49.72095 51.73334 
1 1 1   22   28   15 o  183.984   15.630   26.613   4.3598   25.006   4.7733   34.701   10.709  177.605   17.798  199.992   36.322 -22.38661 40.44812 
1 1 1   22   28   16 o  216.016   13.898   36.443   4.5709   36.540   5.0030   35.952   11.243  215.870   15.239  202.581   37.645 13.28902 40.61287 
1 1 1   22   28   17 o  142.324   31.165   17.354   6.6011   25.298   8.0988   1.6320   11.394  172.216   31.899   95.971   41.693 76.24461 52.49651 
1 1 1   22   28   18 o  267.786   23.439   57.938   9.5106   57.938   9.5106   0.0000   0.0000  267.786   23.439  ?   ?  0.000000 23.43931 
1 1 1   22   28   19 o  147.993   26.106   18.238   5.6975   16.361   6.4529   24.875   12.135  137.765   31.312  161.718   46.526 -23.95255 56.08107 
1 1 1   22   28   20 o  188.971   21.460   28.840   6.0972   28.620   6.8786   29.646   13.171  186.716   24.673  175.212   47.790 11.50356 53.78315 
1 1 1   22   28   21 o  210.220   19.680   35.379   6.2586   29.741   6.9317   60.253   14.559  190.386   24.344  261.570   37.432 -71.18327 44.65221 
1 1 1   22   28   22 o  116.327   32.711   11.862   6.0677   10.042   6.7768   19.218   13.625  107.953   35.465  141.115   50.175 -33.16211 61.44362 
1 1 1   22   28   23 o  132.771   31.607   15.435   6.3308   26.963   7.3808 -16.6585   12.315  178.839   27.872   72.114   35.071 106.7247 44.79736 
1 1 1   22   28   24 o  202.732   20.460   33.205   6.2620   38.065   7.6877   23.623   10.795  215.311   23.721  156.821   43.466 58.48958 49.51703 
1 1 1   22   28   25 o   60.091   27.395  -2.5168   5.5714  -2.4373   7.1560  -2.6390   8.8780   68.855   31.258   76.321   34.712 -7.465797 46.71158 
1 1 1   22   28   26 o   61.699   28.831  -4.8780   6.7461   2.3520   11.340  -8.8384   8.3928   94.209   41.247   63.761   30.483 30.44793 51.28899 
1 1 1   22   28   27 o  188.227   21.948   29.102   6.2045   40.563   8.5491   16.348   9.0186  219.807   25.908  130.600   40.715 89.20607 48.25916 
1 1 1   22   28   28 o   76.370   24.879   4.7783   3.3376   6.0130   3.5916  -3.0362   9.0356   84.242   25.595   75.419   34.573 8.823097 43.01618 
1 1 1   22   28   29 f  192.753   13.619   29.306   3.9923   32.215   4.4611   17.609   8.9462  201.721   14.546  134.423   40.295 67.29733 42.84021 
1 1 1   22   28   30 o  174.171   14.665   24.109   3.8733   26.354   4.3283   15.087   8.6784  181.657   15.722  124.205   40.091 57.45210 43.06361 
1 1 1   22   28   31 o   91.120   25.179   7.2333   3.6286   7.4801   3.9931   6.0639   8.6929   92.286   26.729   93.186   38.192 -0.9000854 46.61563 
1 1 1   22   28   32 o  219.145   28.482   42.275   9.3280   42.275   9.3280   0.0000   0.0000  219.145   28.482  ?   ?  0.000000 28.48244 
1 1 1   22   28   33 o   63.820   30.328  -6.3715   8.0544  -6.3715   8.0544   0.0000   0.0000   63.820   30.328  ?   ?  0.000000 30.32829 
1 1 1   22   28   34 o  234.405   15.088   44.082   5.3846   44.082   5.3846   0.0000   0.0000  234.405   15.088  ?   ?  0.000000 15.08801 
1 1 1   22   28   35 o  103.456   26.683   9.7245   4.2530   12.900   4.7222  -3.9124   9.7864  119.655   26.484   73.329   34.412 46.32607 43.42334 
1 1 1   22   28   36 o  111.965   22.345   10.903   3.6953   13.825   4.6108   5.6543   6.1786  124.662   25.034   83.551   32.896 41.11092 41.33784 
1 1 1   22   29    0 o  245.873   23.098   48.385   8.5164   48.385   8.5164   48.385   8.5164  245.873   23.098  245.873   23.098 0.000000 0.000000 
1 1 1   22   29    1 o  439.552   11.481  149.354   7.7242  154.256   10.880  144.374   10.967  444.628   15.987  429.790   16.672 14.83798 23.09853 
1 1 1   22   29    2 o   68.697   28.815   1.1082   5.1101   3.1830   6.9754  -1.2950   7.5072   84.317   34.344   74.687   33.095 9.629959 47.69476 
1 1 1   22   29    3 o  202.993   17.631   32.513   5.4238   34.061   7.2843   30.588   8.1251  205.443   23.593  192.345   28.457 13.09860 36.96511 
1 1 1   22   29    4 o  138.245   24.679   15.709   5.0306   18.098   6.5960   12.386   7.7780  146.324   30.442  120.084   37.870 26.24050 48.58879 
1 1 1   22   29    5 o  352.052   12.400   95.987   6.6820   88.215   8.6370  107.574   10.546  335.419   16.877  369.488   18.708 -34.06854 25.19574 
1 1 1   22   29    6 o   81.203   34.562   1.3176   7.5299   0.0000   0.0000   1.3176   7.5299  ?   ?    81.203   34.562 0.000000 34.56179 
1 1 1   22   29    7 o  697.669   16.292  380.322   17.398   0.0000   0.0000  380.322   17.398  ?   ?   697.669   16.292 0.000000 16.29208 
1 1 1   22   29    8 o   55.635   26.039  -4.8520   5.5404  -7.0295   7.1563  -1.5943   8.7533   61.407   29.005   79.722   35.509 -18.31511 45.84933 
1 1 1   22   29    9 o  301.155   24.772   73.250   11.318   0.0000   0.0000   73.250   11.318  ?   ?   301.155   24.772 0.000000 24.77221 
1 1 1   22   29   10 o  314.899   12.621   76.877   6.0834   76.263   7.2389   78.351   11.224  312.768   15.121  312.135   23.668 0.6322632 28.08632 
1 1 1   22   29   11 f  224.690   15.866   39.625   5.4216   37.557   6.3805   44.997   10.283  217.393   19.378  232.785   29.523 -15.39188 35.31480 
1 1 1   22   29   12 o  246.732   15.062   47.645   5.6610   53.160   6.7310   34.315   10.464  259.895   17.014  199.247   35.619 60.64793 39.47369 
1 1 1   22   29   13 o  308.615   13.155   73.968   6.2139   78.512   7.3392   62.465   11.678  317.214   15.116  275.422   28.094 41.79169 31.90194 
1 1 1   22   29   14 o  271.949   14.203   57.740   5.8915   51.969   6.8580   73.994   11.510  256.617   17.566  301.892   25.137 -45.27460 30.66644 
1 1 1   22   29   15 o  137.577   26.525   15.820   5.3832   15.359   6.2542   17.139   10.575  133.657   31.148  136.986   44.260 -3.328873 54.12154 
1 1 1   22   29   16 o   64.025   28.791  -1.9647   5.9042  -1.9647   5.9042   0.0000   0.0000   64.025   28.791  ?   ?  0.000000 28.79076 
1 1 1   22   29   17 o  140.822   30.058   16.971   6.2816   16.971   6.2816   0.0000   0.0000  140.822   30.058  ?   ?  0.000000 30.05765 
1 1 1   22   29   18 o   61.246   27.450  -1.6314   5.3195  -7.0290   5.9401   20.226   11.953   53.848   25.717  145.680   47.055 -91.83189 53.62363 
1 1 1   22   29   19 o   88.526   31.814   5.9871   5.4917   6.2178   6.1906   5.1350   11.898   91.256   33.632  103.673   43.752 -12.41642 55.18412 
1 1 1   22   29   20 o  119.120   31.773   12.412   5.8998   7.6779   6.7326   28.075   12.247   98.063   35.227  170.562   45.900 -72.49910 57.86006 
1 1 1   22   29   21 f  113.906   31.773   11.371   5.7490   17.604   6.8864  -2.9637   10.443  141.488   32.484   82.520   37.576 58.96852 49.67104 
1 1 1   22   29   22 o   82.044   31.605   4.4715   5.6042   0.1677   6.7323   14.183   10.113   73.080   31.895  124.164   43.306 -51.08392 53.78346 
1 1 1   22   29   23 o  272.743   15.031   58.599   6.2509   60.932   7.8986   54.691   10.225  275.939   18.813  255.989   26.480 19.94986 32.48263 
1 1 1   22   29   24 o   75.206   30.290   3.0234   5.3572   2.2521   6.9330   4.1665   8.4398   79.174   33.405   89.775   37.293 -10.60109 50.06661 
1 1 1   22   29   25 o  178.208   26.840   26.946   7.0942   36.545   11.700   21.364   8.9212  197.185   40.130  150.715   38.525 46.46985 55.62895 
1 1 1   22   29   26 f  107.838   32.558   10.417   5.8251   12.366   7.7047   7.8173   8.8998  115.611   37.808  100.677   39.531 14.93430 54.70004 
1 1 1   22   29   27 o  158.476   25.967   21.391   6.0806   29.971   8.5614   12.659   8.6377  184.081   31.519  116.109   40.049 67.97223 50.96406 
1 1 1   22   29   28 o  211.143   20.131   36.395   6.4271   37.249   8.9172   35.472   9.2718  207.107   28.918  200.100   31.298 7.007248 42.61255 
1 1 1   22   29   29 o  110.251   22.803   10.355   3.7210   12.323   4.1693   2.6503   8.2493  120.170   23.509   83.299   35.832 36.87082 42.85532 
1 1 1   22   29   30 o  166.593   25.162   23.833   6.2161   27.239   8.7355   20.338   8.8475  170.516   34.651  142.686   39.272 27.83023 52.37355 
1 1 1   22   29   31 o  125.536   39.722   16.112   8.5518   16.112   8.5518   0.0000   0.0000  125.536   39.722  ?   ?  0.000000 39.72218 
1 1 1   22   29   32 o  141.954   18.277   16.609   3.8789   19.014   4.4387   8.8365   7.9785  151.217   19.641   98.441   37.763 52.77583 42.56538 
1 1 1   22   29   33 o  179.209   15.372   25.901   4.1758   31.341   4.8951   11.360   8.0025  196.556   16.421  106.411   38.385 90.14475 41.75018 
1 1 1   22   29   34 o  136.367   18.632   15.479   3.7873   17.514   4.6374   11.404   6.5626  143.135   21.860  107.171   34.885 35.96409 41.16882 
1 1 1   22   30    0 o  116.381   44.558   14.833   7.4941   14.833   7.4941   14.833   7.4941  116.381   44.558  116.381   44.558 0.000000 0.000000 
1 1 1   22   30    1 o  257.478   15.423   51.889   6.0504   51.030   8.3568   52.837   8.7715  252.549   21.833  256.640   22.558 -4.091415 31.39383 
1 1 1   22   30    2 o  126.690   28.462   13.544   5.3845   11.341   7.2793   16.207   8.0014  115.204   36.669  135.624   37.355 -20.42043 52.34492 
1 1 1   22   30    3 o  319.360   13.212   79.167   6.4584   82.700   8.7843   75.010   9.5282  324.122   17.774  307.302   20.373 16.82068 27.03628 
1 1 1   22   30    4 o  259.667   15.281   52.761   6.0468   53.910   8.0842   51.303   9.1103  260.259   20.459  252.109   23.894 8.150284 31.45608 
1 1 1   22   30    5 o  317.022   13.631   78.095   6.6143   72.648   8.5750   86.097   10.393  303.299   18.560  329.036   20.742 -25.73633 27.83414 
1 1 1   22   30    6 o  282.259   12.568   61.773   5.4297   63.468   6.5958   58.211   9.5637  284.879   15.181  268.820   23.479 16.05939 27.95918 
1 1 1   22   30    7 o   88.602   29.317   6.2785   4.6279   8.7430   5.4968   0.2790   8.5763  102.140   31.777   82.851   36.083 19.28851 48.08109 
1 1 1   22   30    8 o  267.263   13.638   55.664   5.5606   57.996   6.5156   49.411   10.669  272.028   15.715  244.133   29.126 27.89465 33.09509 
1 1 1   22   30    9 o  357.707   9.4888   98.679   5.1953   97.070   5.7830  105.410   11.828  354.425   10.660  363.554   21.350 -9.129242 23.86338 
1 1 1   22   30   10 o  170.786   15.921   22.996   4.1139   24.566   4.4777   14.494   10.420  176.281   16.798  128.211   44.000 48.06972 47.09790 
1 1 1   22   30   11 o   64.977   26.082   1.9123   3.9577   1.9421   4.3083   1.7515   10.017   67.044   27.106   91.469   39.415 -24.42553 47.83569 
1 1 1   22   30   12 o  158.572   17.230   19.969   4.1146   19.209   4.4834   24.028   10.359  154.766   19.349  162.081   41.560 -7.315170 45.84343 
1 1 1   22   30   13 o   83.402   27.221   5.5876   3.9947   6.3012   4.3551   1.8042   10.028   87.957   28.402   91.354   39.401 -3.397621 48.57046 
1 1 1   22   30   14 o   61.605   25.672   1.0323   4.0173   1.0278   4.3158   1.0616   10.993   63.396   26.529   92.945   40.655 -29.54884 48.54547 
1 1 1   22   30   15 o  207.009   14.726   33.638   4.6357   33.638   4.6357   0.0000   0.0000  207.009   14.726  ?   ?  0.000000 14.72640 
1 1 1   22   30   16 o   48.646   22.554  -3.0108   4.0034  -2.5792   4.2912  -5.9086   11.119   51.890   23.801   80.911   37.540 -29.02129 44.44951 
1 1 1   22   30   17 o  151.697   18.330   18.449   4.1697   18.808   4.4916   16.207   11.216  152.673   19.679  132.110   45.633 20.56219 49.69512 
1 1 1   22   30   18 o   93.644   31.409   7.2425   5.3078   5.7817   6.0855   11.887   10.851   88.952   33.234  118.163   44.333 -29.21020 55.40667 
1 1 1   22   30   19 o  139.868   26.839   16.574   5.5368   11.940   6.3801   30.710   11.143  116.035   33.838  181.689   41.039 -65.65408 53.19038 
1 1 1   22   30   20 o  107.131   31.237   10.036   5.4373   8.7194   6.5230   13.035   9.8422  101.397   34.813  120.054   42.649 -18.65689 55.05332 
1 1 1   22   30   21 o   71.411   29.900   1.7253   5.4862  -4.7085   6.5945   16.188   9.8872   61.321   28.604  130.352   42.839 -69.03110 51.51072 
1 1 1   22   30   22 o   94.250   31.822   7.4947   5.4487   1.7071   6.9194   16.941   8.8399   77.582   33.078  133.706   40.049 -56.12419 51.94342 
1 1 1   22   30   23 o  176.664   21.789   25.631   5.7671   37.623   7.5881   9.2299   8.8739  213.246   23.646  105.444   39.973 107.8013 46.44336 
1 1 1   22   30   24 o   62.848   29.218  -4.2616   6.7888  -9.1659   11.187  -1.4023   8.5416   74.858   35.623   76.614   34.524 -1.756752 49.60717 
1 1 1   22   30   25 o   69.458   30.089   0.6286   5.8998   0.1287   7.7365   1.3233   9.1202   76.351   33.726   84.202   36.925 -7.850998 50.00919 
1 1 1   22   30   26 o  145.368   28.185   18.453   6.0449   20.766   8.2988   15.840   8.8229  148.363   36.738  127.316   40.354 21.04665 54.57181 
1 1 1   22   30   27 o  151.577   26.368   19.849   5.8955   28.133   8.3743   11.708   8.3011  176.519   32.180  111.233   39.205 65.28590 50.72087 
1 1 1   22   30   28 o   98.995   33.157   8.9005   5.9151   13.817   8.1436   3.4098   8.6059  118.439   38.876   85.770   36.738 32.66958 53.48836 
1 1 1   22   30   29 o  126.401   32.062   14.910   6.2126   24.152   8.5402   4.5223   9.0540  158.422   36.033   89.023   37.895 69.39893 52.29108 
1 1 1   22   30   30 o  162.896   18.183   21.761   4.4562   21.761   4.4562   0.0000   0.0000  162.896   18.183  ?   ?  0.000000 18.18255 
1 1 1   22   30   31 o  169.821   15.941   23.334   4.0950   19.584   4.5168   40.649   9.7052  153.306   19.705  210.511   31.053 -57.20471 36.77718 
1 1 1   22   30   32 o   62.788   25.109   2.3195   3.6531   3.2114   4.0189  -1.9209   8.7634   68.342   26.641   73.151   33.723 -4.809334 42.97610 
1 1 1   22   31    0 o  270.417   20.567   57.928   8.3997   57.928   8.3997   57.928   8.3997  270.417   20.567  270.417   20.567 0.000000 0.000000 
1 1 1   22   31    1 o  357.162   12.886   99.033   7.0446  106.351   10.083   92.055   9.8465  367.695   17.915  341.078   18.935 26.61722 26.06716 
1 1 1   22   31    2 o  319.696   13.565   79.471   6.6380   65.561   8.7296   98.539   10.221  287.118   19.988  352.871   18.994 -65.75229 27.57353 
1 1 1   22   31    3 o  338.547   13.147   89.040   6.8128   87.170   8.8358   91.782   10.699  332.697   17.412  339.457   20.690 -6.760010 27.04148 
1 1 1   22   31    4 o  251.479   15.871   49.653   6.0777   51.924   7.8784   46.314   9.5517  255.154   20.342  237.442   26.747 17.71217 33.60385 
1 1 1   22   31    5 o  239.113   16.805   45.053   6.1113   40.319   7.6520   53.392   10.155  223.505   22.682  255.283   26.370 -31.77823 34.78276 
1 1 1   22   31    6 o  191.093   18.101   28.997   5.2313   31.742   6.1183   21.534   10.088  199.079   20.365  153.309   41.826 45.76942 46.52093 
1 1 1   22   31    7 o  190.576   17.536   28.787   5.0579   27.475   5.8621   32.611   10.005  184.735   21.111  193.864   35.006 -9.128876 40.87874 
1 1 1   22   31    8 o  121.945   25.923   12.475   4.6896   12.803   5.4506   11.539   9.2019  122.328   29.462  116.705   41.262 5.622940 50.70049 
1 1 1   22   31    9 o  173.421   16.009   23.748   4.2016   24.990   4.6404   18.098   9.8980  177.483   17.302  140.276   42.460 37.20695 45.84980 
1 1 1   22   31   10 o  191.415   15.070   28.806   4.3796   29.262   4.8074   26.578   10.621  192.440   16.480  170.349   41.186 22.09167 44.36086 
1 1 1   22   31   11 o  121.364   23.283   12.198   4.1677   12.052   4.5208   13.026   10.757  119.840   25.433  122.639   44.463 -2.798607 51.22319 
1 1 1   22   31   12 o  233.494   12.907   42.529   4.5949   40.410   5.0315   53.175   11.278  227.001   14.558  251.523   29.879 -24.52162 33.23701 
1 1 1   22   31   13 o  238.337   14.045   44.478   5.1009   44.478   5.1009   0.0000   0.0000  238.337   14.045  ?   ?  0.000000 14.04473 
1 1 1   22   31   14 o  295.497   12.412   67.888   5.6138   67.888   5.6138   0.0000   0.0000  295.497   12.412  ?   ?  0.000000 12.41170 
1 1 1   22   31   15 o  502.004   8.8238  194.456   6.7801  197.131   7.6341  184.467   14.752  504.922   9.8779  480.828   20.045 24.09476 22.34633 
1 1 1   22   31   16 o  205.467   14.310   33.178   4.4722   32.835   4.8661   35.039   11.346  203.852   15.717  196.016   39.187 7.835495 42.22115 
1 1 1   22   31   17 o   85.289   27.455   6.0119   4.0719   6.5547   4.3928   2.6983   10.854   88.678   28.513   94.362   40.844 -5.684380 49.81171 
1 1 1   22   31   18 o   57.012   26.349  -3.4120   5.4001  -5.4593   6.2713   2.4602   10.621   58.141   27.367   92.828   40.291 -34.68745 48.70704 
1 1 1   22   31   19 o   61.501   27.754  -1.8264   5.5434  -8.6246   6.5096   16.113   10.574   54.270   26.177  129.544   44.328 -75.27390 51.48009 
1 1 1   22   31   20 o  184.319   20.701   27.665   5.7392   32.124   7.0085   18.588   9.9996  197.000   23.720  138.239   42.836 58.76076 48.96434 
1 1 1   22   31   21 o  131.881   28.371   15.118   5.5570   17.758   6.7623   9.6281   9.7520  141.083   32.045  107.834   41.648 33.24899 52.54939 
1 1 1   22   31   22 o  154.231   25.586   20.160   5.8285   19.088   7.4884   21.807   9.2833  144.671   34.333  151.003   39.656 -6.332138 52.45309 
1 1 1   22   31   23 o  169.013   29.649   24.974   7.3903   30.362   11.982   21.665   9.3886  173.403   44.820  149.498   40.171 23.90521 60.18707 
1 1 1   22   31   24 o   89.279   32.838   6.4416   5.8979   7.3397   7.6174   5.0973   9.3195   95.853   36.868   93.108   38.976 2.745201 53.65017 
1 1 1   22   31   25 o  115.093   41.196   12.819   9.1993   0.0000   0.0000   12.819   9.1993  ?   ?   115.093   41.196 0.000000 41.19563 
1 1 1   22   31   26 f   81.713   32.153   4.7064   5.8993   5.9709   7.6568   2.8592   9.2542   90.382   36.278   86.377   37.551 4.005470 52.21267 
1 1 1   22   31   27 o   80.502   31.873   4.5328   5.8308  -3.4158   7.7323   15.011   8.8780   67.629   31.352  121.323   40.622 -53.69418 51.31321 
1 1 1   22   31   28 o   74.026   31.181   2.5156   6.0245   10.036   7.8664  -8.1533   9.3692  102.977   37.917   66.911   32.048 36.06531 49.64623 
1 1 1   22   31   29 o  167.252   33.441   26.449   8.2616   26.449   8.2616   0.0000   0.0000  167.252   33.441  ?   ?  0.000000 33.44057 
1 1 1   22   31   30 o   52.569   25.319  -6.9642   6.0365 -14.2621   7.6630   4.9712   9.7998   51.935   25.726   90.055   38.895 -38.11962 46.63290 
1 1 1   22   32    0 f   63.213   39.329   2.8028   7.6820   2.8028   7.6820   2.8028   7.6820   63.213   39.329   63.213   39.329 0.000000 0.000000 
1 1 1   22   32    1 o  167.172   23.346   22.847   5.8106   23.068   7.9735   22.597   8.4853  163.112   33.069  160.015   35.567 3.096756 48.56497 
1 1 1   22   32    2 f   96.008   31.190   7.6493   5.2468   9.8069   6.8620   4.6126   8.1410  107.494   35.706   91.863   37.219 15.63139 51.57675 
1 1 1   22   32    3 o  276.929   15.304   60.172   6.4617   56.441   8.2821   65.975   10.330  265.584   20.533  285.117   23.890 -19.53299 31.50173 
1 1 1   22   32    4 o  111.461   31.905   10.749   5.7197   17.920   7.3459  -0.2909   9.1153  142.760   34.088   83.119   36.667 59.64153 50.06460 
1 1 1   22   32    5 o   75.503   30.348   2.8480   5.3662   2.5750   6.8129   3.2941   8.7098   80.821   33.535   89.999   37.677 -9.178040 50.43937 
1 1 1   22   32    6 o  108.940   28.603   10.158   4.8303   8.6628   5.5936   14.541   9.5784  101.137   32.139  126.856   42.187 -25.71853 53.03473 
1 1 1   22   32    7 o   83.687   29.731   5.3260   4.7829   4.4089   5.5083   8.1363   9.6422   81.982   31.394  105.879   41.267 -23.89751 51.85157 
1 1 1   22   32    8 o  303.391   12.524   71.555   5.8159   68.244   6.8632   79.989   10.954  294.816   15.262  314.392   22.921 -19.57562 27.53698 
1 1 1   22   32    9 o   93.119   29.186   7.2676   4.6274   8.3014   5.3183   4.0460   9.3882   98.966   31.326   93.795   39.179 5.171524 50.16255 
1 1 1   22   32   10 o   43.895   20.929  -4.7060   3.9007  -2.8175   4.2822 -13.9103   9.4540   51.136   23.574   63.075   30.687 -11.93833 38.69672 
1 1 1   22   32   11 o   68.487   27.502   2.2855   4.4023   2.2855   4.4023   0.0000   0.0000   68.487   27.502  ?   ?  0.000000 27.50189 
1 1 1   22   32   12 o  192.482   17.394   29.496   5.0692   29.496   5.0692   0.0000   0.0000  192.482   17.394  ?   ?  0.000000 17.39395 
1 1 1   22   32   13 o  129.595   22.218   13.875   4.2485   12.270   4.6603   21.769   10.337  120.153   26.088  150.982   42.779 -30.82876 50.10622 
1 1 1   22   32   14 o  215.554   14.688   36.592   4.8170   36.389   5.3150   37.524   11.398  214.245   16.331  203.308   38.025 10.93689 41.38326 
1 1 1   22   32   15 o  267.534   12.220   55.738   5.0039   57.246   5.5073   48.601   11.979  270.702   13.292  234.816   34.346 35.88644 36.82819 
1 1 1   22   32   16 o  160.526   18.247   20.738   4.4037   21.541   4.7729   16.141   11.418  163.085   19.508  129.536   45.946 33.54906 49.91545 
1 1 1   22   32   17 o  170.700   17.576   23.362   4.5265   21.953   4.9253   31.021   11.484  164.344   19.991  179.691   42.434 -15.34682 46.90708 
1 1 1   22   32   18 o  280.508   15.451   62.206   6.6083   66.234   7.8686   52.564   12.174  287.890   17.946  244.062   33.469 43.82758 37.97655 
1 1 1   22   32   19 o  192.697   20.754   30.290   6.0247   32.602   7.2296   25.035   10.899  197.747   24.403  159.124   43.502 38.62244 49.87914 
1 1 1   22   32   20 o   60.981   27.584  -1.8212   5.5133 -10.6187   6.5228   20.188   10.317   51.337   25.088  142.198   43.418 -90.86162 50.14570 
1 1 1   22   32   21 o  156.819   32.363   22.121   7.5104   50.484   11.633   1.8494   9.8346  238.203   32.775   87.405   38.337 150.7974 50.43690 
1 1 1   22   32   22 o  124.196   36.065   14.594   7.2612   23.247   10.633   7.0314   9.9402  150.764   43.601   99.154   40.762 51.60991 59.68756 
1 1 1   22   32   23 f   72.711   30.637   2.0641   5.8194   0.6119   7.1630   4.8837   9.9808   74.295   32.649   93.365   39.766 -19.06943 51.45168 
1 1 1   22   32   24 o   78.160   31.676   3.7268   5.8986   9.1158   7.5500  -4.7152   9.4497  100.662   37.134   72.799   34.052 27.86314 50.38304 
1 1 1   22   32   25 o  131.778   30.331   15.863   5.9911   23.355   7.8900   5.6601   9.2069  157.935   33.667   92.288   38.693 65.64690 51.28939 
1 1 1   22   32   26 o   70.356   29.995   1.7488   5.6885  -4.3797   7.3738   10.757   8.9401   64.030   29.991  105.852   40.123 -41.82194 50.09362 
1 1 1   22   32   27 o  110.444   37.487   12.149   7.5617   12.149   7.5617   0.0000   0.0000  110.444   37.487  ?   ?  0.000000 37.48676 
1 1 1   22   32   28 o   83.023   35.022   4.1088   7.6179   4.1088   7.6179   0.0000   0.0000   83.023   35.022  ?   ?  0.000000 35.02164 
1 1 1   22   33    0 o  124.893   46.882   17.289   8.3721   17.289   8.3721   17.289   8.3721  124.893   46.882  124.893   46.882 0.000000 0.000000 
1 1 1   22   33    1 o  353.902   13.867   97.784   7.5116  102.774   10.605   92.761   10.641  359.005   19.372  340.177   20.532 18.82864 28.22819 
1 1 1   22   33    2 o  100.218   33.068   8.4931   5.8891   3.3486   7.8477   15.124   8.9098   86.624   35.971  128.371   40.537 -41.74696 54.19582 
1 1 1   22   33    3 o  288.387   15.984   65.550   7.0278   53.232   9.0499   84.262   11.154  255.566   23.395  322.447   22.746 -66.88115 32.62980 
1 1 1   22   33    4 f  160.673   26.405   21.644   6.2681   19.153   8.0755   25.421   9.9413  145.687   36.336  166.163   39.642 -20.47607 53.77528 
1 1 1   22   33    5 o  155.042   26.055   20.150   5.9638   26.409   7.6390   10.381   9.5437  176.043   29.386  111.781   41.647 64.26177 50.97086 
1 1 1   22   33    6 o  268.332   14.326   56.482   5.8625   64.980   7.0795   37.938   10.458  286.912   16.187  208.248   33.981 78.66415 37.63914 
1 1 1   22   33    7 o  341.304   12.006   90.566   6.2723   93.401   7.4779   83.838   11.520  345.562   14.138  320.539   23.647 25.02307 27.55083 
1 1 1   22   33    8 o   55.424   25.191  -2.1383   4.6661  -2.8490   5.2890   0.3575   9.9109   57.703   26.452   86.499   38.192 -28.79615 46.45795 
1 1 1   22   33    9 o  109.503   30.779   10.496   5.3735   10.496   5.3735   0.0000   0.0000  109.503   30.779  ?   ?  0.000000 30.77946 
1 1 1   22   33   10 o  378.208   13.154  111.660   7.6147  111.660   7.6147   0.0000   0.0000  378.208   13.154  ?   ?  0.000000 13.15376 
1 1 1   22   33   11 o  176.591   16.865   24.862   4.5032   26.110   4.9500   18.870   10.846  180.439   18.170  139.106   44.810 41.33334 48.35400 
1 1 1   22   33   12 o   66.016   26.767   1.9984   4.2142   3.9417   4.5977  -8.2144   10.540   76.033   28.785   74.207   35.097 1.825829 45.39101 
1 1 1   22   33   13 o  147.931   20.604   17.891   4.5387   21.572   5.0368   1.9943   10.467  162.605   20.707   91.028   39.747 71.57716 44.81803 
1 1 1   22   33   14 o  145.933   20.972   17.473   4.5499   18.678   5.0085   11.783   10.884  150.254   22.468  115.835   44.184 34.41894 49.56812 
1 1 1   22   33   15 o  100.934   26.981   8.8134   4.2485   9.7082   4.6228   3.9510   10.777  105.545   28.112   95.677   41.049 9.868263 49.75289 
1 1 1   22   33   16 o   89.392   27.945   6.8164   4.2453   7.7568   4.6195   1.7082   10.767   94.675   29.078   90.690   39.937 3.985352 49.40105 
1 1 1   22   33   17 o   74.857   27.686   4.0847   4.2024   5.5511   4.6100  -3.1237   10.221   83.100   29.224   79.805   36.653 3.294830 46.87712 
1 1 1   22   33   18 o   98.029   31.877   8.4590   5.4801   9.5966   6.5073   5.6846   10.163  103.536   34.777   96.965   40.652 6.571709 53.49788 
1 1 1   22   33   19 o  112.145   31.557   11.413   5.6453   13.421   6.9852   7.6300   9.5856  119.603   35.550  100.224   40.463 19.37939 53.86182 
1 1 1   22   33   20 o  157.634   31.608   22.429   7.3609   27.491   11.007   18.334   9.9001  164.236   43.206  133.951   42.777 30.28522 60.79980 
1 1 1   22   33   21 f  176.434   21.859   25.950   5.7768   29.810   7.2920   19.444   9.4663  185.997   26.351  138.127   41.460 47.86969 49.12505 
1 1 1   22   33   22 o  118.184   30.978   12.850   5.6720   13.716   7.2192   11.454   9.1685  118.991   36.317  109.325   40.803 9.665962 54.62420 
1 1 1   22   33   23 o   70.936   29.858   2.0967   5.5176   0.4314   7.0567   4.7161   8.8507   72.698   32.156   88.985   37.654 -16.28746 49.51633 
1 1 1   22   33   24 o  258.220   16.191   53.653   6.3671   65.961   8.3803   36.846   9.7926  283.418   19.435  198.943   33.338 84.47545 38.58995 
1 1 1   22   33   25 o  121.777   31.338   13.921   5.8753   13.697   7.6287   14.249   9.2112  116.604   37.583  116.661   41.279 -0.5606079E-01 55.82526 
1 1 1   22   33   26 o   96.255   36.708   8.4409   7.5115   8.4409   7.5115   0.0000   0.0000   96.255   36.708  ?   ?  0.000000 36.70812 
1 1 1   22   34    0 o  118.733   50.581   16.979   9.3533   16.979   9.3533   16.979   9.3533  118.733   50.581  118.733   50.581 0.000000 0.000000 
1 1 1   22   34    1 o  223.412   20.567   40.359   6.9541   33.468   9.2735   49.213   10.512  196.123   31.995  240.784   29.113 -44.66159 43.25780 
1 1 1   22   34    2 o  198.111   21.576   31.970   6.4367   40.846   8.8251   21.882   9.4085  220.884   26.640  152.739   39.831 68.14511 47.91910 
1 1 1   22   34    3 o   82.211   32.492   4.1607   6.0495   2.1891   8.0668   6.6945   9.1447   83.659   35.694   99.124   39.696 -15.46431 53.38411 
1 1 1   22   34    4 o   64.099   29.026  -2.1475   6.1243 -11.4916   7.9591   11.416   9.5892   58.299   28.316  114.185   41.891 -55.88646 50.56321 
1 1 1   22   34    5 o  156.340   27.314   20.787   6.2984   18.174   8.0754   24.847   10.064  140.510   37.027  162.222   40.621 -21.71158 54.96446 
1 1 1   22   34    6 o  228.893   18.783   42.025   6.5228   42.025   6.5228   0.0000   0.0000  228.893   18.783  ?   ?  0.000000 18.78344 
1 1 1   22   34    7 o  251.654   18.073   50.600   6.9151   50.600   6.9151   0.0000   0.0000  251.654   18.073  ?   ?  0.000000 18.07295 
1 1 1   22   34    8 o  203.292   18.111   33.117   5.5764   30.760   6.4163   40.395   11.274  193.821   22.019  211.933   36.045 -18.11156 42.23785 
1 1 1   22   34    9 o  214.492   17.000   36.665   5.5355   42.778   6.4482   19.538   10.793  231.018   18.388  140.694   44.636 90.32353 48.27489 
1 1 1   22   34   10 o  103.297   30.041   9.3527   5.0349   10.685   5.7836   5.1839   10.232  109.554   32.294   97.195   40.771 12.35931 52.01171 
1 1 1   22   34   11 o  282.410   13.764   62.515   5.9497   60.656   6.9268   67.745   11.619  276.350   16.450  283.588   27.097 -7.238800 31.69944 
1 1 1   22   34   12 o  106.029   27.103   9.7662   4.4154   13.648   4.8705  -8.1429   10.462  126.161   26.083   73.446   34.804 52.71578 43.49343 
1 1 1   22   34   13 o  217.665   14.473   37.426   4.7945   37.929   5.3108   35.209   11.148  218.381   16.000  193.756   38.942 24.62462 42.10018 
1 1 1   22   34   14 o   57.611   25.471  -0.6131   4.4226  -2.5952   4.9004   8.0902   10.269   55.312   25.395  103.396   41.832 -48.08388 48.93708 
1 1 1   22   34   15 o   60.316   25.884   0.5145   4.2866   0.1501   4.7650   2.0611   9.8160   61.903   26.928   87.620   38.369 -25.71729 46.87549 
1 1 1   22   34   16 o   95.942   27.722   8.0880   4.2999   12.623   4.8692  -7.9754   9.1639  120.031   27.140   67.556   32.174 52.47550 42.09158 
1 1 1   22   34   17 o   70.675   27.544   3.2196   4.2953   5.1790   4.8351  -4.1157   9.3552   81.169   29.751   73.878   34.330 7.290977 45.42780 
1 1 1   22   34   18 o  217.446   16.076   37.868   5.3125   37.270   6.3177   39.312   9.8164  213.482   19.551  209.184   31.648 4.298157 37.20002 
1 1 1   22   34   19 o  111.035   31.944   11.419   5.7207   8.1615   7.3618   16.386   9.0891   96.982   36.490  126.789   41.040 -29.80791 54.91633 
1 1 1   22   34   20 o   95.533   32.420   8.2389   5.6556   19.301   7.0950 -11.0398   9.3666  143.791   32.944   63.695   30.886 80.09601 45.15784 
1 1 1   22   34   21 o  121.915   30.720   13.740   5.7301   13.612   7.3426   13.939   9.1638  117.561   36.752  116.668   41.184 0.8929138 55.19832 
1 1 1   22   34   22 o   88.728   32.100   6.8464   5.6024   9.0041   7.0291   3.0889   9.2761   98.653   35.915   85.644   37.406 13.00932 51.85707 
1 1 1   22   34   23 o   61.225   27.651  -1.1741   5.5152  -5.1041   6.8641   5.9848   9.2642   60.109   28.396   92.033   38.711 -31.92388 48.00922 
1 1 1   22   35    0 o   45.773   32.222  -8.6022   8.8493  -8.6022   8.8493  -8.6022   8.8493   45.773   32.222   45.773   32.222 0.000000 0.000000 
1 1 1   22   35    1 o  202.507   23.402   33.913   7.1202   28.828   9.8686   39.435   10.283  176.574   37.663  211.469   32.835 -34.89557 49.96619 
1 1 1   22   35    2 o  161.384   28.509   22.447   6.7848   29.609   9.2501   14.108   9.9819  181.442   34.569  122.151   42.998 59.29035 55.17147 
1 1 1   22   35    3 o   96.616   39.195   6.1994   9.0410   6.1994   9.0410   0.0000   0.0000   96.616   39.195  ?   ?  0.000000 39.19526 
1 1 1   22   35    4 o  111.717   39.172   11.275   8.2798   11.275   8.2798   0.0000   0.0000  111.717   39.172  ?   ?  0.000000 39.17172 
1 1 1   22   35    5 o  146.489   25.330   18.172   5.4740   18.885   6.4115   16.254   10.514  147.005   29.520  128.860   44.200 18.14484 53.15115 
1 1 1   22   35    6 o  310.717   13.581   75.686   6.4590   76.677   7.8051   73.533   11.505  310.623   16.475  296.597   25.593 14.02609 30.43749 
1 1 1   22   35    7 o  131.748   27.949   15.099   5.4614   20.303   6.5487   3.2122   9.8974  152.616   29.096   91.027   39.202 61.58911 48.81962 
1 1 1   22   35    8 o  326.086   13.027   83.266   6.5021   88.640   7.8647   71.660   11.558  334.980   15.339  291.810   26.154 43.16968 30.32016 
1 1 1   22   35    9 o   92.050   30.200   7.2946   4.9145   5.6788   5.7156   11.877   9.6259   86.042   32.196  113.543   41.921 -27.50142 52.85758 
1 1 1   22   35   10 o  145.810   23.983   17.948   5.1664   17.190   6.1101   19.849   9.6766  139.425   29.549  141.276   41.808 -1.850372 51.19597 
1 1 1   22   35   11 o  106.726   29.286   10.150   4.9288   9.9883   5.7999   10.569   9.3505  105.045   32.635  108.575   41.063 -3.530449 52.45220 
1 1 1   22   35   12 f   72.280   28.012   3.4444   4.4232   3.3630   5.0413   3.7166   9.2191   74.309   29.568   89.148   38.100 -14.83939 48.22762 
1 1 1   22   35   13 o   64.405   26.889   1.5219   4.4189  -1.7769   5.0831   11.727   8.9405   58.128   26.371  111.378   40.512 -53.25068 48.33877 
1 1 1   22   35   14 o  190.218   16.434   29.064   4.7378   31.580   5.4508   21.289   9.5822  197.267   18.259  145.146   41.209 52.12102 45.07304 
1 1 1   22   35   15 o  212.436   15.143   35.991   4.8917   42.061   5.7456   20.000   9.3254  228.875   16.512  140.398   40.900 88.47749 44.10696 
1 1 1   22   35   16 f  112.121   29.103   11.374   5.0381   14.919   6.1370   4.0460   8.8229  127.092   31.664   87.719   37.375 39.37292 48.98475 
1 1 1   22   35   17 o  128.126   27.193   14.556   5.1679   16.994   6.2398   9.2299   9.2214  136.324   30.649  102.097   40.191 34.22665 50.54336 
1 1 1   22   35   18 o  156.206   20.320   20.299   4.7434   21.712   5.4999   16.197   9.3721  159.798   23.161  124.480   41.736 35.31772 47.73212 
1 1 1   22   35   19 o  156.523   25.465   21.312   5.8910   27.045   7.3817   11.256   9.7763  173.995   28.719  107.600   41.660 66.39438 50.60027 
1 1 1   22   35   20 o   85.458   34.318   5.3955   6.8553   8.5655   10.356   2.9232   9.1458  100.381   41.473   84.770   37.081 15.61167 55.63255 
1 1 1   22   36    2 o  244.861   20.286   48.934   7.5344   45.260   10.523   52.799   10.792  226.280   31.214  246.600   29.157 -20.31958 42.71362 
1 1 1   22   36    3 o  181.769   26.573   28.314   7.1749   22.767   9.8492   34.588   10.473  151.287   41.352  192.358   36.914 -41.07065 55.43114 
1 1 1   22   36    4 o   98.472   34.161   8.5568   6.2892   18.230   8.7479  -1.7920   9.0481  136.346   39.583   77.000   35.029 59.34595 52.85682 
1 1 1   22   36    5 o  121.314   30.061   13.231   5.5534   15.405   6.8129   8.9269   9.5868  128.650   34.062  103.539   40.909 25.11043 53.23302 
1 1 1   22   36    6 o  148.813   24.206   18.802   5.3240   21.375   6.4996   13.553   9.2817  156.271   28.211  117.789   41.463 38.48156 50.15002 
1 1 1   22   36    7 o  167.126   21.594   23.205   5.3948   24.458   6.5982   20.677   9.3697  168.501   26.455  143.859   40.717 24.64114 48.55626 
1 1 1   22   36    8 o  145.238   24.421   17.993   5.2364   21.037   6.3824   11.727   9.1587  154.974   27.934  111.229   40.920 43.74445 49.54535 
1 1 1   22   36    9 f  227.686   16.271   41.532   5.6331   38.536   6.8076   48.037   10.032  216.247   20.825  234.730   28.507 -18.48279 35.30293 
1 1 1   22   36   10 o   49.645   23.637  -5.1813   4.9384  -7.9419   5.8928   1.3317   9.0514   50.932   24.649   82.537   36.468 -31.60487 44.01690 
1 1 1   22   36   11 o  115.927   29.553   12.176   5.2596   10.026   6.4179   16.574   9.1783  103.924   34.531  127.470   41.239 -23.54617 53.78699 
1 1 1   22   36   12 o  120.830   32.252   13.599   6.0764   14.579   8.2405   12.433   8.9956  120.935   39.070  112.501   40.680 8.434082 56.40298 
1 1 1   22   36   13 o  127.233   27.728   14.426   5.2474   11.661   6.3754   20.235   9.2397  110.861   34.179  140.559   40.644 -29.69791 53.10445 
1 1 1   22   36   14 o   72.963   30.945   2.1266   5.9998   3.9689   8.1305  -0.0761   8.8903   85.172   36.068   78.360   35.274 6.812607 50.44976 
1 1 1   22   36   15 f   87.335   32.808   6.3307   5.9461   12.649   7.9211  -1.8258   8.9998  112.862   38.367   75.273   34.506 37.58831 51.60133 
1 1 1   22   36   16 o   61.679   27.276  -0.1881   5.0748  -1.5736   6.1078   2.9007   9.1197   63.478   28.840   84.903   37.086 -21.42489 46.98026 
1 1 1   22   37    0 o   81.956   47.034   8.8450   9.3884   8.8450   9.3884   8.8450   9.3884   81.956   47.034   81.956   47.034 0.000000 0.000000 
1 1 1   22   37    1 o  196.520   24.599   32.854   7.2373   38.202   10.368   27.774   10.107  202.868   34.634  167.153   40.031 35.71584 52.93449 
1 1 1   22   37    2 o  112.572   35.645   12.090   6.8855   1.1369   9.5347   24.028   9.9540   83.432   37.117  153.562   41.404 -70.13019 55.60610 
1 1 1   22   37    3 o  140.749   32.574   18.351   6.8785   24.385   9.9240   12.772   9.5426  154.938   41.152  113.778   41.782 41.15956 58.64462 
1 1 1   22   37    4 o  115.932   41.422   13.430   9.2966   0.0000   0.0000   13.430   9.2966  ?   ?   115.932   41.422 0.000000 41.42175 
1 1 1   22   37    5 o  175.247   27.821   26.958   7.2132   23.369   10.947   29.712   9.5893  147.607   44.648  176.139   36.756 -28.53180 57.83133 
1 1 1   22   37    6 o  132.607   34.721   16.781   7.1304   5.3533   10.808   25.590   9.4886   95.181   40.978  160.765   38.967 -65.58343 56.54711 
1 1 1   22   37    7 o   97.380   35.269   8.5186   6.7657   4.0780   9.6513   12.809   9.4870   89.647   38.659  113.386   41.657 -23.73901 56.83128 
1 1 1   22   37    8 o   70.133   31.207  -0.1104   6.7431   12.386   9.9777 -10.6163   9.1487  111.881   42.393   63.235   30.630 48.64555 52.30045 
1 1 1   22   37    9 o  154.800   31.555   22.015   7.2231   20.762   10.824   23.021   9.6986  137.889   44.798  149.409   41.116 -11.51987 60.80595 
1 1 1   22   37   10 o   96.439   35.848   8.2988   7.0628   13.176   10.518   4.2936   9.5313  113.827   43.431   89.418   38.490 24.40864 58.03179 
1 1 1   22   37   11 o  116.526   29.749   12.464   5.3243   13.714   6.4786   9.8633   9.3456  119.664   33.853  103.453   40.543 16.21054 52.81798 
1 1 1   23    0    1 o  272.703   8.5127   57.117   3.5454   57.117   3.5454   57.117   3.5454  272.703   8.5127  272.703   8.5127 0.000000 0.000000 
1 1 1   23    0    2 o  392.543   7.6470  118.123   4.5907  118.123   4.5907  118.123   4.5907  392.543   7.6470  392.543   7.6470 0.000000 0.000000 
1 1 1   23    0    3 o  424.513   7.6032  138.123   4.9368  138.123   4.9368  138.123   4.9368  424.513   7.6032  424.513   7.6032 0.000000 0.000000 
1 1 1   23    0    4 o  324.882   12.122   81.222   6.0088   81.222   6.0088   81.222   6.0088  324.882   12.122  324.882   12.122 0.000000 0.000000 
1 1 1   23    0    5 o  423.107   11.815  137.503   7.6379  137.503   7.6379  137.503   7.6379  423.107   11.815  423.107   11.815 0.000000 0.000000 
1 1 1   23    0    7 o  191.974   10.753   28.501   3.1370   28.501   3.1370   28.501   3.1370  191.974   10.753  191.974   10.753 0.000000 0.000000 
1 1 1   23    0    8 o  108.861   32.992   11.322   4.7971   11.322   4.7971   11.322   4.7971  108.861   32.992  108.861   32.992 0.000000 0.000000 
1 1 1   23    0    9 o  105.846   34.674   11.021   4.9796   11.021   4.9796   11.021   4.9796  105.846   34.674  105.846   34.674 0.000000 0.000000 
1 1 1   23    0   10 o  278.429   12.070   59.754   5.1217   59.754   5.1217   59.754   5.1217  278.429   12.070  278.429   12.070 0.000000 0.000000 
1 1 1   23    0   11 o  283.213   12.436   61.844   5.3674   61.844   5.3674   61.844   5.3674  283.213   12.436  283.213   12.436 0.000000 0.000000 
1 1 1   23    0   12 o  611.920   8.7407  286.995   8.1830  286.995   8.1830  286.995   8.1830  611.920   8.7407  611.920   8.7407 0.000000 0.000000 
1 1 1   23    0   13 o  728.681   9.2269  406.972   10.287  406.972   10.287  406.972   10.287  728.681   9.2269  728.681   9.2269 0.000000 0.000000 
1 1 1   23    0   14 o  101.111   27.729   9.4474   3.7106   9.4474   3.7106   9.4474   3.7106  101.111   27.729  101.111   27.729 0.000000 0.000000 
1 1 1   23    0   15 o  323.665   10.507   80.542   5.1929   80.542   5.1929   80.542   5.1929  323.665   10.507  323.665   10.507 0.000000 0.000000 
1 1 1   23    0   16 o   80.714   33.330   7.0678   4.0849   7.0678   4.0849   7.0678   4.0849   80.714   33.330   80.714   33.330 0.000000 0.000000 
1 1 1   23    0   17 o  285.066   11.819   62.636   5.1366   62.636   5.1366   62.636   5.1366  285.066   11.819  285.066   11.819 0.000000 0.000000 
1 1 1   23    0   18 o   39.582   26.237  -1.0514   4.1909  -1.0514   4.1909  -1.0514   4.1909   39.582   26.237   39.582   26.237 0.000000 0.000000 
1 1 1   23    0   19 o   79.603   34.804   7.0539   4.4151   7.0539   4.4151   7.0539   4.4151   79.603   34.804   79.603   34.804 0.000000 0.000000 
1 1 1   23    0   20 o   25.083   17.261  -1.5892   2.1787  -1.5892   2.1787  -1.5892   2.1787   25.083   17.261   25.083   17.261 0.000000 0.000000 
1 1 1   23    0   21 o   43.921   24.480   2.0296   2.4468   2.0296   2.4468   2.0296   2.4468   43.921   24.480   43.921   24.480 0.000000 0.000000 
1 1 1   23    0   22 o   93.020   19.179   7.4419   2.4113   7.4419   2.4113   7.4419   2.4113   93.020   19.179   93.020   19.179 0.000000 0.000000 
1 1 1   23    0   23 o   71.727   24.767   5.1660   2.4495   5.1660   2.4495   5.1660   2.4495   71.727   24.767   71.727   24.767 0.000000 0.000000 
1 1 1   23    0   24 o  106.279   18.523   9.4444   2.7391   9.4444   2.7391   9.4444   2.7391  106.279   18.523  106.279   18.523 0.000000 0.000000 
1 1 1   23    0   25 o  214.249   9.2775   35.394   3.0294   35.394   3.0294   35.394   3.0294  214.249   9.2775  214.249   9.2775 0.000000 0.000000 
1 1 1   23    0   26 f   58.503   26.874   3.8669   2.6352   3.8669   2.6352   3.8669   2.6352   58.503   26.874   58.503   26.874 0.000000 0.000000 
1 1 1   23    0   27 o  284.533   8.1807   62.216   3.5562   62.216   3.5562   62.216   3.5562  284.533   8.1807  284.533   8.1807 0.000000 0.000000 
1 1 1   23    0   28 o   65.183   30.363   4.8499   3.3686   4.8499   3.3686   4.8499   3.3686   65.183   30.363   65.183   30.363 0.000000 0.000000 
1 1 1   23    0   29 o   90.351   37.182   8.9918   5.0888   8.9918   5.0888   8.9918   5.0888   90.351   37.182   90.351   37.182 0.000000 0.000000 
1 1 1   23    0   30 o   62.849   27.929   4.4384   2.8416   4.4384   2.8416   4.4384   2.8416   62.849   27.929   62.849   27.929 0.000000 0.000000 
1 1 1   23    0   31 o   75.387   27.690   5.9027   2.9532   5.9027   2.9532   5.9027   2.9532   75.387   27.690   75.387   27.690 0.000000 0.000000 
1 1 1   23    0   32 o   69.386   28.712   5.2762   3.0296   5.2762   3.0296   5.2762   3.0296   69.386   28.712   69.386   28.712 0.000000 0.000000 
1 1 1   23    0   33 f   46.960   26.848   2.2570   3.0422   2.2570   3.0422   2.2570   3.0422   46.960   26.848   46.960   26.848 0.000000 0.000000 
1 1 1   23    0   34 o   77.740   28.864   6.3320   3.1912   6.3320   3.1912   6.3320   3.1912   77.740   28.864   77.740   28.864 0.000000 0.000000 
1 1 1   23    0   35 o   81.068   30.983   7.0031   3.6260   7.0031   3.6260   7.0031   3.6260   81.068   30.983   81.068   30.983 0.000000 0.000000 
1 1 1   23    0   36 o   62.297   31.346   4.5474   3.6841   4.5474   3.6841   4.5474   3.6841   62.297   31.346   62.297   31.346 0.000000 0.000000 
1 1 1   23    0   37 o  177.359   14.379   24.759   3.8445   24.759   3.8445   24.759   3.8445  177.359   14.379  177.359   14.379 0.000000 0.000000 
1 1 1   23    0   38 o  176.527   15.012   24.604   3.9886   24.604   3.9886   24.604   3.9886  176.527   15.012  176.527   15.012 0.000000 0.000000 
1 1 1   23    0   39 o  331.103   9.9260   84.533   5.0202   84.533   5.0202   84.533   5.0202  331.103   9.9260  331.103   9.9260 0.000000 0.000000 
1 1 1   23    0   40 o  117.801   24.727   12.183   3.9265   12.183   3.9265   12.183   3.9265  117.801   24.727  117.801   24.727 0.000000 0.000000 
1 1 1   23    0   42 o  196.874   16.230   30.705   4.8142   30.705   4.8142   30.705   4.8142  196.874   16.230  196.874   16.230 0.000000 0.000000 
1 1 1   23    0   43 o   58.365   31.943   3.9690   4.0813   3.9690   4.0813   3.9690   4.0813   58.365   31.943   58.365   31.943 0.000000 0.000000 
1 1 1   23    0   44 o   41.331   26.885  -0.0016   4.0962  -0.0016   4.0962  -0.0016   4.0962   41.331   26.885   41.331   26.885 0.000000 0.000000 
1 1 1   23    0   45 o   98.213   32.418   9.8963   4.3295   9.8963   4.3295   9.8963   4.3295   98.213   32.418   98.213   32.418 0.000000 0.000000 
1 1 1   23    0   46 o   44.132   28.346   0.5688   4.3651   0.5688   4.3651   0.5688   4.3651   44.132   28.346   44.132   28.346 0.000000 0.000000 
1 1 1   23    0   47 o  244.947   17.976   47.905   6.6560   47.905   6.6560   47.905   6.6560  244.947   17.976  244.947   17.976 0.000000 0.000000 
1 1 1   23    0   48 o   40.051   26.602  -0.6891   4.3436  -0.6891   4.3436  -0.6891   4.3436   40.051   26.602   40.051   26.602 0.000000 0.000000 
1 1 1   23    0   49 o   30.436   21.675  -5.6867   4.4201  -5.6867   4.4201  -5.6867   4.4201   30.436   21.675   30.436   21.675 0.000000 0.000000 
1 1 1   23    0   50 o  146.552   21.582   18.262   4.5331   18.262   4.5331   18.262   4.5331  146.552   21.582  146.552   21.582 0.000000 0.000000 
1 1 1   23    0   51 o   52.027   30.836   3.0155   4.2550   3.0155   4.2550   3.0155   4.2550   52.027   30.836   52.027   30.836 0.000000 0.000000 
1 1 1   23    0   52 o   82.607   37.732   8.8025   5.1917   8.8025   5.1917   8.8025   5.1917   82.607   37.732   82.607   37.732 0.000000 0.000000 
1 1 1   23    1    0 o  132.240   13.282   13.804   2.6262   13.804   2.6262   13.804   2.6262  132.240   13.282  132.240   13.282 0.000000 0.000000 
1 1 1   23    1    1 o  333.544   5.6086   85.190   2.8634   83.543   4.0921   86.771   4.0080  330.204   8.0965  336.537   7.7808 -6.333313 11.22914 
1 1 1   23    1    2 o  146.590   10.012   16.551   2.2330   17.411   4.3181   16.237   2.6090  149.108   19.378  144.996   11.859 4.112122 22.71890 
1 1 1   23    1    3 o  316.361   6.5888   76.656   3.1905   77.984   6.0586   76.146   3.7531  318.772   12.417  315.259   7.7776 3.512695 14.65198 
1 1 1   23    1    4 o  100.601   19.321   8.0573   2.8669   7.8220   4.1142   8.2794   3.9973   98.794   26.611  101.457   25.709 -2.663551 37.00112 
1 1 1   23    1    5 o  346.577   8.5853   92.052   4.5544   91.499   6.5416   92.572   6.3446  345.280   12.378  347.333   11.934 -2.053223 17.19393 
1 1 1   23    1    6 f  289.591   7.2529   64.246   3.2149   67.308   3.9842   58.531   5.4428  296.344   8.7836  276.114   12.878 20.22943 15.58860 
1 1 1   23    1    7 o  191.677   16.661   28.479   4.8396   0.0000   0.0000   28.479   4.8396  ?   ?   191.677   16.661 0.000000 16.66119 
1 1 1   23    1    8 o  568.214   5.8187  247.262   5.0607  263.315   7.5235  233.997   6.8391  586.156   8.3857  552.589   8.0859 33.56696 11.64911 
1 1 1   23    1    9 o  327.378   6.0813   82.086   3.0473   84.329   4.5179   80.214   4.1275  331.677   8.8992  323.514   8.3354 8.162323 12.19325 
1 1 1   23    1   10 o  347.122   8.5156   92.358   4.5244   88.780   7.2120   94.681   5.8100  339.899   13.862  351.295   10.805 -11.39560 17.57601 
1 1 1   23    1   11 o  468.779   8.2681  168.434   5.9326   0.0000   0.0000  168.434   5.9326  ?   ?   468.779   8.2681 0.000000 8.268129 
1 1 1   23    1   12 o  156.895   10.702   18.976   2.5547   15.295   3.6568   22.485   3.5704  139.817   17.468  170.481   13.801 -30.66379 22.26243 
1 1 1   23    1   13 o  635.339   6.3015  309.217   6.1280  309.312   8.7487  309.125   8.5862  635.123   8.9994  634.953   8.8347 0.1701660 12.61118 
1 1 1   23    1   14 o  440.858   6.4301  148.897   4.3390  149.280   6.2331  148.537   6.0438  441.184   9.2303  440.110   8.9717 1.073456 12.87204 
1 1 1   23    1   15 o  405.254   6.6835  125.835   4.1457  131.118   6.0045  121.022   5.7309  413.430   9.4886  397.199   9.4264 16.23044 13.37504 
1 1 1   23    1   16 o  416.379   6.7915  132.852   4.3284  124.707   6.0871  141.182   6.1559  403.131   9.8650  428.989   9.3752 -25.85834 13.60925 
1 1 1   23    1   17 o  351.965   7.4014   94.957   3.9873   99.256   5.8778   91.292   5.4270  359.538   10.681  344.853   10.282 14.68408 14.82524 
1 1 1   23    1   18 o  220.394   8.3422   37.253   2.8142   33.173   5.0246   39.117   3.3970  206.788   15.999  225.750   9.8309 -18.96208 18.77828 
1 1 1   23    1   19 o  208.674   7.5868   33.387   2.4232   35.368   3.5254   31.613   3.3364  214.307   10.782  202.578   10.799 11.72868 15.25992 
1 1 1   23    1   20 o   43.248   18.044   0.2927   1.9881   0.5413   2.6852  -0.0089   2.9576   50.862   21.074   50.671   21.616 0.1905441 30.18891 
1 1 1   23    1   21 o   79.500   17.528   5.0777   2.0755   3.9669   2.8538   6.3248   3.0240   71.990   22.964   88.438   22.334 -16.44827 32.03401 
1 1 1   23    1   22 o  231.328   6.7256   41.023   2.3814   38.410   3.5594   43.141   3.2041  223.576   10.401  237.079   8.8296 -13.50314 13.64361 
1 1 1   23    1   23 o  272.574   6.0612   56.943   2.5288   55.943   3.2477   58.482   4.0301  270.038   7.8575  275.937   9.5419 -5.899323 12.36079 
1 1 1   23    1   24 o  350.307   5.2676   94.024   2.8244   93.236   4.3156   94.615   3.7355  348.561   8.0890  351.255   6.9480 -2.693695 10.66338 
1 1 1   23    1   25 f  226.343   6.2933   39.277   2.1803   38.925   3.1032   39.620   3.0640  225.119   9.0058  227.138   8.8131 -2.019043 12.60057 
1 1 1   23    1   26 o   72.168   16.813   4.1982   1.8228   4.0026   2.6382   4.3769   2.5213   71.444   21.980   73.948   21.187 -2.504486 30.52910 
1 1 1   23    1   27 o  274.681   6.4089   57.861   2.6945   60.678   3.5752   54.159   4.0996  281.089   8.3098  265.343   10.094 15.74579 13.07444 
1 1 1   23    1   28 o  213.294   7.5947   34.925   2.4795   34.052   3.2501   36.141   3.8350  210.363   10.094  216.221   11.631 -5.858810 15.39989 
1 1 1   23    1   29 o   34.996   16.933  -4.4527   2.7772  -4.6224   5.2466  -4.3867   3.2734   54.592   25.482   39.747   19.012 14.84412 31.79270 
1 1 1   23    1   30 o  164.592   9.4890   20.915   2.3804   26.351   3.9284   17.761   2.9923  183.933   14.060  151.003   13.076 32.92950 19.20041 
1 1 1   23    1   31 o  233.468   6.8956   41.845   2.4642   42.937   3.5430   40.822   3.4295  236.121   9.8031  230.244   9.7313 5.877014 13.81302 
1 1 1   23    1   32 o  109.283   13.174   9.3785   2.1592   8.1584   3.1359   10.478   2.9775   99.938   21.159  114.564   17.538 -14.62587 27.48273 
1 1 1   23    1   33 o  204.805   7.8159   32.244   2.4501   34.183   3.5691   30.516   3.3695  210.109   11.138  198.486   11.136 11.62209 15.74999 
1 1 1   23    1   34 o  111.260   13.714   9.7470   2.2860   9.7178   3.4924   9.7689   3.0239  108.997   21.696  110.149   18.598 -1.151596 28.57603 
1 1 1   23    1   35 o  268.505   7.0490   55.395   2.8970   57.008   4.1401   53.848   4.0552  271.849   9.9497  264.192   10.028 7.657562 14.12654 
1 1 1   23    1   36 o  277.040   8.5812   59.102   3.6388   63.083   4.9337   54.354   5.3885  285.577   11.287  264.199   13.368 21.37830 17.49600 
1 1 1   23    1   37 o   48.350   20.183   0.4833   2.4892   0.3566   3.5685   0.6033   3.4738   56.095   23.832   56.417   23.716 -0.3217316 33.62152 
1 1 1   23    1   38 o  239.880   8.1844   44.313   3.0051   47.647   4.4354   41.484   4.0857  247.940   11.687  231.390   11.536 16.55069 16.42165 
1 1 1   23    1   39 o  246.364   8.1083   46.753   3.0576   46.554   4.4151   46.936   4.2385  244.964   11.775  246.113   11.251 -1.148727 16.28643 
1 1 1   23    1   40 o   72.756   22.163   4.3047   2.6905   8.5438   3.9029   0.4661   3.7140  100.469   25.373   57.265   24.321 43.20328 35.14698 
1 1 1   23    1   41 o   85.735   27.422   6.0762   4.0671   1.6523   5.2793   12.535   6.3788   70.442   29.398  118.791   33.586 -48.34916 44.63508 
1 1 1   23    1   42 o  165.305   12.571   21.414   3.1569   22.085   4.8154   20.908   4.1806  165.307   19.401  161.725   17.150 3.581955 25.89411 
1 1 1   23    1   43 o   67.650   24.954   3.2005   3.4093   0.2585   5.8881   4.6844   4.1816   68.732   29.916   78.042   27.791 -9.310417 40.83303 
1 1 1   23    1   44 o  234.393   9.6800   42.581   3.4729   44.056   4.9252   41.123   4.8977  236.587   13.659  228.353   14.081 8.233444 19.61749 
1 1 1   23    1   45 o   93.541   21.886   7.4243   3.0779   9.9832   4.4591   5.0957   4.2537  106.565   27.235   79.650   28.065 26.91501 39.10805 
1 1 1   23    1   46 o  249.608   9.2880   48.345   3.5485   50.185   5.0545   46.556   4.9831  252.279   13.135  242.782   13.462 9.497284 18.80837 
1 1 1   23    1   47 f   93.307   25.003   7.6405   3.6432   8.6155   5.7136   6.9725   4.7293   97.265   32.588   89.018   29.646 8.247528 44.05463 
1 1 1   23    1   48 o   60.829   23.760   2.2978   3.2017   1.3274   4.1661   3.6977   5.0038   61.620   25.941   74.263   29.487 -12.64382 39.27387 
1 1 1   23    1   49 o   79.836   23.298   5.5955   3.0237   6.7101   4.1837   4.3767   4.3749   86.174   27.839   74.559   28.114 11.61509 39.56513 
1 1 1   23    1   50 o   49.602   21.443   0.2634   2.9843   3.7457   4.2171  -3.2302   4.2239   70.626   27.357   47.911   22.523 22.71487 35.43583 
1 1 1   23    1   51 o   53.443   21.939   1.3615   2.8746  -0.5157   4.0615   3.2458   4.0692   53.595   24.006   67.410   26.646 -13.81437 35.86546 
1 1 1   23    2    0 o  256.199   13.060   50.700   5.0911   50.700   5.0911   50.700   5.0911  256.199   13.060  256.199   13.060 0.000000 0.000000 
1 1 1   23    2    1 o  235.926   7.5383   42.642   2.7222   50.399   5.1633   39.655   3.2036  255.879   13.228  227.458   9.2017 28.42105 16.11403 
1 1 1   23    2    2 o  331.680   8.3229   84.299   4.2254   83.848   6.1416   84.704   5.8223  330.558   12.138  332.291   11.447 -1.732788 16.68485 
1 1 1   23    2    3 o  206.951   8.1256   32.817   2.5739   35.943   5.0660   31.729   2.9884  215.698   15.447  203.444   9.5966 12.25400 18.18500 
1 1 1   23    2    4 o  458.081   8.2600  160.795   5.7915  173.832   8.6516  150.209   7.7960  475.970   11.875  442.483   11.511 33.48685 16.53857 
1 1 1   23    2    5 o  469.980   8.3768  169.266   6.0260  184.749   9.1606  157.456   8.0007  490.642   12.198  453.019   11.538 37.62314 16.79061 
1 1 1   23    2    6 o  382.276   5.5451  111.905   3.2445  123.643   5.1464  104.162   4.1799  401.673   8.3707  368.729   7.4060 32.94421 11.17664 
1 1 1   23    2    7 o  753.658   5.5797  434.965   6.4366  454.861   10.992  424.581   7.9404  770.282   9.3228  744.481   6.9682 25.80042 11.63918 
1 1 1   23    2    8 o  246.061   6.6382   46.378   2.5001   49.483   3.8751   44.163   3.2723  254.024   9.9665  240.029   8.9066 13.99495 13.36636 
1 1 1   23    2    9 o  241.820   7.8826   44.811   2.9176   50.160   3.9883   38.653   4.2793  255.735   10.189  224.024   12.530 31.71051 16.14996 
1 1 1   23    2   10 o  167.553   9.1167   21.587   2.3293   26.107   3.6802   18.567   3.0086  183.888   13.162  154.962   12.799 28.92581 18.35900 
1 1 1   23    2   11 o  334.912   7.4952   85.949   3.8422   97.316   7.7597   82.257   4.4224  355.789   14.249  327.561   8.8206 28.22794 16.75807 
1 1 1   23    2   12 o  471.806   8.4789  170.643   6.1231   0.0000   0.0000  170.643   6.1231  ?   ?   471.806   8.4789 0.000000 8.478872 
1 1 1   23    2   13 o  216.666   8.7282   35.993   2.8946   35.819   4.2998   36.138   3.9144  215.501   13.098  216.613   11.851 -1.112091 17.66358 
1 1 1   23    2   14 o   71.873   21.570   4.0388   2.5625   7.0403   3.9189   1.7969   3.3869   93.771   26.260   62.260   24.405 31.51066 35.84919 
1 1 1   23    2   15 o  348.306   6.0635   92.936   3.2326   95.648   5.6223   91.597   3.9509  353.020   10.405  345.701   7.4667 7.318298 12.80699 
1 1 1   23    2   16 o  159.125   10.650   19.526   2.5788   18.663   6.2769   19.701   2.8286  152.266   27.963  159.723   11.650 -7.456619 30.29274 
1 1 1   23    2   17 o   55.270   22.473   0.9575   2.9800   5.6611   6.0427  -0.5539   3.4254   92.054   33.333   52.461   22.826 39.59264 40.39913 
1 1 1   23    2   18 o   83.752   18.563   5.6345   2.3172   16.847   4.6403   1.9097   2.6745  145.866   21.422   58.133   21.967 87.73282 30.68294 
1 1 1   23    2   19 o  177.733   7.8789   24.224   2.1434   21.127   2.9251   27.815   3.1498  165.386   11.629  189.972   10.878 -24.58646 15.92356 
1 1 1   23    2   20 o  437.538   4.8027  146.626   3.2164  145.724   5.0712  147.232   4.1603  435.935   7.6001  438.329   6.2009 -2.393555 9.808819 
1 1 1   23    2   21 o  255.578   6.5989   50.068   2.5814   45.094   3.5603   55.581   3.7484  242.341   9.5981  269.095   9.1006 -26.75420 13.22666 
1 1 1   23    2   22 o  117.052   12.080   10.653   2.1332   9.0185   2.9863   12.357   3.0481  106.281   19.057  125.431   16.259 -19.14915 25.05085 
1 1 1   23    2   23 o  123.107   11.122   11.749   2.0732   12.795   3.1429   10.944   2.7584  127.589   16.479  118.008   15.658 9.581108 22.73121 
1 1 1   23    2   24 o  438.999   5.8608  147.705   3.9381  155.093   6.5394  143.501   4.9329  449.315   9.5086  432.513   7.4514 16.80118 12.08037 
1 1 1   23    2   25 o  305.073   5.7870   71.334   2.7023   80.067   4.5811   66.674   3.3465  322.832   9.2710  294.798   7.4164 28.03375 11.87246 
1 1 1   23    2   26 f  409.333   5.3595  128.406   3.3579  133.168   4.5743  122.841   4.9450  416.630   7.1731  400.019   8.0763 16.61081 10.80191 
1 1 1   23    2   27 o  206.281   7.0163   32.646   2.2153   37.575   3.3638   28.871   2.9439  221.030   9.9428  193.489   9.9742 27.54041 14.08347 
1 1 1   23    2   28 o   67.495   20.717   3.5776   2.3452   0.1839   3.8275   5.6175   2.9675   57.871   24.636   83.168   22.684 -25.29686 33.48900 
1 1 1   23    2   29 o  201.532   7.4515   31.183   2.2986   34.622   3.4111   28.322   3.1109  212.024   10.511  191.456   10.658 20.56821 14.96916 
1 1 1   23    2   30 o  130.761   12.874   13.342   2.5433   12.924   3.7719   13.691   3.4440  126.954   20.079  131.418   17.561 -4.464043 26.67465 
1 1 1   23    2   31 o   85.551   16.064   5.8735   2.0263   7.7959   3.0284   4.3153   2.7265   97.785   20.869   73.543   22.290 24.24158 30.53488 
1 1 1   23    2   32 f  213.748   7.4306   35.100   2.4311   30.979   3.5585   38.708   3.3291  199.913   11.680  224.161   9.7028 -24.24724 15.18447 
1 1 1   23    2   33 o   69.713   19.454   3.9344   2.1548   3.3079   3.2792   4.4105   2.8585   68.766   24.598   74.334   22.881 -5.568138 33.59432 
1 1 1   23    2   34 o  100.223   15.578   8.0031   2.3122   9.0314   3.4032   7.1216   3.1511  104.931   21.897   92.923   22.414 12.00744 31.33502 
1 1 1   23    2   35 o   87.006   19.283   6.1875   2.5005   3.1511   3.3933   9.7959   3.6991   68.235   24.937  108.989   22.902 -40.75410 33.85750 
1 1 1   23    2   36 o  135.795   13.682   14.473   2.8050   15.060   3.9880   13.898   3.9461  136.833   19.601  131.119   20.320 5.714340 28.23274 
1 1 1   23    2   37 o   63.937   21.546   3.0880   2.4979   2.2477   3.5916   3.8753   3.4763   64.438   25.167   72.416   25.382 -7.977570 35.74378 
1 1 1   23    2   38 o  186.627   10.002   26.980   2.8468   21.666   4.1557   31.679   3.9076  165.356   16.646  201.546   12.732 -36.19009 20.95670 
1 1 1   23    2   39 o  135.113   13.624   14.364   2.7790   13.703   3.9919   14.985   3.8711  129.638   20.823  136.319   19.075 -6.680832 28.23919 
1 1 1   23    2   40 o   45.726   20.917  -1.9460   3.2829  -6.3596   5.6120   0.3501   4.0478   52.791   25.152   59.046   25.241 -6.255131 35.63289 
1 1 1   23    2   41 o  226.110   10.261   39.581   3.5513   33.764   4.6435   47.776   5.5119  207.093   14.745  246.543   14.673 -39.44981 20.80177 
1 1 1   23    2   42 o  119.789   16.273   11.508   2.9064   14.612   4.2481   8.7757   3.9850  133.170   21.580  101.357   25.661 31.81321 33.52890 
1 1 1   23    2   43 o  136.423   15.237   14.823   3.1273   12.345   4.8152   16.632   4.1127  119.635   26.944  143.010   19.280 -23.37570 33.13105 
1 1 1   23    2   44 o  173.727   12.250   23.680   3.2365   23.372   4.7656   23.943   4.4093  169.911   18.630  172.822   16.884 -2.911896 25.14256 
1 1 1   23    2   45 o  234.740   9.5345   42.740   3.4257   45.611   5.0190   40.236   4.6874  240.446   13.694  225.823   13.625 14.62288 19.31758 
1 1 1   23    2   46 o  153.480   14.621   18.800   3.3934   23.609   5.2311   15.306   4.4588  168.915   20.663  134.681   22.417 34.23445 30.48794 
1 1 1   23    2   47 o  145.092   15.312   16.926   3.3492   13.834   4.6036   20.403   4.8815  126.306   24.697  156.396   20.916 -30.09008 32.36394 
1 1 1   23    2   48 o  237.257   11.197   44.102   4.0663   46.973   5.6898   41.106   5.8135  241.917   15.447  225.149   16.994 16.76782 22.96544 
1 1 1   23    2   49 o  114.687   18.484   11.006   3.1345   6.7363   4.3255   15.728   4.5486   86.264   28.334  134.767   22.868 -48.50336 36.41109 
1 1 1   23    2   50 o   93.011   21.367   7.5724   2.9780   6.5588   4.1642   8.6333   4.2605   84.580   27.801   96.132   27.542 -11.55200 39.13396 
1 1 1   23    2   51 o   56.306   23.040   1.6384   3.1572   5.5918   4.9650  -1.0454   4.0908   79.642   29.967   52.214   23.676 27.42804 38.19156 
1 1 1   23    3    0 o   52.326   30.729   2.4527   4.1570   2.4527   4.1570   2.4527   4.1570   52.326   30.729   52.326   30.729 0.000000 0.000000 
1 1 1   23    3    1 o  415.743   11.681  132.609   7.4329  132.609   7.4329   0.0000   0.0000  415.743   11.681  ?   ?  0.000000 11.68058 
1 1 1   23    3    2 o  232.236   15.223   41.627   5.3812   41.627   5.3812   0.0000   0.0000  232.236   15.223  ?   ?  0.000000 15.22266 
1 1 1   23    3    3 o  412.189   8.3802  130.196   5.2871  125.645   7.6768  134.303   7.2922  404.607   12.396  418.409   11.386 -13.80228 16.83179 
1 1 1   23    3    4 o  862.394   7.8172  569.836   10.319  645.258   20.477  544.164   11.946  916.386   14.599  842.548   9.2635 73.83752 17.28957 
1 1 1   23    3    5 o  168.934   7.2834   21.863   1.8833   18.061   5.4077   22.388   2.0091  150.949   24.224  170.941   7.6787 -19.99152 25.41235 
1 1 1   23    3    6 o  455.287   5.3511  158.727   3.7291  148.985   8.6735  160.936   4.1303  440.507   12.864  458.417   5.8864 -17.90985 14.14668 
1 1 1   23    3    7 o  191.828   20.709   28.724   5.9840   28.724   5.9840   0.0000   0.0000  191.828   20.709  ?   ?  0.000000 20.70887 
1 1 1   23    3    8 o  320.524   5.8864   78.681   2.8879   79.575   7.2228   78.511   3.1507  321.746   14.666  320.155   6.4295 1.590485 16.01375 
1 1 1   23    3    9 o  345.150   5.3240   91.225   2.8127   92.121   7.7497   91.089   3.0185  346.162   14.626  344.877   5.7182 1.285065 15.70432 
1 1 1   23    3   10 o  510.132   5.4639  199.291   4.2663  207.337   10.656  197.755   4.6557  519.481   13.402  508.129   5.9861 11.35147 14.67817 
1 1 1   23    3   11 o  153.174   11.838   18.120   2.7539   18.663   6.3485   17.994   3.0564  152.479   28.242  152.466   13.228 0.1298523E-01 31.18612 
1 1 1   23    3   12 o   72.960   22.640   4.1047   2.7922   0.0000   0.0000   4.1047   2.7922  ?   ?    72.960   22.640 0.000000 22.63998 
1 1 1   23    3   13 o  158.550   9.6615   19.354   2.3335   14.004   6.3497   20.189   2.5091  131.099   31.938  161.896   10.177 -30.79736 33.52028 
1 1 1   23    3   14 o  251.863   7.2127   48.612   2.7805   31.896   6.9832   51.762   3.0312  201.527   23.054  259.874   7.6205 -58.34666 24.28042 
1 1 1   23    3   15 o  259.608   6.5760   51.639   2.6131   51.304   4.8615   51.775   3.0988  258.394   12.292  259.889   7.7899 -1.495636 14.55248 
1 1 1   23    3   16 o  164.490   8.9253   20.814   2.2387   25.460   4.5136   19.298   2.5782  180.977   16.474  158.181   10.712 22.79564 19.65070 
1 1 1   23    3   17 o  284.678   6.4218   62.098   2.7982   65.991   5.4255   60.687   3.2661  293.012   12.097  281.358   7.5841 11.65448 14.27804 
1 1 1   23    3   18 o  217.721   8.8611   36.366   2.9530   39.422   5.2573   34.957   3.5692  225.634   15.313  213.043   10.983 12.59093 18.84449 
1 1 1   23    3   19 o  479.138   5.0755  175.844   3.7223  185.037   5.4965  168.056   5.0589  491.283   7.3095  468.225   7.0588 23.05817 10.16145 
1 1 1   23    3   20 o  234.172   5.9144   42.018   2.1199   43.630   3.4384   41.029   2.6926  238.405   9.4225  231.310   7.6050 7.095261 12.10869 
1 1 1   23    3   21 o  242.282   5.9192   44.981   2.1951   46.579   3.6365   44.065   2.7532  246.292   9.6464  239.710   7.5039 6.581833 12.22140 
1 1 1   23    3   22 o   76.865   16.709   4.7436   1.9097   3.7196   3.0168   5.4283   2.4669   70.871   23.680   81.996   19.865 -11.12586 30.90869 
1 1 1   23    3   23 o  447.397   5.4185  153.369   3.7106  157.367   5.5421  150.121   4.9956  452.877   7.9951  442.413   7.3771 10.46405 10.87858 
1 1 1   23    3   24 o  355.688   5.8965   96.966   3.2102   98.270   4.7847   95.898   4.3292  357.756   8.7377  353.504   8.0010 4.251434 11.84752 
1 1 1   23    3   25 o  330.576   7.3054   83.836   3.6965   87.059   5.3390   80.868   5.1228  336.462   10.367  324.285   10.321 12.17773 14.62860 
1 1 1   23    3   26 o  275.004   6.1740   57.984   2.5988   57.994   4.3955   57.979   3.2223  274.560   10.459  274.857   7.6594 -0.2969055 12.96389 
1 1 1   23    3   27 o  244.872   6.8209   45.999   2.5565   54.522   4.4740   41.867   3.1152  266.094   10.985  233.440   8.7185 32.65399 14.02426 
1 1 1   23    3   28 o  357.200   5.8257   97.829   3.1852   96.817   5.3299   98.391   3.9725  354.747   9.8159  358.043   7.2488 -3.296204 12.20228 
1 1 1   23    3   29 o  144.120   9.5279   16.048   2.0899   17.243   3.0849   15.035   2.8413  148.684   13.710  138.786   13.548 9.898911 19.27460 
1 1 1   23    3   30 o  385.114   5.7157  113.736   3.3692  116.044   4.6808  111.254   4.8535  388.651   7.8684  380.456   8.3346 8.194977 11.46200 
1 1 1   23    3   31 o   64.533   20.055   3.2656   2.1901   3.0374   3.5872   3.4012   2.7652   68.835   25.556   67.390   22.670 1.444832 34.16183 
1 1 1   23    3   32 o   70.264   19.134   4.0020   2.1134   6.1017   3.3507   2.6147   2.7235   86.274   24.324   62.105   22.395 24.16907 33.06349 
1 1 1   23    3   33 o  108.859   13.180   9.3129   2.1514   9.1795   3.3061   9.4110   2.8333  106.079   21.104  108.350   17.695 -2.270309 27.54141 
1 1 1   23    3   34 o  134.365   11.156   14.042   2.2736   14.208   3.4923   13.919   2.9952  133.641   17.493  132.928   14.982 0.7134552 23.03188 
1 1 1   23    3   35 o  162.861   10.763   20.576   2.6679   20.100   3.6869   21.100   3.8653  159.875   15.251  163.736   15.612 -3.860565 21.82537 
1 1 1   23    3   36 o  165.340   10.556   21.202   2.6575   18.740   4.1266   22.947   3.4738  153.458   17.905  171.375   13.348 -17.91652 22.33298 
1 1 1   23    3   37 o  109.464   16.018   9.5634   2.6044   10.309   3.6458   8.7866   3.7218  111.900   22.070  102.595   24.109 9.305244 32.68515 
1 1 1   23    3   38 o   62.038   21.124   2.8793   2.4012   0.1699   3.5367   5.1963   3.2706   55.067   23.568   79.790   24.461 -24.72319 33.96704 
1 1 1   23    3   39 o   66.549   22.458   3.3834   2.7138   6.1182   3.7478   0.3688   3.9349   85.913   26.155   58.462   24.936 27.45169 36.13668 
1 1 1   23    3   40 o   64.876   23.929   2.8432   3.1348   1.9717   5.7234   3.2167   3.7467   73.811   30.690   69.611   26.063 4.199501 40.26402 
1 1 1   23    3   41 o   74.030   23.802   4.4117   3.0611   7.9458   4.0899  -0.0894   4.6158   96.530   26.754   61.016   26.522 35.51425 37.67275 
1 1 1   23    3   42 o  248.082   8.6150   47.513   3.2713   53.140   4.9845   43.256   4.3357  261.122   12.471  235.431   12.072 25.69106 17.35713 
1 1 1   23    3   43 o  225.347   10.055   39.361   3.4683   40.470   5.6039   38.673   4.4157  225.646   16.336  222.051   13.049 3.594193 20.90808 
1 1 1   23    3   44 o  139.109   14.434   15.382   3.0286   13.859   4.4201   16.730   4.1582  128.236   23.380  143.057   19.498 -14.82082 30.44365 
1 1 1   23    3   45 o  170.265   13.121   22.882   3.3932   24.502   5.2475   21.718   4.4484  172.757   20.228  163.664   18.058 9.092941 27.11551 
1 1 1   23    3   46 o   49.584   21.913  -0.5276   3.2702   0.3373   4.5084  -1.4878   4.7506   60.618   26.281   56.708   25.632 3.910580 36.71087 
1 1 1   23    3   47 o  287.465   8.4456   64.029   3.7161   64.954   5.2987   63.134   5.2130  287.720   12.032  283.677   12.006 4.043396 16.99715 
1 1 1   23    3   48 o   48.708   21.503  -0.4041   3.1407  -3.2598   4.6857   1.9256   4.2322   51.489   24.049   64.150   26.509 -12.66150 35.79208 
1 1 1   23    3   49 o   94.015   23.132   7.8032   3.3060   6.6231   4.2124   9.6958   5.3346   85.586   27.954  100.684   31.302 -15.09802 41.96659 
1 1 1   23    3   50 o  107.003   18.803   9.7068   2.9671   11.274   4.1619   8.0873   4.2313  111.685   24.972   93.009   27.674 18.67534 37.27555 
1 1 1   23    3   51 o   67.969   24.593   3.8202   3.2886   10.081   5.1466  -0.5001   4.2753  100.986   30.628   54.842   24.593 46.14401 39.27976 
1 1 1   23    4    1 o  333.344   13.162   85.316   6.7157   85.316   6.7157   0.0000   0.0000  333.344   13.162  ?   ?  0.000000 13.16224 
1 1 1   23    4    2 o  695.744   12.623  371.569   13.443  371.569   13.443   0.0000   0.0000  695.744   12.623  ?   ?  0.000000 12.62296 
1 1 1   23    4    3 o  614.484   8.3086  289.354   7.8146  298.159   11.923  282.724   10.347  623.248   12.499  607.087   11.135 16.16107 16.73917 
1 1 1   23    4    4 o  328.603   8.4217   82.751   4.2358   81.137   7.0811   83.650   5.2859  324.972   14.236  330.261   10.457 -5.289185 17.66350 
1 1 1   23    4    5 o  497.819   5.3970  189.771   4.1124  196.608   9.9581  188.365   4.5154  506.035   12.857  495.941   5.9484 10.09424 14.16600 
1 1 1   23    4    6 o  632.845   6.4935  306.761   6.2900  320.747   12.882  302.382   7.2076  646.292   13.022  628.225   7.4956 18.06708 15.02523 
1 1 1   23    4    7 o  645.864   7.3022  319.591   7.2188  367.389   9.7233  260.889   10.775  692.261   9.1765  582.992   12.075 109.2691 15.16656 
1 1 1   23    4    8 o   52.361   21.010   0.9981   2.5672   2.3497   3.3624  -0.8913   3.9753   64.983   24.613   55.756   24.416 9.227215 34.66902 
1 1 1   23    4    9 o  236.671   9.0403   42.943   3.2749   45.109   4.2615   39.820   5.1181  242.433   11.484  227.091   14.805 15.34204 18.73728 
1 1 1   23    4   10 o  933.778   7.3614  668.116   10.521  726.009   16.104  624.995   13.898  972.715   10.816  902.670   10.059 70.04510 14.77058 
1 1 1   23    4   11 o  140.467   10.929   15.233   2.3314   15.857   3.8689   14.878   2.9213  142.270   18.183  138.419   13.980 3.851318 22.93565 
1 1 1   23    4   12 o  429.312   6.2878  141.188   4.1318  142.894   6.2048  139.829   5.5384  431.646   9.3915  427.076   8.4724 4.569702 12.64839 
1 1 1   23    4   13 f  440.799   7.0030  148.885   4.7249  135.245   8.0960  155.932   5.8187  419.546   12.607  450.985   8.4293 -31.43903 15.16558 
1 1 1   23    4   14 o  172.363   11.511   22.916   3.0193   26.240   7.1283   22.189   3.3331  181.736   26.398  169.417   12.952 12.31985 29.40380 
1 1 1   23    4   15 o  269.453   6.1450   55.623   2.5344   67.180   8.1249   54.377   2.6675  294.421   18.117  266.401   6.5418 28.02084 19.26217 
1 1 1   23    4   16 o  248.490   6.2499   47.309   2.3771   52.313   5.2589   46.024   2.6649  260.465   13.234  245.052   7.1049 15.41304 15.02091 
1 1 1   23    4   17 f  351.754   5.6603   94.784   3.0475  109.559   6.2185   90.114   3.4961  377.704   10.756  342.916   6.6609 34.78778 12.65179 
1 1 1   23    4   18 o  250.495   7.4469   48.106   2.8553   48.492   5.4332   47.958   3.3561  250.522   14.228  250.027   8.7695 0.4954529 16.71322 
1 1 1   23    4   19 o  210.169   7.5094   33.868   2.4157   35.480   5.3356   33.452   2.7093  213.747   16.434  208.822   8.4765 4.925644 18.49153 
1 1 1   23    4   20 f   26.077   12.696  -2.9161   1.6263  -3.6958   2.4800  -2.3279   2.1541   33.873   16.292   34.108   16.050 -0.2354584 22.87040 
1 1 1   23    4   21 o  143.932   8.5746   15.953   1.8805   17.990   2.9980   14.632   2.4145  152.306   12.984  137.455   11.584 14.85110 17.40048 
1 1 1   23    4   22 o  155.849   8.3830   18.693   1.9924   20.139   3.2088   17.785   2.5417  161.161   13.122  151.693   11.022 9.467651 17.13707 
1 1 1   23    4   23 o  547.786   5.3420  229.915   4.4791  241.103   6.8287  221.466   5.9338  560.559   7.9587  537.370   7.2143 23.18945 10.74186 
1 1 1   23    4   24 o  289.762   6.1485   64.362   2.7269   67.746   4.1818   61.859   3.5969  296.981   9.1994  283.882   8.2780 13.09903 12.37557 
1 1 1   23    4   25 o  353.600   7.2704   95.921   3.9350   99.665   5.7156   92.548   5.4254  359.985   10.373  346.919   10.217 13.06631 14.56005 
1 1 1   23    4   26 o   64.890   19.043   3.3376   2.0150   5.7903   3.6141   2.2313   2.4273   85.130   25.632   58.364   21.127 26.76600 33.21682 
1 1 1   23    4   27 o  371.767   5.9336  105.967   3.3764  113.096   5.4888  101.627   4.2826  383.552   9.3494  363.849   7.6898 19.70337 12.10553 
1 1 1   23    4   28 o  236.561   7.0027   42.944   2.5356   49.754   4.6805   40.115   3.0166  253.958   12.041  228.477   8.6259 25.48074 14.81188 
1 1 1   23    4   29 o   90.807   16.258   6.5940   2.1767   7.0055   4.2020   6.4430   2.5447   92.794   27.571   89.153   19.214 3.640678 33.60562 
1 1 1   23    4   30 o  334.766   6.6038   86.003   3.3838   92.363   5.6120   82.370   4.2416  346.180   10.591  327.331   8.4658 18.84961 13.55884 
1 1 1   23    4   31 o  101.358   17.293   8.2302   2.5866   23.670   8.8524   6.7890   2.7046  166.180   35.855   91.297   19.915 74.88356 41.01440 
1 1 1   23    4   32 o  414.970   5.8243  132.103   3.6994  127.407   6.3626  134.501   4.5469  406.518   10.226  418.478   7.0987 -11.95981 12.44801 
1 1 1   23    4   33 o  175.236   8.9335   23.700   2.3882   23.792   3.7555   23.637   3.0945  174.476   14.185  174.493   11.653 -0.1702881E-01 18.35813 
1 1 1   23    4   34 o  285.365   7.0630   62.562   3.0850   66.247   4.5540   59.438   4.1940  293.048   10.153  277.639   9.8691 15.40857 14.15901 
1 1 1   23    4   35 o   75.629   19.312   4.6797   2.2434   2.5491   3.4402   6.2561   2.9591   65.265   24.853   87.047   22.154 -21.78188 33.29400 
1 1 1   23    4   36 o  107.666   15.172   9.2122   2.4310   10.911   3.6718   7.8862   3.2439  115.455   21.571   97.659   22.203 17.79590 30.95627 
1 1 1   23    4   37 o   46.150   20.043  -0.2669   2.6311   3.4451   3.8125  -3.6427   3.6357   71.389   26.377   44.279   20.841 27.10976 33.61714 
1 1 1   23    4   38 o  140.138   14.524   15.484   3.0701   13.981   3.9477   17.784   4.8836  131.261   20.304  147.575   22.317 -16.31412 30.17154 
1 1 1   23    4   39 o  186.480   10.995   27.026   3.1243   26.177   4.6284   27.738   4.2346  181.666   16.836  187.760   14.856 -6.094131 22.45372 
1 1 1   23    4   40 o  193.463   11.362   29.131   3.3498   40.772   6.5915   25.077   3.8895  225.706   19.264  178.545   14.354 47.16100 24.02374 
1 1 1   23    4   41 o  109.407   18.746   9.7537   3.0263   14.181   4.0976   4.4406   4.4887  131.515   21.067   78.195   28.665 53.32021 35.57375 
1 1 1   23    4   42 f   52.665   21.570   0.9828   2.7705   5.4331   4.0948  -2.7743   3.7624   81.945   27.587   47.136   21.858 34.80936 35.19664 
1 1 1   23    4   43 o  129.199   15.670   13.348   3.0355   11.135   4.8963   14.729   3.8686  112.882   28.371  134.371   19.369 -21.48882 34.35218 
1 1 1   23    4   44 o   56.158   22.647   1.4327   2.9991   3.0210   4.5893   0.2489   3.9621   71.476   28.284   57.486   24.780 13.99084 37.60364 
1 1 1   23    4   45 o  139.259   15.514   15.550   3.2507   18.876   4.9571   13.040   4.3057  150.278   22.221  123.793   23.585 26.48431 32.40382 
1 1 1   23    4   46 o  163.263   13.682   21.158   3.3875   26.824   4.5985   14.435   5.0090  182.458   16.649  128.434   26.363 54.02429 31.18051 
1 1 1   23    4   47 o   99.812   20.663   8.4437   3.0528   10.901   4.2649   5.8620   4.3716  111.266   25.578   82.906   28.497 28.35952 38.29240 
1 1 1   23    4   48 o  155.963   14.057   19.467   3.3197   25.788   5.0512   14.661   4.4045  176.689   18.975  130.560   22.874 46.12933 29.71972 
1 1 1   23    4   49 o   46.944   21.220  -1.0890   3.2567  -1.4316   4.1462  -0.5373   5.2618   52.110   23.709   60.877   27.292 -8.767345 36.15196 
1 1 1   23    4   50 o   93.498   21.337   7.6605   2.9862   6.9116   4.0664   8.5372   4.3996   86.458   27.395   95.144   28.198 -8.686302 39.31421 
1 1 1   23    4   51 o  108.444   22.173   10.413   3.5563   5.9446   5.1322   14.540   4.9324   81.233   30.487  125.220   26.558 -43.98727 40.43191 
1 1 1   23    5    1 o  114.657   28.721   10.616   5.0299   0.0000   0.0000   10.616   5.0299  ?   ?   114.657   28.721 0.000000 28.72145 
1 1 1   23    5    2 o  448.596   8.5518  154.229   5.8719  142.774   8.7365  163.667   7.9303  431.189   13.237  461.883   11.217 -30.69403 17.35089 
1 1 1   23    5    3 o  174.472   13.348   23.513   3.5376   19.830   5.9799   25.496   4.3877  158.022   25.599  181.379   15.967 -23.35728 30.17064 
1 1 1   23    5    4 o  350.448   8.2595   94.118   4.4304  108.233   7.9434   87.744   5.3378  375.353   13.826  338.246   10.310 37.10709 17.24690 
1 1 1   23    5    5 o  470.702   13.238  170.161   9.5377  170.161   9.5377   0.0000   0.0000  470.702   13.238  ?   ?  0.000000 13.23811 
1 1 1   23    5    6 o  233.396   19.720   42.314   6.9790   42.314   6.9790   0.0000   0.0000  233.396   19.720  ?   ?  0.000000 19.72043 
1 1 1   23    5    7 o  524.063   11.962  210.820   9.5956   0.0000   0.0000  210.820   9.5956  ?   ?   524.063   11.962 0.000000 11.96240 
1 1 1   23    5    8 o  431.373   6.0531  142.524   3.9967  152.828   6.2946  135.564   5.1734  446.463   9.2112  420.582   8.0362 25.88065 12.22402 
1 1 1   23    5    9 o  181.519   8.6907   25.259   2.4146   34.928   4.1258   20.222   2.9779  212.872   12.721  161.838   12.109 51.03450 17.56256 
1 1 1   23    5   10 o  406.944   6.2683  126.853   3.9044  130.924   6.0526  123.951   5.1097  413.176   9.5705  402.126   8.3016 11.04956 12.66929 
1 1 1   23    5   11 o  181.857   9.2722   25.428   2.5724   29.632   4.3689   23.197   3.1825  195.727   14.690  173.382   12.067 22.34563 19.01126 
1 1 1   23    5   12 o  230.147   7.9660   40.600   2.8062   41.347   4.5585   40.144   3.5609  231.606   12.910  228.739   10.171 2.867172 16.43521 
1 1 1   23    5   13 o  386.959   7.1931  114.748   4.2604  118.115   7.8489  113.342   5.0727  391.998   13.081  384.470   8.6201 7.528137 15.66617 
1 1 1   23    5   14 o  383.773   6.6224  112.849   3.8901  115.538   6.0434  110.946   5.0831  388.009   10.176  380.359   8.7311 7.650269 13.40818 
1 1 1   23    5   15 o  298.218   7.4295   68.167   3.3913   71.565   5.5047   66.089   4.3054  305.203   11.783  293.487   9.5842 11.71622 15.18899 
1 1 1   23    5   16 o  302.146   8.3924   70.011   3.8813   67.509   8.9140   70.596   4.3114  294.656   19.881  303.336   9.2859 -8.679840 21.94250 
1 1 1   23    5   17 o   56.418   16.598   2.4960   1.5291  -2.6691   7.5089   2.7194   1.5618   73.495   32.800   58.622   16.635 14.87347 36.77722 
1 1 1   23    5   18 f  174.500   6.7038   23.338   1.7906   21.282   2.5946   25.207   2.4742  166.164   10.252  181.253   8.9181 -15.08920 13.58777 
1 1 1   23    5   19 o  164.381   6.9009   20.713   1.7363   18.559   2.7464   22.147   2.2410  154.937   11.667  169.678   8.6575 -14.74055 14.52792 
1 1 1   23    5   20 o  412.131   5.7877  130.144   3.6510  150.929   7.4291  123.525   4.1922  443.147   10.953  401.422   6.8229 41.72464 12.90399 
1 1 1   23    5   21 f  209.143   6.9933   33.536   2.2387   32.663   3.3151   34.268   3.0354  205.896   10.554  211.259   9.3871 -5.362686 14.12493 
1 1 1   23    5   22 o  299.438   5.7134   68.708   2.6186   73.060   4.1835   65.905   3.3577  308.497   8.8596  293.131   7.4837 15.36563 11.59734 
1 1 1   23    5   23 o  117.344   10.054   10.659   1.7883   6.3533   3.1661   12.676   2.1671   88.517   23.117  127.887   11.183 -39.36985 25.67977 
1 1 1   23    5   24 o  206.993   6.6342   32.854   2.1019   42.971   3.8915   28.687   2.4976  236.355   10.757  193.305   8.4412 43.04941 13.67331 
1 1 1   23    5   25 o  137.079   9.7616   14.517   2.0348   8.6458   3.9129   16.692   2.3822  102.803   25.088  146.917   10.666 -44.11349 27.26104 
1 1 1   23    5   26 o  253.556   8.1970   49.366   3.1812   48.270   4.4113   50.554   4.5920  250.322   11.513  256.147   11.712 -5.824371 16.42366 
1 1 1   23    5   27 f  107.440   13.975   9.0703   2.2437   7.0574   3.9213   10.050   2.7359   93.045   26.342  112.686   16.338 -19.64058 30.99792 
1 1 1   23    5   28 o  429.046   5.4412  141.113   3.5733  157.394   6.4586  133.932   4.2897  452.394   9.3272  417.806   6.7078 34.58813 11.48874 
1 1 1   23    5   29 o  187.264   8.4430   26.952   2.4200   27.828   4.6675   26.631   2.8302  188.514   16.338  185.721   9.9926 2.793121 19.15118 
1 1 1   23    5   30 o  490.679   6.2369  184.720   4.6842  201.350   8.3237  177.012   5.6667  511.079   10.640  480.017   7.7126 31.06131 13.14169 
1 1 1   23    5   31 o  473.173   5.5642  171.709   4.0299  180.618   7.1536  167.567   4.8774  484.273   9.6509  467.185   6.8208 17.08768 11.81790 
1 1 1   23    5   32 o  341.499   6.7900   89.545   3.5492   87.582   8.2120   89.996   3.9358  335.242   16.004  342.232   7.5134 -6.989563 17.67958 
1 1 1   23    5   33 f  285.858   7.0552   62.769   3.0869   69.835   6.0043   60.230   3.5990  300.177   13.068  279.802   8.4036 20.37476 15.53692 
1 1 1   23    5   34 o  137.955   13.825   14.923   2.8799   10.688   5.3605   16.642   3.4145  112.221   30.438  145.301   15.597 -33.07960 34.20100 
1 1 1   23    5   35 o   63.239   21.661   2.9575   2.5250   9.0168   5.4260   1.2826   2.8528  103.524   31.460   55.221   22.152 48.30289 38.47652 
1 1 1   23    5   36 o   35.167   16.575  -2.4694   2.3142  -3.7226   3.4622  -1.4574   3.1113   42.677   20.163   45.989   20.769 -3.311817 28.94677 
1 1 1   23    5   37 o  272.355   8.2534   57.121   3.4406   63.010   5.2745   52.758   4.5394  285.048   12.089  261.030   11.362 24.01761 16.59017 
1 1 1   23    5   38 f  150.417   14.430   17.813   3.2814   22.365   4.4332   12.297   4.8801  167.659   17.534  120.463   27.120 47.19608 32.29504 
1 1 1   23    5   39 o  238.766   9.7343   44.049   3.5575   40.412   7.7044   45.034   4.0107  222.964   22.901  241.140   10.866 -18.17635 25.34803 
1 1 1   23    5   40 o   68.840   22.418   3.7426   2.7099   1.0021   4.2646   5.5986   3.5096   62.718   26.316   82.325   25.355 -19.60689 36.54361 
1 1 1   23    5   41 o  156.846   13.491   19.344   3.2074   18.113   4.4785   20.641   4.5956  149.338   20.104  159.971   19.149 -10.63278 27.76401 
1 1 1   23    5   42 o   67.578   22.926   3.5362   2.8282   3.5329   4.2467   3.5389   3.7913   72.808   27.640   71.049   26.293 1.759781 38.14876 
1 1 1   23    5   43 o  191.782   10.572   28.639   3.0913   28.815   4.6074   28.495   4.1689  190.316   15.964  189.899   14.451 0.4178772 21.53336 
1 1 1   23    5   44 o   82.428   23.874   5.7690   3.1856   6.0226   5.1613   5.6130   4.0488   86.237   30.858   82.198   27.433 4.038673 41.28888 
1 1 1   23    5   45 o  232.345   9.3610   41.873   3.3291   37.612   4.7127   46.117   4.7034  217.906   14.207  242.159   12.734 -24.25362 19.07899 
1 1 1   23    5   46 o   58.315   23.186   1.8321   3.0977   3.8529   4.0759  -0.9312   4.7664   72.494   27.176   58.253   26.056 14.24054 37.64883 
1 1 1   23    5   47 o   71.020   23.506   4.1721   2.9749   8.8257   4.1375  -0.8088   4.2805   99.448   26.644   55.395   24.741 44.05291 36.35932 
1 1 1   23    5   48 o   89.587   22.982   7.0257   3.1669   12.287   4.6752   2.5646   4.3050  116.861   26.719   66.851   27.072 50.01024 38.03682 
1 1 1   23    5   49 o  167.070   13.407   22.338   3.3995   19.787   4.2319   26.979   5.7081  154.348   18.267  178.063   21.370 -23.71490 28.11369 
1 1 1   23    5   50 o  114.898   19.103   11.213   3.2417   9.6152   4.1195   13.810   5.2534  101.988   26.238  120.754   28.823 -18.76524 38.97698 
1 1 1   23    5   51 o   88.888   23.789   7.1955   3.3005   9.8479   5.0455   5.2116   4.3635   99.831   30.337   76.920   28.253 22.91142 41.45516 
1 1 1   23    6    0 o   70.847   36.443   5.6931   5.0437   5.6931   5.0437   5.6931   5.0437   70.847   36.443   70.847   36.443 0.000000 0.000000 
1 1 1   23    6    1 o  105.194   28.110   8.9005   4.6125   0.0000   0.0000   8.9005   4.6125  ?   ?   105.194   28.110 0.000000 28.10991 
1 1 1   23    6    2 o  174.552   16.967   23.670   4.4759   0.0000   0.0000   23.670   4.4759  ?   ?   174.552   16.967 0.000000 16.96704 
1 1 1   23    6    3 o  369.776   9.7223  104.845   5.5027   0.0000   0.0000  104.845   5.5027  ?   ?   369.776   9.7223 0.000000 9.722287 
1 1 1   23    6    4 o  174.244   26.536   24.084   6.8537   24.084   6.8537   0.0000   0.0000  174.244   26.536  ?   ?  0.000000 26.53595 
1 1 1   23    6    5 o  514.531   13.527  203.384   10.653  203.384   10.653   0.0000   0.0000  514.531   13.527  ?   ?  0.000000 13.52708 
1 1 1   23    6    6 o  178.861   26.404   25.355   7.0112   25.355   7.0112   0.0000   0.0000  178.861   26.404  ?   ?  0.000000 26.40383 
1 1 1   23    6    7 o  439.541   7.0653  148.016   4.7534  165.308   6.6186  129.598   6.8309  464.321   9.3128  410.982   10.859 53.33914 14.30543 
1 1 1   23    6    8 o  154.211   11.824   18.363   2.7696   16.089   4.0620   20.338   3.7861  143.196   19.002  161.861   15.471 -18.66473 24.50335 
1 1 1   23    6    9 o  117.964   12.748   10.813   2.2652   9.0668   4.0524   11.606   2.7318  105.982   25.327  121.937   14.950 -15.95567 29.40993 
1 1 1   23    6   10 o  168.043   9.5865   21.728   2.4555   19.576   4.3398   22.742   2.9781  158.288   18.246  171.744   11.394 -13.45546 21.51142 
1 1 1   23    6   11 o  515.549   6.2806  203.610   4.9561  215.848   7.7288  195.063   6.4589  530.485   9.5185  504.424   8.3655 26.06128 12.67218 
1 1 1   23    6   12 f  249.633   7.7062   47.764   2.9445   52.638   4.9987   45.174   3.6438  261.742   12.477  242.658   9.8105 19.08446 15.87210 
1 1 1   23    6   13 o  732.647   7.6154  411.429   8.5400  428.886   15.526  403.856   10.226  746.784   13.583  725.617   9.2071 21.16656 16.40944 
1 1 1   23    6   14 o  203.913   9.0161   31.893   2.8140   26.809   4.6482   34.835   3.5356  185.748   16.521  212.725   10.895 -26.97621 19.79048 
1 1 1   23    6   15 o   74.721   20.648   4.4567   2.4401   0.8229   4.2782   6.2087   2.9706   63.875   26.545   87.767   22.121 -23.89163 34.55344 
1 1 1   23    6   16 o  109.872   15.869   9.4967   2.5913   7.5997   4.5678   10.397   3.1467   97.557   28.683  114.540   18.585 -16.98344 34.17838 
1 1 1   23    6   17 o  263.034   9.3633   53.096   3.7698   65.796   8.9157   50.332   4.1599  290.681   20.163  255.994   10.617 34.68767 22.78756 
1 1 1   23    6   18 o  356.196   7.0829   97.260   3.8616  100.079   4.5723   90.248   7.2119  361.212   8.2699  342.331   13.764 18.88144 16.05712 
1 1 1   23    6   19 o  235.689   5.4136   42.555   1.9530   47.929   3.1964   39.354   2.4670  249.953   8.3548  226.568   7.1138 23.38533 10.97312 
1 1 1   23    6   20 o  273.071   5.6889   57.135   2.3778   60.435   3.5709   54.506   3.1871  280.660   8.3125  266.577   7.8109 14.08350 11.40652 
1 1 1   23    6   21 o  137.369   8.6013   14.539   1.7994   14.592   5.5138   14.533   1.9036  133.791   27.832  137.283   9.1110 -3.492783 29.28492 
1 1 1   23    6   22 o  159.624   7.2972   19.542   1.7829   23.264   3.2782   17.978   2.1246  173.375   12.436  152.743   9.1292 20.63252 15.42696 
1 1 1   23    6   23 o  527.482   4.8440  213.152   3.9110  231.095   6.6644  203.727   4.8302  548.775   7.9341  515.535   6.1212 33.24023 10.02090 
1 1 1   23    6   24 o  102.740   11.796   8.2336   1.8213   9.8224   3.5768   7.6774   2.1162  110.252   21.967   98.686   14.437 11.56660 26.28594 
1 1 1   23    6   25 o  124.885   10.412   12.080   1.9722   9.0529   4.1581   12.958   2.2401  105.064   25.998  129.223   11.444 -24.15872 28.40553 
1 1 1   23    6   26 o  357.918   5.4095   98.186   2.9635  114.007   5.3632   91.232   3.5557  385.158   9.0974  344.870   6.7359 40.28806 11.31969 
1 1 1   23    6   27 o  154.713   12.509   18.591   2.9369   18.352   4.1866   18.822   4.1208  152.449   18.308  154.556   17.741 -2.106750 25.49352 
1 1 1   23    6   28 o   62.924   20.536   3.0045   2.2735   10.162   4.6576   0.7658   2.6049  110.735   27.583   51.045   20.912 59.68963 34.61369 
1 1 1   23    6   29 o  245.732   7.2164   46.360   2.7143   48.776   5.8808   45.706   3.0596  250.184   15.432  243.880   8.1964 6.304382 17.47390 
1 1 1   23    6   30 o  278.654   7.2791   59.631   3.1047   69.760   5.7364   55.434   3.6921  300.393   12.476  268.428   8.9863 31.96460 15.37558 
1 1 1   23    6   31 o  449.811   5.5888  155.180   3.8479  170.780   7.0899  148.666   4.5813  470.818   9.8382  440.042   6.8018 30.77588 11.96056 
1 1 1   23    6   32 o   45.227   19.302   0.0394   2.3603   14.527   7.3717  -1.6154   2.4914  129.662   35.912   39.814   18.216 89.84846 40.26757 
1 1 1   23    6   33 o  312.269   8.1066   74.996   3.8747   83.900   9.0968   73.023   4.2826  326.555   18.273  307.939   9.0860 18.61551 20.40729 
1 1 1   23    6   34 o  173.697   10.232   23.361   2.7084   26.870   6.0611   22.486   3.0275  182.682   22.128  170.096   11.700 12.58571 25.03038 
1 1 1   23    6   35 o  170.147   10.726   22.453   2.7791   24.101   6.0407   22.011   3.1299  172.176   23.538  168.116   12.248 4.059845 26.53392 
1 1 1   23    6   36 o   62.055   22.843   2.5401   2.8548  -2.4478   6.3005   3.8286   3.2023   65.261   29.507   71.227   24.394 -5.966103 38.28462 
1 1 1   23    6   37 o  144.661   15.786   16.562   3.4387   24.235   9.6960   15.458   3.6778  163.977   39.169  139.123   17.669 24.85411 42.97004 
1 1 1   23    6   38 f   55.989   23.434   0.7120   3.3683  -1.9021   7.1952   1.4457   3.8118   70.928   31.848   61.954   25.329 8.974148 40.69220 
1 1 1   23    6   39 o   96.600   20.857   7.7187   2.9936  -1.3926   7.3560   9.5271   3.2772   72.670   32.446  107.646   20.641 -34.97617 38.45509 
1 1 1   23    6   40 o  201.064   9.8247   31.261   3.0236   25.897   4.8376   34.700   3.8734  180.124   17.778  210.961   12.045 -30.83681 21.47470 
1 1 1   23    6   41 o  148.710   13.255   17.392   2.9855   20.138   4.8777   15.746   3.7753  157.235   20.776  139.837   18.060 17.39885 27.52861 
1 1 1   23    6   42 o   94.752   20.174   7.4565   2.8361   5.8068   4.4255   8.6061   3.6944   84.447   28.678  100.615   24.270 -16.16769 37.56902 
1 1 1   23    6   43 o  146.512   13.678   16.968   3.0319   17.772   4.8118   16.438   3.9046  146.398   22.167  142.420   18.338 3.978165 28.76882 
1 1 1   23    6   44 o  212.332   10.167   35.015   3.3044   31.976   5.1765   37.105   4.2929  199.622   17.107  217.228   12.970 -17.60603 21.46801 
1 1 1   23    6   45 f   52.778   22.231   0.6594   3.0626   6.3008   4.0792  -6.6286   4.6365   85.570   27.472   45.121   21.844 40.44931 35.09809 
1 1 1   23    6   46 o  137.639   14.590   15.165   3.0269   12.996   4.1707   17.578   4.3997  123.456   22.915  145.494   20.310 -22.03824 30.62024 
1 1 1   23    6   47 o   58.856   22.579   2.2330   2.8524   2.4151   3.8867   2.0204   4.1993   64.753   25.898   64.587   26.516 0.1651840 37.06492 
1 1 1   23    6   48 o  216.384   10.582   36.648   3.5047   36.868   5.1240   36.454   4.8043  213.657   15.780  213.105   14.821 0.5518036 21.64877 
1 1 1   23    6   49 o   60.398   23.275   2.4805   3.0403  -1.4050   4.0836   7.3126   4.5540   51.656   23.513   88.820   29.068 -37.16413 37.38704 
1 1 1   23    6   50 o   88.309   26.658   7.2377   3.9055   5.1172   4.9566   10.710   6.3426   77.949   29.797  102.186   34.334 -24.23704 45.46077 
1 1 1   23    6   51 o  145.006   14.068   17.073   3.0831   19.373   4.1691   14.298   4.5802  151.641   18.334  125.446   24.733 26.19542 30.78714 
1 1 1   23    7    0 o  209.036   15.830   34.098   4.9981   34.098   4.9981   34.098   4.9981  209.036   15.830  209.036   15.830 0.000000 0.000000 
1 1 1   23    7    1 o  188.748   11.639   27.445   3.3463   30.145   5.4847   25.844   4.2234  196.932   18.409  182.697   15.242 14.23494 23.90026 
1 1 1   23    7    2 o  544.719   10.136  227.572   8.4511   0.0000   0.0000  227.572   8.4511  ?   ?   544.719   10.136 0.000000 10.13607 
1 1 1   23    7    3 o  543.607   7.7506  226.444   6.4489  233.690   11.027  222.678   7.9502  551.593   13.061  538.881   9.6387 12.71136 16.23258 
1 1 1   23    7    4 o  957.388   14.082  704.457   20.636   0.0000   0.0000  704.457   20.636  ?   ?   957.388   14.082 0.000000 14.08204 
1 1 1   23    7    5 o  358.743   10.468   98.728   5.7480   0.0000   0.0000   98.728   5.7480  ?   ?   358.743   10.468 0.000000 10.46799 
1 1 1   23    7    6 o  191.143   12.022   28.161   3.4992   19.218   7.3561   30.776   3.9782  153.964   32.248  199.731   13.085 -45.76677 34.80138 
1 1 1   23    7    7 o  390.826   9.9210  117.158   5.9348  117.158   5.9348   0.0000   0.0000  390.826   9.9210  ?   ?  0.000000 9.921015 
1 1 1   23    7    8 o  597.010   7.2191  273.104   6.5968  294.754   8.9714  247.619   9.7337  619.955   9.4543  567.990   11.196 51.96399 14.65390 
1 1 1   23    7    9 o   75.487   21.101   4.5322   2.5328   4.7551   4.0315   4.3867   3.2555   80.885   27.372   76.173   24.552 4.712486 36.76979 
1 1 1   23    7   10 o  268.818   7.2148   55.375   2.9686   63.346   5.0093   51.060   3.6855  287.241   11.394  258.022   9.3319 29.21893 14.72753 
1 1 1   23    7   11 o  203.958   8.7924   31.899   2.7448   36.734   4.6609   29.331   3.3963  218.094   14.037  195.115   11.422 22.97896 18.09671 
1 1 1   23    7   12 o  655.601   6.5548  329.314   6.5776  349.422   10.205  315.022   8.6032  674.834   9.8795  640.930   8.7696 33.90363 13.21023 
1 1 1   23    7   13 o   70.086   20.984   3.8451   2.4273   10.823   4.7684   1.4046   2.8199  115.485   27.390   56.368   22.214 59.11694 35.26601 
1 1 1   23    7   14 o  144.694   11.723   16.190   2.5741   18.935   4.5530   14.901   3.1207  155.257   19.596  138.298   14.982 16.95886 24.66679 
1 1 1   23    7   15 o  507.686   6.5675  197.510   5.1034  211.093   7.9821  188.117   6.6373  524.420   9.9441  495.221   8.7563 29.19846 13.24986 
1 1 1   23    7   16 o  589.122   6.6621  265.980   6.0074  274.525   9.1384  259.478   7.9720  597.996   9.9840  581.553   8.9559 16.44354 13.41221 
1 1 1   23    7   17 o  402.727   6.9374  124.320   4.2764  123.515   6.7055  124.872   5.5521  400.958   10.926  403.406   8.9917 -2.447601 14.15016 
1 1 1   23    7   18 o  458.807   6.9449  161.365   4.8772  178.677   6.0343  128.751   8.2824  482.641   8.1684  408.949   13.232 73.69183 15.55002 
1 1 1   23    7   19 o  181.067   9.4642   25.239   2.6138   24.910   2.9589   26.409   5.5774  179.718   10.807  183.376   20.207 -3.657593 22.91487 
1 1 1   23    7   20 o   55.302   19.121   2.1485   1.9695   3.8604   2.4760  -0.8004   3.2496   70.171   21.236   49.999   21.981 20.17184 30.56330 
1 1 1   23    7   21 o  276.836   8.6287   58.824   3.6563   61.349   6.2618   57.517   4.5037  281.587   14.578  273.524   10.757 8.063354 18.11774 
1 1 1   23    7   22 o   94.193   10.505   6.9047   1.4888   5.9062   2.9234   7.2544   1.7300   85.406   22.169   96.344   11.991 -10.93814 25.20397 
1 1 1   23    7   23 o  162.639   7.2932   20.291   1.8156   20.379   3.5944   20.261   2.1037  161.775   14.676  162.230   8.5014 -0.4552155 16.96010 
1 1 1   23    7   24 o  109.173   10.437   9.2498   1.7227   1.0615   3.5329   11.804   1.9732   59.477   24.358  123.433   10.545 -63.95626 26.54318 
1 1 1   23    7   25 f  137.664   9.1749   14.627   1.9222   13.869   4.2625   14.821   2.1536  131.431   21.963  138.433   10.236 -7.002106 24.23171 
1 1 1   23    7   26 o  277.561   6.1944   59.077   2.6316   62.373   5.4566   58.078   3.0041  284.323   12.538  275.114   7.1340 9.208099 14.42576 
1 1 1   23    7   27 o  291.163   8.5596   65.143   3.8147   81.403   6.1103   54.758   4.8832  324.784   12.291  266.434   11.974 58.34958 17.15977 
1 1 1   23    7   28 o  191.395   7.9959   28.140   2.3424   32.983   4.8887   26.697   2.6687  205.554   15.656  186.056   9.4016 19.49818 18.26194 
1 1 1   23    7   29 f  112.159   13.443   9.8706   2.2618   16.895   4.7122   7.7681   2.5781  144.930   21.927   98.348   17.781 46.58300 28.23070 
1 1 1   23    7   30 o  234.174   7.8465   42.140   2.8125   48.186   5.4591   39.956   3.2814  248.813   14.396  227.820   9.4103 20.99228 17.19881 
1 1 1   23    7   31 o  138.300   11.004   14.853   2.3101   11.357   5.2685   15.685   2.5703  116.145   29.561  141.967   11.939 -25.82217 31.88096 
1 1 1   23    7   32 o  165.992   9.7457   21.305   2.4652   26.701   5.5918   20.003   2.7466  183.036   20.301  160.545   11.248 22.49030 23.20913 
1 1 1   23    7   33 o   68.828   22.537   3.6559   2.7374   15.038   8.3150   2.2724   2.8990  131.010   38.751   60.919   22.903 70.09026 45.01338 
1 1 1   23    7   34 o  120.925   14.098   11.516   2.5604   6.1572   5.9564   12.731   2.8358   91.331   33.090  127.031   14.866 -35.69987 36.27589 
1 1 1   23    7   35 o  249.632   9.0790   48.023   3.4690   41.945   7.4588   49.700   3.9186  228.778   21.554  253.749   10.089 -24.97115 23.79892 
1 1 1   23    7   36 o   49.762   20.616   0.6360   2.5692  -1.1662   7.1059   0.9070   2.7556   72.497   32.158   52.555   21.517 19.94209 38.69209 
1 1 1   23    7   37 o  160.363   12.858   20.106   3.1295   19.087   10.188   20.213   3.2885  143.601   42.989  160.615   13.502 -17.01399 45.05960 
1 1 1   23    7   38 o  283.084   9.6095   61.888   4.1638   54.081   8.1125   64.680   4.8516  259.753   20.573  289.005   10.967 -29.25241 23.31345 
1 1 1   23    7   39 o   58.852   22.929   1.8889   2.9756   4.6602   7.6973   1.4020   3.2265   90.042   36.292   57.999   23.455 32.04283 43.21168 
1 1 1   23    7   40 o  136.458   15.595   14.802   3.1987   13.843   8.1218   14.979   3.4800  123.309   38.670  136.815   16.983 -13.50585 42.23488 
1 1 1   23    7   41 o  187.689   13.627   27.676   3.8880   38.518   8.5381   24.840   4.3670  214.492   26.576  176.760   16.325 37.73201 31.18945 
1 1 1   23    7   42 o  108.823   20.943   9.8315   3.3618   1.7667   7.9129   11.608   3.7136   81.593   35.095  118.336   21.285 -36.74283 41.04573 
1 1 1   23    7   43 o  244.108   9.8083   46.196   3.6648   39.797   6.5095   49.165   4.4342  221.778   19.371  251.217   11.532 -29.43823 22.54335 
1 1 1   23    7   44 f   92.086   24.027   7.2898   3.4223   10.350   7.4280   6.4650   3.8559  106.557   37.117   86.724   26.555 19.83306 45.63777 
1 1 1   23    7   45 o   73.444   23.710   4.4762   3.0352   6.6639   4.0982   1.8185   4.5170   87.552   27.471   65.888   27.319 21.66313 38.74285 
1 1 1   23    7   46 o  234.463   9.1929   42.678   3.2991   41.225   4.6848   44.108   4.6467  228.224   13.471  236.421   12.889 -8.197296 18.64391 
1 1 1   23    7   47 o   49.649   21.211   0.3607   2.8555   0.8843   3.9348  -0.2218   4.1505   58.754   24.995   56.248   24.781 2.505520 35.19735 
1 1 1   23    7   48 o   58.883   23.110   2.1368   3.0402   1.9212   4.4562   2.3246   4.1583   64.789   27.022   65.007   26.502 -0.2179642 37.84883 
1 1 1   23    7   49 o  102.879   20.313   9.1041   3.0851   9.8984   4.0309   7.9809   4.7936  104.371   25.459   91.957   29.808 12.41396 39.20071 
1 1 1   23    7   50 o   72.960   25.504   4.6077   3.5086   3.1880   4.8035   6.2315   5.1371   69.721   28.461   82.830   30.616 -13.10902 41.80128 
1 1 1   23    7   51 f  138.317   14.255   15.579   2.9747   15.279   4.0618   15.925   4.3688  132.822   20.650  134.667   21.951 -1.845139 30.13737 
1 1 1   23    8    0 o  586.529   10.964  263.901   9.8353  263.901   9.8353  263.901   9.8353  586.529   10.964  586.529   10.964 0.000000 0.000000 
1 1 1   23    8    1 o  295.176   7.8220   66.770   3.5340   63.368   5.5498   69.090   4.5834  287.251   12.623  300.136   9.9770 -12.88467 16.08939 
1 1 1   23    8    2 o   68.931   15.609   3.8008   1.6086   0.0000   0.0000   3.8008   1.6086  ?   ?    68.931   15.609 0.000000 15.60933 
1 1 1   23    8    3 o  495.099   7.9487  187.859   6.0236  179.761   9.2244  193.879   7.9536  483.820   12.456  502.727   10.336 -18.90710 16.18619 
1 1 1   23    8    4 o  577.190   8.2848  255.355   7.3193  270.113   11.652  245.737   9.4068  592.997   12.838  565.903   10.860 27.09363 16.81503 
1 1 1   23    8    5 o  148.848   13.155   17.154   2.9663   24.122   6.7120   15.463   3.3067  174.396   25.934  140.908   15.593 33.48741 30.26094 
1 1 1   23    8    6 o  539.583   10.872  223.431   8.9796   0.0000   0.0000  223.431   8.9796  ?   ?   539.583   10.872 0.000000 10.87249 
1 1 1   23    8    7 o  261.770   14.706   52.874   5.8686   52.874   5.8686   0.0000   0.0000  261.770   14.706  ?   ?  0.000000 14.70646 
1 1 1   23    8    8 o  277.713   8.1194   59.119   3.4514   70.054   5.0303   49.392   4.7442  302.117   10.878  253.585   12.223 48.53235 16.36230 
1 1 1   23    8    9 o  363.478   7.5672  101.255   4.2100  109.063   5.8232   92.704   6.0937  377.024   10.091  347.473   11.457 29.55151 15.26753 
1 1 1   23    8   10 o  304.353   8.1136   71.012   3.7797   75.829   5.2335   65.759   5.4647  314.297   10.879  292.569   12.203 21.72751 16.34819 
1 1 1   23    8   11 o  299.514   8.5724   68.789   3.9300   69.908   5.2539   67.368   5.9214  301.716   11.377  296.023   13.069 5.693024 17.32674 
1 1 1   23    8   12 o  168.057   10.494   21.764   2.6859   19.256   4.4326   23.219   3.3763  156.764   18.851  173.324   12.817 -16.56026 22.79587 
1 1 1   23    8   13 o  336.465   7.6135   86.784   3.9210   91.678   7.3903   84.866   4.6257  345.147   13.989  332.611   9.0861 12.53656 16.68077 
1 1 1   23    8   14 o  147.724   11.790   16.876   2.6437   16.499   4.5806   17.064   3.2373  144.356   21.377  148.169   14.459 -3.813141 25.80768 
1 1 1   23    8   15 o   32.146   15.593  -4.0488   2.3930  -8.2907   4.3482  -2.2057   2.8661   41.681   20.394   41.878   19.299 -0.1968842 28.07728 
1 1 1   23    8   16 o  134.687   13.585   14.105   2.7623   17.952   4.9150   12.329   3.3397  150.483   21.987  125.039   17.966 25.44385 28.39396 
1 1 1   23    8   17 o  102.628   18.280   8.3881   2.7663   5.7100   4.9649   9.5938   3.3313   88.489   30.372  109.456   20.641 -20.96681 36.72210 
1 1 1   23    8   18 o  366.896   11.600  103.507   6.5146  103.507   6.5146   0.0000   0.0000  366.896   11.600  ?   ?  0.000000 11.60049 
1 1 1   23    8   19 o  261.288   6.5157   52.331   2.6058   57.716   3.3498   44.076   4.1470  274.298   7.9785  239.421   11.316 34.87689 13.84615 
1 1 1   23    8   20 o  364.270   6.5050  101.717   3.6269  111.733   5.0480   91.030   5.2146  381.545   8.6437  344.233   9.8969 37.31207 13.14008 
1 1 1   23    8   21 o  109.743   14.516   9.4532   2.3785   8.2394   3.2631   10.829   3.4742  100.928   21.763  116.393   20.236 -15.46510 29.71688 
1 1 1   23    8   22 o  319.766   7.0608   78.420   3.4559   82.487   6.8915   77.054   3.9944  326.979   13.770  316.846   8.2364 10.13333 16.04497 
1 1 1   23    8   23 o  269.197   6.7164   55.573   2.7674   56.682   4.1939   54.717   3.6831  271.524   10.091  266.900   9.0156 4.624298 13.53189 
1 1 1   23    8   24 o  135.983   11.978   14.356   2.4677   10.758   4.2586   16.175   3.0279  114.775   24.953  144.070   13.904 -29.29443 28.56484 
1 1 1   23    8   25 f  158.080   8.3209   19.244   2.0062   23.576   5.6193   18.611   2.1478  172.193   21.809  155.360   9.0715 16.83304 23.62085 
1 1 1   23    8   26 o  270.687   6.1282   56.189   2.5390   47.478   4.9499   59.299   2.9578  247.596   13.108  277.998   6.9512 -30.40244 14.83687 
1 1 1   23    8   27 o  202.177   9.0877   31.429   2.8123   39.433   4.8531   27.383   3.4507  225.285   14.146  188.006   12.055 37.27855 18.58551 
1 1 1   23    8   28 o  214.311   7.2696   35.263   2.3847   32.279   5.0706   36.110   2.7021  203.080   16.454  216.783   8.1435 -13.70332 18.35904 
1 1 1   23    8   29 o  159.770   9.0187   19.700   2.1965   27.508   5.0071   17.839   2.4442  186.919   17.712  151.766   10.588 35.15292 20.63589 
1 1 1   23    8   30 o   48.751   19.860   0.7763   2.3329  -1.1407   4.9475   1.3244   2.6454   60.911   26.934   54.149   21.459 6.761688 34.43795 
1 1 1   23    8   31 o  171.321   9.8669   22.692   2.5765   29.131   5.6388   20.993   2.8965  191.615   19.498  164.442   11.582 27.17278 22.67805 
1 1 1   23    8   32 o  101.405   16.688   8.2290   2.5000   4.9242   5.5395   9.0743   2.8016   85.211   31.733  106.297   17.852 -21.08619 36.41009 
1 1 1   23    8   33 o  105.072   16.317   8.8143   2.5390   15.165   8.2414   8.1483   2.6688  131.420   38.496  100.505   18.010 30.91461 42.50092 
1 1 1   23    8   34 o   53.837   21.512   1.2535   2.6788   1.3784   7.0548   1.2324   2.8957   79.078   33.549   55.278   22.267 23.80014 40.26585 
1 1 1   23    8   35 o  159.127   11.682   19.707   2.8256   19.406   7.4040   19.759   3.0569  149.864   33.156  159.107   12.657 -9.242828 35.48974 
1 1 1   23    8   36 o  218.375   9.2188   36.776   3.0814   39.315   8.1159   36.348   3.3308  219.619   24.564  216.950   10.030 2.669327 26.53310 
1 1 1   23    8   37 o  143.654   13.812   16.219   2.9995   10.052   10.286   16.792   3.1358  113.103   42.998  146.083   14.204 -32.97997 45.28305 
1 1 1   23    8   38 o   53.823   21.954   1.0459   2.8553  -3.8194   7.5811   1.8501   3.0822   68.793   31.585   59.341   23.275 9.451794 39.23430 
1 1 1   23    8   39 o  113.327   21.708   10.614   3.6285   5.5186   7.7134   12.062   4.1118   92.667   36.669  120.450   23.144 -27.78260 43.36163 
1 1 1   23    8   40 o   85.462   23.036   6.1208   3.0817   12.594   7.9347   4.9709   3.3442  118.215   38.354   78.103   24.853 40.11269 45.70220 
1 1 1   23    8   41 o   61.135   24.328   1.8825   3.4128  -1.3240   8.4955   2.4995   3.7268   77.203   34.640   65.722   25.645 11.48121 43.09979 
1 1 1   23    8   42 o  159.645   13.963   20.129   3.3776   18.318   7.2840   20.625   3.8123  142.245   33.930  160.979   15.671 -18.73419 37.37427 
1 1 1   23    8   43 o   74.437   24.359   4.5205   3.1982   2.4419   6.0393   5.3306   3.7702   75.504   31.471   80.270   26.457 -4.766724 41.11448 
1 1 1   23    8   44 o  143.296   16.980   16.591   3.6518   10.886   5.8039   20.330   4.6983  109.162   32.395  157.316   19.961 -48.15320 38.05135 
1 1 1   23    8   45 f   36.914   18.034  -5.8086   3.3619  -7.8869   7.1415  -5.2169   3.8105   57.846   27.778   41.598   20.055 16.24798 34.26106 
1 1 1   23    8   46 o  124.668   17.682   12.743   3.2795   12.239   5.5082   13.019   4.0819  115.232   30.683  123.700   22.382 -8.467781 37.97951 
1 1 1   23    8   47 o  164.301   13.230   21.475   3.2989   14.246   5.2094   26.315   4.2625  125.578   27.834  180.709   15.562 -55.13184 31.88875 
1 1 1   23    8   48 o  126.571   19.952   13.540   3.7373   6.7248   6.0787   17.682   4.7388   87.473   33.102  143.373   22.320 -55.90018 39.92435 
1 1 1   23    8   49 o  169.908   12.810   23.064   3.3071   20.170   4.9557   25.388   4.4404  152.986   21.778  175.792   16.703 -22.80676 27.44595 
1 1 1   23    8   50 o   81.587   23.670   6.0137   3.1292   7.7973   3.9485   3.0020   5.1309   91.276   26.620   69.991   29.076 21.28488 39.42191 
1 1 1   23    9    0 o  167.752   8.6406   21.726   2.2052   21.726   2.2052   21.726   2.2052  167.752   8.6406  167.752   8.6406 0.000000 0.000000 
1 1 1   23    9    1 o  295.300   5.7938   66.789   2.6187   70.897   5.2814   65.449   3.0156  303.915   11.353  292.284   6.7405 11.63101 13.20354 
1 1 1   23    9    2 o  280.096   6.5106   60.100   2.7912   0.0000   0.0000   60.100   2.7912  ?   ?   280.096   6.5106 0.000000 6.510621 
1 1 1   23    9    3 o  285.017   8.2197   62.268   3.5859   61.975   5.9358   62.436   4.4998  283.953   13.657  285.274   10.305 -1.320709 17.10913 
1 1 1   23    9    4 o  280.893   8.8282   60.495   3.7956   66.088   6.6534   57.797   4.6215  292.722   14.899  274.418   11.003 18.30426 18.52121 
1 1 1   23    9    5 o  136.205   14.488   14.428   2.9740   18.324   6.1015   13.214   3.4060  151.172   27.377  129.761   17.603 21.41092 32.54805 
1 1 1   23    9    6 o  481.572   8.4691  177.795   6.2426  216.278   10.665  157.738   7.6994  530.490   13.135  453.314   11.097 77.17587 17.19456 
1 1 1   23    9    7 o   93.679   26.784   7.0027   4.0333   7.0027   4.0333   0.0000   0.0000   93.679   26.784  ?   ?  0.000000 26.78400 
1 1 1   23    9    8 o  676.928   8.9932  351.413   9.3181  358.958   13.935  345.311   12.532  683.319   13.324  670.445   12.212 12.87390 18.07345 
1 1 1   23    9    9 o  131.571   16.150   13.535   3.1841   17.656   5.1613   11.002   4.0458  149.113   23.383  117.060   23.398 32.05299 33.07915 
1 1 1   23    9   10 o  401.407   7.7688  123.513   4.7732  117.889   6.2344  131.480   7.4198  391.910   10.393  413.723   11.717 -21.81274 15.66213 
1 1 1   23    9   11 o  388.057   7.9411  115.449   4.7168  124.142   6.3502  104.751   7.0447  402.160   10.316  369.168   12.467 32.99231 16.18202 
1 1 1   23    9   12 o  337.047   8.4319   87.118   4.3500   90.725   5.8349   82.606   6.5266  343.697   11.092  327.740   13.010 15.95657 17.09652 
1 1 1   23    9   13 o  258.094   10.960   51.162   4.3295   51.999   6.4456   50.474   5.8442  259.131   16.334  255.523   15.009 3.608505 22.18253 
1 1 1   23    9   14 o   84.842   20.037   5.7982   2.5604   5.4666   4.5161   5.9554   3.1083   85.997   28.971   86.038   23.111 -0.4133606E-01 37.06040 
1 1 1   23    9   15 o  202.045   9.6489   31.335   2.9840   32.562   5.0643   30.683   3.6932  204.764   16.293  199.391   12.159 5.372879 20.32994 
1 1 1   23    9   16 o  380.498   8.6878  111.081   5.0598  122.290   6.8473   97.598   7.5097  398.901   11.215  355.981   13.782 42.91928 17.76860 
1 1 1   23    9   17 o  176.544   14.118   24.169   3.7831   24.428   5.1612   23.868   5.5614  176.479   19.429  173.989   21.330 2.490677 28.85184 
1 1 1   23    9   18 o  188.527   12.819   27.488   3.6770   26.634   5.3305   28.263   5.0788  184.369   19.169  190.311   17.636 -5.942184 26.04758 
1 1 1   23    9   19 o  252.750   6.6482   48.973   2.5720   53.522   3.2884   41.805   4.1276  264.118   8.1343  233.126   11.568 30.99193 14.14119 
1 1 1   23    9   20 o  238.373   7.2421   43.578   2.6424   44.687   3.4473   41.998   4.1143  241.220   9.3368  233.642   11.505 7.578079 14.81663 
1 1 1   23    9   21 o  132.249   12.583   13.594   2.5163   11.509   3.5767   15.636   3.5408  120.055   20.180  141.161   16.712 -21.10632 26.20137 
1 1 1   23    9   22 f  298.688   9.5184   68.551   4.3516   71.585   10.400   67.907   4.7912  301.622   22.694  297.149   10.534 4.472992 25.01928 
1 1 1   23    9   23 o  124.607   12.864   12.099   2.4181   7.4953   4.1386   14.485   2.9796   95.971   27.025  136.159   14.521 -40.18844 30.67917 
1 1 1   23    9   24 o  187.207   8.9850   26.928   2.5746   30.532   4.1858   24.735   3.2653  198.326   13.876  178.749   12.004 19.57729 18.34823 
1 1 1   23    9   25 o  327.947   6.9370   82.516   3.4822   77.007   5.8959   85.468   4.3152  315.982   12.190  333.558   8.4519 -17.57556 14.83372 
1 1 1   23    9   26 f  316.936   6.7744   77.070   3.2863   75.082   5.3025   78.310   4.1876  312.155   11.098  319.233   8.5701 -7.077484 14.02172 
1 1 1   23    9   27 o  332.054   6.8435   84.615   3.4782   94.118   5.7407   79.104   4.3721  349.504   10.731  320.752   8.9053 28.75125 13.94490 
1 1 1   23    9   28 o   75.509   16.420   4.6037   1.8437   0.7103   4.7530   5.2933   2.0004   65.651   27.677   81.033   16.684 -15.38176 32.31643 
1 1 1   23    9   29 o  267.256   6.3743   54.810   2.6075   64.752   5.7785   52.268   2.9219  289.247   13.052  260.873   7.3177 28.37341 14.96329 
1 1 1   23    9   30 o  106.394   13.446   8.9055   2.1408   9.7799   5.1068   8.7190   2.3580  107.980   29.884  104.881   15.126 3.098633 33.49416 
1 1 1   23    9   31 o  248.816   8.5150   47.629   3.2429   51.862   6.0700   45.938   3.8362  257.661   15.463  244.071   10.269 13.58977 18.56191 
1 1 1   23    9   32 o  142.299   11.789   15.764   2.5445   16.427   5.8274   15.607   2.8284  140.213   28.131  141.278   13.234 -1.064636 31.08868 
1 1 1   23    9   33 o   90.639   19.892   6.7224   2.6840   16.671   8.4688   5.6114   2.8299  137.291   38.658   82.592   21.994 54.69931 44.47668 
1 1 1   23    9   34 o  240.107   8.1306   44.364   2.9881   57.856   7.7676   42.020   3.2372  270.366   18.889  233.525   9.0567 36.84100 20.94773 
1 1 1   23    9   35 o  217.870   8.8353   36.576   2.9464   46.782   7.9425   34.947   3.1727  241.450   21.724  212.808   9.7404 28.64139 23.80760 
1 1 1   23    9   36 o   99.197   17.586   7.9553   2.5724   16.624   7.9518   6.9420   2.7186  136.523   37.089   91.935   19.897 44.58743 42.08931 
1 1 1   23    9   37 o   55.986   21.789   1.6768   2.6850   2.0894   10.667   1.6489   2.7744   93.758   40.536   56.407   22.094 37.35063 46.16626 
1 1 1   23    9   38 o   40.524   18.756  -2.1088   2.7510  -2.5572   7.9065  -2.0470   2.9343   72.822   32.978   42.404   19.536 30.41778 38.32994 
1 1 1   23    9   39 o  105.515   23.565   9.3413   3.7097   11.259   8.3431   8.8688   4.1416  113.531   39.349  102.035   26.339 11.49604 47.35032 
1 1 1   23    9   40 o   58.283   22.982   1.7560   3.0201   1.5666   8.7581   1.7816   3.2175   84.882   36.715   59.603   23.652 25.27924 43.67383 
1 1 1   23    9   41 o   40.584   19.220  -3.4605   3.1811  -0.3952   7.4119  -4.1527   3.5220   74.437   32.939   41.865   19.941 32.57217 38.50459 
1 1 1   23    9   42 o  270.501   9.0228   56.595   3.7358   45.838   7.3638   60.323   4.3351  237.588   20.448  278.876   10.156 -41.28784 22.83156 
1 1 1   23    9   43 o  113.817   18.885   10.646   3.1746   5.2244   5.7595   13.012   3.8048   84.249   32.140  125.358   20.541 -41.10925 38.14316 
1 1 1   23    9   44 o   66.554   24.592   3.1780   3.3138  -2.8459   5.3606   6.9039   4.2159   57.227   26.379   89.072   27.849 -31.84495 38.35900 
1 1 1   23    9   45 o  108.145   21.302   9.8909   3.4007   6.8179   7.1727   10.782   3.8624   92.067   35.674  112.087   23.274 -20.01941 42.59455 
1 1 1   23    9   46 o   62.372   23.715   2.6268   3.1291  -1.7107   5.0596   5.3133   3.9819   57.658   26.216   79.384   27.202 -21.72662 37.77871 
1 1 1   23    9   47 o   48.809   21.725  -0.6231   3.2704  -8.8922   4.8830   6.1032   4.4040   42.881   21.107   83.432   28.607 -40.55172 35.55100 
1 1 1   23    9   48 o   48.423   21.746  -0.8448   3.3562  -3.4483   5.7134   0.5269   4.1471   56.528   26.453   58.020   25.180 -1.491394 36.52098 
1 1 1   23    9   49 o  107.265   20.334   9.9187   3.2163   9.3500   4.8168   10.376   4.3206   98.653   29.566  105.776   26.688 -7.122665 39.82927 
1 1 1   23    9   50 o   51.309   22.598  -0.0246   3.4484   0.0158   4.7480  -0.0698   5.0167   58.815   26.178   59.909   26.768 -1.093998 37.44073 
1 1 1   23   10    0 o   29.910   18.461   0.5081   1.6585   0.5081   1.6585   0.5081   1.6585   29.910   18.461   29.910   18.461 0.000000 0.000000 
1 1 1   23   10    1 o  601.915   6.1783  277.532   5.6921  279.242   10.114  276.739   6.8863  603.168   10.955  600.924   7.4868 2.243530 13.26877 
1 1 1   23   10    2 o  265.310   6.6637   53.929   2.7061   0.0000   0.0000   53.929   2.7061  ?   ?   265.310   6.6637 0.000000 6.663720 
1 1 1   23   10    3 o  353.018   7.9303   95.522   4.2851   98.728   6.5601   93.137   5.6592  358.539   11.954  348.370   10.613 10.16983 15.98537 
1 1 1   23   10    4 o  454.079   8.0484  158.053   5.5939  155.950   8.2918  159.809   7.5781  450.602   12.022  456.294   10.850 -5.692322 16.19464 
1 1 1   23   10    5 o  305.572   8.9644   71.606   4.1928   71.472   6.7936   71.688   5.3287  304.781   14.563  305.558   11.394 -0.7769165 18.49009 
1 1 1   23   10    6 o  295.071   16.121   67.274   7.2534   67.274   7.2534   0.0000   0.0000  295.071   16.121  ?   ?  0.000000 16.12093 
1 1 1   23   10    7 o  520.307   7.2577  207.471   5.7800  217.757   7.6725  193.973   8.7892  532.799   9.4081  502.584   11.425 30.21475 14.80039 
1 1 1   23   10    8 o  392.089   7.5833  117.836   4.5511  119.279   6.0466  115.951   6.9123  394.255   10.020  388.536   11.623 5.719147 15.34589 
1 1 1   23   10    9 o  396.506   7.7937  120.521   4.7300  123.236   6.2534  116.892   7.2310  400.708   10.196  390.029   12.113 10.67926 15.83241 
1 1 1   23   10   10 o  146.687   16.105   16.783   3.5565   14.983   5.6070   17.995   4.6005  136.072   27.859  151.133   20.409 -15.06056 34.53469 
1 1 1   23   10   11 o  482.508   9.0298  178.600   6.6688  192.279   10.196  168.373   8.8161  499.945   13.324  468.013   12.307 31.93219 18.13811 
1 1 1   23   10   12 f  275.814   9.4650   58.377   3.9958   65.906   5.4849   49.863   5.8331  292.794   12.239  253.944   15.075 38.85065 19.41721 
1 1 1   23   10   13 o  337.480   9.7869   87.425   5.0555   89.645   7.6601   85.711   6.7290  341.104   14.672  333.752   13.172 7.352112 19.71712 
1 1 1   23   10   14 o  151.048   15.054   17.759   3.4341   18.635   4.7381   16.790   4.9844  153.665   20.669  145.145   23.218 8.519470 31.08528 
1 1 1   23   10   15 o  113.120   20.826   10.237   3.4731   8.9493   4.8161   11.633   5.0133  105.028   29.003  119.429   27.924 -14.40155 40.26051 
1 1 1   23   10   16 o  431.453   8.3982  142.815   5.5461  154.183   7.4252  128.468   8.3413  447.933   10.830  408.448   13.342 39.48544 17.18431 
1 1 1   23   10   17 o  149.546   12.629   17.335   2.8638   16.917   4.9168   17.550   3.5232  145.665   22.800  149.986   15.574 -4.321136 27.61131 
1 1 1   23   10   18 o  151.696   17.558   18.046   4.0015   30.654   9.3492   15.219   4.4275  193.911   32.660  138.227   21.636 55.68425 39.17680 
1 1 1   23   10   19 o  328.758   6.6293   82.861   3.3359   90.246   4.6061   74.714   4.8377  342.872   8.7767  311.815   10.136 31.05740 13.40795 
1 1 1   23   10   20 o  202.921   8.8174   31.615   2.7387   36.924   3.8915   26.406   3.8549  218.727   11.666  184.527   13.747 34.20018 18.02973 
1 1 1   23   10   21 o  247.686   7.5918   47.069   2.8782   45.525   3.9192   48.877   4.2405  243.308   10.524  252.051   10.992 -8.743301 15.21725 
1 1 1   23   10   22 o  405.785   7.6477  126.357   4.7501  133.892   8.0006  122.255   5.9031  416.767   12.542  398.824   9.6700 17.94217 15.83687 
1 1 1   23   10   23 o   66.629   20.631   3.4624   2.3201   0.4311   4.2351   4.7621   2.7732   61.700   26.075   77.085   22.260 -15.38467 34.28406 
1 1 1   23   10   24 f  258.100   7.7029   51.137   3.0431   60.361   5.6460   47.360   3.6127  279.595   13.193  248.189   9.5101 31.40602 16.26334 
1 1 1   23   10   25 o  118.762   14.307   11.066   2.5483   15.196   4.9150   9.5475   2.9802  136.862   24.355  109.262   18.479 27.59980 30.57157 
1 1 1   23   10   26 o   81.320   19.860   5.3766   2.4507   6.2049   4.5655   5.0413   2.9046   89.039   29.103   79.050   22.768 9.989586 36.95069 
1 1 1   23   10   27 o  320.328   7.0346   78.766   3.4491   92.850   5.8550   71.282   4.2683  347.029   11.023  304.411   9.1606 42.61853 14.33246 
1 1 1   23   10   28 o  313.496   7.1452   75.463   3.4286   83.781   5.7959   70.986   4.2525  329.463   11.493  303.734   9.1470 25.72876 14.68896 
1 1 1   23   10   29 o   57.102   21.657   1.8943   2.6056  -5.3723   4.8128   4.9074   3.0991   49.832   23.612   78.209   23.778 -28.37703 33.51004 
1 1 1   23   10   30 o  354.853   9.7044   97.012   5.2709   99.264   6.4508   92.488   9.1431  358.392   11.759  343.534   17.445 14.85803 21.03865 
1 1 1   23   10   31 o  188.419   15.947   27.865   4.5561   32.082   5.9969   22.108   7.0068  200.992   19.748  162.889   29.175 38.10323 35.23001 
1 1 1   23   10   32 o  126.555   13.122   12.549   2.5049   8.5977   5.8971   13.419   2.7670  102.142   33.056  130.698   14.052 -28.55549 35.91928 
1 1 1   23   10   33 f  173.937   11.065   23.475   2.9305   33.392   8.8227   22.246   3.1069  200.156   29.699  169.077   12.085 31.07939 32.06352 
1 1 1   23   10   34 o  250.737   7.6979   48.357   2.9543   51.894   7.0490   47.604   3.2539  256.271   18.087  248.630   8.5503 7.641296 20.00577 
1 1 1   23   10   35 o   98.393   17.018   7.8003   2.4702   19.304   6.9791   6.1528   2.6412  150.064   31.393   86.437   20.308 63.62696 37.38922 
1 1 1   23   10   36 o   62.936   21.804   2.9143   2.5616   23.783   10.737   1.6548   2.6378  159.940   42.951   55.593   21.608 104.3467 48.08012 
1 1 1   23   10   37 o  195.010   10.164   29.479   3.0232   33.875   8.3525   28.816   3.2431  201.357   27.846  192.577   11.049 8.780182 29.95763 
1 1 1   23   10   38 f  144.434   13.441   16.396   2.9374   10.135   8.1315   17.336   3.1501  109.466   38.779  148.376   14.037 -38.91057 41.24118 
1 1 1   23   10   39 o  117.914   21.908   11.502   3.8084   26.814   8.4114   7.5531   4.2713  175.356   32.537   94.272   27.742 81.08411 42.75827 
1 1 1   23   10   40 o  134.295   14.978   14.323   3.0263   11.685   7.8702   14.781   3.2784  114.149   38.246  136.093   16.047 -21.94429 41.47619 
1 1 1   23   10   41 o  190.797   12.544   28.520   3.6429   24.141   7.6751   29.794   4.1388  165.827   31.388  194.483   13.997 -28.65511 34.36731 
1 1 1   23   10   42 o  172.530   12.446   23.369   3.2648   11.808   6.2822   27.647   3.8213  113.934   33.678  187.359   13.414 -73.42519 36.25119 
1 1 1   23   10   43 o   47.036   21.330  -1.4690   3.3209  -3.7485   5.4158  -0.0955   4.2040   55.778   25.986   57.712   25.195 -1.933617 36.19496 
1 1 1   23   10   44 o   83.786   23.134   6.0200   3.0644   7.6289   5.3876   5.2506   3.7258   93.229   31.642   79.206   26.310 14.02249 41.15151 
1 1 1   23   10   45 o  113.905   19.837   10.833   3.3328  -1.3022   7.0324   14.348   3.7848   68.866   31.152  131.686   19.355 -62.81979 36.67496 
1 1 1   23   10   46 f   79.973   23.871   5.5396   3.1446  -2.0655   4.9750   10.600   4.0581   56.167   25.713  109.867   24.729 -53.70048 35.67462 
1 1 1   23   10   47 o   42.543   19.711  -2.0312   3.0496   1.2764   4.9676  -4.0317   3.8633   64.975   27.873   43.962   20.924 21.01301 34.85324 
1 1 1   23   10   48 o   58.674   23.177   2.1211   3.0767   3.2143   4.8195   1.3692   3.9971   70.546   28.618   60.082   25.358 10.46370 38.23601 
1 1 1   23   10   49 o   47.070   20.911  -0.4211   3.0160   6.7198   4.7613  -5.2062   3.8976   84.992   29.710   41.476   20.067 43.51617 35.85196 
1 1 1   23   10   50 o   78.354   25.351   5.5873   3.4685  -2.7379   4.7311   15.262   5.1001   51.721   24.160  127.930   26.899 -76.20876 36.15627 
1 1 1   23   11    0 o  765.543   12.039  449.686   14.099  449.686   14.099  449.686   14.099  765.543   12.039  765.543   12.039 0.000000 0.000000 
1 1 1   23   11    1 o   98.934   10.250   7.5911   1.5296   6.2743   1.9540   9.6751   2.4581   89.117   14.847  111.159   14.816 -22.04114 20.97517 
1 1 1   23   11    2 o  246.763   6.2727   46.649   2.3692   49.783   2.8420   39.510   4.2896  254.872   7.2851  226.423   12.425 28.44881 14.40295 
1 1 1   23   11    3 o  359.883   5.7896   99.207   3.1892  100.171   3.7844   96.845   5.9240  361.564   6.8382  355.179   10.897 6.385254 12.86464 
1 1 1   23   11    4 o  305.366   8.5169   71.501   3.9808   73.316   5.9521   70.032   5.3546  308.868   12.590  301.967   11.585 6.901581 17.10918 
1 1 1   23   11    5 o  227.967   10.225   39.884   3.5678   37.693   5.6843   41.307   4.5829  220.441   16.977  231.442   12.989 -11.00079 21.37656 
1 1 1   23   11    6 o   91.779   31.445   6.1185   5.3212   6.1185   5.3212   0.0000   0.0000   91.779   31.445  ?   ?  0.000000 31.44508 
1 1 1   23   11    7 o  425.861   7.3583  139.004   4.7964  155.776   6.5508  119.621   7.0422  450.596   9.4981  394.608   11.659 55.98801 15.03834 
1 1 1   23   11    8 o  196.458   10.694   29.721   3.2036   35.021   4.4256   23.887   4.6434  212.922   13.651  175.048   17.567 37.87476 22.24810 
1 1 1   23   11    9 o  528.702   7.4844  214.274   6.0567  225.556   7.9312  198.490   9.3810  542.164   9.5574  508.198   12.060 33.96619 15.38792 
1 1 1   23   11   10 o  319.707   8.5304   78.395   4.1744   84.466   5.6001   70.803   6.2621  331.614   11.033  303.340   13.487 28.27429 17.42495 
1 1 1   23   11   11 o  264.021   9.8782   53.508   3.9920   49.434   5.1742   59.500   6.2747  253.103   13.404  277.504   14.826 -24.40112 19.98680 
1 1 1   23   11   12 o  200.045   14.095   30.969   4.2882   40.620   6.9875   25.138   5.4313  228.047   20.228  178.996   20.176 49.05026 28.56994 
1 1 1   23   11   13 o  294.921   14.447   67.020   6.5216   0.0000   0.0000   67.020   6.5216  ?   ?   294.921   14.447 0.000000 14.44707 
1 1 1   23   11   14 o  402.271   10.684  124.323   6.5786  111.998   10.854  131.480   8.2710  380.319   18.645  413.293   13.075 -32.97470 22.77263 
1 1 1   23   11   15 o  325.832   11.436   81.623   5.7033   84.507   9.4142   79.951   7.1685  329.762   18.729  322.025   14.544 7.737549 23.71241 
1 1 1   23   11   16 o  222.322   14.779   38.292   5.0007   36.103   8.5174   39.444   6.1774  212.908   26.725  224.984   18.091 -12.07591 32.27281 
1 1 1   23   11   17 o   57.980   22.024   1.8747   2.6973   6.3323   5.1748   0.2119   3.1606   91.922   31.012   53.208   22.508 38.71368 38.31890 
1 1 1   23   11   18 o  209.943   11.532   34.011   3.6915   37.861   5.5638   30.983   4.9338  220.614   16.598  199.513   16.299 21.10074 23.26259 
1 1 1   23   11   19 o  282.540   6.7950   61.211   2.9386   69.361   3.9050   50.570   4.4621  300.601   8.4871  256.368   11.371 44.23312 14.18929 
1 1 1   23   11   20 o   78.718   19.300   5.0079   2.3076   4.8919   3.1880   5.1356   3.3445   78.796   24.149   80.682   24.736 -1.886436 34.56895 
1 1 1   23   11   21 o  255.291   7.6667   50.012   2.9958   48.525   4.1167   51.685   4.3678  251.149   10.709  259.158   11.011 -8.009186 15.35988 
1 1 1   23   11   22 o  325.955   8.3869   81.586   4.1843   81.224   7.0598   81.783   5.1952  324.207   14.227  326.051   10.410 -1.843719 17.62845 
1 1 1   23   11   23 o  307.033   7.4190   72.347   3.4866   75.582   4.9200   69.083   4.9416  313.426   10.256  299.566   10.777 13.86020 14.87704 
1 1 1   23   11   24 o  302.991   7.3657   70.463   3.4160   80.699   6.1555   65.907   4.1063  323.389   12.436  292.802   9.1624 30.58676 15.44658 
1 1 1   23   11   25 o  243.793   8.7300   45.682   3.2577   56.648   7.0234   42.676   3.6771  269.329   17.126  235.451   10.203 33.87758 19.93517 
1 1 1   23   11   26 o  108.582   15.607   9.3329   2.5194   15.911   4.6283   6.5629   3.0033  140.554   22.254   89.579   22.052 50.97575 31.32965 
1 1 1   23   11   27 o  226.139   8.5014   39.317   2.9426   46.085   5.0567   35.851   3.6184  243.596   13.617  215.333   11.015 28.26256 17.51416 
1 1 1   23   11   28 o   59.167   21.833   2.2303   2.6104   9.9926   4.7164  -1.1977   3.1343  109.385   28.039   47.270   21.137 62.11568 35.11357 
1 1 1   23   11   29 o  146.573   14.628   16.844   3.2380   20.452   5.1390   14.469   4.1699  159.604   21.590  133.991   21.024 25.61244 30.13564 
1 1 1   23   11   30 o  185.731   14.977   26.993   4.2215   23.563   5.2871   33.025   7.0118  171.769   20.516  202.743   23.002 -30.97374 30.82202 
1 1 1   23   11   31 o  295.618   8.1596   67.218   3.6921   78.415   6.5584   62.024   4.4671  317.915   13.478  283.545   10.293 34.37036 16.95858 
1 1 1   23   11   32 o  355.631   7.6126   97.238   4.1439   97.426   7.0986   97.140   5.1037  354.392   13.086  355.029   9.3919 -0.6363525 16.10775 
1 1 1   23   11   33 o  346.440   8.7615   92.439   4.6460  115.032   10.740   87.238   5.1530  382.389   18.350  336.228   10.013 46.16104 20.90394 
1 1 1   23   11   34 o  122.243   21.245   12.186   3.8309   13.909   6.5008   11.270   4.7416  126.559   33.160  115.541   27.253 11.01841 42.92237 
1 1 1   23   11   35 o  333.388   8.3444   85.604   4.2581   95.218   7.7100   81.384   5.1077  349.428   14.415  324.538   10.282 24.89078 17.70679 
1 1 1   23   11   36 o   55.597   21.196   1.8088   2.5041   1.5669   7.8200   1.8364   2.6433   82.192   35.108   56.629   21.733 25.56296 41.28997 
1 1 1   23   11   37 o  308.358   7.5815   73.191   3.5783   78.966   8.7854   72.043   3.9181  315.475   18.272  305.735   8.3726 9.739807 20.09898 
1 1 1   23   11   38 o   62.857   22.097   2.8824   2.6355   15.958   7.8470   1.2199   2.7980  132.607   37.167   54.207   21.870 78.39987 43.12401 
1 1 1   23   11   39 o  114.362   22.167   10.866   3.7401   7.0158   7.1607   12.310   4.3859   95.904   36.007  120.959   24.528 -25.05482 43.56802 
1 1 1   23   11   40 o   88.468   21.725   6.5633   2.9203  -7.1078   7.4234   9.0664   3.1764   61.597   29.226  104.627   20.568 -43.03039 35.73811 
1 1 1   23   11   41 o  254.336   9.6783   50.103   3.7677   42.397   7.2537   52.950   4.4091  228.178   21.005  260.996   11.037 -32.81796 23.72795 
1 1 1   23   11   42 o   82.866   22.601   5.8179   2.9460   5.7355   5.5949   5.8495   3.4653   85.998   31.918   83.043   25.120 2.954910 40.61770 
1 1 1   23   11   43 o  119.040   18.764   11.653   3.3057   18.412   5.2966   7.3399   4.2309  147.172   24.365   91.625   27.766 55.54725 36.94077 
1 1 1   23   11   44 o   90.074   21.962   6.9364   3.0006   0.4327   5.2542   10.084   3.6554   64.938   28.263  108.652   22.711 -43.71374 36.25701 
1 1 1   23   11   45 o   65.225   24.897   2.8863   3.4575   7.0391   6.7268   1.3953   4.0307   91.601   34.784   61.438   25.668 30.16271 43.22943 
1 1 1   23   11   46 o   78.712   22.991   5.3695   2.9432   7.0670   4.8487   4.3791   3.7036   88.789   30.018   73.439   26.154 15.35002 39.81404 
1 1 1   23   11   47 o   85.584   23.951   6.5086   3.2611   4.4066   5.6638   7.5511   3.9887   77.940   31.231   91.013   26.816 -13.07335 41.16389 
1 1 1   23   11   48 o  134.517   14.892   14.719   3.0147   11.962   4.5134   16.939   4.0509  114.249   26.348  141.828   19.150 -27.57821 32.57177 
1 1 1   23   11   49 f   55.498   22.291   1.7547   2.8929   0.3236   4.4871   2.7727   3.7845   58.527   25.777   64.343   25.614 -5.815880 36.33893 
1 1 1   23   12    0 o  613.895   7.7503  288.797   7.2799  288.797   7.2799  288.797   7.2799  613.895   7.7503  613.895   7.7503 0.000000 0.000000 
1 1 1   23   12    1 o  382.684   5.7130  112.179   3.3464  121.598   5.8782  107.662   4.0704  398.096   9.6468  374.810   7.0950 23.28622 11.97499 
1 1 1   23   12    2 o  196.386   8.5609   29.576   2.5733   29.576   2.5733   0.0000   0.0000  196.386   8.5609  ?   ?  0.000000 8.560896 
1 1 1   23   12    3 o  303.484   7.1161   70.586   3.3056   70.586   3.3056   0.0000   0.0000  303.484   7.1161  ?   ?  0.000000 7.116070 
1 1 1   23   12    4 o  256.762   6.2864   50.510   2.4706   52.632   2.8645   44.347   4.8819  262.057   7.1413  239.753   13.356 22.30316 15.14559 
1 1 1   23   12    5 o  133.070   15.098   13.812   3.0208   9.2761   4.5856   17.289   4.0151  106.951   27.767  148.558   18.027 -41.60703 33.10544 
1 1 1   23   12    6 o  496.076   12.384  189.173   9.4031  189.173   9.4031   0.0000   0.0000  496.076   12.384  ?   ?  0.000000 12.38381 
1 1 1   23   12    7 o  267.961   10.297   55.123   4.2235   59.820   6.6823   51.999   5.4502  278.126   15.762  259.579   13.767 18.54633 20.92723 
1 1 1   23   12    8 o  160.984   13.081   20.065   3.1955   20.167   4.3268   19.943   4.7395  160.593   17.907  159.296   19.871 1.297592 26.74901 
1 1 1   23   12    9 o  260.572   9.4906   52.107   3.7852   56.553   5.0576   46.446   5.7073  271.217   12.183  245.002   15.296 26.21515 19.55468 
1 1 1   23   12   10 o   92.448   22.116   6.9035   3.0875   9.8974   4.1506   3.1943   4.6199  110.498   25.111   75.519   28.791 34.97935 38.20294 
1 1 1   23   12   11 o   93.061   22.829   7.0035   3.2272   9.8482   4.1841   2.8254   5.0706  110.169   25.340   76.198   29.863 33.97047 39.16550 
1 1 1   23   12   12 o  515.003   8.0928  203.425   6.3794  206.323   8.2628  199.149   10.038  518.287   10.416  508.710   12.891 9.577057 16.57303 
1 1 1   23   12   13 o  408.739   9.8330  128.284   6.1518  151.997   9.6244  111.904   7.9992  444.127   14.158  381.157   13.711 62.96976 19.70886 
1 1 1   23   12   14 o  234.156   12.689   42.323   4.5310   48.112   6.6635   37.345   6.1795  248.759   17.614  218.792   18.630 29.96741 25.63856 
1 1 1   23   12   15 o  128.384   21.518   13.159   4.0788   12.762   5.8934   13.524   5.6510  124.558   31.027  128.470   29.377 -3.911652 42.72795 
1 1 1   23   12   16 o  126.695   22.238   12.864   4.1552   10.070   5.9149   15.586   5.8385  111.292   32.617  138.193   28.547 -26.90089 43.34531 
1 1 1   23   12   17 o  160.179   16.006   20.028   3.8716   22.785   5.0321   16.028   6.0609  170.154   19.685  139.925   29.241 30.22894 35.24956 
1 1 1   23   12   18 o  118.996   13.911   11.069   2.4859   12.435   3.0615   8.4262   4.2590  125.763   16.287  101.599   26.946 24.16421 31.48613 
1 1 1   23   12   19 o  230.989   7.7374   40.941   2.7356   46.481   3.7156   34.383   4.0425  245.922   9.8711  210.864   12.582 35.05779 15.99232 
1 1 1   23   12   20 o   63.075   20.900   2.9634   2.3515   4.0866   3.3280   1.8434   3.3231   74.095   24.871   61.714   24.179 12.38048 34.68639 
1 1 1   23   12   21 o  133.790   12.851   13.931   2.5993   16.583   3.7934   11.584   3.5687  145.157   17.421  120.352   20.080 24.80480 26.58414 
1 1 1   23   12   22 o  294.484   8.8131   66.628   3.9725   64.420   6.7845   67.780   4.9003  288.005   15.447  296.730   10.789 -8.724731 18.84169 
1 1 1   23   12   23 o  233.502   8.7111   41.896   3.1134   47.606   4.5083   36.689   4.3047  248.484   11.853  217.602   12.984 30.88176 17.58063 
1 1 1   23   12   24 o  243.047   8.0977   45.374   3.0125   53.965   5.3344   41.352   3.6502  264.263   13.188  231.764   10.290 32.49921 16.72725 
1 1 1   23   12   25 o   39.634   18.149  -1.6631   2.4808   4.7858   5.0749  -3.6879   2.8437   83.579   30.503   37.389   17.839 46.19024 35.33650 
1 1 1   23   12   26 o  348.728   7.1066   93.365   3.7933  104.726   6.7255   88.064   4.5937  368.284   11.931  338.388   8.8690 29.89615 14.86622 
1 1 1   23   12   27 o   66.728   22.496   3.3240   2.7230   1.8103   4.5139   4.1900   3.4141   68.216   27.688   74.550   25.189 -6.333832 37.43143 
1 1 1   23   12   28 o  131.348   15.480   13.596   3.0525   20.990   4.9346   9.0128   3.8849  162.173   20.326  104.372   24.702 57.80085 31.98980 
1 1 1   23   12   29 o  214.413   12.457   35.688   4.0704   39.721   5.3577   30.183   6.2599  225.354   15.629  194.393   21.393 30.96078 26.49381 
1 1 1   23   12   30 o   83.676   22.065   5.7507   2.8664   1.4872   5.0539   7.7725   3.4803   69.768   28.910   96.925   23.665 -27.15705 37.36087 
1 1 1   23   12   31 o  380.525   7.3264  111.281   4.2672  121.093   7.2630  106.108   5.2734  395.564   11.996  371.107   9.2837 24.45682 15.16861 
1 1 1   23   12   32 o  253.026   9.3438   49.344   3.6188   53.119   6.5845   47.711   4.3316  260.054   16.629  248.377   11.394 11.67715 20.15793 
1 1 1   23   12   33 o  197.557   12.341   30.370   3.7131   23.809   9.5681   31.533   4.0289  163.396   38.830  201.094   13.162 -37.69832 40.99994 
1 1 1   23   12   34 o  281.759   9.0708   61.202   3.9119   54.313   6.9876   64.347   4.7212  262.304   17.505  288.498   10.691 -26.19418 20.51138 
1 1 1   23   12   35 o   64.366   25.094   2.2818   3.5660   7.1108   6.5715   0.2663   4.2455   96.026   34.762   60.233   25.801 35.79360 43.29084 
1 1 1   23   12   36 o  213.976   12.577   35.703   4.1010   33.853   9.4908   36.127   4.5475  198.557   32.342  214.811   13.905 -16.25323 35.20419 
1 1 1   23   12   37 o  317.551   9.1458   77.840   4.4454   71.799   7.7957   80.750   5.4114  301.410   16.967  322.834   10.951 -21.42331 20.19390 
1 1 1   23   12   38 o  272.590   10.091   57.495   4.2104   64.151   7.5833   54.528   5.0623  284.351   17.509  264.695   12.495 19.65640 21.50983 
1 1 1   23   12   39 o  148.591   17.180   17.681   3.8353   22.181   7.3583   16.002   4.4941  159.424   31.272  139.441   21.767 19.98247 38.10180 
1 1 1   23   12   40 o  172.394   11.966   23.252   3.1379   14.715   7.2984   25.188   3.4756  126.591   35.972  179.199   12.755 -52.60782 38.16677 
1 1 1   23   12   41 o  226.280   10.231   39.734   3.5435   26.772   6.1354   46.222   4.3407  179.764   22.812  243.560   11.643 -63.79643 25.61137 
1 1 1   23   12   42 o  174.958   13.064   24.129   3.4734   24.585   5.5199   23.830   4.4690  172.578   21.352  172.061   17.200 0.5173798 27.41808 
1 1 1   23   12   43 o  150.747   13.496   18.016   3.0810   11.907   5.2239   21.275   3.8152  115.030   29.522  163.055   15.472 -48.02453 33.33054 
1 1 1   23   12   44 o   50.640   21.721   0.2615   3.0162  -5.2416   5.0960   3.2287   3.7420   50.474   24.026   68.242   25.937 -17.76830 35.35454 
1 1 1   23   12   45 o   50.616   21.866   0.1504   3.0984  -5.6935   6.5478   1.8364   3.5170   57.750   27.415   60.372   24.462 -2.622501 36.74208 
1 1 1   23   12   46 o   98.279   20.372   8.2494   2.9639   8.2588   4.8592   8.2439   3.7402   94.461   29.948   96.043   25.147 -1.582504 39.10540 
1 1 1   23   12   47 o  179.238   12.362   25.535   3.3708   16.434   5.8035   30.169   4.1409  132.508   29.384  193.865   14.050 -61.35695 32.57040 
1 1 1   23   12   48 o   78.036   22.976   5.4126   2.9290  -0.9356   4.6844   9.4877   3.7532   56.221   25.429  102.499   24.294 -46.27721 35.16829 
1 1 1   23   12   49 o  109.679   18.611   10.237   3.0127   7.1154   4.7795   12.295   3.8807   86.485   29.793  118.007   22.302 -31.52219 37.21569 
1 1 1   23   13    0 o   43.753   26.737   1.2781   3.4022   1.2781   3.4022   1.2781   3.4022   43.753   26.737   43.753   26.737 0.000000 0.000000 
1 1 1   23   13    1 o  167.791   9.9576   21.685   2.5459   21.685   2.5459   0.0000   0.0000  167.791   9.9576  ?   ?  0.000000 9.957601 
1 1 1   23   13    2 o  276.345   6.6163   58.520   2.7986   57.097   3.2782   62.342   5.3735  272.893   7.8483  284.776   12.328 -11.88260 14.61410 
1 1 1   23   13    3 o  333.787   6.3445   85.368   3.2414   88.880   3.8499   76.817   6.0077  340.510   7.3867  316.097   12.417 24.41370 14.44803 
1 1 1   23   13    4 o  320.626   7.4084   78.804   3.6357   78.804   3.6357   0.0000   0.0000  320.626   7.4084  ?   ?  0.000000 7.408368 
1 1 1   23   13    5 o  389.899   7.1607  116.525   4.2735  116.525   4.2735   0.0000   0.0000  389.899   7.1607  ?   ?  0.000000 7.160735 
1 1 1   23   13    6 o  150.852   15.171   17.712   3.4554   17.157   5.0450   18.202   4.7424  146.810   23.224  151.823   20.967 -5.012421 31.28829 
1 1 1   23   13    7 o  382.009   9.0466  111.969   5.2897  116.233   7.7936  108.327   7.2027  388.671   13.101  375.304   12.538 13.36655 18.13381 
1 1 1   23   13    8 o  491.335   7.6104  185.095   5.7234  201.598   7.5249  162.444   8.8158  512.493   9.5927  459.566   12.533 52.92651 15.78256 
1 1 1   23   13    9 o  210.703   11.093   34.206   3.5649   37.936   4.6824   29.063   5.4985  221.522   13.880  192.870   18.867 28.65208 23.42249 
1 1 1   23   13   10 o   45.180   20.576  -1.9365   3.1324   1.0468   4.0958  -6.1401   4.8619   63.442   26.133   49.215   23.438 14.22628 35.10365 
1 1 1   23   13   11 o  648.328   7.9280  322.375   7.8673  336.820   10.088  299.947   12.570  662.286   9.9511  624.197   13.156 38.08875 16.49578 
1 1 1   23   13   12 o  106.572   24.261   9.2133   3.8687   2.4837   5.5579   15.539   5.3883   77.279   30.948  138.653   26.353 -61.37418 40.64765 
1 1 1   23   13   13 o  448.626   8.2888  154.415   5.6917  156.257   7.1558  151.244   9.3910  450.976   10.367  443.009   13.849 7.967224 17.29947 
1 1 1   23   13   14 o  269.633   10.318   55.863   4.2584   56.834   5.3286   54.145   7.0839  271.675   12.814  263.878   17.641 7.797394 21.80354 
1 1 1   23   13   15 o   70.446   25.731   3.2059   3.6121   5.2190   4.5349  -0.2877   5.9741   84.514   29.026   70.468   30.402 14.04656 42.03311 
1 1 1   23   13   16 o  401.999   10.448  124.224   6.4289  127.904   9.2257  120.751   8.9637  407.007   14.809  395.462   14.809 11.54419 20.94283 
1 1 1   23   13   18 o  242.217   9.4558   45.076   3.5057   48.387   4.1226   36.432   6.6621  250.811   10.739  215.298   20.462 35.51292 23.10896 
1 1 1   23   13   19 o  236.618   9.3561   43.020   3.3886   43.719   3.8836   40.790   6.9357  238.394   10.643  227.935   20.085 10.45834 22.73057 
1 1 1   23   13   20 o   94.113   17.950   7.1034   2.4913   7.9908   3.6835   6.3553   3.3823   98.867   24.473   88.466   24.254 10.40034 34.45523 
1 1 1   23   13   21 o  145.776   14.216   16.580   3.1317   17.765   5.9318   16.122   3.6875  147.509   27.277  143.101   17.178 4.407776 32.23550 
1 1 1   23   13   22 o  180.337   10.306   25.109   2.8330   30.953   4.0808   19.672   3.9362  199.720   13.427  158.376   16.479 41.34416 21.25644 
1 1 1   23   13   23 o  106.083   17.220   8.9672   2.7001   7.9854   4.0085   9.7826   3.6533   98.539   26.145  109.643   22.522 -11.10411 34.50848 
1 1 1   23   13   24 o  105.789   18.440   8.9739   2.8773   15.759   4.6755   4.8381   3.6504  139.793   22.624   79.230   26.029 60.56302 34.48738 
1 1 1   23   13   25 o   74.633   22.519   4.4450   2.7873   1.4645   4.2380   6.7170   3.7001   65.353   26.712   90.570   25.570 -25.21760 36.97782 
1 1 1   23   13   26 o   62.359   21.350   2.8389   2.4531   6.6246   4.3772   1.1056   2.9619   90.665   28.382   55.350   22.441 35.31569 36.18174 
1 1 1   23   13   27 o  134.685   13.723   14.200   2.7895   22.279   5.4187   11.287   3.2537  166.698   21.756  118.760   18.502 47.93804 28.55958 
1 1 1   23   13   28 o   55.097   22.945   0.6788   3.2060   1.0992   4.6367   0.2936   4.4379   66.132   27.571   62.063   26.477 4.068920 38.22558 
1 1 1   23   13   29 o  149.926   14.026   17.595   3.1812   15.156   5.0616   19.188   4.0899  135.663   25.307  155.707   17.462 -20.04486 30.74630 
1 1 1   23   13   30 o  130.311   15.028   13.386   2.9426   19.105   5.3677   10.929   3.5184  153.186   23.655  116.063   20.558 37.12309 31.33960 
1 1 1   23   13   31 o  185.734   11.380   26.771   3.2195   29.995   5.9252   25.420   3.8351  193.868   20.267  180.326   14.004 13.54153 24.63503 
1 1 1   23   13   32 o  138.455   15.438   15.136   3.2159   8.2286   6.0680   17.834   3.7923  100.366   33.583  150.024   16.803 -49.65741 37.55251 
1 1 1   23   13   33 o  145.003   16.140   16.645   3.5213   27.570   9.1926   14.767   3.8121  178.213   34.949  135.635   18.873 42.57762 39.71931 
1 1 1   23   13   34 o  116.902   19.570   11.086   3.3779   8.9553   7.0400   11.724   3.8501  104.384   36.147  119.527   21.849 -15.14349 42.23745 
1 1 1   23   13   35 o   85.535   24.063   6.0873   3.2828   6.6274   6.9263   5.9308   3.7282   94.864   35.453   84.858   26.133 10.00607 44.04350 
1 1 1   23   13   36 o  141.557   19.962   16.223   4.2052   26.038   7.7022   12.054   5.0193  174.941   29.834  118.720   28.064 56.22077 40.95980 
1 1 1   23   13   37 o   74.536   26.967   4.0326   3.9539   12.380   6.8632  -0.1142   4.8373  117.971   35.278   62.392   27.136 55.57934 44.50722 
1 1 1   23   13   38 o  126.725   19.842   13.095   3.7224   20.150   7.0025   10.317   4.3947  152.075   31.132  109.854   26.453 42.22104 40.85245 
1 1 1   23   13   39 o  188.033   13.501   27.781   3.8598   37.484   7.2949   24.009   4.5486  213.879   22.627  173.239   17.389 40.64085 28.53665 
1 1 1   23   13   40 f  260.007   10.533   52.477   4.1917   52.944   6.7254   52.180   5.3602  257.681   17.149  257.714   13.637 -0.3250122E-01 21.91058 
1 1 1   23   13   41 o  119.374   25.998   12.299   4.6157   19.348   5.5436  -3.6300   8.3338  151.186   24.817   71.185   32.841 80.00056 41.16302 
1 1 1   23   13   42 o  182.216   14.610   26.381   4.0406   24.262   5.4342   29.001   6.0427  171.310   21.175  187.285   21.467 -15.97540 30.15336 
1 1 1   23   13   43 o  138.624   18.801   15.772   3.8862   13.295   5.1826   18.955   5.8741  122.153   28.277  147.323   27.046 -25.16985 39.12921 
1 1 1   23   13   44 o   88.394   24.994   6.8375   3.5325   5.8665   5.0932   7.7376   4.9035   84.159   30.582   92.949   30.150 -8.789902 42.94521 
1 1 1   23   13   45 o  111.949   19.420   10.512   3.2070   4.6648   6.6431   12.289   3.6620   82.394   33.533  120.633   20.570 -38.23902 39.33991 
1 1 1   23   13   46 o   82.634   22.896   6.0040   2.9958   5.1328   4.8286   6.5493   3.8198   78.960   29.583   85.342   26.480 -6.382057 39.70345 
1 1 1   23   13   47 o  242.702   9.7481   46.077   3.6213   33.100   6.0184   53.441   4.5338  198.111   20.127  260.360   11.377 -62.24910 23.11980 
1 1 1   23   13   48 o  103.590   19.753   9.2360   3.0177   7.5081   4.7456   10.409   3.9101   88.813   29.699  107.233   24.375 -18.42000 38.42126 
1 1 1   23   14    0 o  626.695   11.808  301.547   11.317  301.547   11.317  301.547   11.317  626.695   11.808  626.695   11.808 0.000000 0.000000 
1 1 1   23   14    1 o  225.936   7.8012   39.141   2.6978   37.638   3.1495   43.284   5.2283  221.467   9.2911  236.604   14.507 -15.13715 17.22694 
1 1 1   23   14    2 o  452.503   6.4048  156.907   4.4360  159.633   5.3444  150.868   7.9540  456.293   7.6522  443.041   11.729 13.25204 14.00470 
1 1 1   23   14    3 o  518.193   6.5033  205.779   5.1581  211.514   6.2711  193.785   9.0697  525.210   7.8008  502.097   11.801 23.11258 14.14661 
1 1 1   23   14    4 o   81.106   20.999   5.2948   2.6273   5.2948   2.6273   0.0000   0.0000   81.106   20.999  ?   ?  0.000000 20.99863 
1 1 1   23   14    5 f  163.027   11.518   20.528   2.8556   20.528   2.8556   0.0000   0.0000  163.027   11.518  ?   ?  0.000000 11.51763 
1 1 1   23   14    6 o  182.817   10.434   25.752   2.9077   25.752   2.9077   0.0000   0.0000  182.817   10.434  ?   ?  0.000000 10.43437 
1 1 1   23   14    7 o   59.323   21.274   2.3240   2.4543   2.3240   2.4543   0.0000   0.0000   59.323   21.274  ?   ?  0.000000 21.27376 
1 1 1   23   14    8 o  440.299   7.9625  148.684   5.3662  169.473   6.9687  118.398   8.4110  469.833   9.6904  392.027   14.017 77.80603 17.04073 
1 1 1   23   14    9 o  547.403   7.8054  229.808   6.5399  249.782   8.5178  201.126   10.207  570.359   9.7569  511.143   13.047 59.21606 16.29153 
1 1 1   23   14   10 o  469.223   8.0169  168.882   5.7578  181.939   7.4601  149.644   9.0552  486.715   10.014  440.791   13.421 45.92374 16.74543 
1 1 1   23   14   11 o  457.126   8.2208  160.316   5.7520  173.094   7.3249  139.762   9.2899  474.703   10.081  425.774   14.255 48.92865 17.45944 
1 1 1   23   14   12 o  281.228   12.334   60.872   5.3093   62.032   7.5779   59.754   7.4410  282.539   17.610  277.280   17.624 5.259247 24.91447 
1 1 1   23   14   13 o  266.126   6.9197   54.302   2.8187   57.596   3.0746   36.950   7.0570  274.048   7.3298  216.787   21.553 57.26062 22.76543 
1 1 1   23   14   14 o  128.328   19.807   13.084   3.7653   10.189   4.5868   19.068   6.5933  111.598   27.119  152.932   29.232 -41.33434 39.87432 
1 1 1   23   14   15 o  313.863   6.6508   75.529   3.1951   76.436   3.4844   70.738   8.0088  315.691   7.2110  301.656   17.420 14.03534 18.85304 
1 1 1   23   14   16 o  150.564   7.9539   17.444   1.8265   17.825   1.8991   12.753   6.6712  152.176   8.1833  124.007   34.090 28.16904 35.05799 
1 1 1   23   14   17 o  151.805   12.640   17.882   2.9104   17.882   2.9104   0.0000   0.0000  151.805   12.640  ?   ?  0.000000 12.64041 
1 1 1   23   14   18 o  120.063   15.311   11.326   2.7498   11.890   3.0172   8.5617   6.6808  122.822   16.464  105.040   35.238 17.78216 38.89405 
1 1 1   23   14   19 o  431.491   7.6778  142.896   5.0708  145.037   5.9510  137.221   9.6886  434.490   8.9483  421.143   15.030 13.34619 17.49211 
1 1 1   23   14   20 o  292.383   13.403   66.021   5.9981   69.269   8.6138   62.964   8.3574  297.561   19.012  283.519   19.374 14.04221 27.14424 
1 1 1   23   14   21 o  109.749   16.235   9.5399   2.6450   9.3216   3.7383   9.7586   3.7429  106.833   23.500  109.444   23.070 -2.610596 32.93165 
1 1 1   23   14   22 o  240.417   8.2380   44.402   3.0315   51.412   4.2010   36.787   4.3789  258.376   10.623  217.801   13.197 40.57480 16.94132 
1 1 1   23   14   23 o  270.861   7.8041   56.349   3.2355   61.730   4.5067   50.624   4.6479  283.110   10.400  256.138   11.855 26.97186 15.77057 
1 1 1   23   14   24 o  226.182   9.4681   39.369   3.2779   42.064   4.9154   37.211   4.3987  232.665   13.865  218.946   13.187 13.71925 19.13516 
1 1 1   23   14   25 o   98.591   16.581   7.7668   2.4133   14.597   4.0256   3.9352   3.0152  134.995   20.095   71.735   23.661 63.25972 31.04292 
1 1 1   23   14   26 o  222.861   9.9259   38.263   3.3859   41.215   4.6148   34.821   4.9831  230.366   13.142  211.053   15.535 19.31281 20.34803 
1 1 1   23   14   27 o  195.352   11.479   29.573   3.4174   29.196   4.6631   30.012   5.0228  192.995   15.928  195.385   16.963 -2.390488 23.26920 
1 1 1   23   14   28 o  101.668   18.756   8.3501   2.8111   14.415   5.1967   5.8411   3.3424  131.795   26.676   84.524   24.446 47.27062 36.18358 
1 1 1   23   14   29 o   73.925   23.808   4.2889   3.0618   8.9834   5.2098   1.8118   3.7843  103.549   30.684   63.798   25.541 39.75077 39.92311 
1 1 1   23   14   30 o   55.273   22.048   1.3439   2.8094   1.4999   4.8694   1.2661   3.4396   68.673   28.411   59.174   24.111 9.498806 37.26288 
1 1 1   23   14   31 o  111.202   18.149   9.9500   2.9826   10.303   5.4911   9.8024   3.5522  110.000   31.183  109.238   22.006 0.7623215 38.16587 
1 1 1   23   14   32 o  121.992   17.562   11.910   3.1848   18.694   6.8646   10.049   3.5951  147.849   31.309  110.545   22.021 37.30360 38.27721 
1 1 1   23   14   33 o  132.495   17.989   14.055   3.5538   29.835   12.035   12.547   3.7197  179.233   44.155  124.342   20.241 54.89165 48.57353 
1 1 1   23   14   34 o   42.835   19.809  -2.2999   3.0589 -10.4447   5.6120   1.1427   3.6486   46.720   22.923   59.712   24.639 -12.99124 33.65326 
1 1 1   23   14   35 o  139.163   17.088   15.455   3.5633   16.012   7.3133   15.282   4.0804  134.189   35.177  137.361   19.994 -3.171371 40.46238 
1 1 1   23   14   36 o  152.811   16.310   18.553   3.7560   11.583   7.3183   21.045   4.3763  114.595   36.798  162.262   17.920 -47.66622 40.92921 
1 1 1   23   14   37 o   87.489   26.900   6.4016   3.9521   11.783   6.6601   3.4767   4.9099  115.156   34.823   75.570   29.450 39.58521 45.60657 
1 1 1   23   14   38 o   94.978   26.934   7.7138   4.0959   11.692   6.6801   5.3172   5.1849  114.264   34.946   84.092   30.811 30.17202 46.58873 
1 1 1   23   14   39 o  174.952   14.358   24.174   3.8111   17.068   6.5005   27.896   4.7044  138.859   31.330  187.075   16.602 -48.21593 35.45644 
1 1 1   23   14   40 o   67.439   27.882   1.8402   4.6853   3.2881   5.5164  -1.9087   8.8765   76.409   30.750   76.843   34.857 -0.4341431 46.48140 
1 1 1   23   14   41 o   83.331   28.985   5.7021   4.5292   3.7831   5.2641   11.172   8.8870   76.918   30.338  110.270   40.347 -33.35268 50.48083 
1 1 1   23   14   42 o   80.521   25.856   5.4886   3.6131   1.8629   5.3622   8.5037   4.8899   70.109   29.468   97.598   29.907 -27.48920 41.98573 
1 1 1   23   14   43 o  153.527   16.087   18.990   3.7241   12.075   5.3360   25.557   5.1999  115.176   29.978  176.324   19.599 -61.14783 35.81559 
1 1 1   23   14   44 o   80.011   27.131   5.4485   3.9608   5.0407   6.9213   5.6470   4.8298   84.777   34.328   82.369   29.804 2.407249 45.46122 
1 1 1   23   14   45 o   38.435   18.713  -5.5774   3.5335  -5.3071   4.9559  -5.8569   5.0394   48.930   23.402   48.481   23.295 0.4487190 33.01950 
1 1 1   23   14   46 o   82.583   25.419   6.1089   3.5279   4.2625   4.8098   8.2590   5.1903   74.871   29.156   93.418   31.055 -18.54707 42.59647 
1 1 1   23   14   47 o   79.064   26.500   5.5999   3.7784   5.3599   5.5688   5.8047   5.1434   80.271   31.341   81.391   30.525 -1.120750 43.74940 
1 1 1   23   14   48 f  102.093   24.967   9.5580   3.8690   0.9349   5.5092   17.950   5.4348   64.967   28.589  139.843   26.357 -74.87524 38.88537 
1 1 1   23   15    0 o   95.574   21.816   8.0323   2.7807   8.0323   2.7807   8.0323   2.7807   95.574   21.816   95.574   21.816 0.000000 0.000000 
1 1 1   23   15    1 o  127.537   13.578   12.664   2.6099   11.356   2.9941   16.800   5.3253  120.133   16.738  144.741   24.937 -24.60810 30.03382 
1 1 1   23   15    2 o  108.372   16.112   9.2586   2.5912   9.4644   2.9872   8.6332   5.2080  109.115   18.550  103.688   30.668 5.427902 35.84158 
1 1 1   23   15    3 o  173.886   10.451   23.308   2.7687   23.456   3.2096   22.880   5.4735  174.223   12.111  170.309   21.475 3.914352 24.65441 
1 1 1   23   15    4 o  285.117   9.0353   62.386   3.9431   62.386   3.9431   0.0000   0.0000  285.117   9.0353  ?   ?  0.000000 9.035295 
1 1 1   23   15    5 o  399.455   6.9587  122.319   4.2546  125.944   5.0389  113.315   7.9411  405.209   8.1243  383.591   13.525 21.61798 15.77769 
1 1 1   23   15    6 f   94.290   18.929   7.1279   2.6370   7.3496   2.9880   6.3472   5.6078   95.454   21.020   93.351   32.265 2.103172 38.50775 
1 1 1   23   15    7 o  317.843   7.7047   77.477   3.7483   77.059   4.3225   78.747   7.5267  316.871   8.9122  319.438   15.394 -2.566742 17.78754 
1 1 1   23   15    8 o  542.912   7.1869  225.999   5.9723  225.999   5.9723   0.0000   0.0000  542.912   7.1869  ?   ?  0.000000 7.186921 
1 1 1   23   15    9 o  275.743   8.2420   58.336   3.4786   58.336   3.4786   0.0000   0.0000  275.743   8.2420  ?   ?  0.000000 8.241979 
1 1 1   23   15   10 o  513.870   6.4673  202.409   5.0868  214.455   5.7476  158.868   10.927  528.855   7.1003  453.505   15.742 75.34961 17.26927 
1 1 1   23   15   11 o  328.349   5.6907   82.614   2.8600   84.383   3.0755   71.302   7.7770  331.818   6.0555  303.127   16.828 28.69077 17.88430 
1 1 1   23   15   12 o  473.202   5.2590  171.558   3.8091  173.515   4.1117  159.715   10.115  475.854   5.6452  454.922   14.526 20.93188 15.58470 
1 1 1   23   15   13 o  301.145   5.5063   69.491   2.5381   71.711   2.6953   52.112   7.5412  305.900   5.7566  258.319   19.210 47.58115 20.05425 
1 1 1   23   15   14 f  333.729   5.4308   85.343   2.7741   86.403   2.9468   77.090   8.2246  335.771   5.7338  314.984   17.123 20.78644 18.05797 
1 1 1   23   15   15 o   63.060   15.903   3.1958   1.5348   3.1792   1.5759   3.5021   6.7567   62.917   16.250   86.082   34.238 -23.16476 37.89896 
1 1 1   23   15   16 o  273.236   6.2152   57.237   2.5993   57.237   2.5993   0.0000   0.0000  273.236   6.2152  ?   ?  0.000000 6.215196 
1 1 1   23   15   17 f  276.554   7.6484   58.694   3.2376   62.121   3.5261   40.291   8.1717  284.465   8.0984  225.215   24.078 59.24933 25.40367 
1 1 1   23   15   18 o   82.697   19.434   5.5396   2.4183   5.3277   2.5992   6.9053   6.5972   81.055   20.836   97.803   34.899 -16.74781 40.64553 
1 1 1   23   15   19 o  250.823   12.357   48.526   4.7442   51.910   6.0208   42.983   7.7050  258.455   15.287  233.200   21.841 25.25502 26.65932 
1 1 1   23   15   20 o  174.234   11.117   23.480   2.9492   24.385   3.2169   18.710   7.3844  177.437   11.914  149.382   33.161 28.05487 35.23612 
1 1 1   23   15   21 o  334.482   8.6711   85.984   4.4393   86.865   5.0235   82.841   9.4853  336.003   9.7677  325.147   19.144 10.85535 21.49148 
1 1 1   23   15   22 o  213.041   9.1518   34.907   2.9843   42.504   4.3121   27.923   4.1343  234.357   12.062  189.337   14.373 45.02036 18.76377 
1 1 1   23   15   23 f   38.734   17.890  -1.9358   2.4838  -2.0232   3.7558  -1.8679   3.3112   49.878   22.644   46.666   21.215 3.211960 31.02897 
1 1 1   23   15   24 o  241.644   8.5945   44.902   3.1788   50.478   4.4520   39.102   4.5404  255.753   11.373  224.379   13.279 31.37440 17.48371 
1 1 1   23   15   25 o  150.961   15.477   17.897   3.5256   19.255   3.9147   12.066   8.1121  156.345   16.613  119.838   38.769 36.50738 42.17892 
1 1 1   23   15   26 o  433.865   7.1508  144.573   4.7488  156.078   6.2954  129.384   7.2333  450.296   9.1339  409.281   11.546 41.01483 14.72237 
1 1 1   23   15   27 o  349.730   6.9597   93.932   3.7256  103.248   5.6675   86.844   4.9439  365.956   10.118  335.744   9.6203 30.21176 13.96153 
1 1 1   23   15   28 o  102.530   18.973   8.5060   2.8679   9.6478   4.3590   7.6345   3.8082  107.411   26.643   95.851   25.508 11.55963 36.88473 
1 1 1   23   15   29 o  270.218   9.1310   56.246   3.7766   60.448   5.9593   53.425   4.8822  278.575   14.021  262.703   12.142 15.87170 18.54745 
1 1 1   23   15   30 o  388.720   7.4096  116.159   4.4086  130.692   7.5069  108.508   5.4469  410.863   11.937  375.167   9.4854 35.69650 15.24676 
1 1 1   23   15   31 o  125.529   16.505   12.534   3.0944   24.288   6.0339   8.3399   3.6045  172.817   23.414  100.100   23.862 72.71622 33.43093 
1 1 1   23   15   32 o   89.005   23.750   6.5887   3.2957   15.711   8.9170   5.1454   3.5468  132.259   40.361   80.056   25.608 52.20299 47.79953 
1 1 1   23   15   33 o  121.813   17.196   11.877   3.1170   9.9492   5.6295   12.730   3.7432  107.660   31.895  125.201   20.222 -17.54060 37.76517 
1 1 1   23   15   34 o   93.176   22.530   7.2332   3.1779   14.229   5.7742   4.1933   3.8062  128.604   29.900   75.097   26.539 53.50652 39.97934 
1 1 1   23   15   35 o   73.600   25.090   4.1798   3.3876  -0.9418   6.4214   6.1548   3.9876   69.072   30.607   86.315   27.100 -17.24282 40.88070 
1 1 1   23   15   36 o  130.606   18.146   13.741   3.5295   15.883   6.2721   12.749   4.2697  134.995   31.008  123.763   23.396 11.23180 38.84419 
1 1 1   23   15   37 o  139.689   16.863   15.616   3.5326   10.669   6.4174   17.766   4.2314  109.882   34.360  148.253   19.091 -38.37109 39.30693 
1 1 1   23   15   38 o   49.119   22.519  -2.2295   3.8346   1.9721   6.1553  -4.8944   4.9021   75.163   31.581   50.585   23.928 24.57770 39.62237 
1 1 1   23   15   39 o  215.958   12.942   36.594   4.2584   28.652   6.1399   43.956   5.9111  186.703   21.901  234.976   16.541 -48.27313 27.44566 
1 1 1   23   15   40 o  129.085   29.588   14.774   5.7211   14.774   5.7211   0.0000   0.0000  129.085   29.588  ?   ?  0.000000 29.58836 
1 1 1   23   15   41 o   83.082   25.842   5.8940   3.6354  -2.5139   5.4891   12.464   4.8521   58.806   26.954  119.116   27.209 -60.31018 38.29938 
1 1 1   23   15   42 o   68.933   25.861   3.3822   3.6923   6.2025   5.5447   1.1351   4.9493   86.906   31.859   65.604   27.974 21.30183 42.39695 
1 1 1   23   15   43 o   62.247   25.067   2.0501   3.6687   1.6637   5.5267   2.3545   4.9053   69.636   29.623   69.242   28.570 0.3949127 41.15543 
1 1 1   23   15   44 o  210.066   14.604   35.312   4.6666   19.462   8.0260   43.407   5.7358  139.367   37.004  231.808   16.269 -92.44125 40.42257 
1 1 1   23   15   45 o   61.848   24.806   2.2309   3.5766   0.5101   5.0115   4.0174   5.1062   62.650   27.426   74.999   29.785 -12.34892 40.48820 
1 1 1   23   15   46 o   83.510   26.660   6.3323   3.8456   4.5528   5.6074   7.9125   5.2840   77.680   31.093   91.297   31.333 -13.61658 44.14240 
1 1 1   23   15   47 f  149.261   17.817   18.594   3.9900   25.472   5.8486   12.605   5.4571  170.605   22.982  113.437   30.687 57.16896 38.33879 
1 1 1   23   16    0 o  225.770   18.657   40.037   6.3460   40.037   6.3460   40.037   6.3460  225.770   18.657  225.770   18.657 0.000000 0.000000 
1 1 1   23   16    1 o  384.340   7.2236  113.260   4.2495  109.416   4.9549  123.951   8.2634  377.619   8.5726  401.152   13.458 -23.53290 15.95637 
1 1 1   23   16    2 o   62.044   21.819   2.6493   2.5698   3.1628   2.8989   0.7652   5.5531   66.918   23.194   71.329   29.985 -4.410980 37.90865 
1 1 1   23   16    3 o  283.782   9.4180   61.829   4.0909   61.829   4.0909   0.0000   0.0000  283.782   9.4180  ?   ?  0.000000 9.418031 
1 1 1   23   16    4 o   57.730   21.930   1.8537   2.6742   2.7258   2.9894  -1.6404   5.9835   64.693   23.442   66.916   29.604 -2.222847 37.76100 
1 1 1   23   16    5 o  315.209   7.8554   76.211   3.7900   76.112   4.3497   76.526   7.7232  314.889   9.0247  314.322   16.107 0.5668335 18.46287 
1 1 1   23   16    6 o   86.551   21.614   6.0583   2.8548   6.8552   3.2070   3.0164   6.2656   91.973   22.876   82.530   32.925 9.442780 40.09166 
1 1 1   23   16    7 o  131.709   15.243   13.567   3.0162   11.418   3.3655   22.334   6.7988  119.930   18.964  166.412   27.663 -46.48178 33.53922 
1 1 1   23   16    8 o  114.671   15.262   10.327   2.6123   11.220   2.8495   5.6244   6.5398  119.469   15.983   93.160   34.522 26.30888 38.04224 
1 1 1   23   16    9 o  254.544   7.9976   49.711   3.1160   49.414   3.4363   51.086   7.3905  253.710   8.8488  255.876   19.006 -2.165741 20.96486 
1 1 1   23   16   10 o  418.300   8.6701  134.316   5.5511  134.316   5.5511   0.0000   0.0000  418.300   8.6701  ?   ?  0.000000 8.670126 
1 1 1   23   16   11 o  484.887   8.5034  180.474   6.3111  180.474   6.3111   0.0000   0.0000  484.887   8.5034  ?   ?  0.000000 8.503415 
1 1 1   23   16   12 o  398.147   5.6552  121.483   3.4464  121.483   3.4464   0.0000   0.0000  398.147   5.6552  ?   ?  0.000000 5.655214 
1 1 1   23   16   13 o   88.483   11.567   6.1275   1.5291   6.1237   1.5622   6.2135   7.4589   88.410   11.842   98.129   36.768 -9.719231 38.62770 
1 1 1   23   16   14 o  256.402   6.0162   50.395   2.3611   49.984   2.4612   55.142   8.3638  255.334   6.2975  265.095   20.779 -9.761444 21.71223 
1 1 1   23   16   15 o   57.916   16.432   2.6659   1.5241   2.6078   1.5593   3.9105   7.2138   57.439   16.722   89.193   35.408 -31.75378 39.15830 
1 1 1   23   16   16 o  206.123   7.0478   32.594   2.2236   32.594   2.2236   0.0000   0.0000  206.123   7.0478  ?   ?  0.000000 7.047767 
1 1 1   23   16   17 o  225.868   13.069   39.507   4.4988   42.194   5.5681   34.456   7.6347  232.851   15.715  207.774   24.476 25.07748 29.08666 
1 1 1   23   16   18 o  162.069   17.989   20.679   4.3873   16.660   5.3026   29.402   7.8115  143.306   25.088  190.522   27.590 -47.21588 37.29097 
1 1 1   23   16   19 o  112.647   15.271   10.007   2.5652   10.613   2.7558   6.0705   7.0203  115.921   15.954   95.539   35.695 20.38250 39.09830 
1 1 1   23   16   20 o  315.163   7.8452   76.284   3.7845   78.752   4.2031   65.712   8.6987  320.112   8.5783  289.190   19.770 30.92194 21.55124 
1 1 1   23   16   21 o  249.380   8.9889   47.825   3.4311   49.783   3.7594   38.060   8.3953  254.339   9.6569  217.423   25.725 36.91629 27.47829 
1 1 1   23   16   22 o  276.437   8.7181   58.760   3.6888   63.296   4.0857   38.757   8.5804  286.812   9.3067  219.091   26.100 67.72165 27.71007 
1 1 1   23   16   23 o  128.704   17.080   13.129   3.2817   13.416   3.6024   11.727   7.9566  129.704   18.685  118.545   38.401 11.15871 42.70517 
1 1 1   23   16   24 o  325.353   9.3031   81.482   4.6329   82.086   5.2327   79.293   9.9658  326.304   10.477  316.761   20.668 9.542511 23.17172 
1 1 1   23   16   25 o  278.861   8.4506   59.807   3.6070   62.297   4.9519   56.993   5.2646  284.037   11.390  271.389   12.674 12.64774 17.03984 
1 1 1   23   16   26 o   42.110   18.781  -0.9007   2.4577  -0.8180   3.7880  -0.9609   3.2298   53.741   23.676   48.843   21.672 4.898045 32.09695 
1 1 1   23   16   27 o  153.195   11.713   18.248   2.7256   22.162   4.1670   15.321   3.6034  167.725   16.443  138.936   17.321 28.78914 23.88236 
1 1 1   23   16   28 o  218.044   10.089   36.673   3.3673   38.236   5.1184   35.480   4.4711  221.046   15.221  213.327   13.766 7.719833 20.52284 
1 1 1   23   16   29 o  162.777   12.282   20.638   3.0376   21.830   4.9950   19.938   3.8264  165.091   20.188  159.034   15.934 6.056442 25.71823 
1 1 1   23   16   30 o  151.534   13.744   17.992   3.1531   20.677   5.5267   16.697   3.8391  159.298   23.361  144.822   17.687 14.47643 29.30098 
1 1 1   23   16   31 o  323.749   8.2716   80.698   4.0989   81.149   6.8127   80.442   5.1315  322.940   13.783  322.678   10.390 0.2617798 17.26003 
1 1 1   23   16   32 o  230.581   11.152   41.156   3.9359   43.061   8.7703   40.676   4.4043  229.328   25.413  228.531   12.640 0.7973785 28.38286 
1 1 1   23   16   33 o  324.527   8.1708   81.118   4.0587   99.316   6.5701   69.888   5.1613  357.771   11.998  300.377   11.226 57.39374 16.43058 
1 1 1   23   16   34 o  331.125   8.1813   84.477   4.1465   86.316   6.5708   83.259   5.3453  333.064   12.889  327.970   10.648 5.094330 16.71845 
1 1 1   23   16   35 o   53.148   22.684   0.2367   3.2600   1.4152   6.0138  -0.2538   3.8795   73.415   31.051   55.771   24.279 17.64394 39.41597 
1 1 1   23   16   36 o  209.028   11.673   34.049   3.7199   41.465   6.1552   29.781   4.6689  228.159   17.765  193.963   15.865 34.19594 23.81839 
1 1 1   23   16   37 o  252.540   10.101   49.400   3.9044   51.262   6.5617   48.379   4.8580  253.991   16.976  248.708   12.805 5.283447 21.26370 
1 1 1   23   16   38 o  192.554   14.214   29.252   4.1598   24.776   6.1341   33.063   5.6601  172.499   23.872  202.772   18.438 -30.27347 30.16373 
1 1 1   23   16   39 o  138.856   24.030   16.267   4.9224   17.418   5.7175   12.969   9.6762  141.991   27.299  117.354   42.224 24.63734 50.28004 
1 1 1   23   16   40 o   97.764   27.089   8.3824   4.1934   7.8081   5.6331   9.0963   6.2805   94.705   32.354  100.843   34.164 -6.138397 47.05276 
1 1 1   23   16   41 o   59.031   24.393   1.3439   3.5838  -2.9960   5.7574   4.0891   4.5790   59.129   27.285   75.456   28.688 -16.32735 39.59121 
1 1 1   23   16   42 o   66.239   25.472   2.9173   3.6356   0.0785   5.6492   4.9244   4.7499   65.739   28.939   79.332   29.416 -13.59253 41.26492 
1 1 1   23   16   43 o  107.267   27.033   10.344   4.4367  -1.8256   7.9143   15.922   5.3577   70.903   32.449  133.705   27.107 -62.80254 42.28200 
1 1 1   23   16   44 o   66.486   26.919   2.5714   4.2553  -0.7950   7.5435   4.1426   5.1535   70.723   32.101   75.894   29.991 -5.171028 43.93112 
1 1 1   23   16   45 o   42.020   20.235  -4.8634   3.8522 -10.9249   5.6148   0.5274   5.2950   44.487   22.034   63.783   28.049 -19.29533 35.66843 
1 1 1   23   16   46 o  170.256   17.502   24.019   4.4960   9.8069   6.9152   34.425   5.9174   98.249   35.645  202.450   19.331 -104.2008 40.54961 
1 1 1   23   17    0 o   70.455   38.197   5.5566   5.7814   5.5566   5.7814   5.5566   5.7814   70.455   38.197   70.455   38.197 0.000000 0.000000 
1 1 1   23   17    1 o  398.014   8.7320  121.591   5.3196  121.591   5.3196   0.0000   0.0000  398.014   8.7320  ?   ?  0.000000 8.731997 
1 1 1   23   17    2 o  617.532   8.7752  292.712   8.2945  292.712   8.2945   0.0000   0.0000  617.532   8.7752  ?   ?  0.000000 8.775229 
1 1 1   23   17    3 o  175.834   11.581   23.886   3.0994   23.073   3.5545   26.465   6.3307  172.496   13.572  182.715   23.156 -10.21964 26.84050 
1 1 1   23   17    4 o  106.174   18.319   8.9795   2.8695   6.8863   3.2252   16.931   6.2862   92.136   22.954  143.880   29.534 -51.74306 37.40483 
1 1 1   23   17    5 o  235.500   9.7846   42.604   3.5270   41.132   4.0343   47.378   7.2647  231.240   11.398  246.254   19.432 -15.01352 22.52790 
1 1 1   23   17    6 o  255.056   9.2335   49.956   3.6047   51.079   4.0827   45.985   7.6776  257.795   10.347  242.166   20.918 15.62851 23.33737 
1 1 1   23   17    7 o   91.688   21.973   6.8162   3.0435   9.7346   3.3869  -5.4248   6.9366  110.080   20.865   64.136   29.719 45.94373 36.31230 
1 1 1   23   17    8 o  321.092   7.3791   79.081   3.6266   80.088   4.0193   74.672   8.4123  323.052   8.1285  309.848   17.813 13.20316 19.57967 
1 1 1   23   17    9 f  196.902   9.6424   29.788   2.9061   28.110   3.1364   39.971   7.7267  190.884   10.779  225.025   22.745 -34.14130 25.17013 
1 1 1   23   17   10 o  446.961   7.5796  153.268   5.1855  154.671   5.9749  148.985   10.438  448.827   8.6973  438.946   15.536 9.881165 17.80467 
1 1 1   23   17   11 o  279.863   7.7116   60.099   3.3034   61.826   3.5755   50.032   8.6332  283.804   8.2309  251.911   22.631 31.89214 24.08175 
1 1 1   23   17   12 o  260.836   7.9831   52.219   3.1872   54.548   3.4222   36.988   8.7517  266.550   8.3881  214.728   27.240 51.82176 28.50250 
1 1 1   23   17   13 o  167.286   11.152   21.635   2.8392   21.635   2.8392   0.0000   0.0000  167.286   11.152  ?   ?  0.000000 11.15207 
1 1 1   23   17   14 o  366.895   7.5712  103.305   4.2518  103.305   4.2518   0.0000   0.0000  366.895   7.5712  ?   ?  0.000000 7.571187 
1 1 1   23   17   15 o  214.809   9.4163   35.470   3.0960   35.470   3.0960   0.0000   0.0000  214.809   9.4163  ?   ?  0.000000 9.416273 
1 1 1   23   17   16 o   41.252   16.602   0.6121   1.6082   0.1206   1.6475   10.560   7.4117   38.586   16.282  114.242   37.068 -75.65611 40.48666 
1 1 1   23   17   17 o  217.339   8.4880   36.290   2.8237   36.685   2.9975   33.176   8.4133  218.471   8.9639  202.378   27.902 16.09383 29.30689 
1 1 1   23   17   18 o   95.880   17.067   7.3540   2.4129   6.8211   2.5302   12.706   8.0188   91.940   18.618  123.310   38.384 -31.37077 42.66082 
1 1 1   23   17   19 o  249.414   8.5214   47.809   3.2531   48.026   3.4864   46.352   9.0456  249.902   9.1146  240.648   24.919 9.254044 26.53332 
1 1 1   23   17   20 o  143.752   12.844   16.096   2.7964   17.658   2.9730   4.1044   8.2363  150.581   13.027   92.910   37.509 57.67190 39.70645 
1 1 1   23   17   21 f  177.546   11.184   24.409   3.0238   24.271   3.2312   25.383   8.5784  176.883   12.006  173.655   33.487 3.227890 35.57437 
1 1 1   23   17   22 o  336.094   8.7773   86.884   4.5154   87.296   4.9805   84.977   10.701  336.713   9.6636  327.701   21.452 9.011993 23.52850 
1 1 1   23   17   23 o  249.594   9.5805   47.971   3.6601   48.967   3.9574   42.079   9.6244  252.059   10.258  226.988   28.317 25.07057 30.11775 
1 1 1   23   17   24 o  200.612   11.329   31.170   3.4645   33.374   3.7523   18.437   9.0194  207.487   11.864  144.971   39.549 62.51587 41.29062 
1 1 1   23   17   25 o  183.835   10.885   26.174   3.0493   22.826   4.0224   30.697   4.6757  170.545   15.581  197.981   15.555 -27.43689 22.01636 
1 1 1   23   17   26 o   63.671   22.545   2.8572   2.7482   2.2412   3.7608   3.5629   4.0258   65.630   25.719   73.265   27.098 -7.634865 37.36017 
1 1 1   23   17   27 o  198.542   9.8639   30.395   2.9976   31.269   4.5716   29.736   3.9702  199.850   15.056  195.334   13.359 4.516388 20.12802 
1 1 1   23   17   28 o  262.207   8.8652   52.951   3.5580   53.841   5.2295   52.184   4.8548  263.457   12.968  259.567   12.219 3.890076 17.81832 
1 1 1   23   17   29 o  158.095   12.185   19.477   2.9259   24.618   4.6210   16.036   3.7802  176.357   17.343  141.862   17.801 34.49457 24.85263 
1 1 1   23   17   30 o   87.300   21.342   6.2951   2.8279   7.3010   4.4749   5.6262   3.6488   93.711   28.591   83.164   25.893 10.54697 38.57301 
1 1 1   23   17   31 o  109.618   22.441   9.9303   3.6384   20.423   11.485   8.7598   3.8360  147.446   45.944  102.229   24.774 45.21742 52.19798 
1 1 1   23   17   32 o  238.790   9.9819   44.053   3.6484   47.401   6.1270   42.213   4.5412  245.236   16.418  232.713   12.798 12.52318 20.81673 
1 1 1   23   17   33 o  117.737   17.728   11.158   3.0957   15.757   5.1639   8.5781   3.8678  137.284   25.514  100.852   25.143 36.43187 35.82109 
1 1 1   23   17   34 o  279.397   9.5299   60.306   4.0755   68.047   7.1969   56.652   4.9447  293.870   16.061  270.076   11.962 23.79443 20.02580 
1 1 1   23   17   35 o  201.622   11.788   31.690   3.6221   33.725   6.0075   30.528   4.5401  204.923   19.383  196.694   15.198 8.229248 24.63098 
1 1 1   23   17   36 o  271.386   10.702   57.120   4.4454   61.235   6.5121   53.529   6.0831  278.680   15.326  260.505   15.323 18.17484 21.67221 
1 1 1   23   17   37 o   69.274   25.900   3.2829   3.6971   3.0075   5.5336   3.5050   4.9690   75.795   30.694   75.402   29.559 0.3930283 42.61258 
1 1 1   23   17   38 o  133.704   21.984   14.869   4.3426   9.7408   5.5910   22.668   6.8946  104.566   31.969  161.555   28.945 -56.98891 43.12548 
1 1 1   23   17   39 o  208.743   12.967   34.284   4.1227   31.319   5.8278   37.254   5.8329  196.029   19.689  215.047   17.883 -19.01833 26.59793 
1 1 1   23   17   40 o  107.951   23.193   9.9601   3.7181   9.8867   5.8170   10.011   4.8346  104.136   32.738  105.794   28.994 -1.658073 43.73131 
1 1 1   23   17   41 o  127.677   22.170   13.773   4.1755   11.483   6.0234   15.892   5.7933  111.000   33.016  133.096   29.237 -22.09610 44.10066 
1 1 1   23   17   42 o   71.344   25.609   4.0025   3.5575   3.9549   5.3644   4.0398   4.7530   76.717   30.509   75.120   29.058 1.596680 42.13315 
1 1 1   23   17   43 o  108.711   23.379   10.320   3.7746   10.395   5.5845   10.256   5.1216  104.551   31.948  104.668   30.258 -0.1170578 44.00273 
1 1 1   23   17   44 o  126.069   24.828   14.107   4.6203   17.910   10.275   13.144   5.1729  124.476   43.637  118.830   28.752 5.645485 52.25740 
1 1 1   23   17   45 o   98.968   24.123   8.8045   3.6211   0.3577   5.0295   17.895   5.2176   61.775   27.245  141.605   24.986 -79.82988 36.96711 
1 1 1   23   17   46 o   42.780   20.366  -3.6976   3.6642  -6.8730   5.4552  -1.0874   4.9460   48.616   23.574   57.115   25.951 -8.499100 35.05944 
1 1 1   23   18    1 o  271.262   12.350   56.668   5.1275   62.879   6.9854   49.411   7.5504  284.683   16.097  251.335   19.787 33.34834 25.50737 
1 1 1   23   18    2 o  169.913   12.108   22.339   3.1284   19.961   3.5170   31.350   6.8464  160.167   14.503  199.030   22.890 -38.86308 27.09838 
1 1 1   23   18    3 o  433.263   7.4568  143.994   4.9451  146.017   5.8325  138.821   9.3261  436.108   8.7375  424.085   14.367 12.02341 16.81560 
1 1 1   23   18    4 o  244.523   9.5405   45.934   3.5708   44.408   4.0785   50.945   7.3900  240.266   11.090  255.398   19.041 -15.13158 22.03515 
1 1 1   23   18    5 o  461.105   7.5528  163.112   5.3306  165.649   6.2601  156.421   10.167  464.476   8.8054  450.024   14.760 14.45200 17.18664 
1 1 1   23   18    6 o  345.774   8.1501   91.761   4.3134   95.425   4.9889   80.911   8.5847  352.467   9.2474  322.601   17.451 29.86618 19.74936 
1 1 1   23   18    7 o  122.499   17.409   11.858   3.1724   13.497   3.5613   5.5594   6.9815  130.637   18.314   94.171   35.514 36.46537 39.95814 
1 1 1   23   18    8 o  417.541   6.9363  133.710   4.4330  135.230   4.9715  127.809   9.7930  419.800   7.7371  406.437   15.742 13.36298 17.54042 
1 1 1   23   18    9 o  210.973   11.120   34.348   3.5781   33.331   4.0027   38.390   7.9822  207.564   12.659  219.891   24.112 -12.32686 27.23296 
1 1 1   23   18   10 o  170.460   11.212   22.461   2.9091   24.979   3.1526   8.0243   7.5491  179.751   11.519  104.858   37.341 74.89279 39.07732 
1 1 1   23   18   11 o  408.045   6.9869  127.720   4.3638  131.518   4.8381  111.151   10.106  413.974   7.6354  378.378   17.449 35.59579 19.04643 
1 1 1   23   18   12 o  324.349   7.4446   80.730   3.6960   79.809   4.0001   86.107   9.6638  322.413   8.1056  331.969   19.099 -9.555878 20.74815 
1 1 1   23   18   13 o  251.273   8.3996   48.492   3.2305   50.400   3.4652   35.811   8.9313  256.122   8.8390  210.417   28.461 45.70493 29.80234 
1 1 1   23   18   14 o  189.793   10.655   27.815   3.0828   27.815   3.0828   0.0000   0.0000  189.793   10.655  ?   ?  0.000000 10.65494 
1 1 1   23   18   15 o  103.967   11.691   8.4353   1.8282   8.4353   1.8282   0.0000   0.0000  103.967   11.691  ?   ?  0.000000 11.69106 
1 1 1   23   18   16 o  106.552   11.813   8.8607   1.8942   8.8607   1.8942   0.0000   0.0000  106.552   11.813  ?   ?  0.000000 11.81316 
1 1 1   23   18   17 o  101.526   15.234   8.1632   2.2943   8.1632   2.2943   0.0000   0.0000  101.526   15.234  ?   ?  0.000000 15.23374 
1 1 1   23   18   18 o  302.590   7.6225   70.315   3.5304   71.215   3.8046   64.742   9.4706  304.442   8.1646  286.072   21.793 18.36963 23.27188 
1 1 1   23   18   19 o  281.279   8.1212   60.797   3.4965   60.727   3.7360   61.288   9.9244  281.036   8.6851  277.354   23.602 3.682434 25.14934 
1 1 1   23   18   20 o   47.441   19.970   0.2829   2.4685   0.8547   2.5904  -5.3684   8.1434   51.307   20.917   70.144   32.396 -18.83731 38.56233 
1 1 1   23   18   21 o  384.563   8.3930  113.705   4.9403  119.045   5.5510   93.363   10.834  393.302   9.2210  343.909   20.678 49.39398 22.64076 
1 1 1   23   18   22 o  155.177   14.731   18.859   3.4569   18.287   3.7113   22.607   9.4997  152.433   16.153  160.917   38.981 -8.483917 42.19485 
1 1 1   23   18   23 o  347.486   9.0860   92.940   4.8326   98.754   5.3706   68.206   11.077  358.023   9.8004  291.282   25.090 66.74164 26.93595 
1 1 1   23   18   24 o   49.060   21.124  -0.1135   2.8726  -0.9420   3.0019   8.8874   9.8950   46.961   20.863  111.127   42.191 -64.16649 47.06687 
1 1 1   23   18   25 o   67.010   23.457   3.2399   2.9684   1.6728   3.1064   19.708   10.070   58.999   23.294  148.289   42.294 -89.29043 48.28475 
1 1 1   23   18   26 o  108.475   16.830   9.4041   2.7038   6.3264   3.5122   13.881   4.2362   87.615   24.974  130.675   21.958 -43.05955 33.25482 
1 1 1   23   18   27 o  277.987   8.1273   59.456   3.4581   63.375   4.7458   55.020   5.0493  286.414   10.825  266.485   12.379 19.92871 16.44480 
1 1 1   23   18   28 f  130.080   13.813   13.297   2.7081   19.533   4.0287   8.1561   3.6578  157.009   17.037   98.934   24.325 58.07503 29.69828 
1 1 1   23   18   29 o   97.457   19.784   7.7657   2.8505   7.9721   4.5395   7.6313   3.6625   97.455   28.578   95.560   24.818 1.894867 37.85013 
1 1 1   23   18   30 o  126.820   19.222   12.977   3.6143   0.4245   10.725   14.585   3.8389   90.977   39.966  134.609   19.174 -43.63190 44.32704 
1 1 1   23   18   31 o  183.236   11.847   26.141   3.3049   19.701   5.2697   30.316   4.2431  155.247   22.861  196.682   14.190 -41.43440 26.90675 
1 1 1   23   18   32 o  228.258   10.408   40.301   3.6362   36.722   5.9658   42.416   4.5865  214.814   18.319  233.174   12.901 -18.35980 22.40623 
1 1 1   23   18   33 o  117.963   18.985   11.288   3.3115   10.513   5.5245   11.723   4.1372  110.019   31.309  118.599   23.621 -8.579964 39.21947 
1 1 1   23   18   34 o  230.173   12.121   41.304   4.2554   42.801   6.2587   40.017   5.8032  231.919   17.766  224.568   17.009 7.351074 24.59566 
1 1 1   23   18   35 f  157.028   15.739   19.586   3.7320   21.094   5.3486   18.155   5.2097  160.160   22.434  147.741   23.850 12.41878 32.74318 
1 1 1   23   18   36 o  198.430   11.911   30.765   3.6008   34.683   5.6229   28.042   4.6882  208.169   17.819  187.645   16.490 20.52376 24.27830 
1 1 1   23   18   37 o   87.158   27.301   6.4503   4.0497   11.391   5.2190  -1.0252   6.4199  113.477   29.701   67.867   30.306 45.60997 42.43345 
1 1 1   23   18   38 o  216.324   11.651   36.607   3.8435   31.528   5.8795   40.397   5.0790  196.715   19.796  225.819   14.776 -29.10422 24.70215 
1 1 1   23   18   39 o   89.286   26.344   6.9197   3.8471   9.9892   5.7286   4.3980   5.1922  104.825   32.412   78.908   30.414 25.91718 44.44694 
1 1 1   23   18   40 o   68.868   25.692   3.4073   3.6344  -0.9019   5.5020   6.7430   4.8408   62.597   27.997   88.410   29.994 -25.81290 41.02961 
1 1 1   23   18   41 o  102.770   24.106   9.2024   3.7265   11.925   5.6802   7.1451   4.9376  113.208   31.584   89.936   30.293 23.27187 43.76326 
1 1 1   23   18   42 o   66.842   26.395   2.8460   3.9891  -1.6562   5.3286   8.5859   6.0166   58.990   26.854   96.142   33.410 -37.15206 42.86418 
1 1 1   23   18   43 o   89.608   29.187   7.3661   4.5935   1.5971   10.193   8.8362   5.1455   83.390   37.633   96.778   30.832 -13.38719 48.65046 
1 1 1   23   18   44 o  107.456   22.207   10.099   3.5317   8.7951   5.0260   11.371   4.9638   95.963   30.461  109.652   29.095 -13.68935 42.12357 
1 1 1   23   18   45 o  141.051   18.983   16.777   3.9944   10.066   5.9838   22.171   5.3647  100.039   33.348  159.551   22.599 -59.51196 40.28408 
1 1 1   23   19    0 o  296.157   16.598   68.159   7.4698   68.159   7.4698   68.159   7.4698  296.157   16.598  296.157   16.598 0.000000 0.000000 
1 1 1   23   19    1 o  225.167   20.396   39.820   6.9531   0.0000   0.0000   39.820   6.9531  ?   ?   225.167   20.396 0.000000 20.39605 
1 1 1   23   19    2 o  457.518   9.1492  160.794   6.4071  158.491   8.3262  164.138   10.033  453.626   11.992  461.043   14.217 -7.416687 18.59881 
1 1 1   23   19    3 o  371.265   7.9856  105.790   4.5380  103.333   5.2109  113.504   9.2322  366.745   9.2828  382.991   15.749 -16.24652 18.28097 
1 1 1   23   19    4 o  289.219   9.0786   64.255   4.0190   61.082   4.5866   74.747   8.3404  281.794   10.634  309.863   17.658 -28.06912 20.61298 
1 1 1   23   19    5 o  114.785   19.573   10.531   3.3155   9.7984   3.7182   13.374   7.3249  109.915   22.846  126.669   36.053 -16.75339 42.68216 
1 1 1   23   19    6 o  256.954   9.7861   50.754   3.8489   52.648   4.3416   43.802   8.3185  261.573   10.844  235.199   23.418 26.37393 25.80692 
1 1 1   23   19    7 o  179.818   12.479   25.044   3.4135   27.971   3.8581   14.494   7.3241  189.926   13.357  131.492   35.542 58.43449 37.96925 
1 1 1   23   19    8 o  401.879   8.3403  124.015   5.1304  126.797   5.9590  116.045   10.085  406.146   9.5856  386.723   17.038 19.42307 19.54944 
1 1 1   23   19    9 o  228.173   9.4445   40.018   3.2985   41.066   3.5727   33.966   8.5852  231.070   10.101  205.084   28.087 25.98552 29.84862 
1 1 1   23   19   10 o  303.001   8.0560   70.490   3.7362   71.550   4.0863   65.091   9.2257  305.181   8.7479  287.739   21.094 17.44165 22.83635 
1 1 1   23   19   11 o  264.712   8.3795   53.819   3.3952   54.142   3.6520   51.764   9.2165  265.433   8.9889  255.379   23.854 10.05367 25.49175 
1 1 1   23   19   12 o  119.715   15.485   11.283   2.7709   11.265   2.9347   11.426   8.4122  119.401   16.498  118.956   39.535 0.4442139 42.83919 
1 1 1   23   19   13 o   54.270   21.328   1.3845   2.5927   1.6424   2.7084  -1.4419   8.9671   56.521   21.915   82.428   36.365 -25.90680 42.45774 
1 1 1   23   19   14 o  249.690   9.4351   47.949   3.6059   47.949   3.6059   0.0000   0.0000  249.690   9.4351  ?   ?  0.000000 9.435115 
1 1 1   23   19   15 o  184.428   10.663   26.287   2.9971   28.018   3.1924   13.421   8.7024  190.366   11.003  126.448   40.077 63.91765 41.55981 
1 1 1   23   19   16 o  312.421   6.3099   74.876   3.0174   75.460   3.1713   69.298   9.8053  313.601   6.6067  296.040   21.792 17.56122 22.77180 
1 1 1   23   19   17 o  139.816   12.341   15.214   2.6139   16.046   2.7176   4.9383   9.5524  143.587   12.490   99.812   40.360 43.77470 42.24786 
1 1 1   23   19   18 o  214.480   10.124   35.433   3.3235   35.433   3.3235   0.0000   0.0000  214.480   10.124  ?   ?  0.000000 10.12382 
1 1 1   23   19   19 o  142.160   13.124   15.767   2.8234   15.767   2.8234   0.0000   0.0000  142.160   13.124  ?   ?  0.000000 13.12369 
1 1 1   23   19   20 o  157.246   11.823   19.204   2.8248   19.260   2.9672   18.654   9.2314  157.362   12.420  145.958   40.091 11.40372 41.97119 
1 1 1   23   19   21 o  296.633   8.9650   67.710   4.0704   67.398   4.3983   69.570   10.743  295.809   9.7142  294.906   24.009 0.9026184 25.89945 
1 1 1   23   19   22 o  180.592   11.287   25.279   3.1043   25.508   3.2652   23.124   10.014  181.299   11.831  161.761   40.529 19.53741 42.22028 
1 1 1   23   19   23 o  178.861   11.678   24.829   3.1795   23.652   3.3464   35.755   10.193  174.344   12.626  205.861   33.501 -31.51755 35.80107 
1 1 1   23   19   24 o   84.955   22.445   5.9369   2.9624   6.9141   3.1080  -3.7637   9.7923   91.583   22.365   80.354   36.511 11.22840 42.81692 
1 1 1   23   19   25 o  236.655   10.463   43.228   3.7902   45.952   4.0611   24.828   10.554  243.915   10.878  166.266   41.580 77.64828 42.97894 
1 1 1   23   19   26 o  129.092   18.874   13.371   3.6192   13.371   3.6192   0.0000   0.0000  129.092   18.874  ?   ?  0.000000 18.87427 
1 1 1   23   19   27 o  163.712   11.849   20.857   2.9490   19.301   3.7092   23.531   4.8621  156.466   15.700  171.895   18.785 -15.42850 24.48193 
1 1 1   23   19   28 o   48.982   20.517   0.4473   2.5846   3.6101   3.7247  -2.4899   3.5895   71.951   26.152   46.890   21.604 25.06131 33.92127 
1 1 1   23   19   29 o  198.432   12.523   30.680   3.7841   26.283   7.9385   31.972   4.3046  176.064   30.566  202.143   13.999 -26.07933 33.61943 
1 1 1   23   19   30 o  106.176   22.240   9.3310   3.4985   24.862   7.7698   5.3814   3.9182  170.734   30.868   82.024   26.968 88.70926 40.98915 
1 1 1   23   19   31 o  143.426   13.943   16.186   3.0222   15.730   4.5810   16.537   4.0216  138.499   22.372  143.449   18.766 -4.949188 29.20018 
1 1 1   23   19   32 o   67.766   24.950   3.1377   3.4060   4.8109   5.0686   1.7601   4.5991   82.050   30.394   67.537   27.741 14.51356 41.15064 
1 1 1   23   19   33 o  309.705   9.9893   74.201   4.7353   75.755   6.9610   72.863   6.4605  311.033   14.622  305.407   13.820 5.625732 20.11949 
1 1 1   23   19   34 o  136.878   17.081   15.021   3.5008   17.656   5.9176   13.602   4.3421  143.683   27.913  127.857   23.035 15.82655 36.19014 
1 1 1   23   19   35 o   86.321   23.759   6.2960   3.2381   1.7939   4.9057   9.7721   4.3106   68.703   28.477  106.532   26.535 -37.82927 38.92357 
1 1 1   23   19   36 o   48.101   22.263  -2.6843   3.8757  -2.0133   4.8587  -3.8582   6.4266   56.643   25.730   61.724   28.603 -5.081196 38.47314 
1 1 1   23   19   37 o   67.621   24.824   3.2837   3.3681   2.8266   5.1414   3.6274   4.4578   72.978   29.574   73.475   28.217 -0.4976959 40.87596 
1 1 1   23   19   38 f   90.639   25.924   7.1284   3.7778   7.2353   5.4595   7.0301   5.2330   91.871   31.831   90.657   31.178 1.214020 44.55612 
1 1 1   23   19   39 o  167.941   14.656   22.469   3.7296   25.935   5.6552   19.801   4.9616  176.844   21.322  154.088   21.633 22.75571 30.37494 
1 1 1   23   19   40 o  162.010   15.194   21.039   3.7237   16.160   5.6729   24.733   4.9359  134.445   28.454  173.729   18.865 -39.28389 34.13984 
1 1 1   23   19   41 o  197.178   13.426   30.895   4.0280   27.654   6.1970   33.267   5.3005  180.296   22.978  202.239   17.289 -21.94278 28.75587 
1 1 1   23   19   42 o  164.328   15.518   21.857   3.8570   17.882   5.5112   25.674   5.3997  141.520   26.414  174.772   20.579 -33.25256 33.48460 
1 1 1   23   19   43 o  193.191   16.813   30.553   4.9222   22.775   7.6502   36.047   6.4299  152.468   33.680  206.698   20.598 -54.23045 39.47895 
1 1 1   23   19   44 o  114.572   20.832   11.329   3.5186   16.141   5.0599   6.8236   4.8962  133.669   25.664   85.865   30.122 47.80349 39.57233 
1 1 1   23   20    0 o  359.067   15.335   99.763   8.3933   99.763   8.3933   99.763   8.3933  359.067   15.335  359.067   15.335 0.000000 0.000000 
1 1 1   23   20    1 o   90.981   28.630   6.5522   4.4476   10.174   6.1853   2.6748   6.3999  111.452   33.527   81.517   33.009 29.93536 47.04961 
1 1 1   23   20    2 o   57.285   25.388  -1.2922   4.4198   3.3581   5.8394  -7.5293   6.7628   81.329   31.993   59.107   28.002 22.22218 42.51635 
1 1 1   23   20    3 o  255.506   12.412   50.336   4.8542   48.818   6.0681   53.034   8.0895  250.542   15.906  259.845   20.506 -9.303192 25.95181 
1 1 1   23   20    4 o  359.304   10.582   99.343   5.8198   94.210   7.4835  107.198   9.2574  349.185   14.002  371.861   16.264 -22.67621 21.46116 
1 1 1   23   20    5 o  309.699   11.438   73.878   5.4218   71.782   6.9005   77.260   8.7648  304.615   14.800  314.638   18.278 -10.02264 23.51881 
1 1 1   23   20    6 o  255.902   12.477   50.507   4.8871   48.630   5.9867   54.258   8.4610  250.060   15.721  262.520   21.239 -12.45995 26.42418 
1 1 1   23   20    7 o  284.167   11.508   62.215   5.0056   58.653   5.9733   70.615   9.1733  275.071   14.236  300.073   20.088 -25.00241 24.62118 
1 1 1   23   20    8 o  463.142   7.9194  164.691   5.6141  163.053   6.3868  170.256   11.775  460.605   9.0591  468.419   16.423 -7.813568 18.75558 
1 1 1   23   20    9 o  313.600   8.9867   75.584   4.3137   77.578   4.7868   66.963   9.9510  317.576   9.8475  291.157   22.504 26.41946 24.56402 
1 1 1   23   20   10 o  293.348   9.1187   66.152   4.0943   67.733   4.4736   57.994   10.161  296.723   9.8499  269.800   24.886 26.92300 26.76465 
1 1 1   23   20   11 o  126.654   17.005   12.683   3.2132   12.881   3.4642   11.463   8.5988  127.341   18.299  119.105   39.977 8.235847 43.96625 
1 1 1   23   20   12 o  334.671   8.6599   86.082   4.4361   86.088   4.8604   86.050   10.856  334.541   9.4919  330.345   21.589 4.196106 23.58388 
1 1 1   23   20   13 o   99.892   21.598   8.1286   3.2062   8.1286   3.2062   0.0000   0.0000   99.892   21.598  ?   ?  0.000000 21.59849 
1 1 1   23   20   14 o  197.021   11.460   30.039   3.4411   31.955   3.7327   19.190   8.8809  203.111   12.061  149.116   38.607 53.99527 40.44698 
1 1 1   23   20   15 o   68.856   22.392   3.6391   2.7041   3.3884   2.8274   6.3265   9.2569   67.623   22.923  102.803   40.332 -35.18024 46.39090 
1 1 1   23   20   16 o  100.942   18.350   8.1947   2.7307   8.1382   2.8705   8.7330   8.8559  100.342   19.392  109.195   40.228 -8.853622 44.65770 
1 1 1   23   20   17 o  247.536   13.550   47.583   5.1146   46.985   5.9073   49.373   10.221  245.330   15.816  246.764   27.531 -1.434357 31.75049 
1 1 1   23   20   18 o   91.131   17.595   6.6931   2.3654   5.9888   2.4419   17.402   9.5219   85.826   19.083  141.022   41.399 -55.19585 45.58549 
1 1 1   23   20   19 o   35.921   16.605  -1.7036   2.1462  -2.7532   2.2025   18.051   9.5552   33.231   15.812  143.307   41.301 -110.0756 44.22431 
1 1 1   23   20   20 o  274.230   9.6858   57.928   4.0656   57.928   4.0656   0.0000   0.0000  274.230   9.6858  ?   ?  0.000000 9.685781 
1 1 1   23   20   21 o  154.542   12.494   18.599   2.9301   18.599   2.9301   0.0000   0.0000  154.542   12.494  ?   ?  0.000000 12.49378 
1 1 1   23   20   22 o  398.384   8.4010  122.095   5.1228  122.095   5.1228   0.0000   0.0000  398.384   8.4010  ?   ?  0.000000 8.401039 
1 1 1   23   20   23 o  291.229   9.0279   65.312   4.0243   66.571   4.2738   55.462   11.953  293.926   9.4996  258.619   30.802 35.30640 32.23405 
1 1 1   23   20   24 o  141.992   14.584   15.844   3.1247   13.915   3.2512   39.199   11.312  132.510   16.378  213.701   35.854 -81.19064 39.41764 
1 1 1   23   20   25 o  317.562   9.0515   77.693   4.3996   81.749   4.7680   54.446   11.415  325.620   9.5666  256.386   29.634 69.23380 31.13998 
1 1 1   23   20   26 o  111.256   20.170   10.070   3.3082   10.070   3.3082   0.0000   0.0000  111.256   20.170  ?   ?  0.000000 20.16953 
1 1 1   23   20   27 o  362.710   8.6944  101.352   4.8269  105.647   5.2825   79.622   11.881  370.134   9.3243  313.246   24.988 56.88821 26.67081 
1 1 1   23   20   28 o  223.397   18.428   39.615   6.2449   44.159   7.6116   30.258   10.923  234.492   21.444  183.248   40.061 51.24443 45.43899 
1 1 1   23   20   29 o  113.256   16.760   10.275   2.8177   7.8720   3.9288   12.820   4.0433   96.679   25.989  125.024   21.928 -28.34513 34.00428 
1 1 1   23   20   30 o   49.131   21.424  -0.3516   3.0316  -0.4486   4.0161  -0.2231   4.6223   56.186   24.575   60.906   26.508 -4.720367 36.14681 
1 1 1   23   20   31 o  148.505   15.068   17.435   3.3775   17.922   4.5051   16.809   5.1038  148.718   20.323  142.305   24.305 6.412659 31.68190 
1 1 1   23   20   32 o   86.243   22.461   6.2204   2.9943   6.0033   4.6188   6.3777   3.9326   86.301   29.298   87.365   26.829 -1.064026 39.72565 
1 1 1   23   20   33 o  104.307   21.293   9.0351   3.2846   6.9459   5.1501   10.467   4.2644   91.628   30.938  110.879   25.639 -19.25101 40.18055 
1 1 1   23   20   34 o  201.062   14.045   31.825   4.2953   32.682   5.3767   30.314   7.1411  202.212   17.545  190.592   25.088 11.61995 30.61475 
1 1 1   23   20   35 o  176.922   17.625   25.136   4.7095   23.416   6.3229   27.278   7.0580  166.520   25.629  179.391   26.502 -12.87065 36.86779 
1 1 1   23   20   36 o   93.165   23.951   7.4345   3.4343   4.8263   5.3620   9.2487   4.4720   81.602   31.039  102.673   27.781 -21.07072 41.65613 
1 1 1   23   20   37 o  122.106   20.034   12.343   3.6145   15.958   5.8377   10.095   4.6029  134.140   29.256  106.906   27.851 27.23417 40.39297 
1 1 1   23   20   38 o  113.660   23.956   11.095   4.0363   12.481   6.2157   10.085   5.3077  115.905   33.284  105.434   30.897 10.47105 45.41371 
1 1 1   23   20   39 o  189.097   14.147   28.431   4.0651   31.076   6.7673   26.937   5.0846  191.706   23.559  181.632   18.550 10.07343 29.98494 
1 1 1   23   20   40 o   89.809   25.560   7.1452   3.6817   11.474   6.0566   4.6084   4.6368  109.667   33.218   77.056   28.966 32.61134 44.07380 
1 1 1   23   20   41 o   89.167   24.684   7.0721   3.4836   7.1775   5.1193   6.9813   4.7542   89.032   30.824   87.937   29.725 1.095833 42.82175 
1 1 1   23   20   42 f  120.837   23.065   12.764   4.1104   21.193   7.5472   9.2097   4.9010  146.548   34.260   98.676   29.880 47.87167 45.45968 
1 1 1   23   20   43 o   65.253   25.033   3.0959   3.5061   2.3392   4.9059   3.8859   5.0126   67.491   28.268   73.522   29.409 -6.031067 40.79149 
1 1 1   23   21    0 o  425.443   15.076  139.856   9.7892  139.856   9.7892  139.856   9.7892  425.443   15.076  425.443   15.076 0.000000 0.000000 
1 1 1   23   21    1 o  112.403   27.062   10.418   4.6000   8.1975   6.1950   13.148   6.8677  102.183   33.925  125.184   34.659 -23.00156 48.49933 
1 1 1   23   21    2 o  131.288   24.620   14.011   4.7657   26.315   6.5732   0.3759   6.9197  181.199   24.314   76.973   32.955 104.2265 40.95356 
1 1 1   23   21    3 o  292.106   9.5528   65.613   4.2711   67.309   4.9901   60.968   8.2597  295.622   11.028  278.850   19.474 16.77148 22.37998 
1 1 1   23   21    4 o  300.057   9.3953   69.226   4.3151   70.436   4.9297   65.260   8.9239  302.469   10.648  288.201   20.361 14.26840 22.97697 
1 1 1   23   21    5 o   99.474   28.024   8.1171   4.4493   8.1749   5.4892   8.0064   7.5973  100.808   31.816  104.396   37.430 -3.587669 49.12513 
1 1 1   23   21    6 o  224.328   25.430   40.310   8.5776   0.0000   0.0000   40.310   8.5776  ?   ?   224.328   25.430 0.000000 25.43044 
1 1 1   23   21    7 o  405.741   11.059  126.837   6.8683  126.209   8.8112  127.809   10.965  403.845   14.254  405.195   17.679 -1.349609 22.71001 
1 1 1   23   21    8 o   84.581   27.375   5.5891   4.0441   3.0216   4.5194   15.906   9.0591   73.540   28.367  136.378   40.473 -62.83801 49.42425 
1 1 1   23   21    9 o  541.248   8.8765  225.204   7.3538  225.871   8.7657  223.619   13.512  541.542   10.575  536.429   16.456 5.113464 19.56109 
1 1 1   23   21   10 o  362.734   10.160  101.300   5.6411  100.927   6.5301  102.398   11.198  361.691   11.795  360.939   20.353 0.7515564 23.52373 
1 1 1   23   21   11 f  101.373   26.742   8.4900   4.2093   9.8371   4.6684   2.6343   9.7335  108.858   27.892   94.655   39.739 14.20240 48.55082 
1 1 1   23   21   12 o  231.953   15.447   41.947   5.4529   41.947   5.4529   0.0000   0.0000  231.953   15.447  ?   ?  0.000000 15.44708 
1 1 1   23   21   13 o  247.091   12.931   47.333   4.8735   47.349   5.6382   47.284   9.6917  246.588   15.010  242.076   26.595 4.512344 30.53811 
1 1 1   23   21   14 o   68.854   27.227   2.3002   4.2500   2.0087   4.7989   3.3599   9.1507   70.635   28.591   94.059   38.932 -23.42393 48.30287 
1 1 1   23   21   15 o  292.604   11.814   66.111   5.2911   64.535   6.0987   70.907   10.640  288.628   13.805  298.327   23.490 -9.698029 27.24641 
1 1 1   23   21   16 o  172.507   18.781   23.554   4.8788   19.185   5.5929   37.458   9.9784  153.626   24.616  212.537   31.638 -58.91058 40.08605 
1 1 1   23   21   17 o  477.628   9.9691  175.750   7.2881  176.081   8.5454  174.867   13.958  477.486   11.692  472.157   19.314 5.328705 22.57780 
1 1 1   23   21   18 o  186.054   18.245   27.338   5.1289   31.386   5.9561   15.727   10.089  198.934   19.825  134.454   43.208 64.47943 47.53887 
1 1 1   23   21   19 o  254.845   8.7943   49.977   3.4304   49.779   3.6107   51.811   10.992  254.262   9.2778  251.374   29.108 2.888107 30.55109 
1 1 1   23   21   20 o   57.121   21.433   1.9799   2.5364   1.8965   2.6169   3.2715   10.301   57.125   21.695   97.147   40.839 -40.02224 46.24374 
1 1 1   23   21   21 o   90.603   19.303   6.6879   2.5951   6.4454   2.6749   10.569   10.701   88.756   20.150  117.528   44.040 -28.77202 48.43051 
1 1 1   23   21   22 o  104.208   17.468   8.7199   2.6876   8.5425   2.7701   11.567   11.097  102.913   18.254  120.853   44.932 -17.93964 48.49801 
1 1 1   23   21   23 o  111.079   17.747   9.9007   2.9158   9.9007   2.9158   0.0000   0.0000  111.079   17.747  ?   ?  0.000000 17.74710 
1 1 1   23   21   24 o  155.844   14.062   19.035   3.3182   19.035   3.3182   0.0000   0.0000  155.844   14.062  ?   ?  0.000000 14.06180 
1 1 1   23   21   25 o  345.534   8.9944   92.004   4.7570   92.004   4.7570   0.0000   0.0000  345.534   8.9944  ?   ?  0.000000 8.994387 
1 1 1   23   21   26 o  224.270   11.097   38.912   3.8092   40.566   4.0288   24.969   11.698  228.604   11.551  163.320   45.239 65.28380 46.69074 
1 1 1   23   21   27 o  185.910   22.499   28.013   6.2719   25.252   7.5998   33.910   11.106  172.880   29.796  195.331   38.515 -22.45134 48.69502 
1 1 1   23   21   28 o   69.010   25.071   3.3235   3.4227   3.3271   3.5997   3.2894   11.051   69.772   25.656   97.720   41.737 -27.94797 48.99184 
1 1 1   23   21   29 o  238.605   10.682   44.061   3.9011   48.920   4.6377   32.302   7.2141  251.034   12.070  198.577   24.238 52.45628 27.07668 
1 1 1   23   21   30 o  147.117   13.451   17.005   2.9954   18.058   4.2038   15.919   4.2691  149.888   18.732  139.924   20.545 9.963608 27.80280 
1 1 1   23   21   31 o  182.287   11.672   25.907   3.2394   29.716   4.6915   22.436   4.4784  193.784   15.959  167.544   17.733 26.24016 23.85647 
1 1 1   23   21   32 o  128.204   16.487   13.161   3.1604   14.135   4.8173   12.426   4.1875  129.433   25.222  121.973   23.279 7.460701 34.32292 
1 1 1   23   21   33 o  119.043   21.427   11.743   3.7606   14.890   4.6307   5.6487   6.4446  133.447   23.531   88.609   33.952 44.83808 41.30856 
1 1 1   23   21   34 f  182.872   12.372   26.215   3.4426   27.216   4.8796   25.223   4.8577  184.206   17.517  176.962   18.193 7.243530 25.25586 
1 1 1   23   21   35 o  152.141   14.618   18.394   3.3621   24.098   4.9036   13.334   4.6188  172.326   18.901  124.864   25.038 47.46253 31.37138 
1 1 1   23   21   36 o  129.890   18.222   13.762   3.5231   11.956   5.3203   15.173   4.7016  115.509   29.870  133.775   23.836 -18.26540 38.21444 
1 1 1   23   21   37 o   97.882   25.632   8.3670   3.8856   4.0163   5.7652   11.988   5.2596   79.137   31.579  115.420   29.623 -36.28214 43.29829 
1 1 1   23   21   38 o  131.816   19.923   14.429   3.8943   8.1343   6.0956   18.770   5.0621   95.547   33.604  148.901   22.948 -53.35349 40.69220 
1 1 1   23   21   39 o   54.945   23.651   0.4015   3.5992   3.3012   5.8946  -1.3223   4.5448   75.990   31.332   55.479   25.074 20.51079 40.12984 
1 1 1   23   21   40 o  108.047   23.235   10.194   3.7285   8.9671   5.9477   10.988   4.7855   97.411   33.246  109.293   28.361 -11.88239 43.69931 
1 1 1   23   21   41 o   69.599   27.721   3.2304   4.4351   8.8507   10.858   2.1049   4.8589   99.067   41.802   66.987   28.098 32.07962 50.36733 
1 1 1   23   21   42 o   53.004   22.932   0.3808   3.4182  -1.0477   5.0563   1.5831   4.6389   58.184   26.359   63.854   27.151 -5.670097 37.84135 
1 1 1   23   22    0 o   64.680   38.463   3.8277   6.6593   3.8277   6.6593   3.8277   6.6593   64.680   38.463   64.680   38.463 0.000000 0.000000 
1 1 1   23   22    1 o  144.269   23.848   16.830   5.0821   17.054   7.0141   16.583   7.3738  142.403   32.849  139.920   34.620 2.483139 47.72414 
1 1 1   23   22    2 o  324.031   12.032   81.015   5.9676   86.982   8.0145   73.589   8.9401  334.814   15.639  306.355   19.162 28.45935 24.73347 
1 1 1   23   22    3 o  292.737   12.741   66.190   5.7088   72.309   7.7261   58.832   8.4723  304.555   16.637  273.332   20.398 31.22354 26.32201 
1 1 1   23   22    4 o  144.294   22.460   16.746   4.7991   16.687   6.1647   16.837   7.6458  141.857   29.359  140.699   35.503 1.157486 46.06982 
1 1 1   23   22    5 o  242.265   10.949   45.230   4.0602   45.157   4.5987   45.486   8.6465  241.508   12.483  238.774   23.982 2.734085 27.03669 
1 1 1   23   22    6 o   99.631   23.617   8.1447   3.5466   7.3479   3.9289   11.652   8.2426   94.617   26.222  119.079   39.113 -24.46185 47.08931 
1 1 1   23   22    7 o  211.745   10.713   34.634   3.4607   32.762   3.7236   46.503   9.3772  205.710   11.876  240.557   25.874 -34.84721 28.46973 
1 1 1   23   22    8 o   73.447   23.765   4.1724   3.0479   3.1790   3.2741   10.626   8.3449   68.262   24.561  115.158   39.379 -46.89632 46.41082 
1 1 1   23   22    9 o  111.681   18.647   9.9921   3.0752   11.357   3.3007   1.0193   8.4643  119.212   18.705   85.461   36.515 33.75067 41.02712 
1 1 1   23   22   10 o  160.730   14.032   20.157   3.4175   20.157   3.4175   0.0000   0.0000  160.730   14.032  ?   ?  0.000000 14.03197 
1 1 1   23   22   11 o  374.085   8.5766  107.590   4.9108  107.590   4.9108   0.0000   0.0000  374.085   8.5766  ?   ?  0.000000 8.576597 
1 1 1   23   22   12 o   58.341   22.691   1.7556   2.9104   2.0121   3.0770  -0.4224   8.9659   60.746   23.413   84.098   36.752 -23.35241 43.57655 
1 1 1   23   22   13 o  123.713   16.850   12.134   3.1077   11.388   3.2879   18.381   9.5167  119.338   18.607  144.903   41.043 -25.56485 45.06369 
1 1 1   23   22   14 o  209.831   10.774   34.040   3.4487   33.781   3.6708   35.990   10.068  208.876   11.526  207.676   32.758 1.199936 34.72626 
1 1 1   23   22   15 o  221.996   10.689   38.006   3.6319   39.509   3.8641   26.616   10.638  226.265   11.157  174.086   40.659 52.17912 42.16195 
1 1 1   23   22   16 o  166.557   13.066   21.608   3.3043   20.672   3.4610   31.237   11.104  162.670   14.038  189.308   39.594 -26.63741 42.00855 
1 1 1   23   22   17 o  191.158   12.271   28.375   3.5714   27.477   3.7770   35.962   10.973  187.875   13.219  205.183   36.265 -17.30771 38.59924 
1 1 1   23   22   18 o  174.941   19.446   24.330   5.1188   25.391   5.8692   20.960   10.463  177.847   22.032  152.912   42.939 24.93462 48.26115 
1 1 1   23   22   19 o  278.931   18.388   61.277   7.8067   66.907   10.246   53.486   12.054  289.065   23.357  253.545   31.756 35.52023 39.42035 
1 1 1   23   22   20 o  249.292   8.9983   47.856   3.4335   49.137   3.5983   34.823   11.477  252.553   9.3084  199.570   38.971 52.98303 40.06687 
1 1 1   23   22   21 o   68.363   21.698   3.6711   2.5503   3.1300   2.6225   13.092   10.942   64.852   22.076  125.106   44.914 -60.25356 50.04582 
1 1 1   23   22   22 o  284.962   8.9234   62.546   3.8921   63.782   4.1198   52.281   11.872  287.672   9.3564  249.898   31.755 37.77477 33.10448 
1 1 1   23   22   23 o   54.154   21.298   1.4357   2.5872   1.8628   2.6691  -5.2084   10.527   57.112   21.857   80.544   37.068 -23.43230 43.03262 
1 1 1   23   22   24 o  128.620   15.611   13.103   3.0104   13.103   3.0104   0.0000   0.0000  128.620   15.611  ?   ?  0.000000 15.61118 
1 1 1   23   22   25 o  112.025   35.607   10.776   6.8657   10.776   6.8657   0.0000   0.0000  112.025   35.607  ?   ?  0.000000 35.60688 
1 1 1   23   22   26 o   94.299   35.440   6.4003   6.9402   6.4003   6.9402   0.0000   0.0000   94.299   35.440  ?   ?  0.000000 35.43999 
1 1 1   23   22   27 o   45.447   20.872  -2.1613   3.3139  -2.1613   3.3139   0.0000   0.0000   45.447   20.872  ?   ?  0.000000 20.87203 
1 1 1   23   22   28 o  224.775   11.840   39.308   4.0590   39.874   4.2329   32.846   14.309  226.255   12.269  182.220   49.857 44.03458 51.34470 
1 1 1   23   22   29 o  259.327   11.445   52.170   4.5429   51.255   4.8189   59.481   13.618  256.786   12.260  261.251   34.930 -4.464661 37.01936 
1 1 1   23   22   30 o   86.568   24.182   6.2914   3.3276   4.9986   3.9042   9.7246   6.3624   79.440   26.936  105.882   34.343 -26.44289 43.64654 
1 1 1   23   22   31 o  125.932   16.190   12.689   3.0485   13.879   4.4654   11.650   4.1718  128.953   23.489  117.713   23.969 11.24029 33.55966 
1 1 1   23   22   32 o   73.414   25.595   4.1550   3.5325   5.9793   4.3395   0.5717   6.0817   85.187   28.399   70.657   30.578 14.52974 41.73194 
1 1 1   23   22   33 o  202.167   12.868   32.078   3.9613   39.591   4.9433   18.595   6.6219  223.955   14.498  145.057   30.778 78.89853 34.02158 
1 1 1   23   22   34 o  149.516   14.342   17.745   3.2419   20.344   4.6539   15.296   4.5184  157.812   19.696  135.177   22.639 22.63469 30.00702 
1 1 1   23   22   35 o   59.954   23.786   1.9258   3.2533   2.5815   4.8301   1.3813   4.4014   70.540   28.638   63.972   26.783 6.567707 39.21002 
1 1 1   23   22   36 o  377.744   9.0816  110.602   5.2508  106.292   7.2728  115.295   7.5889  367.941   12.914  383.187   12.939 -15.24588 18.28066 
1 1 1   23   22   37 o   75.777   26.354   4.6764   3.7442   2.0690   5.3548   7.1705   5.2373   70.395   29.511   90.557   31.188 -20.16233 42.93663 
1 1 1   23   22   38 o  134.062   17.693   14.747   3.5418   11.795   5.2083   17.287   4.8308  113.216   29.689  142.271   22.966 -29.05495 37.53506 
1 1 1   23   22   39 o  118.644   19.542   11.824   3.4253   9.5928   4.9077   13.944   4.7829  101.524   29.698  125.245   25.808 -23.72157 39.34463 
1 1 1   23   22   40 o   76.517   24.445   5.1046   3.2327   5.6318   4.7067   4.6338   4.4477   80.949   29.401   75.830   28.396 5.119019 40.87519 
1 1 1   23   22   41 o   74.887   26.829   4.7480   3.9028   11.323   7.5286   2.3320   4.5639  104.461   37.281   66.259   27.466 38.20249 46.30573 
1 1 1   23   23    0 o  517.387   14.640  206.678   11.572  206.678   11.572  206.678   11.572  517.387   14.640  517.387   14.640 0.000000 0.000000 
1 1 1   23   23    1 o  340.476   11.790   89.463   6.1441   85.467   8.4839   93.871   8.9097  330.963   16.803  347.290   16.761 -16.32675 23.73309 
1 1 1   23   23    2 o  342.512   11.655   90.521   6.1101   87.085   8.2562   94.681   9.0851  334.707   16.115  348.686   17.023 -13.97839 23.44097 
1 1 1   23   23    3 o  172.755   20.002   23.682   5.1912   29.063   6.8279   16.310   7.9919  190.239   23.981  137.882   37.068 52.35657 44.14878 
1 1 1   23   23    4 o  113.921   22.002   10.545   3.6975   8.5587   4.1749   17.769   7.9628  101.721   26.536  144.051   36.167 -42.33018 44.85778 
1 1 1   23   23    5 o  304.942   9.8493   71.590   4.5972   74.580   5.3300   62.907   9.0845  310.974   11.198  282.105   21.194 28.86871 23.97002 
1 1 1   23   23    6 o  110.653   22.215   9.9747   3.6318   7.2735   4.0113   22.258   8.5542   94.105   26.643  161.619   35.546 -67.51366 44.42289 
1 1 1   23   23    7 o  148.998   14.913   17.390   3.3553   15.382   3.6284   29.242   8.8153  139.451   17.376  187.496   31.857 -48.04538 36.28725 
1 1 1   23   23    8 o  219.927   10.774   37.287   3.6268   35.608   3.8927   48.338   9.9845  214.422   11.908  244.420   27.147 -29.99759 29.64368 
1 1 1   23   23    9 o  176.997   13.692   24.401   3.6806   24.401   3.6806   0.0000   0.0000  176.997   13.692  ?   ?  0.000000 13.69232 
1 1 1   23   23   10 o   89.888   22.547   6.6288   3.0968   6.7623   3.2802   5.5340   9.3935   90.720   23.451  100.679   40.263 -9.958832 46.59508 
1 1 1   23   23   11 o  120.656   18.262   11.622   3.2671   12.335   3.5021   6.8394   9.0706  124.163   19.035  103.470   40.110 20.69298 44.39713 
1 1 1   23   23   12 o  331.756   8.5343   84.641   4.3337   87.024   4.7120   71.566   11.038  336.270   9.1547  299.077   24.324 37.19324 25.98945 
1 1 1   23   23   13 o  117.108   18.977   11.006   3.2853   9.2180   3.4813   25.552   9.9300  106.153   22.143  171.302   38.775 -65.14835 44.65229 
1 1 1   23   23   14 o  269.793   9.5639   56.060   3.9495   54.794   4.2336   64.554   10.966  266.580   10.375  283.061   25.587 -16.48062 27.61036 
1 1 1   23   23   15 o  213.399   11.315   35.264   3.6828   36.691   3.9078   23.934   11.012  217.580   11.778  163.294   43.338 54.28676 44.90951 
1 1 1   23   23   16 o  188.996   13.349   27.821   3.8369   26.470   4.1099   36.988   10.706  183.981   14.718  208.865   34.706 -24.88438 37.69805 
1 1 1   23   23   17 o  272.965   9.8168   57.430   4.1015   61.853   4.4090   28.997   11.179  283.206   10.171  180.629   41.330 102.5771 42.56330 
1 1 1   23   23   18 o  220.543   22.786   39.050   7.5811   48.037   9.7059   24.988   12.141  242.913   26.536  164.736   46.251 78.17700 53.32307 
1 1 1   23   23   19 o   96.681   30.678   7.6721   5.0981   5.2707   5.6861   17.515   11.512   86.968   32.197  139.677   46.240 -52.70881 56.34530 
1 1 1   23   23   20 o  228.808   16.272   41.106   5.6616   45.815   6.5164   26.607   11.435  241.035   17.788  170.823   43.591 70.21173 47.08035 
1 1 1   23   23   21 o  234.110   16.092   43.029   5.7312   38.002   6.5716   59.001   11.713  218.492   19.867  267.230   29.107 -48.73820 35.24121 
1 1 1   23   23   22 o  240.900   9.5483   44.758   3.5207   44.901   3.6895   43.303   11.774  241.196   9.9938  224.291   35.476 16.90509 36.85707 
1 1 1   23   23   23 o   83.240   33.064   3.8357   6.2935   3.8357   6.2935   0.0000   0.0000   83.240   33.064  ?   ?  0.000000 33.06399 
1 1 1   23   23   24 o  127.662   33.850   14.249   6.7221   14.249   6.7221   0.0000   0.0000  127.662   33.850  ?   ?  0.000000 33.85034 
1 1 1   23   23   25 o  338.563   9.0315   88.393   4.6803   89.437   4.9978   80.949   13.343  340.392   9.5925  312.853   28.166 27.53946 29.75478 
1 1 1   23   23   26 o  146.579   15.317   16.984   3.3856   17.186   3.5182   14.456   12.449  147.290   15.856  128.229   47.607 19.06107 50.17808 
1 1 1   23   23   27 f  161.931   14.942   20.681   3.6618   23.018   3.8324  -3.8277   12.411  170.953   14.792   88.670   40.600 82.28318 43.21091 
1 1 1   23   23   28 o  179.820   14.258   25.425   3.8923   25.425   3.8923   0.0000   0.0000  179.820   14.258  ?   ?  0.000000 14.25840 
1 1 1   23   23   29 o  280.841   10.835   61.147   4.6577   61.147   4.6577   0.0000   0.0000  280.841   10.835  ?   ?  0.000000 10.83530 
1 1 1   23   23   30 o   63.684   25.096   2.1997   3.5989   2.1997   3.5989   0.0000   0.0000   63.684   25.096  ?   ?  0.000000 25.09574 
1 1 1   23   23   31 f  221.382   12.724   38.379   4.2933   43.207   5.4874   30.760   6.8935  233.717   15.426  192.625   23.894 41.09151 28.44077 
1 1 1   23   23   32 f   94.835   21.387   7.5559   3.0305   6.3609   4.2093   8.8417   4.3664   86.775   27.912  100.763   27.530 -13.98820 39.20419 
1 1 1   23   23   33 o  246.187   11.601   47.258   4.3717   48.899   5.6255   44.756   6.9462  248.561   14.854  234.985   19.488 13.57573 24.50406 
1 1 1   23   23   34 o   67.334   24.214   3.3788   3.1816   3.9374   4.5887   2.8617   4.4153   75.136   28.682   69.847   27.710 5.289070 39.88106 
1 1 1   23   23   35 o  210.717   11.243   34.744   3.6132   36.687   5.1271   32.826   5.0928  214.333   15.738  202.210   16.601 12.12387 22.87558 
1 1 1   23   23   36 o   80.151   25.367   5.4975   3.4874  -0.6217   4.6761   13.166   5.2348   58.526   26.017  120.978   28.703 -62.45149 38.73938 
1 1 1   23   23   37 o  101.724   22.020   8.8952   3.3291   16.909   4.8525   1.7697   4.5757  140.387   23.407   65.372   27.333 75.01456 35.98555 
1 1 1   23   23   38 o   55.976   23.518   1.0223   3.4128  -0.1999   5.1146   2.0033   4.5821   61.474   27.275   65.877   27.432 -4.402325 38.68330 
1 1 1   23   23   39 o  137.699   16.629   15.547   3.4339   12.769   4.9747   18.076   4.7458  117.739   28.011  145.188   22.049 -27.44859 35.64793 
1 1 1   23   23   40 o   54.568   23.960   0.0436   3.8504   9.7138   7.4766  -3.4469   4.4918   98.692   36.844   49.291   23.189 49.40138 43.53437 
1 1 1   23   24    0 o   89.316   43.249   9.4681   6.8983   9.4681   6.8983   9.4681   6.8983   89.316   43.249   89.316   43.249 0.000000 0.000000 
1 1 1   23   24    1 o  100.916   29.839   8.4019   4.9308   8.6229   6.6854   8.1382   7.3018  104.255   35.249  103.530   36.740 0.7244492 50.91422 
1 1 1   23   24    2 o  188.971   18.772   28.195   5.3578   32.442   7.3392   23.350   7.8396  200.836   24.374  167.059   31.821 33.77684 40.08299 
1 1 1   23   24    3 o  110.163   28.927   10.133   4.9400   11.520   6.4378   8.1476   7.7037  116.914   33.961  104.439   37.664 12.47465 50.71374 
1 1 1   23   24    4 o   81.342   29.925   4.4722   4.8981  -0.1348   6.1007   12.828   8.2161   70.774   30.628  123.206   38.929 -52.43182 49.53334 
1 1 1   23   24    5 o  355.219   9.2964   97.105   5.0545   92.492   5.7215  113.504   10.787  346.345   10.793  380.935   18.501 -34.59006 21.41891 
1 1 1   23   24    6 o  217.459   12.425   36.669   4.1185   32.865   4.5543   53.740   9.6477  205.315   14.587  258.899   24.643 -53.58388 28.63692 
1 1 1   23   24    7 o  214.190   12.565   35.593   4.1013   35.593   4.1013   0.0000   0.0000  214.190   12.565  ?   ?  0.000000 12.56495 
1 1 1   23   24    8 o  181.021   13.750   25.534   3.7813   25.534   3.7813   0.0000   0.0000  181.021   13.750  ?   ?  0.000000 13.75001 
1 1 1   23   24    9 o  276.818   9.5201   59.003   4.0337   60.958   4.4026   48.780   10.067  281.235   10.227  245.097   27.298 36.13824 29.15079 
1 1 1   23   24   10 o  261.602   9.8009   52.719   3.9244   53.895   4.2550   46.023   10.155  264.372   10.515  237.292   28.532 27.08076 30.40798 
1 1 1   23   24   11 o  204.822   11.666   32.512   3.6422   33.863   3.9292   24.263   9.7089  208.894   12.343  166.696   38.782 42.19850 40.69898 
1 1 1   23   24   12 o  280.362   9.4426   60.533   4.0521   61.175   4.3688   56.582   10.841  281.711   10.132  263.930   27.225 17.78070 29.04956 
1 1 1   23   24   13 o  277.466   9.5794   59.306   4.0684   56.569   4.3612   77.655   11.292  270.806   10.522  311.453   23.869 -40.64685 26.08532 
1 1 1   23   24   14 o  168.751   13.881   22.243   3.5537   21.753   3.7552   26.447   10.997  166.619   14.881  172.047   42.103 -5.427994 44.65580 
1 1 1   23   24   15 o  168.756   13.806   22.246   3.5350   22.142   3.7442   23.096   10.725  168.134   14.697  160.109   42.897 8.024841 45.34449 
1 1 1   23   24   16 o  202.201   12.167   31.754   3.7480   32.602   3.9450   23.887   12.012  204.775   12.648  161.087   46.272 43.68777 47.96930 
1 1 1   23   24   17 o  296.612   10.891   67.954   4.9445   67.175   5.3596   72.403   12.814  294.651   11.884  297.202   28.519 -2.550476 30.89620 
1 1 1   23   24   18 o  233.790   15.509   42.809   5.5182   45.431   6.2305   33.270   11.884  240.309   17.050  192.915   41.480 47.39346 44.84750 
1 1 1   23   24   19 o  148.102   24.108   17.969   5.2770   22.220   5.9846   3.1181   11.187  164.874   24.456   98.882   42.108 65.99114 48.69436 
1 1 1   23   24   20 o   83.175   30.508   4.9012   5.0856   6.7245   5.7413  -1.7411   10.958   93.042   32.619   88.173   39.467 4.869690 51.20231 
1 1 1   23   24   21 o  112.624   30.546   10.851   5.3988   11.745   6.2595   8.2530   10.668  116.570   33.379  109.590   43.201 6.980133 54.59383 
1 1 1   23   24   22 o  261.172   18.206   53.982   7.2323   53.982   7.2323   0.0000   0.0000  261.172   18.206  ?   ?  0.000000 18.20569 
1 1 1   23   24   23 o  373.244   9.0616  107.422   5.1769  107.422   5.1769   0.0000   0.0000  373.244   9.0616  ?   ?  0.000000 9.061613 
1 1 1   23   24   24 o  298.449   9.3433   68.732   4.2682   68.864   4.4886   67.481   13.789  298.609   9.8207  281.823   32.565 16.78558 34.01313 
1 1 1   23   24   25 o  308.526   9.5887   73.509   4.5281   75.677   4.7702   53.759   14.397  312.932   9.9591  244.906   39.772 68.02641 40.99980 
1 1 1   23   24   26 o  211.885   11.891   34.963   3.8409   32.771   3.9943   61.872   13.995  204.831   12.804  266.464   35.173 -61.63286 37.43095 
1 1 1   23   24   27 o   94.330   22.653   7.4512   3.2295   9.2633   3.3498 -16.4326   12.161  105.744   21.430   71.708   34.869 34.03557 40.92757 
1 1 1   23   24   28 o  194.800   12.609   29.680   3.7394   30.456   3.9940   24.169   10.643  197.097   13.317  158.933   42.797 38.16344 44.82101 
1 1 1   23   24   29 o  116.204   21.076   11.165   3.6106   11.135   3.8929   11.350   9.6570  115.353   22.857  113.833   41.996 1.519325 47.81322 
1 1 1   23   24   30 o  218.088   14.202   37.474   4.7150   41.383   5.4258   25.421   9.5284  228.558   15.603  164.955   38.449 63.60260 41.49400 
1 1 1   23   24   31 o  312.793   10.596   76.009   5.0732   79.662   5.8984   65.627   9.9448  319.518   12.061  282.010   23.246 37.50833 26.18842 
1 1 1   23   24   32 o  145.099   18.616   17.129   4.0390   17.355   4.5204   16.235   8.9949  144.947   20.986  128.957   40.731 15.99007 45.81956 
1 1 1   23   24   33 f  106.266   21.566   9.5119   3.3880   11.871   4.5502   6.5763   5.0754  116.884   26.094   88.386   30.687 28.49817 40.28117 
1 1 1   23   24   34 o  209.236   11.923   34.359   3.8026   31.486   5.1275   37.870   5.6683  197.683   17.115  216.850   17.219 -19.16713 24.27815 
1 1 1   23   24   35 o  168.468   20.028   23.462   5.0633   23.462   5.0633   0.0000   0.0000  168.468   20.028  ?   ?  0.000000 20.02806 
1 1 1   23   24   36 o  114.887   19.249   11.025   3.2651   16.674   4.8509   6.3449   4.4150  139.210   23.610   85.125   28.645 54.08492 37.12100 
1 1 1   23   24   37 o   49.806   21.726  -0.0387   3.1202   2.0360   4.5198  -1.9278   4.3128   65.700   27.292   52.139   23.896 13.56033 36.27449 
1 1 1   23   24   38 o  214.958   11.189   36.400   3.6686   39.577   5.4354   33.741   4.9719  220.800   16.196  203.891   16.061 16.90808 22.80945 
1 1 1   23   24   39 o  125.797   23.615   13.928   4.3801   16.056   10.821   13.511   4.7901  116.809   44.174  121.889   26.436 -5.079536 51.48045 
1 1 1   23   25    0 o   68.995   41.074   4.5016   7.6084   4.5016   7.6084   4.5016   7.6084   68.995   41.074   68.995   41.074 0.000000 0.000000 
1 1 1   23   25    1 o  214.611   17.161   36.163   5.5902   29.025   7.8080   43.670   8.0073  188.137   27.965  233.885   22.651 -45.74860 35.98749 
1 1 1   23   25    2 o  196.092   19.031   30.408   5.6402   27.472   7.6054   33.995   8.4076  182.895   28.064  204.005   27.637 -21.11043 39.38734 
1 1 1   23   25    3 o  361.367   12.135  100.937   6.7120  100.610   8.9233  101.363   10.186  359.387   16.222  359.304   18.584 0.8352661E-01 24.66825 
1 1 1   23   25    4 o  122.300   28.061   12.496   5.1415   20.414   6.6829   1.0127   8.0483  156.814   28.908   83.224   35.584 73.59026 45.84636 
1 1 1   23   25    5 o  304.044   10.033   71.235   4.6692   69.918   5.2643   76.093   10.109  300.913   11.430  309.807   21.451 -8.894135 24.30563 
1 1 1   23   25    6 o  181.221   16.333   25.791   4.4818   25.791   4.4818   0.0000   0.0000  181.221   16.333  ?   ?  0.000000 16.33311 
1 1 1   23   25    7 o   72.544   24.491   3.9701   3.2274   3.8966   3.4714   4.4385   8.7635   72.961   25.376   95.142   38.592 -22.18085 46.18747 
1 1 1   23   25    8 o   82.652   24.622   5.5411   3.3479   4.6333   3.6069   11.190   8.9977   77.625   25.892  117.266   40.850 -39.64106 48.36469 
1 1 1   23   25    9 o  481.170   7.7036  177.936   5.6736  183.375   6.3677  156.985   12.497  488.240   8.5208  447.651   18.239 40.58911 20.13104 
1 1 1   23   25   10 o  260.908   9.9446   52.468   3.9714   51.712   4.2881   57.025   10.529  258.853   10.823  265.352   26.268 -6.499176 28.41047 
1 1 1   23   25   11 f  333.097   8.6219   85.376   4.3959   84.349   4.7836   90.954   11.147  330.908   9.4444  338.370   21.636 -7.461182 23.60712 
1 1 1   23   25   12 o  356.218   8.5691   97.643   4.6722  100.701   5.1050   81.862   11.596  361.599   9.2235  319.568   23.879 42.03119 25.59799 
1 1 1   23   25   13 o  158.718   14.580   19.746   3.5025   18.822   3.7209   26.927   10.376  154.569   15.957  174.587   39.724 -20.01785 42.80937 
1 1 1   23   25   14 o  248.800   10.474   47.774   3.9886   50.565   4.2807   29.392   10.986  255.869   10.930  182.001   40.482 73.86832 41.93151 
1 1 1   23   25   15 o  230.312   12.734   41.233   4.4717   41.780   4.8138   37.788   12.078  231.577   13.641  207.457   39.478 24.11975 41.76829 
1 1 1   23   25   16 o  164.634   16.708   21.411   4.1519   22.352   4.4259   14.513   11.985  168.008   17.466  130.203   46.974 37.80547 50.11595 
1 1 1   23   25   17 o   73.483   25.030   4.0954   3.3714   3.8523   3.5052   7.0982   12.319   72.534   25.484  110.980   45.473 -38.44566 52.12666 
1 1 1   23   25   18 o  140.039   25.235   16.221   5.2101   12.511   5.7962   31.830   11.889  120.768   31.152  187.311   42.451 -66.54346 52.65434 
1 1 1   23   25   19 o   64.241   27.961  -0.2671   5.1437  -0.1342   5.7795  -0.7734   11.280   68.275   29.678   90.987   40.430 -22.71207 50.15387 
1 1 1   23   25   20 o  176.161   21.421   25.029   5.6569   23.449   6.5037   29.938   11.465  168.426   26.070  181.149   42.142 -12.72351 49.55414 
1 1 1   23   25   21 f  167.792   26.598   23.378   6.6032   23.378   6.6032   0.0000   0.0000  167.792   26.598  ?   ?  0.000000 26.59781 
1 1 1   23   25   22 o   64.021   29.193  -2.9977   6.3310  -2.9977   6.3310   0.0000   0.0000   64.021   29.193  ?   ?  0.000000 29.19322 
1 1 1   23   25   23 f   97.091   32.913   7.7336   5.8290   5.0680   6.5072   18.560   13.114   87.921   34.003  140.078   49.287 -52.15701 59.87833 
1 1 1   23   25   24 o  188.859   12.273   27.824   3.5286   29.386   3.6630   7.6883   13.151  194.074   12.396  111.923   46.528 82.15047 48.15052 
1 1 1   23   25   25 o   60.262   22.974   2.1917   2.9417   2.4037   3.0195  -1.7647   13.045   61.849   23.348   93.578   42.370 -31.72859 48.37728 
1 1 1   23   25   26 o   91.253   22.642   6.9829   3.1475   8.8185   3.2637 -17.4303   11.902  103.072   21.388   69.600   33.987 33.47211 40.15668 
1 1 1   23   25   27 o   98.252   22.702   8.1105   3.3454   7.4956   3.5433   13.157   10.151   94.032   24.406  120.342   43.254 -26.30939 49.66439 
1 1 1   23   25   28 o  136.195   17.900   14.971   3.6411   14.888   3.9713   15.407   9.1200  135.061   19.798  127.595   41.090 7.465561 45.61049 
1 1 1   23   25   29 o  277.071   11.348   59.734   4.8125   66.921   5.5703   38.578   9.5569  292.786   12.430  210.766   30.512 82.02045 32.94646 
1 1 1   23   25   30 o   76.735   25.854   4.7629   3.5965   6.9026   3.8932  -7.6893   9.3921   89.624   26.518   69.440   32.927 20.18375 42.27707 
1 1 1   23   25   31 o   46.254   22.887 -12.2655   6.0063 -22.5371   8.3037  -0.9939   8.6985   48.899   24.599   77.530   34.897 -28.63112 42.69572 
1 1 1   23   25   32 o  148.433   16.694   17.756   3.7270   22.789   4.4631   6.1620   6.7743  167.898   17.630   89.835   34.708 78.06377 38.92881 
1 1 1   23   25   33 o   83.003   25.844   5.9193   3.6350   3.1639   4.3834   11.986   6.5044   70.623   27.739  112.907   34.475 -42.28327 44.24857 
1 1 1   23   25   34 o   97.458   23.059   8.2172   3.3861   8.0328   4.3597   8.4975   5.3758   94.697   28.071   96.634   31.580 -1.937096 42.25234 
1 1 1   23   25   35 o   53.507   23.204   0.1745   3.5166  -1.4624   4.7345   2.1890   5.2522   56.169   25.470   69.717   29.227 -13.54853 38.76761 
1 1 1   23   25   36 o   47.985   21.837  -1.4481   3.5197  -2.3860   4.6652  -0.2089   5.3627   53.204   24.554   62.656   27.857 -9.452118 37.13413 
1 1 1   23   25   37 o   91.480   24.703   7.4967   3.5401   4.7001   4.8177   10.779   5.2191   76.992   29.389  106.447   30.479 -29.45505 42.34045 
1 1 1   23   25   38 o   97.960   25.195   8.6884   3.7991   7.7668   7.5964   8.9958   4.3871   92.240   36.425   98.277   27.877 -6.036469 45.86813 
1 1 1   23   26    0 o  415.787   16.538  134.209   10.487  134.209   10.487  134.209   10.487  415.787   16.538  415.787   16.538 0.000000 0.000000 
1 1 1   23   26    1 o  186.070   19.005   27.435   5.3368   29.091   7.5473   25.778   7.5473  188.582   26.910  176.455   28.948 12.12752 39.52417 
1 1 1   23   26    2 o  190.856   19.138   28.866   5.5156   31.181   7.4981   26.136   8.1420  195.900   25.620  176.638   31.258 19.26166 40.41621 
1 1 1   23   26    3 o  176.964   21.026   25.034   5.5837   26.672   7.4228   22.898   8.4743  180.014   27.838  163.402   34.941 16.61183 44.67441 
1 1 1   23   26    4 o  226.939   20.701   40.931   7.1117   40.931   7.1117   0.0000   0.0000  226.939   20.701  ?   ?  0.000000 20.70146 
1 1 1   23   26    5 o   67.099   29.874  -1.6066   6.1888  -1.6066   6.1888   0.0000   0.0000   67.099   29.874  ?   ?  0.000000 29.87389 
1 1 1   23   26    6 o   80.218   26.410   5.0246   3.7573   6.8791   4.2238  -2.0066   8.2246   91.626   27.738   76.757   34.287 14.86897 44.10168 
1 1 1   23   26    7 o  219.269   11.554   37.257   3.8640   38.085   4.2314   33.101   9.4803  221.459   12.534  198.505   32.313 22.95390 34.65919 
1 1 1   23   26    8 o  289.299   9.6644   64.497   4.2795   68.845   4.7129   44.065   10.216  298.750   10.307  231.065   29.563 67.68480 31.30816 
1 1 1   23   26    9 o  240.328   10.847   44.594   3.9900   45.385   4.3484   40.376   10.037  242.273   11.726  220.436   30.571 21.83708 32.74288 
1 1 1   23   26   10 o  273.769   9.8979   57.788   4.1476   57.110   4.5229   61.373   10.399  271.952   10.866  275.784   24.905 -3.831909 27.17196 
1 1 1   23   26   11 o  219.706   11.505   37.419   3.8556   36.800   4.1658   41.119   10.183  217.610   12.560  222.181   30.768 -4.571594 33.23277 
1 1 1   23   26   12 o  343.993   8.8808   91.122   4.6760   91.475   5.1274   89.382   11.397  344.445   9.7254  334.552   22.385 9.892975 24.40677 
1 1 1   23   26   13 o  222.656   11.745   38.463   3.9884   37.580   4.2734   44.432   11.107  219.809   12.757  229.751   32.491 -9.942459 34.90536 
1 1 1   23   26   14 o  137.518   20.772   15.278   4.2360   13.943   4.5879   22.993   11.027  130.180   23.906  158.342   43.947 -28.16179 50.02866 
1 1 1   23   26   15 o  356.829   9.0650   98.113   4.9510   97.792   5.3464  100.045   13.119  356.038   9.8106  352.138   24.492 3.900177 26.38411 
1 1 1   23   26   16 o  204.485   12.516   32.543   3.8985   34.677   4.1563   16.922   11.245  210.989   12.932  136.731   45.717 74.25826 47.51130 
1 1 1   23   26   17 f  138.903   17.635   15.385   3.6648   17.334   3.8756  -1.0852   11.265  147.601   17.495   90.325   40.253 57.27653 43.89078 
1 1 1   23   26   18 o   61.951   27.436  -1.0594   5.1527  -3.2971   5.7867   7.5076   11.322   60.282   27.647  108.904   43.974 -48.62146 51.94246 
1 1 1   23   26   19 o   80.320   30.761   4.1202   5.2887   1.1452   5.9404   15.491   11.614   72.730   30.816  131.452   46.368 -58.72186 55.67465 
1 1 1   23   26   20 o  123.717   33.417   13.384   6.4771   13.384   6.4771   0.0000   0.0000  123.717   33.417  ?   ?  0.000000 33.41695 
1 1 1   23   26   21 o   57.509   27.123  -5.8853   6.2153  -5.8853   6.2153   0.0000   0.0000   57.509   27.123  ?   ?  0.000000 27.12316 
1 1 1   23   26   22 o  192.289   20.926   29.838   6.0596   30.764   6.8167   26.352   13.230  194.052   23.424  163.420   49.004 30.63124 54.31494 
1 1 1   23   26   23 o  156.470   33.100   21.460   7.6798   19.416   9.1982   26.164   13.954  144.865   40.112  161.005   50.719 -16.14008 64.66393 
1 1 1   23   26   24 o   74.192   32.799  -0.5695   7.3320  -1.9868   9.1945   1.9058   12.151   79.295   35.767   96.936   42.563 -17.64091 55.59576 
1 1 1   23   26   25 o  107.536   21.148   9.5804   3.3568   10.550   3.5166  -0.3707   11.265  112.990   21.110   89.568   40.059 23.42212 45.28082 
1 1 1   23   26   26 o  312.680   9.5214   75.635   4.5569   80.504   5.0314   53.411   10.749  322.333   10.198  251.155   28.464 71.17827 30.23547 
1 1 1   23   26   27 f   49.879   21.910  -0.4690   3.2228  -0.2105   3.4485  -2.2522   9.0573   52.521   22.877   77.321   35.126 -24.79947 41.91895 
1 1 1   23   26   28 o  187.556   14.756   27.854   4.2021   32.508   4.7205   10.089   9.2224  202.434   15.349  108.153   40.810 94.28099 43.60125 
1 1 1   23   26   29 o  219.938   12.820   37.982   4.2970   46.296   4.8356   6.7763   9.3683  242.775   13.061   98.160   39.871 144.6151 41.95614 
1 1 1   23   26   30 o   74.876   25.700   4.4917   3.5549   4.4140   3.8758   4.9034   8.9226   75.273   26.761   91.683   38.237 -16.41091 46.67155 
1 1 1   23   26   31 o   90.876   25.498   7.1747   3.6911   9.1729   4.1120  -1.1153   8.3754  102.350   26.151   75.505   34.090 26.84561 42.96518 
1 1 1   23   26   32 o   69.886   26.171   3.5278   3.7782   3.6209   4.1460   3.0719   9.1747   71.642   27.284   86.540   37.505 -14.89812 46.37902 
1 1 1   23   26   33 o  196.223   13.764   30.598   4.1078   32.917   5.0369   25.991   7.0985  202.001   16.433  171.307   28.042 30.69359 32.50261 
1 1 1   23   26   34 o  144.040   20.083   17.348   4.3073   13.611   4.7108   36.404   10.637  124.079   25.652  192.427   37.463 -68.34809 45.40320 
1 1 1   23   26   35 o  190.558   11.811   28.681   3.4281   32.755   5.1513   25.442   4.5927  200.500   16.944  176.376   17.232 24.12332 24.16711 
1 1 1   23   26   36 o   45.137   20.463  -1.1681   3.0536  -0.5791   4.4842  -1.6775   4.1698   56.605   25.299   51.624   23.599 4.981117 34.59692 
1 1 1   23   27    0 o  498.883   15.211  192.655   11.591  192.655   11.591  192.655   11.591  498.883   15.211  498.883   15.211 0.000000 0.000000 
1 1 1   23   27    1 o  240.490   21.901   46.192   7.9734   46.192   7.9734   0.0000   0.0000  240.490   21.901  ?   ?  0.000000 21.90087 
1 1 1   23   27    2 o   65.007   29.692  -3.4522   6.5831  -3.4522   6.5831   0.0000   0.0000   65.007   29.692  ?   ?  0.000000 29.69159 
1 1 1   23   27    3 o  230.132   16.647   41.582   5.8244   49.571   7.5666   29.966   9.1242  250.048   19.936  188.225   32.866 61.82315 38.43947 
1 1 1   23   27    4 o   72.474   29.347   2.2421   5.0586   3.8955   6.2414  -0.9236   8.6362   83.774   33.037   80.832   35.673 2.942467 48.62080 
1 1 1   23   27    5 o  289.145   13.664   64.899   6.0471   64.686   7.5913   65.269   10.003  286.941   17.366  285.443   23.093 1.498352 28.89445 
1 1 1   23   27    6 o   38.732   19.255 -10.6388   4.4439  -7.2705   5.2252 -19.4443   8.4484   49.124   23.634   53.340   26.522 -4.215351 35.52407 
1 1 1   23   27    7 o  152.052   15.925   18.228   3.6513   19.206   4.0258   13.694   8.6688  155.755   17.172  125.520   40.022 30.23590 43.55083 
1 1 1   23   27    8 o  137.378   17.831   15.032   3.6610   15.417   4.0057   13.082   9.0210  138.666   19.404  123.288   40.939 15.37819 45.30462 
1 1 1   23   27    9 o  273.495   10.265   57.727   4.2970   58.916   4.8156   53.081   9.5185  276.029   11.398  256.251   24.569 19.77802 27.08421 
1 1 1   23   27   10 o  162.731   15.272   20.819   3.7594   20.539   4.1564   22.080   8.8145  161.080   17.120  158.585   36.991 2.494919 40.76122 
1 1 1   23   27   11 o  511.946   7.9382  201.618   6.2203  204.444   7.0376  191.526   13.299  515.171   8.9248  494.024   17.588 21.14709 19.72273 
1 1 1   23   27   12 o   59.849   24.367   1.3335   3.5093   1.9349   3.7573  -2.7755   9.8208   64.038   25.513   81.825   36.932 -17.78736 44.88700 
1 1 1   23   27   13 o  143.851   20.355   16.677   4.3566   20.176   4.8352   1.5793   10.043  158.436   20.413   91.452   39.437 66.98310 44.40702 
1 1 1   23   27   14 o  295.873   10.199   67.597   4.6189   73.624   5.0411   36.065   11.530  308.652   10.671  202.131   38.678 106.5215 40.12275 
1 1 1   23   27   15 o   64.794   25.185   2.3253   3.5838   2.9979   3.8193  -2.6305   10.367   69.248   26.231   84.042   37.938 -14.79347 46.12276 
1 1 1   23   27   16 o  177.609   14.618   24.760   3.9386   25.180   4.2299   22.023   10.801  178.807   15.612  154.048   43.757 24.75900 46.45828 
1 1 1   23   27   17 o   98.682   24.750   8.1620   3.7318   6.8960   3.9587   18.268   11.185   90.933   26.693  140.309   45.536 -49.37608 52.78337 
1 1 1   23   27   18 o   88.518   34.062   5.1982   6.5039   8.9288   8.0411  -1.8597   11.060  105.706   38.424   87.622   39.403 18.08369 55.03683 
1 1 1   23   27   19 o   96.475   37.352   6.4187   7.8587   6.4187   7.8587   0.0000   0.0000   96.475   37.352  ?   ?  0.000000 37.35209 
1 1 1   23   27   20 o   90.343   35.064   5.4241   6.9386   2.6908   8.0891   13.035   13.498   85.958   36.165  124.945   48.791 -38.98695 60.73282 
1 1 1   23   27   21 o  149.710   32.445   19.595   7.2201   26.804   8.7245   3.9275   12.862  174.907   33.811  103.197   44.565 71.71071 55.93969 
1 1 1   23   27   22 o  101.079   33.317   8.7028   5.9788   15.330   6.9366 -10.4469   11.791  131.034   34.215   76.811   36.558 54.22288 50.07153 
1 1 1   23   27   23 o  108.508   32.692   10.347   5.8776   12.832   7.1068   4.9674   10.456  119.308   35.949   98.248   41.214 21.05933 54.68938 
1 1 1   23   27   24 o  127.497   31.558   14.386   6.1255   9.8155   7.7483   22.004   10.003  106.759   37.850  151.647   41.766 -44.88847 56.36509 
1 1 1   23   27   25 o   79.930   31.381   4.0502   5.6077   0.9967   7.5082   7.9020   8.4329   78.076   33.882  100.663   38.771 -22.58743 51.49006 
1 1 1   23   27   26 o   97.602   22.585   8.0503   3.3071   5.8521   3.5870   20.508   8.5393   83.354   25.627  147.968   37.620 -64.61333 45.51953 
1 1 1   23   27   27 o  167.917   15.185   22.416   3.8605   25.596   4.2829   8.6351   8.9151  179.262   15.769  102.951   39.805 76.31133 42.81458 
1 1 1   23   27   28 o   75.389   25.048   4.6306   3.3768   4.8008   3.6419   3.5877   9.0147   76.925   26.016   88.850   37.816 -11.92516 45.90107 
1 1 1   23   27   29 o  149.477   17.814   18.120   3.9954   19.171   4.4725   13.967   8.8908  152.955   19.551  119.800   40.648 33.15512 45.10554 
1 1 1   23   27   30 o  215.251   13.475   36.614   4.4174   41.960   5.0394   18.880   9.1787  229.984   14.388  136.882   40.766 93.10272 43.23091 
1 1 1   23   27   31 o   86.084   26.197   6.4766   3.7603   8.8012   4.1789  -3.4145   8.6201   99.455   26.832   71.420   33.107 28.03536 42.61506 
1 1 1   23   27   32 o   80.362   26.554   5.5552   3.7969   6.0900   4.2559   3.4691   8.4056   83.719   28.125   84.233   36.199 -0.5137405 45.84095 
1 1 1   23   27   33 o   72.817   27.919   3.9003   4.3595   3.9003   4.3595   0.0000   0.0000   72.817   27.919  ?   ?  0.000000 27.91862 
1 1 1   23   27   34 o   75.780   26.780   4.8170   3.8755   3.3034   4.4563   9.5151   7.8511   70.244   27.848   99.431   37.622 -29.18726 46.80681 
1 1 1   23   27   35 o  132.432   29.116   16.293   5.7413   13.619   8.0591   19.049   8.1811  113.408   38.699  134.905   37.999 -21.49780 54.23605 
1 1 1   23   28    1 o  148.429   37.294   19.397   8.4623   0.0000   0.0000   19.397   8.4623  ?   ?   148.429   37.294 0.000000 37.29390 
1 1 1   23   28    2 o  116.674   39.435   11.482   8.3676   0.0000   0.0000   11.482   8.3676  ?   ?   116.674   39.435 0.000000 39.43469 
1 1 1   23   28    3 o  219.941   17.111   38.106   5.7149   31.406   7.3343   48.460   9.1180  196.375   24.965  244.640   24.688 -48.26515 35.11040 
1 1 1   23   28    4 o  238.928   15.856   44.761   5.7658   44.696   7.3651   44.865   9.2667  236.865   20.517  234.445   26.276 2.419876 33.33705 
1 1 1   23   28    5 o   86.867   30.131   5.7947   4.8927   4.9401   5.9946   7.5001   8.4681   86.508   32.840  102.703   39.021 -16.19435 51.00108 
1 1 1   23   28    6 o  148.991   22.992   18.078   5.0747   22.625   6.1956   8.8074   8.8458  166.116   25.154  107.793   40.109 58.32303 47.34386 
1 1 1   23   28    7 o  132.586   20.770   14.227   4.0766   20.118   4.6207  -6.4582   8.6591  158.605   19.441   70.124   32.733 88.48113 38.07077 
1 1 1   23   28    8 o  246.356   12.429   47.161   4.6715   49.184   5.3659   40.827   9.4950  251.085   14.018  222.074   28.598 29.01161 31.84924 
1 1 1   23   28    9 o  265.095   11.743   54.409   4.7649   54.486   5.4852   54.173   9.6188  264.432   13.598  258.543   24.603 5.889587 28.11094 
1 1 1   23   28   10 o  365.869   10.010  103.323   5.6059  101.811   6.4414  108.045   11.382  362.652   11.604  368.834   20.238 -6.181976 23.32927 
1 1 1   23   28   11 o  251.472   14.616   49.450   5.6018   53.185   6.7071   40.837   10.186  259.886   16.954  220.357   31.061 39.52879 35.38696 
1 1 1   23   28   12 o  248.193   15.057   48.249   5.6929   48.103   6.6344   48.658   11.086  246.751   17.683  240.858   30.774 5.892807 35.49311 
1 1 1   23   28   13 o  258.591   11.984   51.833   4.7434   52.186   5.2762   50.343   10.832  258.744   13.368  245.845   29.368 12.89836 32.26711 
1 1 1   23   28   14 o  203.496   14.454   32.449   4.4728   31.972   4.9081   34.785   10.864  201.443   16.051  198.915   37.044 2.527679 40.37201 
1 1 1   23   28   15 o  251.273   12.821   49.185   4.9148   49.634   5.4255   47.133   11.603  251.948   14.126  234.748   33.221 17.20013 36.09916 
1 1 1   23   28   16 o  112.651   24.267   10.607   4.0607   11.254   4.3907   6.7820   10.676  115.694   25.483  104.789   42.564 10.90479 49.60923 
1 1 1   23   28   17 o  315.682   10.027   77.025   4.8449   80.254   5.3065   60.855   11.876  321.987   10.767  269.648   29.243 52.33926 31.16217 
1 1 1   23   28   18 o  101.695   34.013   8.7050   6.2241   8.7050   6.2241   0.0000   0.0000  101.695   34.013  ?   ?  0.000000 34.01254 
1 1 1   23   28   19 o  145.692   26.587   17.878   5.7105   25.313   6.7797  -0.2800   10.595  174.150   26.249   88.098   39.163 86.05204 47.14595 
1 1 1   23   28   20 o   56.520   26.209  -3.7341   5.4092  -5.0234   6.4043  -0.5246   10.104   59.894   28.021   85.593   38.135 -25.69829 47.32276 
1 1 1   23   28   21 o  134.632   28.813   15.637   5.7582   20.953   7.0492   4.9768   9.9822  155.294   30.744   96.972   40.443 58.32215 50.80230 
1 1 1   23   28   22 o   92.828   32.223   7.0963   5.5962   7.2807   7.0898   6.7914   9.1150   96.334   35.895   99.197   39.665 -2.862587 53.49569 
1 1 1   23   28   23 o   89.832   31.835   6.5301   5.4807   8.0738   7.2673   4.4940   8.3460   99.225   36.458   90.295   37.262 8.930733 52.13136 
1 1 1   23   28   24 f   53.762   25.410  -5.2139   5.5074  -2.4250   7.3019  -8.8940   8.3877   69.163   31.466   63.477   30.382 5.686119 43.73951 
1 1 1   23   28   25 o  145.492   26.603   18.136   5.7059   15.783   7.8239   20.809   8.3396  129.532   37.384  149.404   36.727 -19.87206 52.40684 
1 1 1   23   28   26 o  140.301   33.082   17.892   6.9886   17.176   11.815   18.277   8.6675  130.052   46.672  137.739   39.223 -7.686203 60.96486 
1 1 1   23   28   27 o   78.634   25.201   5.1685   3.4338   5.0170   3.7555   5.9406   8.4797   78.249   26.419   93.301   37.920 -15.05177 46.21517 
1 1 1   23   28   28 o  143.128   17.619   16.640   3.7783   19.434   4.2744   6.6587   8.0801  154.402   18.452   93.936   37.416 60.46603 41.71893 
1 1 1   23   28   29 o   85.830   25.305   6.4049   3.5509   8.4454   3.9520  -2.1440   8.0891   97.903   25.952   71.767   32.830 26.13604 41.84933 
1 1 1   23   28   30 o   58.819   24.477   1.2942   3.6448   4.3278   4.1028 -10.0610   7.9379   74.555   27.394   58.415   28.350 16.14035 39.42289 
1 1 1   23   28   31 o   72.618   26.246   4.1886   3.7439   1.7752   4.2546   12.470   7.8813   63.738   26.478  111.489   38.266 -47.75093 46.53384 
1 1 1   23   28   32 o  203.537   16.183   33.539   5.0001   33.539   5.0001   0.0000   0.0000  203.537   16.183  ?   ?  0.000000 16.18333 
1 1 1   23   28   33 o  112.260   23.739   11.085   3.9516   17.499   4.5329  -9.2224   8.0658  143.425   21.295   59.204   28.698 84.22113 35.73536 
1 1 1   23   29    0 o  254.845   24.955   52.375   9.5200   52.375   9.5200   52.375   9.5200  254.845   24.955  254.845   24.955 0.000000 0.000000 
1 1 1   23   29    1 o  145.445   26.710   17.614   5.7270   16.640   7.8379   18.729   8.3886  137.329   36.618  145.339   37.469 -8.010925 52.39095 
1 1 1   23   29    2 o  177.188   21.967   25.341   5.8298   25.345   7.7724   25.336   8.8149  173.312   30.409  170.914   34.876 2.397659 46.27120 
1 1 1   23   29    3 o  181.766   21.064   26.548   5.7517   35.519   7.8147   15.943   8.4962  208.718   24.956  133.767   39.059 74.95055 46.35134 
1 1 1   23   29    4 o  312.705   20.272   77.759   9.6506   0.0000   0.0000   77.759   9.6506  ?   ?   312.705   20.272 0.000000 20.27199 
1 1 1   23   29    5 o  102.718   38.686   7.7523   8.2784   0.0000   0.0000   7.7523   8.2784  ?   ?   102.718   38.686 0.000000 38.68632 
1 1 1   23   29    6 f  149.847   38.201   20.037   8.7882   0.0000   0.0000   20.037   8.7882  ?   ?   149.847   38.201 0.000000 38.20083 
1 1 1   23   29    7 o   94.502   34.285   6.7421   6.3976  -3.4333   9.0361   16.969   9.0590   76.969   35.012  137.222   40.408 -60.25363 53.46595 
1 1 1   23   29    8 o  254.406   11.404   50.102   4.4408   53.851   4.9741   35.378   9.8580  263.498   12.333  203.746   32.717 59.75140 34.96476 
1 1 1   23   29    9 o  285.028   12.456   63.040   5.4341   61.050   6.2511   69.194   10.994  279.392   14.669  291.837   24.848 -12.44418 28.85468 
1 1 1   23   29   10 o   67.556   27.429   1.9228   4.4316   4.3129   4.9223  -8.3038   10.182   79.777   29.873   73.961   34.832 5.815475 45.88720 
1 1 1   23   29   11 o  130.824   20.190   13.870   3.9127   12.380   4.2021   23.585   10.729  122.375   23.285  159.398   42.990 -37.02334 48.89079 
1 1 1   23   29   12 o   56.025   24.143   0.0066   3.7589  -0.6136   4.0512   3.8456   10.079   55.947   24.571   96.019   40.382 -40.07222 47.26978 
1 1 1   23   29   13 o  113.089   23.962   10.672   4.0188   12.992   4.3531  -2.7190   10.458  125.206   23.579   83.676   37.907 41.53059 44.64212 
1 1 1   23   29   14 o  512.651   8.5470  202.585   6.7066  213.982   7.6717  165.644   13.812  526.420   9.5212  456.501   19.767 69.91916 21.94072 
1 1 1   23   29   15 o   85.321   26.738   6.0014   3.8838   4.5591   4.1980   14.569   10.232   78.152   27.844  126.672   43.593 -48.51938 51.72699 
1 1 1   23   29   16 o  334.262   10.685   86.528   5.4667   86.528   5.4667   0.0000   0.0000  334.262   10.685  ?   ?  0.000000 10.68480 
1 1 1   23   29   17 o   90.818   27.255   6.9520   4.0912   6.9520   4.0912   0.0000   0.0000   90.818   27.255  ?   ?  0.000000 27.25530 
1 1 1   23   29   18 o  194.615   19.118   30.416   5.6215   34.285   6.8732   22.597   9.7698  205.078   22.253  155.264   40.637 49.81479 46.33110 
1 1 1   23   29   19 o  185.348   20.026   27.777   5.5911   28.752   6.9285   25.957   9.4672  185.965   24.972  168.447   37.664 17.51759 45.19016 
1 1 1   23   29   20 o  210.619   18.517   35.583   5.9090   37.412   7.4046   32.376   9.8050  213.401   23.035  190.323   34.946 23.07846 41.85442 
1 1 1   23   29   21 o   89.980   31.798   6.5770   5.4640   12.240   6.8190  -3.5821   9.1329  116.079   35.267   75.297   34.606 40.78210 49.40979 
1 1 1   23   29   22 f  125.332   29.305   13.793   5.5213   9.3296   6.9356   21.515   9.1232  103.388   35.874  150.627   39.194 -47.23848 53.13308 
1 1 1   23   29   23 o   82.949   31.294   5.0508   5.4223   2.2337   7.0977   8.9994   8.4029   79.287   33.645  103.530   38.979 -24.24233 51.49123 
1 1 1   23   29   24 o  123.728   29.802   13.592   5.5768   12.153   7.3536   15.539   8.5557  114.448   36.901  127.094   39.662 -12.64570 54.17325 
1 1 1   23   29   25 o   70.835   31.295  -0.1105   6.6646   10.475   11.804  -5.0634   8.0746  111.032   44.876   67.306   31.481 43.72529 54.81723 
1 1 1   23   29   26 o   96.039   32.324   8.1552   5.6218   16.090   8.1592   0.9835   7.7568  128.490   38.474   77.674   34.058 50.81655 51.38300 
1 1 1   23   29   27 o   94.175   32.657   7.8348   5.7471   18.819   8.3857  -1.8946   7.8921  138.224   38.309   71.547   32.613 66.67724 50.31090 
1 1 1   23   29   28 o   64.744   25.253   2.6525   3.6127   2.6196   4.0090   2.7943   8.3330   66.359   26.380   82.906   35.837 -16.54749 44.49882 
1 1 1   23   29   29 o  101.609   24.280   9.0577   3.7247   13.525   4.1718  -8.4977   8.2697  125.775   22.496   61.766   29.720 64.00952 37.27338 
1 1 1   23   29   30 o  142.201   17.523   16.597   3.7333   15.793   4.2358   19.397   7.9025  136.793   20.893  139.442   36.573 -2.649551 42.11975 
1 1 1   23   29   31 o   52.646   23.560  -0.7732   3.9026  -0.7732   3.9026   0.0000   0.0000   52.646   23.560  ?   ?  0.000000 23.56002 
1 1 1   23   29   32 o   99.809   33.093   9.6286   5.8955   11.841   8.3653   7.4455   8.3099  106.961   39.144   92.892   37.615 14.06950 54.28708 
1 1 1   23   30    0 f  255.722   24.563   52.733   9.4104   52.733   9.4104   52.733   9.4104  255.722   24.563  255.722   24.563 0.000000 0.000000 
1 1 1   23   30    1 o  219.392   18.580   38.236   6.1806   31.632   8.3954   46.051   9.1326  194.307   29.125  237.234   25.554 -42.92618 38.74642 
1 1 1   23   30    2 o  223.068   18.027   39.440   6.1025   37.976   8.1604   41.298   9.1919  215.388   25.231  223.425   27.456 -8.037308 37.28826 
1 1 1   23   30    3 o  207.949   18.813   34.416   5.9231   35.990   7.8221   32.301   9.0684  209.797   24.841  194.987   31.455 14.81062 40.08120 
1 1 1   23   30    4 o   80.346   31.010   4.0289   5.4035   6.0996   7.1004   1.1793   8.3294   93.661   35.696   83.505   35.963 10.15565 50.67078 
1 1 1   23   30    5 o  150.386   25.330   18.745   5.6234   12.000   7.2188   29.157   8.9685  117.143   36.411  184.035   33.053 -66.89199 49.17608 
1 1 1   23   30    6 o   44.986   21.694  -6.4277   4.4648  -6.0514   5.1858  -7.5057   8.7778   50.735   24.174   68.605   32.319 -17.86943 40.35933 
1 1 1   23   30    7 o  275.235   13.219   58.936   5.5691   60.705   6.6159   54.634   10.316  278.040   15.609  257.643   26.539 20.39685 30.78927 
1 1 1   23   30    8 o   82.946   29.330   5.2254   4.6497   5.3826   5.2404   4.6437   10.081   85.345   31.020   97.870   40.715 -12.52518 51.18559 
1 1 1   23   30    9 o   66.819   26.265   2.4075   3.9330   1.1225   4.2986   9.0107   9.7444   63.580   26.530  108.831   41.737 -45.25125 49.45510 
1 1 1   23   30   10 o   64.275   25.889   1.8596   3.9139  -0.3505   4.2787   13.186   9.6862   58.276   25.430  122.038   42.392 -63.76211 49.43439 
1 1 1   23   30   11 f  154.206   23.213   19.535   5.3091   20.156   6.2467   17.920   10.076  154.729   27.378  138.525   43.010 16.20457 50.98439 
1 1 1   23   30   12 o  259.069   15.236   52.762   6.0151   54.865   7.1558   47.698   11.105  262.899   17.889  236.453   31.464 26.44539 36.19365 
1 1 1   23   30   13 o  290.605   14.116   65.993   6.2790   72.593   7.6980   52.874   10.853  303.154   16.654  250.890   28.783 52.26312 33.25412 
1 1 1   23   30   14 o  210.729   18.224   35.438   5.8202   35.549   7.0042   35.190   10.462  209.016   22.234  199.286   35.604 9.729736 41.97668 
1 1 1   23   30   15 o  213.265   16.198   36.009   5.2479   36.009   5.2479   0.0000   0.0000  213.265   16.198  ?   ?  0.000000 16.19764 
1 1 1   23   30   16 o  105.273   25.962   9.4681   4.1572   12.957   4.5942  -6.2973   9.7663  123.843   25.096   73.997   34.614 49.84566 42.75423 
1 1 1   23   30   17 o   43.435   20.799  -5.0128   3.9421  -3.7618   4.3760 -10.3998   9.0810   49.352   23.112   65.054   31.262 -15.70232 38.87769 
1 1 1   23   30   18 o   42.160   20.393  -5.9767   4.0204 -10.4228   4.4391   14.315   9.4834   38.604   19.200  123.422   41.980 -84.81799 46.16273 
1 1 1   23   30   19 o  217.462   17.689   37.835   5.8368   43.584   7.2742   27.444   9.7801  231.667   20.733  171.871   38.170 59.79663 43.43780 
1 1 1   23   30   20 o  141.747   27.010   17.246   5.6461   12.263   6.9077   27.275   9.8000  115.771   35.558  170.723   38.430 -54.95213 52.35653 
1 1 1   23   30   21 o  171.971   22.963   24.555   5.8935   29.987   7.4067   15.181   9.7301  188.015   26.470  125.204   42.523 62.81059 50.08896 
1 1 1   23   30   22 o  189.133   20.614   29.268   5.8709   33.568   7.4366   22.155   9.5650  199.902   24.840  150.824   40.554 49.07793 47.55713 
1 1 1   23   30   23 o   72.717   30.200   2.3194   5.5327  -2.9739   7.2026   9.9386   8.6413   67.007   30.773  105.985   39.602 -38.97846 50.15223 
1 1 1   23   30   24 o  203.435   23.545   34.708   7.1961   40.197   12.232   31.802   8.8992  202.950   40.790  188.001   32.077 14.94890 51.89185 
1 1 1   23   30   25 o   70.818   29.818   1.9578   5.5059   1.7938   7.7583   2.1242   7.8150   79.158   34.397   80.174   34.680 -1.015877 48.84548 
1 1 1   23   30   26 o  140.937   28.802   17.800   6.0033   17.494   8.2980   18.136   8.6959  132.164   38.604  133.725   39.646 -1.561035 55.33615 
1 1 1   23   30   27 o   87.766   32.340   6.5521   5.7240   19.583   7.9630  -7.3796   8.2337  141.098   36.571   63.209   30.212 77.88895 47.43586 
1 1 1   23   30   28 o  131.941   30.395   16.122   6.0119   18.880   8.1326   12.800   8.9269  136.718   37.661  111.755   40.506 24.96341 55.30958 
1 1 1   23   30   29 o   50.815   22.665  -0.6805   3.5797  -0.9906   3.9055   0.9487   8.9523   52.062   23.413   79.342   35.582 -27.27956 42.59446 
1 1 1   23   30   30 o  106.728   38.046   11.592   7.8387   11.592   7.8387   0.0000   0.0000  106.728   38.046  ?   ?  0.000000 38.04582 
1 1 1   23   31    0 o  153.994   41.442   22.814   8.4418   22.814   8.4418   22.814   8.4418  153.994   41.442  153.994   41.442 0.000000 0.000000 
1 1 1   23   31    1 o  221.485   18.542   39.062   6.2280   39.124   8.5304   38.992   9.1138  217.624   26.132  215.958   28.249 1.665497 38.48185 
1 1 1   23   31    2 o   69.538   29.504   1.0013   5.4571   5.4606   7.4065  -4.2945   8.0714   91.926   36.072   70.343   32.405 21.58270 48.49018 
1 1 1   23   31    3 o  221.150   18.290   38.914   6.1354   44.686   8.1381   31.312   9.3390  234.604   22.957  190.085   33.313 44.51859 40.45695 
1 1 1   23   31    4 o  184.605   21.323   27.578   5.9141   33.411   7.5881   18.550   9.4394  201.379   25.167  141.568   41.123 59.81076 48.21254 
1 1 1   23   31    5 o  165.120   23.659   22.411   5.8085   23.990   7.2485   19.576   9.7099  168.077   29.237  145.016   41.588 23.06082 50.83644 
1 1 1   23   31    6 o  254.534   14.309   50.773   5.5521   52.235   6.5296   46.954   10.549  257.116   16.682  235.771   29.905 21.34436 34.24277 
1 1 1   23   31    7 o  251.359   14.407   49.547   5.5199   49.982   6.5328   48.460   10.320  251.244   17.089  240.369   28.613 10.87508 33.32805 
1 1 1   23   31    8 o  141.647   23.815   16.629   4.9801   15.659   5.7418   19.576   10.006  135.210   28.635  144.152   42.471 -8.942154 51.22311 
1 1 1   23   31    9 o   91.190   26.551   7.0191   3.9309   4.8595   4.2586   19.454   10.219   79.684   28.081  143.213   43.096 -63.52888 51.43766 
1 1 1   23   31   10 o  101.651   25.462   8.7747   3.9531   8.4768   4.3485   10.193   9.4884   99.533   27.587  110.980   41.492 -11.44756 49.82568 
1 1 1   23   31   11 o  277.386   11.270   59.716   4.7849   60.176   5.2898   57.646   11.223  278.034   12.430  261.801   28.465 16.23239 31.06026 
1 1 1   23   31   12 o  102.912   25.836   9.0377   4.0636   6.9471   4.4771   18.814   9.6814   90.845   28.741  140.728   41.858 -49.88362 50.77488 
1 1 1   23   31   13 o  254.073   13.617   50.608   5.2764   50.608   5.2764   0.0000   0.0000  254.073   13.617  ?   ?  0.000000 13.61746 
1 1 1   23   31   14 o  164.317   19.905   21.909   4.9041   21.909   4.9041   0.0000   0.0000  164.317   19.905  ?   ?  0.000000 19.90501 
1 1 1   23   31   15 o  209.027   14.460   34.445   4.5980   36.804   5.1048   24.301   10.584  215.604   15.574  158.292   42.702 57.31111 45.45276 
1 1 1   23   31   16 o  185.603   16.187   27.414   4.5526   24.993   5.0407   38.126   10.604  175.883   19.027  206.458   34.794 -30.57564 39.65682 
1 1 1   23   31   17 o   48.079   22.502  -3.4978   4.1364  -2.9506   4.6067  -5.7750   9.3971   52.703   24.350   72.612   33.962 -19.90862 41.78914 
1 1 1   23   31   18 o  170.767   17.365   23.411   4.4757   24.845   5.0206   17.863   9.8782  175.163   19.032  134.863   42.694 40.29991 46.74356 
1 1 1   23   31   19 o  264.986   15.435   55.652   6.2334   52.461   7.7395   61.542   10.517  254.284   20.047  270.775   25.682 -16.49030 32.57978 
1 1 1   23   31   20 o   56.112   26.092  -3.6418   5.4181   2.8091   6.6993 -15.8397   9.2122   79.060   33.066   58.828   28.964 20.23102 43.95753 
1 1 1   23   31   21 o  163.575   24.048   22.577   5.8413   25.702   7.3559   17.242   9.6110  171.240   29.106  131.030   42.180 40.20937 51.24747 
1 1 1   23   31   22 o  122.535   30.346   13.592   5.6617   10.077   7.0222   20.122   9.5706  104.649   36.109  140.949   41.541 -36.30051 55.04118 
1 1 1   23   31   23 o   65.411   30.058  -2.6926   6.8860   4.5759   10.606  -7.9886   9.0535   93.509   40.425   66.473   31.747 27.03596 51.40075 
1 1 1   23   31   24 o  109.960   32.320   11.304   5.8004   13.750   7.4818   7.6196   9.1830  118.314   37.117   97.419   39.508 20.89587 54.20870 
1 1 1   23   31   25 o  138.532   28.174   17.203   5.7707   25.967   7.7030   5.9924   8.7120  168.582   30.994   91.573   37.952 77.00915 49.00043 
1 1 1   23   31   26 o  114.747   31.699   12.434   5.7518   19.000   7.7746   4.4950   8.5490  138.613   36.237   86.783   36.879 51.83071 51.70260 
1 1 1   23   31   27 o  156.044   25.978   21.459   5.9866   29.309   7.9681   11.284   9.0713  178.997   30.155  106.183   40.376 72.81313 50.39428 
1 1 1   23   31   28 o   58.046   27.049  -3.2930   5.8734  -3.1263   7.4250  -3.5717   9.6007   65.736   30.559   73.293   34.295 -7.556282 45.93526 
1 1 1   23   32    0 o  199.818   31.331   34.136   8.8793   34.136   8.8793   34.136   8.8793  199.818   31.331  199.818   31.331 0.000000 0.000000 
1 1 1   23   32    1 o  104.639   33.022   9.4936   5.9131   17.204   8.2144   1.2009   8.5187  136.987   37.897   83.340   36.129 53.64653 52.35934 
1 1 1   23   32    2 o  280.207   15.759   61.908   6.7315   60.677   9.2367   63.302   9.8304  273.462   22.261  278.632   23.263 -5.170135 32.19774 
1 1 1   23   32    3 o  225.447   18.628   40.630   6.3705   42.352   8.4272   38.333   9.7313  226.667   24.689  211.343   31.004 15.32419 39.63343 
1 1 1   23   32    4 o  206.901   19.914   34.477   6.2286   33.571   7.9720   35.896   9.9795  200.335   26.660  202.691   33.325 -2.355972 42.67659 
1 1 1   23   32    5 o  286.221   15.960   64.674   6.9644   68.488   9.0524   59.142   10.902  291.787   20.397  266.149   27.141 25.63843 33.95116 
1 1 1   23   32    6 o  172.416   20.389   24.104   5.2765   27.573   6.3722   16.536   9.4111  183.075   23.266  132.492   41.639 50.58260 47.69767 
1 1 1   23   32    7 o  128.871   26.461   14.138   5.0447   12.399   5.8193   19.397   10.120  118.503   31.530  142.115   42.915 -23.61245 53.25280 
1 1 1   23   32    8 o  345.202   11.871   92.703   6.2723   94.415   7.4500   88.535   11.624  347.266   14.016  329.228   23.216 18.03775 27.11850 
1 1 1   23   32    9 o  285.003   13.016   63.412   5.6781   63.373   6.5855   63.528   11.210  283.511   15.231  275.542   26.923 7.969177 30.93311 
1 1 1   23   32   10 o  229.215   13.291   41.192   4.6429   40.722   5.1353   43.293   10.867  227.234   14.846  222.331   32.928 4.902893 36.11980 
1 1 1   23   32   11 o   84.588   28.583   5.8423   4.3959   5.8423   4.3959   0.0000   0.0000   84.588   28.583  ?   ?  0.000000 28.58266 
1 1 1   23   32   12 o  100.136   28.197   8.7001   4.5055   8.7001   4.5055   0.0000   0.0000  100.136   28.197  ?   ?  0.000000 28.19711 
1 1 1   23   32   13 o   52.109   23.784  -2.1255   4.2152  -4.9352   4.6016   12.527   10.508   48.362   22.965  117.444   43.713 -69.08203 49.37817 
1 1 1   23   32   14 o  271.394   12.281   57.467   5.1015   60.976   5.7203   43.830   11.276  279.053   13.393  221.580   34.361 57.47325 36.87898 
1 1 1   23   32   15 o   92.423   27.824   7.3655   4.2589   5.6127   4.6859   15.689   10.212   83.651   29.459  126.879   43.557 -43.22774 52.58371 
1 1 1   23   32   16 o   52.485   24.353  -3.1973   4.6804  -1.6632   5.3193  -8.4573   9.8495   60.219   27.180   70.282   33.440 -10.06363 43.09254 
1 1 1   23   32   17 o  153.843   19.242   19.303   4.4318   17.315   4.9515   27.312   9.9380  143.573   23.333  169.051   39.173 -25.47794 45.59573 
1 1 1   23   32   18 o  203.406   15.107   32.891   4.6698   34.833   5.2579   25.637   10.161  208.557   16.609  161.218   41.065 47.33849 44.29613 
1 1 1   23   32   19 o  306.358   13.418   73.826   6.2920   90.805   8.0426   47.039   10.102  338.211   15.536  232.144   29.067 106.0674 32.95821 
1 1 1   23   32   20 o   76.985   30.339   3.9471   5.2602   1.2529   6.4692   9.2036   9.0363   72.916   31.547  102.771   39.979 -29.85474 50.92682 
1 1 1   23   32   21 o  135.995   32.393   17.164   6.6466   17.938   10.463   16.640   8.6059  129.926   44.097  128.434   39.729 1.491837 59.35411 
1 1 1   23   32   22 o   79.923   32.999   3.7505   6.5506   1.1972   10.210   5.5368   8.5398   84.950   38.055   90.373   37.525 -5.423065 53.44496 
1 1 1   23   32   23 o  107.992   31.421   10.904   5.5070   7.4156   7.1367   16.037   8.6579   93.056   35.711  124.624   40.025 -31.56757 53.64005 
1 1 1   23   32   24 o  167.170   23.311   23.898   5.8023   32.760   7.6906   12.188   8.8404  193.086   26.740  109.811   40.232 83.27516 48.30754 
1 1 1   23   32   25 o   48.911   23.736  -7.6119   5.5612  -7.3988   7.0312  -7.9679   9.0884   57.161   27.479   65.495   31.420 -8.334133 41.74100 
1 1 1   23   33    0 o   47.151   32.778  -6.2239   8.3678  -6.2239   8.3678  -6.2239   8.3678   47.151   32.778   47.151   32.778 0.000000 0.000000 
1 1 1   23   33    1 f  114.340   33.645   11.710   6.2826   11.783   8.5382   11.623   9.2775  114.424   39.798  114.306   41.315 0.1187515 57.36534 
1 1 1   23   33    2 o  230.639   19.556   42.850   6.8387   46.173   9.1276   38.597   10.325  235.309   25.763  209.380   33.336 25.92897 42.13136 
1 1 1   23   33    3 o   66.686   29.324  -0.3394   5.7866  -5.5246   7.6147   6.7472   8.9021   65.131   30.498   98.369   39.245 -33.23777 49.70160 
1 1 1   23   33    4 o  103.185   33.023   9.3244   5.8976   3.2404   7.5640   18.757   9.4185   84.391   35.202  139.992   41.195 -55.60141 54.18699 
1 1 1   23   33    5 o  168.624   25.075   23.819   6.2747   23.952   7.9304   23.595   10.261  164.439   32.659  156.443   41.978 7.996429 53.18605 
1 1 1   23   33    6 o  202.016   17.837   32.683   5.4588   27.898   6.3677   45.947   10.603  183.775   23.151  230.534   30.819 -46.75929 38.54554 
1 1 1   23   33    7 o  118.150   27.527   12.090   4.8858   12.842   5.6687   9.9198   9.6350  120.438   30.668  108.834   41.558 11.60410 51.64871 
1 1 1   23   33    8 o  246.598   14.665   47.958   5.5105   53.716   6.4991   33.232   10.394  260.076   16.410  190.645   36.953 69.43147 40.43254 
1 1 1   23   33    9 o  200.169   19.888   32.479   6.0127   32.479   6.0127   0.0000   0.0000  200.169   19.888  ?   ?  0.000000 19.88811 
1 1 1   23   33   10 o  381.879   12.893  114.025   7.5363  114.025   7.5363   0.0000   0.0000  381.879   12.893  ?   ?  0.000000 12.89332 
1 1 1   23   33   11 o  232.666   13.332   42.537   4.7281   40.829   5.1456   51.801   11.983  227.208   14.878  241.719   33.269 -14.51117 36.44426 
1 1 1   23   33   12 o   90.459   27.488   7.0439   4.1425   7.2480   4.5388   6.0262   10.137   91.706   28.930   98.110   40.823 -6.403931 50.03450 
1 1 1   23   33   13 o  117.611   25.376   11.897   4.4341   10.094   4.8800   20.433   10.619  106.767   29.076  141.888   44.171 -35.12050 52.88147 
1 1 1   23   33   14 o  110.605   25.726   10.606   4.2732   6.7539   4.7422   27.237   9.8543   88.952   29.689  168.624   38.963 -79.67161 48.98519 
1 1 1   23   33   15 o  120.360   24.219   12.398   4.3074   13.669   4.8486   7.6384   9.3817  125.549   26.083   99.637   40.099 25.91155 47.83609 
1 1 1   23   33   16 o   78.354   28.045   4.8817   4.2635   2.2163   4.8242   14.390   9.1116   68.905   28.370  120.536   41.149 -51.63071 49.98051 
1 1 1   23   33   17 o   73.571   27.401   4.0170   4.1305   3.2750   4.6604   6.7349   8.9196   72.154   28.518   95.403   38.845 -23.24879 48.18971 
1 1 1   23   33   18 o  262.632   13.534   54.538   5.4219   66.372   6.6680   31.444   9.3146  288.645   15.145  183.787   34.375 104.8576 37.56388 
1 1 1   23   33   19 o   55.854   24.683  -0.4140   4.1489   3.2632   4.7955 -11.3598   8.2735   72.269   28.813   58.527   28.526 13.74222 40.54507 
1 1 1   23   33   20 f  185.501   25.080   29.642   6.9386   37.402   10.878   24.320   9.0094  196.199   37.590  156.720   37.960 39.47905 53.42282 
1 1 1   23   33   21 o  131.989   28.892   15.813   5.6749   18.962   7.1939   10.626   9.2339  140.944   33.786  105.218   40.558 35.72629 52.78649 
1 1 1   23   33   22 o   57.913   26.699  -2.5228   5.4936   1.1392   6.8371  -9.1942   9.2283   72.931   31.977   64.685   31.192 8.245392 44.67096 
1 1 1   23   33   23 o   78.385   31.154   4.3985   5.5906   9.6816   6.9927  -4.9608   9.3072  100.482   35.922   70.504   33.234 29.97712 48.93727 
1 1 1   23   34    0 o   91.658   49.485   11.106   9.6659   11.106   9.6659   11.106   9.6659   91.658   49.485   91.658   49.485 0.000000 0.000000 
1 1 1   23   34    1 o  168.455   27.899   24.377   6.9417   25.901   9.9556   22.936   9.6840  164.801   39.895  154.317   40.491 10.48354 56.84334 
1 1 1   23   34    2 o  125.978   34.501   14.556   6.8482   7.6253   9.5123   22.014   9.8672  101.280   40.512  150.274   41.520 -48.99387 58.01017 
1 1 1   23   34    3 o  253.023   19.030   51.603   7.3161   56.827   10.168   45.994   10.535  260.199   25.873  229.884   30.708 30.31487 40.15450 
1 1 1   23   34    4 o  158.898   27.617   21.720   6.4729   24.621   8.8308   18.353   9.5158  163.247   36.282  136.941   41.673 26.30554 55.25427 
1 1 1   23   34    5 o  238.158   19.433   45.880   7.0223   51.867   9.3021   37.948   10.708  249.313   24.701  204.302   35.531 45.01093 43.27392 
1 1 1   23   34    6 o  253.916   15.233   51.078   5.8930   57.506   7.1914   37.938   10.282  267.949   17.633  205.559   33.859 62.38954 38.17504 
1 1 1   23   34    7 o  262.142   17.272   54.987   6.8914   54.987   6.8914   0.0000   0.0000  262.142   17.272  ?   ?  0.000000 17.27187 
1 1 1   23   34    8 o  367.006   14.265  106.067   8.0131  106.067   8.0131   0.0000   0.0000  367.006   14.265  ?   ?  0.000000 14.26456 
1 1 1   23   34    9 o   90.793   30.168   7.0924   4.8986   9.2580   5.7300   1.2122   9.4420  101.645   32.553   84.553   37.308 17.09196 49.51309 
1 1 1   23   34   10 o  230.293   15.103   42.124   5.2940   41.852   6.2385   42.823   10.007  227.796   18.040  220.628   30.445 7.168594 35.38826 
1 1 1   23   34   11 o  149.288   22.489   18.673   4.9795   21.540   5.9173   11.717   9.2169  158.887   25.170  111.644   41.053 47.24352 48.15481 
1 1 1   23   34   12 o  141.957   21.098   16.769   4.4449   19.504   5.1037   8.1806   9.0452  152.453   22.552  100.150   39.684 52.30322 45.64392 
1 1 1   23   34   13 o   82.379   28.189   5.6943   4.2761   4.0251   4.9089   10.946   8.7069   76.162   29.512  108.133   39.880 -31.97127 49.61202 
1 1 1   23   34   14 o   57.334   25.087  -0.0766   4.1888  -3.3411   4.7741   10.842   8.7312   52.307   24.379  107.449   39.874 -55.14249 46.73636 
1 1 1   23   34   15 o  112.350   25.789   11.093   4.3410   11.424   5.0426   10.146   8.5314  112.315   29.098  104.655   39.301 7.659897 48.90017 
1 1 1   23   34   16 o   95.612   27.562   8.1738   4.2549   9.4145   4.9125   4.4479   8.5129  101.635   29.707   87.536   36.979 14.09898 47.43375 
1 1 1   23   34   17 o  312.936   11.032   76.584   5.2842   84.043   6.2139   57.100   10.043  326.889   12.419  257.320   25.848 69.56967 28.67692 
1 1 1   23   34   18 o   59.676   26.190   0.0307   4.5955   3.7264   5.4413  -9.1631   8.5823   75.940   30.547   62.269   30.041 13.67142 42.84352 
1 1 1   23   34   19 o  227.577   15.343   41.566   5.3134   48.805   6.5424   27.538   9.1071  244.945   17.567  167.837   36.491 77.10751 40.49909 
1 1 1   23   34   20 o   90.844   31.736   7.4487   5.4324   12.381   6.9179  -0.4842   8.7738  111.896   35.761   76.280   34.622 35.61578 49.77442 
1 1 1   23   35    0 f  226.084   31.723   44.027   10.358   44.027   10.358   44.027   10.358  226.084   31.723  226.084   31.723 0.000000 0.000000 
1 1 1   23   35    1 o   93.726   35.053   7.2602   6.7733   7.4559   9.6716   7.0719   9.4888   99.503   40.475   98.143   40.025 1.360809 56.92302 
1 1 1   23   35    2 o  109.935   34.734   11.223   6.5408   16.037   9.3931   6.6907   9.1133  126.537   41.763   96.330   39.249 30.20712 57.31137 
1 1 1   23   35    3 o  158.730   28.622   22.126   6.6981   27.105   9.4999   17.204   9.4455  168.447   37.777  130.652   41.790 37.79546 56.33355 
1 1 1   23   35    4 o  100.349   39.161   8.3838   8.6912   8.3838   8.6912   0.0000   0.0000  100.349   39.161  ?   ?  0.000000 39.16064 
1 1 1   23   35    5 o  171.159   27.392   25.439   6.9342   25.439   6.9342   0.0000   0.0000  171.159   27.392  ?   ?  0.000000 27.39206 
1 1 1   23   35    6 o   69.852   29.028   2.1308   5.1160  -0.8679   6.2671   8.1203   8.8573   66.665   29.843   99.542   39.324 -32.87722 49.36600 
1 1 1   23   35    7 o  239.617   15.911   45.897   5.8023   53.195   7.1818   32.178   9.8462  256.206   18.437  185.021   36.064 71.18515 40.50322 
1 1 1   23   35    8 o  189.385   19.093   29.310   5.4592   31.730   6.7148   24.592   9.3763  194.430   23.009  158.235   38.970 36.19582 45.25609 
1 1 1   23   35    9 o  171.527   20.608   24.358   5.3022   24.613   6.5815   23.887   8.9502  168.592   26.368  156.764   37.751 11.82793 46.04837 
1 1 1   23   35   10 o  138.048   24.479   16.385   4.9830   20.381   6.1769   8.9372   8.4323  152.242   27.520  100.749   38.779 51.49290 47.55212 
1 1 1   23   35   11 o  175.602   19.236   25.329   5.0856   26.218   6.2604   23.604   8.7206  175.562   23.920  155.891   37.086 19.67137 44.13105 
1 1 1   23   35   12 o  132.755   22.106   14.924   4.3340   14.404   5.0429   16.395   8.4769  127.707   26.660  127.174   39.445 0.5331039 47.60936 
1 1 1   23   35   13 o  149.573   20.261   18.625   4.5192   21.316   5.3006   11.463   8.6474  158.787   22.434  108.412   39.780 50.37497 45.66954 
1 1 1   23   35   14 o  129.695   23.988   14.538   4.5866   19.764   5.4330   1.5736   8.5568  151.503   24.246   80.392   35.492 71.11069 42.98310 
1 1 1   23   35   15 o  135.072   22.378   15.547   4.4647   14.429   5.1164   19.115   9.1415  127.104   27.125  135.076   40.787 -7.972130 48.98324 
1 1 1   23   35   16 o  139.847   25.226   17.104   5.2011   17.823   6.3311   15.614   9.1217  138.868   30.610  121.633   41.173 17.23448 51.30500 
1 1 1   23   36    1 o   70.423   33.144  -5.4663   9.1915  -5.4663   9.1915   0.0000   0.0000   70.423   33.144  ?   ?  0.000000 33.14383 
1 1 1   23   36    2 o  189.233   34.917   33.590   9.7409   33.590   9.7409   0.0000   0.0000  189.233   34.917  ?   ?  0.000000 34.91681 
1 1 1   23   36    3 o  245.884   19.431   49.515   7.2533   53.815   9.7473   44.178   10.858  250.355   25.807  219.011   33.451 31.34424 42.24859 
1 1 1   23   36    4 o  105.240   34.832   10.439   6.5323   11.924   8.9228   8.7236   9.5892  110.444   40.426  101.116   40.595 9.328362 57.29026 
1 1 1   23   36    5 o  235.732   20.170   45.796   7.2076   42.380   9.5684   50.277   10.959  218.424   29.364  236.222   31.062 -17.79802 42.74430 
1 1 1   23   36    6 o  107.004   33.926   10.824   6.2356   4.4122   8.3396   18.955   9.3907   86.919   36.653  134.889   41.464 -47.96957 55.34151 
1 1 1   23   36    7 o  148.148   28.354   19.590   6.1954   16.207   8.3486   23.736   9.2429  126.442   39.133  153.722   39.170 -27.28001 55.36882 
1 1 1   23   36    8 o  121.794   32.537   13.985   6.1807   16.113   8.6571   11.774   8.8270  125.269   40.001  109.365   40.181 15.90363 56.69756 
1 1 1   23   36    9 o  167.646   24.984   24.275   6.2152   32.922   8.6356   14.983   8.9522  190.568   30.644  120.351   40.789 70.21732 51.01721 
1 1 1   23   36   10 o   94.302   32.632   8.0785   5.7370   11.924   7.7720   3.4738   8.5041  109.877   37.984   84.516   36.368 25.36053 52.58701 
1 1 1   23   36   11 o   72.000   30.261   2.3648   5.6540   5.1717   7.4516  -1.4437   8.6801   86.236   35.353   74.519   34.059 11.71679 49.09032 
1 1 1   24    0    1 o   74.407   30.550   5.9745   3.4376   5.9745   3.4376   5.9745   3.4376   74.407   30.550   74.407   30.550 0.000000 0.000000 
1 1 1   24    0    2 f  208.234   9.4400   33.424   2.9947   33.424   2.9947   33.424   2.9947  208.234   9.4400  208.234   9.4400 0.000000 0.000000 
1 1 1   24    0    3 o  161.816   10.791   20.332   2.6455   20.332   2.6455   20.332   2.6455  161.816   10.791  161.816   10.791 0.000000 0.000000 
1 1 1   24    0    4 o  221.429   9.0502   37.749   3.0557   37.749   3.0557   37.749   3.0557  221.429   9.0502  221.429   9.0502 0.000000 0.000000 
1 1 1   24    0    5 o  580.943   12.215  259.101   10.851  259.101   10.851  259.101   10.851  580.943   12.215  580.943   12.215 0.000000 0.000000 
1 1 1   24    0    6 o  255.372   9.0913   50.150   3.5434   50.150   3.5434   50.150   3.5434  255.372   9.0913  255.372   9.0913 0.000000 0.000000 
1 1 1   24    0    7 o   34.521   21.899   0.3058   2.5092   0.3058   2.5092   0.3058   2.5092   34.521   21.899   34.521   21.899 0.000000 0.000000 
1 1 1   24    0    8 o   74.639   26.560   5.6534   2.7658   5.6534   2.7658   5.6534   2.7658   74.639   26.560   74.639   26.560 0.000000 0.000000 
1 1 1   24    0    9 o  134.783   14.960   14.448   2.9890   14.448   2.9890   14.448   2.9890  134.783   14.960  134.783   14.960 0.000000 0.000000 
1 1 1   24    0   10 o  459.690   10.877  162.256   7.6437  162.256   7.6437  162.256   7.6437  459.690   10.877  459.690   10.877 0.000000 0.000000 
1 1 1   24    0   11 o  200.090   11.522   31.001   3.5020   31.001   3.5020   31.001   3.5020  200.090   11.522  200.090   11.522 0.000000 0.000000 
1 1 1   24    0   12 o  134.245   17.154   14.508   3.3674   14.508   3.3674   14.508   3.3674  134.245   17.154  134.245   17.154 0.000000 0.000000 
1 1 1   24    0   13 o   40.788   25.543   0.7254   3.2936   0.7254   3.2936   0.7254   3.2936   40.788   25.543   40.788   25.543 0.000000 0.000000 
1 1 1   24    0   14 o   34.570   23.219  -1.3803   3.4740  -1.3803   3.4740  -1.3803   3.4740   34.570   23.219   34.570   23.219 0.000000 0.000000 
1 1 1   24    0   15 o  186.632   15.129   27.276   4.2565   27.276   4.2565   27.276   4.2565  186.632   15.129  186.632   15.129 0.000000 0.000000 
1 1 1   24    0   16 o  331.694   10.457   84.608   5.2972   84.608   5.2972   84.608   5.2972  331.694   10.457  331.694   10.457 0.000000 0.000000 
1 1 1   24    0   17 f   95.553   31.503   9.0337   4.0919   9.0337   4.0919   9.0337   4.0919   95.553   31.503   95.553   31.503 0.000000 0.000000 
1 1 1   24    0   18 o   96.897   31.259   9.2162   4.0948   9.2162   4.0948   9.2162   4.0948   96.897   31.259   96.897   31.259 0.000000 0.000000 
1 1 1   24    0   19 o   37.768   25.343  -1.5557   4.1202  -1.5557   4.1202  -1.5557   4.1202   37.768   25.343   37.768   25.343 0.000000 0.000000 
1 1 1   24    0   20 o   74.013   34.063   6.2264   4.2344   6.2264   4.2344   6.2264   4.2344   74.013   34.063   74.013   34.063 0.000000 0.000000 
1 1 1   24    0   22 o  151.027   11.104   17.785   2.5350   17.785   2.5350   17.785   2.5350  151.027   11.104  151.027   11.104 0.000000 0.000000 
1 1 1   24    0   23 o   77.340   24.973   5.8616   2.6116   5.8616   2.6116   5.8616   2.6116   77.340   24.973   77.340   24.973 0.000000 0.000000 
1 1 1   24    0   24 o  162.543   11.162   20.567   2.7470   20.567   2.7470   20.567   2.7470  162.543   11.162  162.543   11.162 0.000000 0.000000 
1 1 1   24    0   25 o  104.483   17.705   9.0994   2.5873   9.0994   2.5873   9.0994   2.5873  104.483   17.705  104.483   17.705 0.000000 0.000000 
1 1 1   24    0   26 o  224.730   9.3436   38.946   3.2014   38.946   3.2014   38.946   3.2014  224.730   9.3436  224.730   9.3436 0.000000 0.000000 
1 1 1   24    0   27 o   21.720   15.634  -4.4755   2.5643  -4.4755   2.5643  -4.4755   2.5643   21.720   15.634   21.720   15.634 0.000000 0.000000 
1 1 1   24    0   28 o  194.906   13.224   29.632   3.9035   29.632   3.9035   29.632   3.9035  194.906   13.224  194.906   13.224 0.000000 0.000000 
1 1 1   24    0   29 o   52.406   32.084   1.9818   4.9193   1.9818   4.9193   1.9818   4.9193   52.406   32.084   52.406   32.084 0.000000 0.000000 
1 1 1   24    0   30 o   36.590   22.980   0.5767   2.6869   0.5767   2.6869   0.5767   2.6869   36.590   22.980   36.590   22.980 0.000000 0.000000 
1 1 1   24    0   31 o  122.870   17.494   12.353   3.0972   12.353   3.0972   12.353   3.0972  122.870   17.494  122.870   17.494 0.000000 0.000000 
1 1 1   24    0   32 o  301.735   8.8013   70.064   4.0570   70.064   4.0570   70.064   4.0570  301.735   8.8013  301.735   8.8013 0.000000 0.000000 
1 1 1   24    0   33 o  269.317   9.6628   55.934   3.9716   55.934   3.9716   55.934   3.9716  269.317   9.6628  269.317   9.6628 0.000000 0.000000 
1 1 1   24    0   34 o   43.424   26.135   1.5462   3.1479   1.5462   3.1479   1.5462   3.1479   43.424   26.135   43.424   26.135 0.000000 0.000000 
1 1 1   24    0   35 o  134.053   21.723   15.039   4.1062   15.039   4.1062   15.039   4.1062  134.053   21.723  134.053   21.723 0.000000 0.000000 
1 1 1   24    0   36 o   65.483   30.297   4.9596   3.3517   4.9596   3.3517   4.9596   3.3517   65.483   30.297   65.483   30.297 0.000000 0.000000 
1 1 1   24    0   37 o  178.513   14.364   25.102   3.8663   25.102   3.8663   25.102   3.8663  178.513   14.364  178.513   14.364 0.000000 0.000000 
1 1 1   24    0   38 o  119.625   23.533   12.392   3.8337   12.392   3.8337   12.392   3.8337  119.625   23.533  119.625   23.533 0.000000 0.000000 
1 1 1   24    0   39 o   54.583   30.117   3.3751   3.6617   3.3751   3.6617   3.3751   3.6617   54.583   30.117   54.583   30.117 0.000000 0.000000 
1 1 1   24    0   40 o   55.161   33.299   2.7161   5.1410   2.7161   5.1410   2.7161   5.1410   55.161   33.299   55.161   33.299 0.000000 0.000000 
1 1 1   24    0   41 o   51.795   30.172   2.7603   3.9539   2.7603   3.9539   2.7603   3.9539   51.795   30.172   51.795   30.172 0.000000 0.000000 
1 1 1   24    0   42 o  219.733   15.000   38.010   4.9909   38.010   4.9909   38.010   4.9909  219.733   15.000  219.733   15.000 0.000000 0.000000 
1 1 1   24    0   43 o   90.636   32.610   8.7326   4.1416   8.7326   4.1416   8.7326   4.1416   90.636   32.610   90.636   32.610 0.000000 0.000000 
1 1 1   24    0   44 o  365.241   10.066  103.145   5.6177  103.145   5.6177  103.145   5.6177  365.241   10.066  365.241   10.066 0.000000 0.000000 
1 1 1   24    0   45 o   63.332   33.085   4.9420   4.2028   4.9420   4.2028   4.9420   4.2028   63.332   33.085   63.332   33.085 0.000000 0.000000 
1 1 1   24    0   46 o  125.216   26.118   14.034   4.4125   14.034   4.4125   14.034   4.4125  125.216   26.118  125.216   26.118 0.000000 0.000000 
1 1 1   24    0   47 o  156.655   21.634   20.627   4.9055   20.627   4.9055   20.627   4.9055  156.655   21.634  156.655   21.634 0.000000 0.000000 
1 1 1   24    0   48 f   60.360   34.199   4.5145   4.8773   4.5145   4.8773   4.5145   4.8773   60.360   34.199   60.360   34.199 0.000000 0.000000 
1 1 1   24    0   49 o   97.106   32.505   10.039   4.3100   10.039   4.3100   10.039   4.3100   97.106   32.505   97.106   32.505 0.000000 0.000000 
1 1 1   24    0   50 o   70.619   33.410   6.3286   4.0926   6.3286   4.0926   6.3286   4.0926   70.619   33.410   70.619   33.410 0.000000 0.000000 
1 1 1   24    1    0 o   94.744   19.876   7.7350   2.5386   7.7350   2.5386   7.7350   2.5386   94.744   19.876   94.744   19.876 0.000000 0.000000 
1 1 1   24    1    1 o  296.301   8.0195   67.292   3.6371   0.0000   0.0000   67.292   3.6371  ?   ?   296.301   8.0195 0.000000 8.019547 
1 1 1   24    1    2 o   92.403   17.491   6.7956   2.3832   0.0000   0.0000   6.7956   2.3832  ?   ?    92.403   17.491 0.000000 17.49078 
1 1 1   24    1    3 o  176.447   9.9610   23.959   2.6792   0.0000   0.0000   23.959   2.6792  ?   ?   176.447   9.9610 0.000000 9.960985 
1 1 1   24    1    4 o  320.488   8.6860   78.750   4.2609   74.022   6.0015   83.556   6.0505  310.403   12.632  329.851   11.984 -19.44769 17.41191 
1 1 1   24    1    5 o   69.980   23.116   3.6230   2.8776   0.7220   4.2517   6.0752   3.9090   63.414   26.417   88.028   26.692 -24.61464 37.55398 
1 1 1   24    1    6 o  221.472   6.7866   37.582   2.3006   41.853   3.5075   34.357   3.0478  233.573   9.8108  211.645   9.4082 21.92819 13.59285 
1 1 1   24    1    7 o  239.895   6.5884   44.092   2.4192   42.188   3.5581   45.729   3.2991  234.495   9.9132  244.201   8.8263 -9.705139 13.27311 
1 1 1   24    1    8 o  268.654   6.3615   55.295   2.6159   55.288   3.8276   55.301   3.5834  268.476   9.3143  268.545   8.7179 -0.6961060E-01 12.75763 
1 1 1   24    1    9 o  201.144   8.3385   31.021   2.5672   35.814   3.5339   25.665   3.7358  215.996   10.689  182.193   13.492 33.80350 17.21314 
1 1 1   24    1   10 o  402.171   5.8928  123.901   3.6274  123.382   5.3395  124.347   4.9434  401.101   8.6971  402.729   8.0194 -1.628815 11.83004 
1 1 1   24    1   11 o  299.626   7.1931   68.808   3.2989   68.610   5.5915   68.913   4.0857  298.782   12.227  299.737   8.9054 -0.9554749 15.12595 
1 1 1   24    1   12 o  682.924   6.3196  357.351   6.6059  365.757   9.6198  349.849   9.0873  690.475   9.1022  675.347   8.7910 15.12750 12.65432 
1 1 1   24    1   13 o  225.449   8.2415   38.980   2.8440   40.641   4.0521   37.367   3.9925  229.686   11.563  220.173   11.891 9.513123 16.58619 
1 1 1   24    1   14 o  514.228   6.2441  202.622   4.9146  210.609   7.1510  195.473   6.7657  523.929   8.9172  504.773   8.7568 19.15500 12.49789 
1 1 1   24    1   15 o  132.231   13.684   13.606   2.7296   16.919   4.0627   10.879   3.6852  146.742   18.499  116.582   21.442 30.15946 28.31936 
1 1 1   24    1   16 o  234.540   8.8496   42.212   3.1770   54.876   4.7253   31.765   4.2918  267.166   11.555  202.589   13.925 64.57632 18.09496 
1 1 1   24    1   17 o  122.498   15.589   11.765   2.8568   12.474   4.2931   11.202   3.8271  124.535   23.381  118.161   21.969 6.374023 32.08265 
1 1 1   24    1   18 o  306.055   7.9088   71.854   3.7049   69.120   5.4348   74.227   5.0640  299.744   11.846  310.775   10.646 -11.03009 15.92649 
1 1 1   24    1   19 o  369.440   6.9285  104.650   3.9179   89.956   8.1503  109.066   4.4680  341.222   15.605  377.066   7.7416 -35.84378 17.41979 
1 1 1   24    1   20 o  166.849   9.0066   21.438   2.2916   19.494   3.2879   23.274   3.1957  158.413   13.694  173.453   12.113 -15.04025 18.28296 
1 1 1   24    1   21 o  248.752   5.9252   47.428   2.2560   45.132   3.4716   49.105   2.9682  242.385   9.3573  252.985   7.6653 -10.59981 12.09609 
1 1 1   24    1   22 o  351.312   5.5645   94.588   2.9922   95.535   4.3845   93.762   4.0937  352.787   8.1196  349.557   7.6511 3.229950 11.15653 
1 1 1   24    1   23 o  273.234   6.9956   57.269   2.9257   60.466   4.4295   54.795   3.8966  280.372   10.322  266.999   9.5348 13.37238 14.05173 
1 1 1   24    1   24 o   83.456   18.501   5.6289   2.3013   7.7630   3.4369   3.8945   3.0985   97.492   23.342   72.021   23.997 25.47022 33.47638 
1 1 1   24    1   25 o  251.551   5.8730   48.517   2.2613   47.372   3.2651   49.572   3.1347  248.304   8.5910  254.064   8.0610 -5.759964 11.78066 
1 1 1   24    1   26 f   61.140   17.854   2.9686   1.7751   5.9497   2.6147   0.4202   2.4176   85.513   20.284   47.734   19.905 37.77819 28.41910 
1 1 1   24    1   27 o  209.508   7.4910   33.706   2.4022   32.556   3.1340   35.344   3.7403  205.637   9.9571  213.755   11.474 -8.118347 15.19184 
1 1 1   24    1   28 o  136.462   11.994   14.491   2.4798   11.567   3.6354   17.035   3.3913  119.765   20.572  147.345   15.258 -27.58036 25.61321 
1 1 1   24    1   29 o  163.461   9.2559   20.633   2.3063   22.937   3.0705   17.649   3.4936  171.929   11.738  149.893   15.449 22.03583 19.40195 
1 1 1   24    1   30 o   78.530   18.382   5.0206   2.1705   2.8926   3.4775   6.3786   2.7781   67.438   25.137   88.228   20.894 -20.79041 32.68687 
1 1 1   24    1   31 o  190.846   7.9305   28.005   2.3166   28.813   3.3821   27.291   3.1796  192.751   11.516  187.655   11.120 5.095108 16.00838 
1 1 1   24    1   32 o   97.751   14.694   7.5915   2.1305   4.2532   3.0658   10.709   2.9627   73.670   23.834  115.787   17.243 -42.11763 29.41736 
1 1 1   24    1   33 o  320.577   6.0841   78.889   2.9854   78.055   4.3096   79.659   4.1394  318.342   8.8444  321.696   8.4067 -3.353912 12.20233 
1 1 1   24    1   34 o  174.432   9.4720   23.532   2.5195   26.831   3.8441   21.047   3.3358  185.292   13.650  164.061   13.401 21.23111 19.12885 
1 1 1   24    1   35 o  248.267   8.2146   47.458   3.1216   45.638   4.4131   49.280   4.4161  242.663   11.882  252.275   11.437 -9.611832 16.49141 
1 1 1   24    1   36 o  196.041   10.009   29.766   2.9934   33.167   4.4076   26.854   4.0782  205.809   14.076  184.952   14.523 20.85680 20.22497 
1 1 1   24    1   37 o  230.672   8.1543   40.992   2.8791   45.357   4.2686   37.349   3.8996  241.849   11.531  219.132   11.668 22.71638 16.40476 
1 1 1   24    1   38 o  211.272   9.0198   34.451   2.9168   30.124   4.2343   38.359   4.0238  195.852   14.222  221.941   11.888 -26.08929 18.53610 
1 1 1   24    1   39 o   70.655   21.908   4.0410   2.6152   4.1469   3.7854   3.9442   3.6173   74.459   26.450   72.805   25.857 1.653542 36.98866 
1 1 1   24    1   40 o   66.901   25.426   2.8619   3.5960   6.1281   5.2591  -0.0061   4.9281   87.904   31.181   63.008   27.397 24.89586 41.50751 
1 1 1   24    1   41 o  214.614   9.9761   35.688   3.2771   36.580   4.3845   34.557   4.9329  215.860   13.335  208.846   15.543 7.013687 20.47943 
1 1 1   24    1   42 o   59.404   23.130   2.0268   3.0269   0.4199   4.5943   3.2594   4.0237   62.007   26.706   70.286   26.852 -8.279869 37.87135 
1 1 1   24    1   43 o  188.119   11.296   27.679   3.2374   32.674   4.6902   23.134   4.4743  202.718   15.227  169.344   17.515 33.37341 23.20839 
1 1 1   24    1   44 o  108.581   19.053   9.7733   3.0511   5.1532   4.2702   14.592   4.3610   79.633   28.113  131.479   22.478 -51.84571 35.99454 
1 1 1   24    1   45 o  170.888   12.074   23.009   3.1379   25.270   4.4905   20.851   4.3866  176.838   16.792  159.727   18.271 17.11081 24.81503 
1 1 1   24    1   46 f   57.980   23.302   1.7436   3.1632   0.0083   4.2341   3.9353   4.7585   57.541   25.198   74.584   29.012 -17.04329 38.42761 
1 1 1   24    1   47 o   52.154   22.728   0.0657   3.4070  -1.4076   5.3820   1.0509   4.4010   59.640   27.087   61.528   26.311 -1.887222 37.76215 
1 1 1   24    1   48 o  204.983   11.031   33.133   3.4481   28.235   4.5278   39.897   5.3203  186.133   16.050  221.664   15.784 -35.53185 22.51047 
1 1 1   24    1   49 o   51.560   21.796   0.8097   2.9607   2.3405   4.1624  -0.7580   4.2122   64.165   26.378   53.911   24.273 10.25393 35.84629 
1 1 1   24    1   50 o   91.091   21.558   7.3772   2.9591   6.2857   4.2602   8.3946   4.1131   82.085   28.136   94.023   27.097 -11.93755 39.06288 
1 1 1   24    2    0 o  576.726   11.393  255.242   10.048  255.242   10.048  255.242   10.048  576.726   11.393  576.726   11.393 0.000000 0.000000 
1 1 1   24    2    1 o  306.781   6.6494   72.103   3.1224   75.641   5.6276   70.529   3.7530  313.872   11.714  303.340   8.0831 10.53238 14.23211 
1 1 1   24    2    2 o  100.929   18.095   8.0908   2.6927   7.8643   4.0227   8.2747   3.6244   98.816   26.179  101.306   23.781 -2.489967 35.36769 
1 1 1   24    2    3 o  171.374   15.673   22.795   4.0656   0.0000   0.0000   22.795   4.0656  ?   ?   171.374   15.673 0.000000 15.67287 
1 1 1   24    2    4 f   41.053   17.981  -0.5093   2.1570   0.0000   0.0000  -0.5093   2.1570  ?   ?    41.053   17.981 0.000000 17.98133 
1 1 1   24    2    5 o  213.007   6.3273   34.758   2.0629   29.157   5.5021   35.674   2.2253  193.454   18.820  215.782   6.7374 -22.32797 19.98949 
1 1 1   24    2    6 o  329.457   4.9280   83.119   2.4851   83.192   4.5051   83.088   2.9794  329.371   8.9361  329.350   5.9101 0.2102661E-01 10.71369 
1 1 1   24    2    7 o  111.416   8.7707   9.5777   1.4836   7.9226   3.0900   10.073   1.6913   99.356   20.977  114.173   9.7724 -14.81696 23.14162 
1 1 1   24    2    8 o  370.904   5.2450  105.360   2.9777  109.519   5.0084  103.086   3.7033  377.919   8.6583  366.802   6.5960 11.11716 10.88459 
1 1 1   24    2    9 o  439.900   7.7381  148.337   5.2102   0.0000   0.0000  148.337   5.2102  ?   ?   439.900   7.7381 0.000000 7.738086 
1 1 1   24    2   10 o   73.342   18.221   4.3174   2.0364   5.5839   3.2079   3.4626   2.6355   83.718   23.870   67.947   22.107 15.77113 32.53431 
1 1 1   24    2   11 o  333.130   6.9875   85.050   3.5629   95.622   6.5605   80.628   4.2432  352.729   12.151  324.241   8.5498 28.48865 14.85786 
1 1 1   24    2   12 f  287.084   6.9743   63.166   3.0646   69.472   4.6230   58.223   4.0933  300.840   10.040  275.435   9.7092 25.40485 13.96645 
1 1 1   24    2   13 o  119.771   13.726   11.184   2.4708   12.522   3.6867   10.093   3.3292  125.683   19.821  112.515   20.067 13.16762 28.20573 
1 1 1   24    2   14 o  363.967   6.5811  101.523   3.6663  108.253   5.6267   96.557   4.8331  375.523   9.7893  354.750   8.9009 20.77328 13.23088 
1 1 1   24    2   15 o   90.814   21.239   6.6582   2.8997   8.0290   5.8599   6.2137   3.3368  101.771   32.954   87.869   24.090 13.90224 40.82041 
1 1 1   24    2   16 o  315.983   8.1878   76.589   3.9600   78.756   7.7147   75.814   4.6143  319.424   15.779  314.244   9.5934 5.179260 18.46648 
1 1 1   24    2   17 o  172.792   12.517   23.097   3.2881   11.830   6.5615   26.875   3.7996  120.172   34.094  186.319   13.413 -66.14702 36.63767 
1 1 1   24    2   18 o  169.081   9.7022   22.028   2.5004   12.248   4.6708   25.956   2.9603  122.827   25.671  183.475   10.586 -60.64782 27.76835 
1 1 1   24    2   19 o  152.951   10.662   18.070   2.4804   18.358   4.8292   17.967   2.8909  152.128   21.326  152.246   12.516 -0.1181946 24.72726 
1 1 1   24    2   20 o  236.870   6.4418   43.013   2.3355   44.025   3.2893   41.985   3.3168  239.446   8.9748  233.808   9.2680 5.638199 12.90132 
1 1 1   24    2   21 o   69.100   16.121   3.8418   1.6739   6.5222   2.7059   2.1802   2.1304   89.803   20.178   56.373   19.862 33.43005 28.31321 
1 1 1   24    2   22 o  238.031   6.9695   43.458   2.5393   39.978   3.5150   47.256   3.6723  228.027   10.071  247.961   9.6757 -19.93434 13.96571 
1 1 1   24    2   23 o  223.723   6.5345   38.384   2.2376   34.326   3.5636   41.026   2.8751  210.876   11.079  231.163   8.1258 -20.28712 13.73984 
1 1 1   24    2   24 f  352.772   6.1757   95.426   3.3347   91.961   5.3559   97.620   4.2614  345.744   10.121  356.597   7.8074 -10.85321 12.78204 
1 1 1   24    2   25 o  204.035   7.2298   31.950   2.2579   34.821   3.7744   30.350   2.8176  212.212   11.665  198.682   9.2653 13.53026 14.89675 
1 1 1   24    2   26 o  231.641   7.5461   41.198   2.6755   39.558   3.9609   42.575   3.6284  226.217   11.477  235.180   10.080 -8.962784 15.27469 
1 1 1   24    2   27 o  204.322   8.3814   32.086   2.6212   32.127   3.9389   32.053   3.5117  203.509   12.709  203.556   11.316 -0.4689026E-01 17.01623 
1 1 1   24    2   28 o  295.725   6.1960   67.095   2.8046   73.556   4.7419   63.619   3.4782  309.019   10.025  287.741   7.8973 21.27866 12.76225 
1 1 1   24    2   29 o  117.743   12.330   10.833   2.1892   13.922   2.9961   7.2958   3.2066  133.057   14.971   94.204   22.540 38.85314 27.05928 
1 1 1   24    2   30 o  312.464   6.1834   74.925   2.9573   80.734   4.9979   71.796   3.6684  323.615   10.090  305.615   7.8422 18.00040 12.77923 
1 1 1   24    2   31 o   90.531   16.702   6.5939   2.2291   4.1164   3.6711   8.0408   2.8055   74.787   26.091   99.601   19.097 -24.81406 32.33343 
1 1 1   24    2   32 o  108.296   13.137   9.2240   2.1331   7.8900   3.1263   10.386   2.9177   98.013   21.436  113.983   17.264 -15.97025 27.52391 
1 1 1   24    2   33 f   47.095   19.105   0.7833   2.1479   2.2360   3.2839  -0.3028   2.8395   62.799   24.192   47.897   20.811 14.90209 31.91204 
1 1 1   24    2   34 o  285.485   6.7750   62.620   2.9605   65.070   4.5419   60.810   3.9037  290.290   10.222  280.891   9.0797 9.398712 13.67221 
1 1 1   24    2   35 o  167.783   10.541   21.844   2.6933   24.285   3.7466   19.233   3.8745  176.052   14.020  155.818   16.496 20.23441 21.64897 
1 1 1   24    2   36 f   62.130   21.381   2.8585   2.4611   6.5034   3.7147   0.0066   3.2858   88.363   25.834   52.568   22.613 35.79482 34.33313 
1 1 1   24    2   37 o   68.289   22.048   3.6800   2.6245   4.8392   3.6420   2.4278   3.7853   78.169   26.015   66.088   25.829 12.08089 36.65942 
1 1 1   24    2   38 o  118.064   15.084   11.085   2.6636   10.493   3.9735   11.568   3.5896  111.900   23.924  118.893   20.463 -6.992455 31.48176 
1 1 1   24    2   39 o   78.430   21.175   5.1088   2.6013   4.4033   3.7803   5.7433   3.5851   75.819   26.475   83.196   25.627 -7.377350 36.84653 
1 1 1   24    2   40 o  144.833   16.007   16.716   3.4892   16.234   5.6854   17.007   4.4194  137.502   27.966  144.307   20.592 -6.804718 34.72931 
1 1 1   24    2   41 o  117.870   18.321   11.304   3.1981   7.2443   4.1761   17.062   4.9732   91.963   27.522  142.936   23.552 -50.97242 36.22384 
1 1 1   24    2   42 o   84.349   21.744   6.0025   2.8251   8.3309   4.1381   3.9701   3.8663   97.970   26.814   73.178   26.637 24.79278 37.79594 
1 1 1   24    2   43 o   78.840   23.737   5.2472   3.0995   2.7852   4.8362   6.9634   4.0377   71.379   28.768   89.678   27.113 -18.29842 39.53153 
1 1 1   24    2   44 o   62.158   23.125   2.6845   2.9403   3.1386   4.2888   2.2819   4.0389   70.159   27.473   65.383   26.312 4.775566 38.04045 
1 1 1   24    2   45 o   76.374   23.522   4.9585   3.0204   6.0442   4.3199   3.9202   4.2246   83.956   28.335   73.158   27.617 10.79765 39.56738 
1 1 1   24    2   46 o  147.067   16.083   17.514   3.5613   19.057   5.1225   16.070   4.9547  149.362   23.156  135.978   24.716 13.38350 33.86849 
1 1 1   24    2   47 o  137.649   16.010   15.431   3.3102   14.861   5.0703   15.855   4.3700  128.652   26.626  136.319   21.669 -7.667511 34.32908 
1 1 1   24    2   48 o   67.101   23.287   3.7132   2.9227   6.6300   4.1566   0.8608   4.1105   85.210   27.765   58.826   25.298 26.38376 37.56196 
1 1 1   24    2   49 o   99.137   21.628   8.6479   3.1896   10.138   4.1599   6.5226   4.9685  104.711   26.059   84.090   30.256 20.62177 39.93136 
1 1 1   24    2   50 o   79.041   22.971   5.6349   2.9447   7.9743   4.1681   3.3035   4.1609   91.443   27.525   67.647   26.880 23.79577 38.47309 
1 1 1   24    3    0 o   25.803   18.563  -6.2361   3.5919  -6.2361   3.5919  -6.2361   3.5919   25.803   18.563   25.803   18.563 0.000000 0.000000 
1 1 1   24    3    1 o  270.819   13.199   56.366   5.4714   56.366   5.4714   0.0000   0.0000  270.819   13.199  ?   ?  0.000000 13.19922 
1 1 1   24    3    2 f  313.815   8.2927   75.494   3.9833   82.718   6.2526   70.559   5.1677  328.146   12.449  303.182   11.136 24.96399 16.70251 
1 1 1   24    3    3 o  526.664   6.5056  212.498   5.2443  226.255   9.9248  207.169   6.1771  542.780   11.946  519.904   7.7623 22.87543 14.24653 
1 1 1   24    3    4 o   78.845   17.490   4.9802   2.0555   7.4690   4.9831   4.4698   2.2564   97.729   30.231   74.710   19.518 23.01858 35.98439 
1 1 1   24    3    5 o  259.382   6.1463   51.538   2.4402   0.0000   0.0000   51.538   2.4402  ?   ?   259.382   6.1463 0.000000 6.146332 
1 1 1   24    3    6 f   46.151   16.636   1.3701   1.5028   0.0000   0.0000   1.3701   1.5028  ?   ?    46.151   16.636 0.000000 16.63631 
1 1 1   24    3    7 o  133.608   8.5543   13.743   1.7402   14.164   5.5087   13.697   1.8341  132.294   28.073  133.333   9.0405 -1.038712 29.49322 
1 1 1   24    3    8 o  300.942   5.3711   69.365   2.4741   66.182   6.9789   69.822   2.6460  292.710   15.633  301.917   5.7256 -9.207001 16.64890 
1 1 1   24    3    9 o  265.820   5.5706   54.123   2.2665   54.691   6.8055   54.052   2.4037  265.779   16.816  265.631   5.9121 0.1474304 17.82478 
1 1 1   24    3   10 o  228.560   5.8543   40.018   2.0481   41.919   6.5475   39.812   2.1563  232.192   18.579  227.958   6.1799 4.234451 19.57937 
1 1 1   24    3   11 o  211.268   6.0143   34.195   1.9448   31.416   6.4675   34.471   2.0392  200.177   21.442  212.109   6.2811 -11.93201 22.34287 
1 1 1   24    3   12 o  317.871   8.2322   77.486   4.0053   0.0000   0.0000   77.486   4.0053  ?   ?   317.871   8.2322 0.000000 8.232162 
1 1 1   24    3   13 o  363.659   7.1484  101.372   3.9790   97.222   8.3833  102.579   4.5206  355.107   15.424  365.737   8.0753 -10.63004 17.40969 
1 1 1   24    3   14 o  406.857   5.4429  126.806   3.3895  132.553   6.0805  124.215   4.0827  415.560   9.5596  402.586   6.6256 12.97440 11.63114 
1 1 1   24    3   15 o  247.797   6.6418   47.062   2.5192   44.664   4.7584   47.996   2.9694  240.556   12.971  250.176   7.7545 -9.620270 15.11244 
1 1 1   24    3   16 o  248.848   6.6582   47.466   2.5361   54.800   5.2153   45.194   2.9023  266.834   12.769  242.751   7.8112 24.08363 14.96906 
1 1 1   24    3   17 o  179.559   9.6371   24.828   2.6390   25.946   4.7603   24.333   3.1708  182.354   17.260  177.484   11.738 4.870132 20.87353 
1 1 1   24    3   18 o   99.624   14.500   7.8126   2.1461   11.188   4.7286   6.9367   2.4085  117.068   26.947   93.187   17.529 23.88130 32.14690 
1 1 1   24    3   19 o  471.843   5.7601  170.611   4.1600  175.397   7.5291  168.508   4.9911  477.725   10.297  468.784   6.9559 8.940735 12.42601 
1 1 1   24    3   20 o  239.280   6.2403   43.889   2.2855   44.059   3.3337   43.739   3.1394  239.523   9.0929  238.697   8.5928 0.8264923 12.51073 
1 1 1   24    3   21 o  232.917   7.0190   41.608   2.5023   44.843   3.5037   38.240   3.5750  241.588   9.4752  222.997   10.474 18.59081 14.12385 
1 1 1   24    3   22 o   89.394   13.486   6.3017   1.7879   5.5228   2.8309   6.8185   2.3060   82.585   22.000   92.382   16.932 -9.796265 27.76137 
1 1 1   24    3   23 o  253.968   5.9522   49.448   2.3138   46.787   3.8340   50.971   2.9018  246.638   10.156  257.735   7.3556 -11.09746 12.54001 
1 1 1   24    3   24 o  165.990   9.3348   21.247   2.3620   27.013   3.9832   18.120   2.9335  186.416   14.063  152.730   12.663 33.68527 18.92408 
1 1 1   24    3   25 o  429.949   6.3187  141.781   4.1583  147.964   5.6568  134.512   6.1336  438.854   8.4213  418.193   9.5823 20.66187 12.75688 
1 1 1   24    3   26 o   99.075   13.236   7.7181   1.9570   5.5997   3.4130   8.7559   2.3887   83.408   24.863  105.206   15.281 -21.79757 29.18320 
1 1 1   24    3   27 o  173.034   8.4272   23.014   2.2320   21.066   3.9519   23.926   2.7046  163.899   15.955  175.983   10.083 -12.08417 18.87414 
1 1 1   24    3   28 o  199.625   7.7811   30.618   2.3775   23.761   4.1522   33.963   2.9000  174.125   15.750  210.104   9.0177 -35.97926 18.14850 
1 1 1   24    3   29 f  134.281   12.389   14.060   2.5177   13.992   4.0377   14.103   3.2204  131.840   20.689  133.659   16.063 -1.818817 26.19309 
1 1 1   24    3   30 o  116.940   12.835   10.712   2.2596   14.041   4.1641   9.3225   2.6901  131.782   21.377  108.076   16.808 23.70547 27.19338 
1 1 1   24    3   31 o  284.463   6.5589   62.128   2.8558   64.431   4.8088   60.874   3.5495  288.875   10.876  281.315   8.2434 7.560333 13.64673 
1 1 1   24    3   32 o  158.114   9.7805   19.349   2.3554   20.906   3.6609   18.249   3.0768  163.242   14.813  152.808   13.287 10.43391 19.89887 
1 1 1   24    3   33 o  255.364   6.9466   50.106   2.7152   52.649   4.2850   48.399   3.5097  261.049   10.724  250.613   9.1494 10.43608 14.09675 
1 1 1   24    3   34 o  106.902   15.195   9.0865   2.4163   10.837   3.5470   7.5710   3.3007  115.252   20.875   95.513   22.879 19.73904 30.97132 
1 1 1   24    3   35 o  119.648   13.166   11.256   2.3713   13.530   3.6803   9.6412   3.1008  129.578   19.131  108.947   19.301 20.63169 27.17631 
1 1 1   24    3   36 o  168.100   10.571   21.939   2.7060   22.509   4.2658   21.555   3.5004  168.495   16.763  165.749   13.927 2.745209 21.79315 
1 1 1   24    3   37 o  184.899   10.439   26.532   2.9423   28.340   4.1122   24.636   4.2115  190.004   14.243  176.584   15.747 13.42026 21.23320 
1 1 1   24    3   38 f  165.994   10.917   21.441   2.7582   26.831   4.1567   17.200   3.6869  184.556   14.840  146.913   16.692 37.64238 22.33488 
1 1 1   24    3   39 o   74.813   24.398   4.4865   3.2094  -2.8811   5.6964   7.9129   3.8846   60.134   27.524   96.456   25.806 -36.32166 37.72987 
1 1 1   24    3   40 o   66.424   22.607   3.3905   2.7501   1.1927   3.8711   5.6298   3.9076   60.868   25.269   82.745   26.918 -21.87659 36.92025 
1 1 1   24    3   41 o   38.809   18.486  -3.6205   3.0283  -5.3716   3.9533  -1.1338   4.7111   42.742   20.561   58.162   25.967 -15.42016 33.12191 
1 1 1   24    3   42 o   98.446   20.418   8.0878   2.9757   5.0107   4.3501   10.794   4.0796   79.805   28.353  112.447   24.403 -32.64118 37.40920 
1 1 1   24    3   43 o  207.030   10.717   33.442   3.3845   35.479   5.4521   32.165   4.3171  210.229   17.091  201.637   14.076 8.591660 22.14164 
1 1 1   24    3   44 o  130.814   15.428   13.761   3.0298   18.382   4.4913   9.9019   4.1042  149.087   20.202  106.419   25.525 42.66796 32.55242 
1 1 1   24    3   45 o   75.373   23.276   4.8178   2.9553   3.3115   4.3023   6.1634   4.0664   70.656   27.558   84.345   27.461 -13.68877 38.90458 
1 1 1   24    3   46 o   82.237   24.820   5.9011   3.3858   2.5450   4.8033   9.2155   4.7734   69.191   28.377  100.298   29.274 -31.10620 40.77052 
1 1 1   24    3   47 o   93.326   22.339   7.6066   3.1486   17.645   4.8698   0.3959   4.1274  142.956   23.038   57.735   25.088 85.22082 34.06156 
1 1 1   24    3   48 f   83.254   22.403   6.1245   2.9176   5.4837   4.0220   6.8363   4.2388   78.895   27.322   86.255   28.035 -7.360565 39.14616 
1 1 1   24    3   49 f  143.735   15.015   16.856   3.2547   15.255   4.1244   19.499   5.2986  132.928   20.966  147.928   24.241 -15.00000 32.05034 
1 1 1   24    3   50 o  139.633   13.904   15.832   2.9322   14.995   4.1668   16.652   4.1270  130.883   21.549  139.253   19.931 -8.369919 29.35324 
1 1 1   24    4    1 o  186.835   11.887   26.915   3.3818   31.981   5.1726   23.134   4.4694  203.037   16.795  172.403   17.165 30.63376 24.01482 
1 1 1   24    4    2 o  441.196   8.0275  149.208   5.4210  159.809   8.4316  141.738   7.0777  456.142   12.077  429.738   10.760 26.40341 16.17483 
1 1 1   24    4    3 o  349.795   8.2803   93.801   4.4333   99.763   7.2546   90.248   5.6008  360.273   13.156  342.913   10.671 17.35986 16.93926 
1 1 1   24    4    4 o  387.568   6.5688  115.082   3.8968  120.657   7.8628  113.267   4.4865  396.222   12.965  384.427   7.6247 11.79550 15.04079 
1 1 1   24    4    5 o  313.016   5.9906   75.054   2.8702   86.342   7.1774   72.905   3.1315  335.048   13.996  308.471   6.6323 26.57721 15.48752 
1 1 1   24    4    6 o  123.009   9.1515   11.669   1.7107   21.138   6.0587   10.849   1.7833  163.070   25.077  118.497   9.9234 44.57392 26.96906 
1 1 1   24    4    7 o  384.878   11.811  113.786   6.9577   0.0000   0.0000  113.786   6.9577  ?   ?   384.878   11.811 0.000000 11.81055 
1 1 1   24    4    8 o  359.490   12.030   99.292   6.6196   0.0000   0.0000   99.292   6.6196  ?   ?   359.490   12.030 0.000000 12.03032 
1 1 1   24    4    9 o  482.404   12.061  178.820   8.9058   0.0000   0.0000  178.820   8.9058  ?   ?   482.404   12.061 0.000000 12.06130 
1 1 1   24    4   10 o  494.537   7.2488  187.453   5.4870  197.414   7.0406  172.044   8.7567  507.292   9.0674  473.142   12.091 34.15021 15.11361 
1 1 1   24    4   11 o  489.558   7.3107  183.711   5.4782  198.769   7.1401  162.162   8.5415  508.997   9.1647  459.311   12.149 49.68524 15.21844 
1 1 1   24    4   12 o  208.907   8.9597   33.482   2.8649   27.971   5.3863   35.656   3.3832  189.245   18.846  215.501   10.257 -26.25505 21.45601 
1 1 1   24    4   13 o  260.549   7.3782   52.043   2.9424   49.055   4.6648   54.018   3.7920  252.594   12.065  265.308   9.3378 -12.71474 15.25675 
1 1 1   24    4   14 o  175.897   9.5349   23.819   2.5575   31.876   4.3418   19.537   3.1649  202.950   14.064  158.792   13.139 44.15787 19.24645 
1 1 1   24    4   15 o   30.400   13.730  -0.7366   1.3599   5.8698   4.2075  -1.5072   1.4370   87.208   27.891   28.083   13.181 59.12469 30.84884 
1 1 1   24    4   16 o  317.288   5.5787   77.130   2.7093   89.831   5.8424   73.651   3.0580  341.852   11.166  309.991   6.4449 31.86105 12.89220 
1 1 1   24    4   17 o  607.261   6.2688  282.630   5.8268  303.568   9.5312  270.135   7.3630  628.672   9.9050  593.397   8.1066 35.27515 12.79940 
1 1 1   24    4   18 f  205.043   8.0797   32.257   2.5358   30.470   5.0628   32.855   2.9297  197.753   16.888  206.855   9.2532 -9.102081 19.25690 
1 1 1   24    4   19 o  195.158   7.6458   29.217   2.2839   37.753   5.3195   27.288   2.5289  220.433   15.872  188.536   8.7632 31.89642 18.13071 
1 1 1   24    4   20 o  195.460   7.8761   29.315   2.3564   26.332   5.3830   30.022   2.6208  183.034   19.515  197.749   8.6586 -14.71535 21.34974 
1 1 1   24    4   21 o  177.714   7.7565   24.235   2.1099   24.756   3.0272   23.743   2.9423  179.024   11.102  175.323   11.020 3.700974 15.64281 
1 1 1   24    4   22 o  303.887   5.2982   70.768   2.4644   81.066   4.2063   65.385   3.0410  324.918   8.4579  291.978   6.8044 32.93991 10.85520 
1 1 1   24    4   23 o  270.552   6.1051   56.123   2.5282   53.707   3.8865   57.895   3.3288  264.307   9.6067  274.619   7.9194 -10.31174 12.45016 
1 1 1   24    4   24 o  400.335   5.2849  122.834   3.2384  123.951   5.9533  122.364   3.8594  401.462   9.6882  399.445   6.3124 2.017426 11.56317 
1 1 1   24    4   25 o  121.638   10.578   11.478   1.9499   10.377   3.4506   11.995   2.3634  113.469   20.627  124.021   12.626 -10.55223 24.18489 
1 1 1   24    4   26 o   74.944   21.389   4.5255   2.5745  -4.1039   3.5516   14.079   3.7371   42.808   20.284  133.019   18.885 -90.21091 27.71414 
1 1 1   24    4   27 o  108.195   12.517   9.1630   2.0346   13.531   3.8982   7.5278   2.3853  129.893   20.269   97.045   16.658 32.84821 26.23581 
1 1 1   24    4   28 o   78.354   17.062   4.9676   1.9882   6.1634   3.8220   4.5240   2.3280   87.211   26.382   74.616   19.984 12.59489 33.09590 
1 1 1   24    4   29 o  150.198   10.816   17.493   2.4699   23.192   4.2769   14.642   3.0253  171.721   16.474  136.541   14.708 35.18063 22.08421 
1 1 1   24    4   30 o  158.133   10.773   19.386   2.5919   24.645   4.4230   16.635   3.1987  176.982   16.518  145.627   14.545 31.35539 22.00930 
1 1 1   24    4   31 o  138.983   11.475   15.028   2.4193   12.364   5.1446   15.785   2.7414  121.278   28.241  142.201   12.730 -20.92340 30.97724 
1 1 1   24    4   32 o  319.186   7.0664   78.279   3.4523   73.970   8.4863   79.133   3.7792  306.408   18.176  320.805   7.6964 -14.39786 19.73817 
1 1 1   24    4   33 o  161.437   10.630   20.217   2.6119   27.630   5.2865   17.823   3.0042  186.438   18.781  150.984   13.130 35.45404 22.91567 
1 1 1   24    4   34 o  261.669   8.2358   52.711   3.2986   55.970   5.9005   51.230   3.9783  267.638   14.457  257.588   10.090 10.05054 17.63026 
1 1 1   24    4   35 o   91.488   17.172   6.7764   2.3164   8.3382   3.6931   5.7635   2.9741   99.815   24.382   83.431   22.690 16.38411 33.30635 
1 1 1   24    4   36 o  235.851   7.9548   42.830   2.8717   47.769   4.8999   40.246   3.5442  247.516   12.979  228.194   10.147 19.32129 16.47440 
1 1 1   24    4   37 o  207.165   8.7533   33.100   2.7756   29.982   4.1977   35.522   3.6999  195.486   14.124  213.763   11.349 -18.27737 18.11847 
1 1 1   24    4   38 o  190.390   11.388   28.220   3.3035   29.597   4.3689   26.381   5.0480  193.872   14.835  181.589   18.417 12.28302 23.64859 
1 1 1   24    4   39 o  224.922   10.599   39.203   3.6489   40.753   6.4367   38.469   4.4293  225.653   18.807  221.715   13.110 3.938614 22.92578 
1 1 1   24    4   40 f  151.458   12.174   17.974   2.7985   18.947   4.3283   17.275   3.6684  153.132   18.865  147.014   16.593 6.117874 25.12397 
1 1 1   24    4   41 o   69.169   23.651   3.7177   3.0101   6.8069   4.1380   0.2458   4.3868   89.390   27.532   60.353   26.045 29.03716 37.89907 
1 1 1   24    4   42 o   95.929   20.141   7.6780   2.8631   5.7400   4.2729   9.2572   3.8570   83.343   28.180  103.852   24.636 -20.50963 37.43041 
1 1 1   24    4   43 o   67.813   22.961   3.6434   2.8367   9.7189   4.2328  -1.3104   3.8221  105.446   26.311   51.281   23.102 54.16518 35.01397 
1 1 1   24    4   44 o   69.359   23.450   3.8705   2.9590   7.1882   4.7056   1.7007   3.8054   90.515   29.544   61.701   25.276 28.81422 38.88116 
1 1 1   24    4   45 o  123.574   17.163   12.476   3.1586   10.077   4.8440   14.251   4.1662  105.350   29.085  129.919   21.717 -24.56939 36.29817 
1 1 1   24    4   46 o  189.968   11.766   28.437   3.4045   30.303   4.6263   26.232   5.0280  193.986   15.716  178.602   18.668 15.38388 24.40280 
1 1 1   24    4   47 o  127.434   16.482   13.313   3.1395   12.150   4.7394   14.223   4.1910  115.415   27.262  128.598   22.088 -13.18292 35.08711 
1 1 1   24    4   48 o   93.504   20.936   7.6077   2.9217   8.7403   4.0402   6.3662   4.2302   97.401   26.428   83.636   28.040 13.76475 38.53119 
1 1 1   24    4   49 o   46.287   20.792  -0.7433   3.0701  -1.0320   3.9409  -0.2977   4.8969   51.376   23.273   58.855   26.361 -7.478245 35.16424 
1 1 1   24    4   50 o   74.322   25.259   4.9380   3.4331   7.2820   4.8034   2.4902   4.9085   86.854   29.870   67.008   28.181 19.84586 41.06573 
1 1 1   24    5    0 o  291.556   13.689   65.636   6.0780   65.636   6.0780   65.636   6.0780  291.556   13.689  291.556   13.689 0.000000 0.000000 
1 1 1   24    5    1 o  468.426   11.293  168.467   8.0966   0.0000   0.0000  168.467   8.0966  ?   ?   468.426   11.293 0.000000 11.29253 
1 1 1   24    5    2 o  244.454   10.384   45.858   3.8854   48.385   6.0878   44.122   5.0471  250.132   15.984  239.132   13.848 11.00017 21.14887 
1 1 1   24    5    3 o  304.735   8.9142   71.214   4.1579   75.010   6.9323   69.081   5.1963  312.232   14.505  299.951   11.318 12.28067 18.39866 
1 1 1   24    5    4 o  431.046   7.8302  142.421   5.1662  166.115   8.9870  130.727   6.3136  464.934   12.629  412.766   9.9931 52.16870 16.10415 
1 1 1   24    5    5 o  257.412   17.403   51.340   6.8164   51.340   6.8164   0.0000   0.0000  257.412   17.403  ?   ?  0.000000 17.40264 
1 1 1   24    5    6 o  233.281   11.189   41.787   3.9952   56.234   6.9580   34.682   4.8798  269.519   16.953  211.698   15.160 57.82085 22.74268 
1 1 1   24    5    7 o  268.937   8.4396   55.460   3.4741   58.140   4.5956   51.886   5.3070  275.180   10.911  259.403   13.412 15.77722 17.28953 
1 1 1   24    5    8 o  275.080   10.922   58.103   4.5987   50.766   7.8238   61.975   5.6842  255.341   20.183  283.896   13.081 -28.55446 24.05129 
1 1 1   24    5    9 o  308.993   12.606   73.401   5.9623   0.0000   0.0000   73.401   5.9623  ?   ?   308.993   12.606 0.000000 12.60649 
1 1 1   24    5   10 o  180.209   9.5744   24.990   2.6315   31.614   5.5349   23.056   2.9911  201.479   18.142  172.872   11.368 28.60634 21.40951 
1 1 1   24    5   11 f  230.594   7.6770   40.767   2.7096   41.145   4.5993   40.566   3.3533  230.908   13.067  229.914   9.5289 0.9945068 16.17220 
1 1 1   24    5   12 o  108.731   14.593   9.2678   2.3674   11.604   5.0932   8.6239   2.6738  119.333   28.311  104.307   17.357 15.02549 33.20859 
1 1 1   24    5   13 o  426.155   7.0243  139.209   4.5818  164.703   9.2400  130.897   5.2762  462.632   13.049  413.100   8.3444 49.53217 15.48861 
1 1 1   24    5   14 o  385.028   6.5300  113.617   3.8483  121.829   6.2047  108.484   4.9059  398.293   10.178  376.041   8.5235 22.25269 13.27535 
1 1 1   24    5   15 o  123.515   25.401   12.352   4.6418   12.352   4.6418   0.0000   0.0000  123.515   25.401  ?   ?  0.000000 25.40061 
1 1 1   24    5   16 o  193.326   9.3601   28.694   2.7697   31.609   4.9529   27.367   3.3410  201.647   16.183  188.286   11.650 13.36086 19.94054 
1 1 1   24    5   17 o  131.039   7.6074   13.214   1.5193   14.918   4.9421   13.036   1.5966  136.106   24.629  130.108   8.0567 5.998672 25.91373 
1 1 1   24    5   18 o  283.102   6.5248   61.440   2.8274   62.502   5.7773   61.106   3.2422  284.796   13.253  282.254   7.5045 2.541290 15.23038 
1 1 1   24    5   19 o  135.321   8.9426   14.121   1.8418   7.1224   5.0335   15.203   1.9790   95.361   30.507  140.394   9.2616 -45.03348 31.88167 
1 1 1   24    5   20 o  346.009   5.4434   91.742   2.8829   92.574   4.1202   90.944   4.0352  347.347   7.7497  344.286   7.6573 3.060913 10.89458 
1 1 1   24    5   21 o  204.457   7.6156   32.076   2.3833   32.232   5.7951   32.044   2.6146  202.753   18.891  204.301   8.3612 -1.548096 20.65849 
1 1 1   24    5   22 o  112.284   9.5199   9.7591   1.6207   7.7005   2.8536   10.739   1.9692   97.722   19.757  117.606   11.069 -19.88397 22.64666 
1 1 1   24    5   23 o  469.216   4.8443  168.693   3.4792  175.037   5.8451  165.211   4.3297  477.473   7.9978  464.190   6.0939 13.28354 10.05487 
1 1 1   24    5   24 o  266.283   5.9265   54.367   2.4155   59.068   4.6491   52.629   2.8270  276.932   10.968  261.890   7.0525 15.04251 13.03973 
1 1 1   24    5   25 o  520.778   5.2667  207.884   4.1982  227.621   8.0100  200.409   4.9295  543.951   9.6207  511.158   6.3005 32.79288 11.50015 
1 1 1   24    5   26 o  109.282   11.765   9.3187   1.9368   12.933   3.7197   7.9744   2.2686  127.133   19.757  100.294   15.259 26.83970 24.96338 
1 1 1   24    5   27 o  170.220   9.4048   22.366   2.4409   23.978   3.9996   21.409   3.0812  175.133   15.067  166.038   12.209 9.095001 19.39276 
1 1 1   24    5   28 o  101.092   13.298   8.0446   2.0077   6.5023   4.0169   8.5582   2.3179   89.423   27.045  103.948   15.003 -14.52466 30.92752 
1 1 1   24    5   29 o  191.016   8.0934   28.053   2.3663   29.474   4.5285   27.519   2.7753  194.062   15.371  188.767   9.6376 5.294510 18.14280 
1 1 1   24    5   30 o  226.805   8.2746   39.565   2.8726   39.147   5.4335   39.728   3.3842  223.547   15.985  227.051   9.7377 -3.503845 18.71757 
1 1 1   24    5   31 o  355.010   6.0317   96.721   3.2775  103.518   6.1407   94.014   3.8758  366.108   10.958  349.793   7.2390 16.31549 13.13329 
1 1 1   24    5   32 o  241.218   8.1428   44.768   3.0064   47.615   7.7935   44.270   3.2587  244.316   21.046  239.753   8.8799 4.563400 22.84252 
1 1 1   24    5   33 o   72.312   22.737   4.1600   2.8058  -1.7433   7.5237   5.1137   3.0240   73.454   32.803   79.161   23.356 -5.707802 40.26877 
1 1 1   24    5   34 o  140.739   12.319   15.474   2.6271   12.521   5.4590   16.364   2.9969  121.054   29.689  144.414   13.723 -23.36047 32.70668 
1 1 1   24    5   35 o  116.100   15.135   10.699   2.6257   11.633   5.6981   10.447   2.9585  116.074   31.339  114.030   17.510 2.044411 35.89914 
1 1 1   24    5   36 o   45.982   20.144  -0.4577   2.7083   0.8688   6.9133  -0.6982   2.9435   76.362   32.823   47.092   20.802 29.26997 38.86006 
1 1 1   24    5   37 o   83.693   31.872   4.7410   5.6578   4.7410   5.6578   0.0000   0.0000   83.693   31.872  ?   ?  0.000000 31.87237 
1 1 1   24    5   38 o  163.340   15.785   21.142   3.8972   25.230   6.1870   18.453   5.0178  175.079   23.696  149.847   22.578 25.23178 32.73053 
1 1 1   24    5   39 o  181.128   10.453   25.498   2.8856   23.672   4.5892   26.693   3.7110  172.059   17.677  184.501   13.229 -12.44125 22.07879 
1 1 1   24    5   40 o  100.794   18.197   8.3035   2.7041   7.0844   4.2397   9.1395   3.5108   91.222   27.829  104.323   22.637 -13.10094 35.87307 
1 1 1   24    5   41 o  133.902   15.782   14.336   3.1724   11.740   4.4514   17.016   4.5223  117.098   25.554  143.748   21.189 -26.65002 33.19581 
1 1 1   24    5   42 o  209.326   9.8019   33.984   3.1405   27.636   4.6525   39.297   4.2567  185.872   16.525  223.858   12.473 -37.98544 20.70404 
1 1 1   24    5   43 o  167.943   11.817   22.144   3.0182   20.747   4.4204   23.364   4.1310  159.702   18.421  170.783   15.989 -11.08177 24.39265 
1 1 1   24    5   44 o  140.651   15.633   15.913   3.3087   22.350   5.5693   12.402   4.1132  162.820   22.987  120.541   23.135 42.27835 32.61301 
1 1 1   24    5   45 o  121.035   17.630   12.022   3.1702   11.823   4.2878   12.261   4.7084  116.429   24.819  117.520   26.773 -1.090851 36.50724 
1 1 1   24    5   46 o  133.291   15.142   14.348   3.0344   16.894   4.2247   11.634   4.3612  142.201   19.960  114.581   25.521 27.61996 32.39950 
1 1 1   24    5   47 o  103.699   20.622   9.2196   3.1579   12.031   4.6357   6.7857   4.3137  114.982   26.830   86.498   28.290 28.48425 38.98923 
1 1 1   24    5   48 o  130.285   14.902   13.818   2.9183   14.935   3.8657   12.338   4.4500  132.760   19.614  116.567   25.638 16.19275 32.28057 
1 1 1   24    5   49 o   77.498   22.548   5.3569   2.8358   3.8691   3.7115   7.4437   4.3956   69.287   25.941   88.552   28.527 -19.26556 38.55820 
1 1 1   24    5   50 o   78.773   26.410   5.7034   3.7526   7.5802   4.7998   2.7522   6.0187   88.260   29.867   71.437   30.664 16.82362 42.80536 
1 1 1   24    6    0 f  202.946   17.175   32.310   5.2472   32.310   5.2472   32.310   5.2472  202.946   17.175  202.946   17.175 0.000000 0.000000 
1 1 1   24    6    1 o  282.612   12.719   61.382   5.5017   0.0000   0.0000   61.382   5.5017  ?   ?   282.612   12.719 0.000000 12.71856 
1 1 1   24    6    2 o  312.517   8.6975   74.894   4.1604   80.620   7.0118   71.782   5.1686  323.718   14.151  305.772   11.043 17.94644 17.95024 
1 1 1   24    6    3 o  317.297   8.1979   77.186   3.9814   87.537   7.4469   73.043   4.7113  337.279   14.425  308.533   9.9763 28.74597 17.53876 
1 1 1   24    6    4 o  511.720   13.062  201.314   10.231  201.314   10.231   0.0000   0.0000  511.720   13.062  ?   ?  0.000000 13.06225 
1 1 1   24    6    5 o  306.397   16.200   72.554   7.5706   72.554   7.5706   0.0000   0.0000  306.397   16.200  ?   ?  0.000000 16.20034 
1 1 1   24    6    6 o  142.649   31.317   16.583   6.6505   16.583   6.6505   0.0000   0.0000  142.649   31.317  ?   ?  0.000000 31.31734 
1 1 1   24    6    7 o   78.674   26.367   4.5575   3.7404   4.5575   3.7404   0.0000   0.0000   78.674   26.367  ?   ?  0.000000 26.36656 
1 1 1   24    6    8 o  263.966   6.9699   53.400   2.8161   60.083   4.7857   49.860   3.4829  279.693   11.179  254.954   8.9250 24.73875 14.30461 
1 1 1   24    6    9 o  406.184   6.2236  126.410   3.8693  130.119   6.1331  123.957   4.9871  411.762   9.7311  402.066   8.1037 9.696594 12.66349 
1 1 1   24    6   10 o  213.889   9.0378   35.098   2.9588   29.628   7.8354   36.008   3.1954  192.818   27.313  216.607   9.6380 -23.78847 28.96322 
1 1 1   24    6   11 o  189.727   10.820   27.738   3.1293   0.0000   0.0000   27.738   3.1293  ?   ?   189.727   10.820 0.000000 10.82042 
1 1 1   24    6   12 o  423.133   6.9831  137.238   4.5227  155.479   8.9020  130.891   5.2508  449.522   12.938  413.099   8.3043 36.42224 15.37371 
1 1 1   24    6   13 o  212.485   9.0163   34.647   2.9324   36.837   5.8778   33.921   3.3836  217.547   17.808  209.880   10.566 7.666916 20.70698 
1 1 1   24    6   14 o  276.009   7.5033   58.415   3.1699   62.975   5.3610   55.963   3.9306  286.122   12.241  269.997   9.5112 16.12494 15.50190 
1 1 1   24    6   15 o  213.441   8.7591   34.961   2.8616   38.284   4.9579   33.301   3.5042  222.341   14.651  207.855   11.054 14.48621 18.35293 
1 1 1   24    6   16 o  538.721   6.5474  222.461   5.3989  246.352   8.6482  207.205   6.9110  566.320   9.9769  519.607   8.6895 46.71222 13.23049 
1 1 1   24    6   17 o  282.683   8.0062   61.307   3.4641   67.840   5.8560   57.790   4.2965  296.781   12.891  274.241   10.236 22.54062 16.46056 
1 1 1   24    6   18 o   82.544   24.719   5.4093   3.3678   1.1195   4.8795   9.3118   4.6541   68.446   28.388  106.701   28.106 -38.25494 39.94817 
1 1 1   24    6   19 o  352.118   6.3955   95.052   3.4469  101.189   4.0445   78.766   6.5891  363.214   7.2750  319.591   13.470 43.62314 15.30892 
1 1 1   24    6   20 o  191.878   5.8860   28.220   1.7287   38.434   2.9889   23.086   2.1190  223.721   8.7285  173.439   7.9822 50.28207 11.82804 
1 1 1   24    6   21 o  101.443   11.594   8.0258   1.7678   4.7330   5.4342   8.4156   1.8695   85.170   31.487  103.843   11.982 -18.67241 33.68968 
1 1 1   24    6   22 o  372.529   5.1925  106.348   2.9608  114.635   4.7863  101.211   3.7682  386.410   8.0926  363.253   6.7773 23.15744 10.55565 
1 1 1   24    6   23 o   99.160   10.887   7.6602   1.6252   10.392   3.0411   6.5682   1.9229  114.267   17.982   91.110   14.256 23.15736 22.94691 
1 1 1   24    6   24 o  165.823   7.4461   21.108   1.8899   20.430   3.5184   21.382   2.2406  161.868   14.350  166.567   8.8197 -4.699005 16.84343 
1 1 1   24    6   25 o  175.648   7.6402   23.691   2.0541   21.910   4.2235   24.243   2.3509  167.065   16.742  177.599   8.6480 -10.53392 18.84338 
1 1 1   24    6   26 o   49.168   18.027   1.5278   1.7753   3.3544   3.6469   0.9605   2.0324   70.895   25.860   47.342   18.794 23.55286 31.96849 
1 1 1   24    6   27 o  250.113   7.4097   48.045   2.8366   46.288   4.5173   49.189   3.6449  244.787   12.056  252.798   9.4198 -8.011353 15.30002 
1 1 1   24    6   28 f  335.261   5.9108   86.226   3.0332   83.232   6.0298   87.241   3.5096  328.173   12.004  337.098   6.8019 -8.925049 13.79730 
1 1 1   24    6   29 f  407.832   5.6634  127.583   3.5353  136.893   7.0418  124.445   4.0879  421.146   10.924  402.615   6.6334 18.53104 12.78029 
1 1 1   24    6   30 o  109.461   14.908   9.4827   2.4328   13.666   4.6776   7.9315   2.8484  128.867   24.612   98.808   19.526 30.05882 31.41648 
1 1 1   24    6   31 o  300.924   6.5692   69.535   3.0258   72.911   5.7781   68.259   3.5517  306.867   12.302  297.949   7.7880 8.917847 14.55967 
1 1 1   24    6   32 o   45.719   19.275   0.2605   2.3056   1.1593   5.1410   0.0342   2.5796   68.905   28.902   47.093   20.141 21.81278 35.22776 
1 1 1   24    6   33 o  351.565   7.7136   95.068   4.1508  107.910   9.7316   92.213   4.5892  370.912   17.141  346.017   8.6651 24.89413 19.20694 
1 1 1   24    6   34 f  158.817   10.940   19.598   2.6433   21.606   5.8326   19.079   2.9653  162.348   24.212  156.331   12.497 6.017776 27.24693 
1 1 1   24    6   35 o   81.105   20.688   5.4301   2.5763   16.416   6.0694   3.0155   2.8454  138.732   29.491   64.799   22.941 73.93372 37.36326 
1 1 1   24    6   36 f   79.728   23.228   5.2428   3.0077   5.6572   7.0573   5.1508   3.3248   91.623   35.418   79.483   24.712 12.14013 43.18672 
1 1 1   24    6   37 o   80.886   22.834   5.4298   2.9508  -0.9434   5.9987   7.4641   3.3892   66.778   29.587   94.318   23.549 -27.53997 37.81440 
1 1 1   24    6   38 o  241.424   9.1021   45.008   3.3635   39.548   6.6052   46.919   3.9082  221.963   19.645  246.169   10.372 -24.20656 22.21484 
1 1 1   24    6   39 o  155.398   15.454   19.156   3.6271   24.628   6.6794   16.867   4.3194  171.223   26.330  143.959   20.155 27.26418 33.15843 
1 1 1   24    6   40 o  126.838   16.621   12.920   3.1493   18.613   6.9297   11.438   3.5354  144.850   32.099  117.878   20.329 26.97241 37.99528 
1 1 1   24    6   41 o   48.159   21.764  -1.4263   3.4227   1.9187   6.3519  -2.7950   4.0631   75.470   31.915   49.208   22.782 26.26199 39.21231 
1 1 1   24    6   42 o  178.547   13.566   25.167   3.6796   26.135   5.9878   24.579   4.6642  177.391   22.564  174.596   17.698 2.794449 28.67628 
1 1 1   24    6   43 o  150.920   13.458   18.048   3.0763   23.436   4.7278   14.092   4.0512  169.722   18.499  129.981   21.085 39.74062 28.04951 
1 1 1   24    6   44 o   66.589   23.155   3.4718   2.8902   6.3342   4.2139   0.9290   3.9716   85.571   27.959   59.509   25.205 26.06204 37.64321 
1 1 1   24    6   45 o  231.595   11.294   41.978   4.0036   50.870   6.1764   35.535   5.2579  251.628   16.121  209.913   16.497 41.71562 23.06625 
1 1 1   24    6   46 o   50.766   21.532   0.5652   2.9050   4.2593   4.0465  -3.3638   4.1732   73.592   27.178   47.778   22.437 25.81369 35.24308 
1 1 1   24    6   47 f  151.659   14.315   18.530   3.2837   15.095   4.7147   21.766   4.5760  130.728   24.462  161.647   18.849 -30.91975 30.88116 
1 1 1   24    6   48 o   49.521   21.197   0.4671   2.8613  -0.6842   3.7924   1.9887   4.3597   51.668   23.166   63.852   26.687 -12.18436 35.33959 
1 1 1   24    6   49 o   52.882   21.689   1.3392   2.8061  -1.6516   3.7286   5.2457   4.2614   48.154   22.124   77.061   27.978 -28.90754 35.66868 
1 1 1   24    7    0 o  433.832   11.110  144.562   7.3668  144.562   7.3668  144.562   7.3668  433.832   11.110  433.832   11.110 0.000000 0.000000 
1 1 1   24    7    1 o  267.995   8.9459   55.085   3.6696   58.117   5.7312   52.978   4.7773  274.882   13.622  262.604   11.885 12.27771 18.07787 
1 1 1   24    7    2 o  346.822   9.4847   92.281   5.0350   0.0000   0.0000   92.281   5.0350  ?   ?   346.822   9.4847 0.000000 9.484668 
1 1 1   24    7    3 o  464.911   7.3579  165.661   5.2359  174.303   9.2578  161.597   6.3489  476.187   12.702  459.000   9.0368 17.18643 15.58833 
1 1 1   24    7    4 o  488.935   13.006  183.808   9.7336  183.808   9.7336   0.0000   0.0000  488.935   13.006  ?   ?  0.000000 13.00627 
1 1 1   24    7    5 o  742.154   9.1629  422.520   10.409  467.568   16.729  394.063   13.296  779.490   14.021  716.095   12.130 63.39551 18.54015 
1 1 1   24    7    6 o  265.601   18.455   54.766   7.4560   54.766   7.4560   0.0000   0.0000  265.601   18.455  ?   ?  0.000000 18.45487 
1 1 1   24    7    7 o  152.993   11.270   18.076   2.6205   17.802   4.0282   18.277   3.4505  150.808   17.793  153.337   14.889 -2.529266 23.20105 
1 1 1   24    7    8 f  223.873   8.9318   38.448   3.0606   44.749   4.5687   33.317   4.1224  240.941   12.431  207.722   13.032 33.21867 18.00957 
1 1 1   24    7    9 o  607.282   7.3267  282.702   6.8104  306.630   9.2655  254.583   10.044  632.095   9.5767  575.624   11.400 56.47131 14.88873 
1 1 1   24    7   10 o  387.431   6.3340  115.019   3.7562  122.546   6.1519  110.546   4.7428  399.525   10.060  379.665   8.1615 19.86032 12.95423 
1 1 1   24    7   11 o  294.628   7.9316   66.568   3.5769   89.090   9.0856   62.437   3.8911  339.069   17.567  285.264   8.9116 53.80542 19.69776 
1 1 1   24    7   12 o  328.339   7.8481   82.674   3.9442   89.438   9.7227   81.342   4.3152  339.377   18.790  325.611   8.6583 13.76642 20.68901 
1 1 1   24    7   13 o  180.407   10.039   25.071   2.7611   20.771   5.6890   26.396   3.1580  161.592   23.706  184.983   11.206 -23.39131 26.22093 
1 1 1   24    7   14 o  467.176   7.2000  167.338   5.1485  171.667   9.6107  165.595   6.0972  472.144   13.299  464.560   8.5747 7.583344 15.82351 
1 1 1   24    7   15 o  539.153   6.5987  222.820   5.4455  227.412   8.4616  219.574   7.1147  544.088   10.160  534.899   8.6899 9.189270 13.36969 
1 1 1   24    7   16 o  153.397   11.532   18.200   2.6878   20.716   4.9055   17.121   3.2130  162.076   20.214  148.318   14.331 13.75833 24.77853 
1 1 1   24    7   17 o  135.739   12.926   14.320   2.6532   19.223   4.8058   12.171   3.1820  155.889   20.649  124.246   17.193 31.64275 26.86995 
1 1 1   24    7   18 o  121.419   27.496   12.072   4.9913   12.072   4.9913   0.0000   0.0000  121.419   27.496  ?   ?  0.000000 27.49600 
1 1 1   24    7   19 o  376.705   5.7065  108.756   3.2903  107.946   4.1641  110.103   5.3685  375.137   7.2520  378.595   9.2643 -3.458038 11.76516 
1 1 1   24    7   20 o  226.643   7.1661   39.403   2.4860   43.875   3.1747   32.314   3.9971  239.029   8.6772  204.325   12.846 34.70319 15.50199 
1 1 1   24    7   21 o  171.634   8.8472   22.688   2.3163   20.555   2.9669   26.018   3.7068  162.897   11.983  183.140   13.315 -20.24350 17.91310 
1 1 1   24    7   22 o   67.673   23.036   3.3495   2.8556   7.0653   5.6227   2.0579   3.3149   95.954   32.326   62.660   24.259 33.29397 40.41685 
1 1 1   24    7   23 o  212.805   6.3506   34.732   2.0685   41.774   3.6897   31.504   2.4980  232.974   10.347  202.544   8.0577 30.43007 13.11440 
1 1 1   24    7   24 o  137.827   8.2841   14.646   1.7395   17.268   3.5301   13.805   1.9991  148.382   15.786  133.589   9.8460 14.79379 18.60455 
1 1 1   24    7   25 f   89.109   13.317   6.2710   1.7606   7.8861   3.9484   5.8702   1.9670   97.849   25.942   85.696   15.569 12.15291 30.25543 
1 1 1   24    7   26 o  175.461   7.6184   23.647   2.0460   27.969   4.6167   22.590   2.2824  188.993   16.113  171.179   8.7402 17.81381 18.33125 
1 1 1   24    7   27 o  348.877   5.6600   93.347   3.0224  102.309   6.1377   90.479   3.4727  364.172   11.011  343.343   6.6079 20.82919 12.84173 
1 1 1   24    7   28 o   99.228   16.921   7.8866   2.4779   8.7338   4.2609   7.4537   3.0459  102.429   26.850   95.403   21.387 7.025543 34.32687 
1 1 1   24    7   29 o  193.033   7.9461   28.647   2.3478   26.366   4.8040   29.363   2.6910  182.858   17.373  195.304   9.0020 -12.44672 19.56634 
1 1 1   24    7   30 o  350.932   6.4777   94.548   3.4795   97.888   6.1961   93.009   4.2051  355.918   11.374  347.799   7.8991 8.118896 13.84751 
1 1 1   24    7   31 o  130.537   11.677   13.282   2.3085   19.390   5.3114   11.860   2.5632  154.453   23.183  122.814   13.879 31.63865 27.01967 
1 1 1   24    7   32 o  164.239   10.990   20.939   2.7467   20.744   5.6102   21.001   3.1501  159.507   23.699  164.110   12.638 -4.603653 26.85831 
1 1 1   24    7   33 o   52.781   20.793   1.3443   2.4700   11.297   8.4657   0.4182   2.5824  115.573   39.660   48.840   20.485 66.73276 44.63829 
1 1 1   24    7   34 o  233.114   8.0302   41.831   2.8653   46.526   6.5013   40.699   3.1920  242.597   17.629  229.755   9.0767 12.84215 19.82826 
1 1 1   24    7   35 o  180.491   11.135   25.317   3.0612   31.097   7.1398   24.015   3.3885  194.861   24.479  175.366   12.710 19.49489 27.58159 
1 1 1   24    7   36 o  130.988   14.531   13.560   2.8643   23.520   8.9742   12.431   3.0224  162.008   37.002  124.867   16.195 37.14096 40.39085 
1 1 1   24    7   37 o  330.295   7.4008   83.970   3.7416   84.861   8.2863   83.742   4.1934  327.939   16.562  329.600   8.3120 -1.660950 18.53050 
1 1 1   24    7   38 f   47.378   20.419  -0.0505   2.6891  -3.6805   6.2608   0.7706   2.9778   61.713   28.469   53.287   22.145 8.425987 36.06773 
1 1 1   24    7   39 o  222.898   11.410   38.696   3.8797   37.366   6.8953   39.312   4.6931  214.491   21.284  223.793   13.768 -9.301987 25.34839 
1 1 1   24    7   40 o   72.984   23.506   4.3157   2.9846   15.327   6.6907   1.5803   3.3348  130.378   33.383   59.167   23.874 71.21066 41.04147 
1 1 1   24    7   41 o  191.354   12.598   28.734   3.6691   25.540   6.4141   30.287   4.4733  174.392   24.722  195.456   15.069 -21.06415 28.95202 
1 1 1   24    7   42 o   67.734   25.903   3.0196   3.7466   0.0000   0.0000   3.0196   3.7466  ?   ?    67.734   25.903 0.000000 25.90258 
1 1 1   24    7   43 o   90.563   22.998   7.0463   3.1939   13.271   5.5807   4.0146   3.8948  121.082   30.211   72.914   26.705 48.16747 40.32200 
1 1 1   24    7   44 o   83.633   25.359   6.0591   3.5283   2.1848   5.4733   8.8140   4.6152   71.251   29.851   98.994   28.754 -27.74297 41.44711 
1 1 1   24    7   45 o  122.654   19.283   12.520   3.5007   7.8938   6.6652   14.282   4.1139   94.339   34.872  130.014   21.418 -35.67542 40.92468 
1 1 1   24    7   46 o   50.599   21.887   0.1833   3.1128  -2.1107   5.0494   1.5895   3.9534   56.162   25.782   61.243   25.489 -5.081161 36.25510 
1 1 1   24    7   47 o   73.386   23.719   4.6623   3.0368   1.2667   4.5237   7.4480   4.0973   62.422   26.684   89.999   27.336 -27.57713 38.20023 
1 1 1   24    7   48 o   39.657   18.658  -2.5261   2.9080  -2.8336   4.1699  -2.2348   4.0574   48.329   22.610   49.032   22.723 -0.7032928 32.05595 
1 1 1   24    7   49 o   32.370   16.103  -7.0905   3.1300  -3.3971   4.4374 -10.7474   4.4155   48.539   22.900   36.997   18.516 11.54113 29.44940 
1 1 1   24    8    0 o  461.741   10.435  163.667   7.3667  163.667   7.3667  163.667   7.3667  461.741   10.435  461.741   10.435 0.000000 0.000000 
1 1 1   24    8    1 o  149.394   11.197   17.236   2.5418   16.819   4.3749   17.449   3.1230  146.096   20.096  149.977   13.758 -3.881378 24.35429 
1 1 1   24    8    2 o  370.220   8.8426  105.127   5.0108   0.0000   0.0000  105.127   5.0108  ?   ?   370.220   8.8426 0.000000 8.842589 
1 1 1   24    8    3 o  452.736   12.377  157.550   8.5771  157.550   8.5771   0.0000   0.0000  452.736   12.377  ?   ?  0.000000 12.37724 
1 1 1   24    8    4 o  455.750   12.833  159.715   8.9520  159.715   8.9520   0.0000   0.0000  455.750   12.833  ?   ?  0.000000 12.83288 
1 1 1   24    8    5 o  369.195   8.2724  104.524   4.6747  116.233   8.3605   99.198   5.6386  388.596   14.056  359.474   10.248 29.12112 17.39509 
1 1 1   24    8    6 o  338.857   15.792   88.525   8.1906   88.525   8.1906   0.0000   0.0000  338.857   15.792  ?   ?  0.000000 15.79176 
1 1 1   24    8    7 o   62.413   20.900   2.8446   2.3502  -3.8433   3.9691   6.4554   2.9164   47.207   22.077   89.457   21.554 -42.24953 30.85395 
1 1 1   24    8    8 o   42.584   18.668  -0.5531   2.3294  -2.0894   3.7908   0.3788   2.9525   50.389   22.825   52.343   21.926 -1.954102 31.65078 
1 1 1   24    8    9 o   92.138   19.235   6.8126   2.6250   8.4941   4.1510   5.6921   3.3886  102.323   26.346   84.592   24.658 17.73128 36.08489 
1 1 1   24    8   10 o  249.014   9.0308   47.581   3.4421   55.913   5.1544   40.875   4.6243  269.614   12.490  230.085   13.186 39.52832 18.16203 
1 1 1   24    8   11 o  282.818   7.1795   61.319   3.1079   65.409   5.3985   59.292   3.8010  291.640   12.094  277.973   8.9336 13.66769 15.03544 
1 1 1   24    8   12 o  436.741   6.4349  146.184   4.3016  161.999   7.0914  136.977   5.4108  459.286   10.087  422.557   8.3658 36.72879 13.10504 
1 1 1   24    8   13 o  292.739   9.1282   65.777   4.0901   0.0000   0.0000   65.777   4.0901  ?   ?   292.739   9.1282 0.000000 9.128185 
1 1 1   24    8   14 o  231.541   9.7191   41.171   3.4445   33.816   8.8844   42.472   3.7367  205.223   29.098  235.114   10.384 -29.89085 30.89548 
1 1 1   24    8   15 o  319.518   7.9709   78.320   3.8983   83.001   7.6900   76.701   4.5224  327.871   15.323  316.056   9.3483 11.81482 17.94977 
1 1 1   24    8   16 o  140.169   13.471   15.280   2.8546   15.670   5.9799   15.165   3.2486  138.376   29.153  139.274   15.502 -0.8979340 33.01876 
1 1 1   24    8   17 o  194.147   12.937   29.171   3.8224   33.979   5.5086   24.705   5.3084  208.723   17.401  177.178   19.919 31.54530 26.44945 
1 1 1   24    8   18 o  357.954   8.9739   98.398   4.9168  114.995   6.9441   81.711   6.9627  386.496   11.738  325.399   13.979 61.09702 18.25403 
1 1 1   24    8   19 o  520.258   6.9103  207.588   5.5028  235.008   9.0716  191.625   6.9217  552.726   10.723  499.475   9.0537 53.25070 14.03381 
1 1 1   24    8   20 o  184.865   7.8797   26.230   2.2296   26.714   2.8165   25.418   3.6493  186.143   9.9210  181.028   13.262 5.115402 16.56252 
1 1 1   24    8   21 o  130.930   10.820   13.283   2.1490   12.774   2.7644   14.060   3.4164  127.767   14.386  133.548   17.107 -5.780731 22.35154 
1 1 1   24    8   22 o  339.326   8.0190   88.412   4.1649  100.901   7.3411   82.484   5.0577  361.463   13.269  327.437   10.092 34.02649 16.67031 
1 1 1   24    8   23 o  302.652   6.9182   70.284   3.2049   72.249   4.3427   67.934   4.7492  306.539   9.2556  297.056   10.445 9.482971 13.95591 
1 1 1   24    8   24 o   99.054   17.469   7.8545   2.5518   2.4826   3.7104   12.676   3.5151   66.874   25.729  126.137   18.779 -59.26289 31.85301 
1 1 1   24    8   25 o  311.570   7.2777   74.532   3.4707   85.147   6.7279   70.683   4.0514  331.792   13.248  303.205   8.7298 28.58713 15.86547 
1 1 1   24    8   26 o   39.836   16.486   0.3520   1.6405  -1.5154   4.0200   0.7251   1.7969   53.404   23.904   43.745   17.569 9.658440 29.66640 
1 1 1   24    8   27 o   88.903   13.538   6.2580   1.7840   6.6459   4.2965   6.1772   1.9611   90.583   28.080   87.979   15.107 2.603912 31.88568 
1 1 1   24    8   28 o   53.480   20.864   1.4400   2.4664   1.1414   4.4186   1.5752   2.9726   64.987   26.989   57.698   22.785 7.288631 35.32096 
1 1 1   24    8   29 o  150.454   9.5228   17.507   2.1817   18.633   4.8087   17.215   2.4481  152.235   21.213  148.963   10.811 3.271713 23.80896 
1 1 1   24    8   30 o  173.508   9.4370   23.264   2.4968   23.303   5.1367   23.251   2.8570  170.846   20.023  173.199   10.831 -2.353943 22.76471 
1 1 1   24    8   31 o   83.293   19.439   5.6795   2.4332   8.0187   5.3858   5.0796   2.7273   98.650   31.556   78.752   21.855 19.89865 38.38524 
1 1 1   24    8   32 o   93.046   16.644   6.9696   2.2834   4.4761   5.7121   7.4438   2.4911   83.613   31.981   95.986   17.604 -12.37332 36.50637 
1 1 1   24    8   33 o  132.895   12.667   13.825   2.5454   18.403   8.8884   13.416   2.6566  143.051   39.359  130.706   13.472 12.34535 41.60056 
1 1 1   24    8   34 o   96.738   19.652   7.6601   2.8107   16.320   11.429   7.1027   2.8997  133.901   46.075   92.776   20.919 41.12441 50.60133 
1 1 1   24    8   35 o  111.625   15.709   9.9388   2.6097  -0.3458   6.9417   11.632   2.8163   73.378   32.196  120.951   15.574 -47.57275 35.76493 
1 1 1   24    8   36 o  169.608   11.496   22.409   2.9669   23.774   9.1711   22.249   3.1355  162.364   37.637  168.811   12.218 -6.446976 39.57023 
1 1 1   24    8   37 o   44.284   19.795  -0.9656   2.7463  -1.8889   7.2673  -0.8118   2.9662   70.979   31.928   46.770   20.760 24.20926 38.08339 
1 1 1   24    8   38 o   49.965   21.079   0.4071   2.7604  -1.5656   7.6396   0.7033   2.9604   73.253   32.860   52.833   22.029 20.41983 39.56026 
1 1 1   24    8   39 o   48.932   21.926  -1.1536   3.3915   8.5226   6.8372  -4.3114   3.9059  100.654   35.569   44.617   21.179 56.03711 41.39709 
1 1 1   24    8   40 o   63.098   23.347   2.7159   2.9891  -0.9887   6.7222   3.6289   3.3372   69.617   31.054   69.719   24.827 -0.1020813 39.75887 
1 1 1   24    8   41 o  109.816   21.109   10.067   3.4193   12.002   6.7566   9.4008   3.9644  114.237   35.180  104.507   25.099 9.730469 43.21567 
1 1 1   24    8   42 o  188.394   11.378   27.780   3.2657   28.051   5.5029   27.633   4.0573  185.316   19.703  186.699   14.307 -1.383575 24.34915 
1 1 1   24    8   43 o  146.892   14.637   17.231   3.2471   11.007   5.4802   20.599   4.0309  109.674   31.174  159.753   16.733 -50.07794 35.38060 
1 1 1   24    8   44 o   56.979   23.705   1.1483   3.4174  -0.4676   5.3997   2.2280   4.4137   62.920   27.965   66.656   27.254 -3.736679 39.04890 
1 1 1   24    8   45 o  101.686   22.535   8.9357   3.4152   2.6000   6.6131   11.240   3.9882   76.263   32.423  113.745   23.677 -37.48186 40.14768 
1 1 1   24    8   46 o   77.213   23.788   5.1946   3.0889   4.4179   5.0337   5.6637   3.9121   76.584   29.826   80.415   26.965 -3.830612 40.20821 
1 1 1   24    8   47 o  113.819   20.575   11.117   3.4525   6.5375   5.9700   13.418   4.2320   85.918   32.735  123.583   23.225 -37.66467 40.13717 
1 1 1   24    8   48 o   29.293   14.766  -9.1685   3.0773  -7.9686   4.4287 -10.2888   4.2791   40.691   20.043   36.723   18.356 3.967712 27.17871 
1 1 1   24    8   49 o   61.461   23.471   2.7819   3.0735   2.8650   4.7078   2.7202   4.0575   67.748   27.974   64.858   26.276 2.889824 38.37957 
1 1 1   24    9    0 o  216.199   11.597   36.150   3.8125   36.150   3.8125   36.150   3.8125  216.199   11.597  216.199   11.597 0.000000 0.000000 
1 1 1   24    9    1 o   65.464   18.693   3.3933   1.9658  -1.7778   3.6097   5.5735   2.3438   49.857   22.457   83.282   18.829 -33.42457 29.30608 
1 1 1   24    9    2 o  272.189   6.4602   56.770   2.6915   0.0000   0.0000   56.770   2.6915  ?   ?   272.189   6.4602 0.000000 6.460220 
1 1 1   24    9    3 o  411.763   7.6837  129.986   4.8427  126.774   7.4579  132.327   6.3677  406.132   11.997  415.199   10.020 -9.066956 15.63103 
1 1 1   24    9    4 f  393.435   12.901  119.057   7.7692  119.057   7.7692   0.0000   0.0000  393.435   12.901  ?   ?  0.000000 12.90132 
1 1 1   24    9    5 f  348.706   14.272   93.636   7.6176   93.636   7.6176   0.0000   0.0000  348.706   14.272  ?   ?  0.000000 14.27210 
1 1 1   24    9    6 o  367.884   14.828  104.280   8.3496  104.280   8.3496   0.0000   0.0000  367.884   14.828  ?   ?  0.000000 14.82813 
1 1 1   24    9    7 o  190.521   9.9388   27.941   2.8883   34.264   4.5762   23.755   3.7236  210.441   14.292  175.089   14.012 35.35214 20.01463 
1 1 1   24    9    8 f  225.390   9.0910   38.982   3.1363   41.353   4.7088   37.091   4.2046  231.411   13.351  219.235   12.583 12.17534 18.34569 
1 1 1   24    9    9 f  538.961   7.3678  222.703   6.0781  244.947   8.3656  197.832   8.8459  564.873   9.6755  507.349   11.391 57.52475 14.94567 
1 1 1   24    9   10 o  439.492   7.5776  148.107   5.0974  165.654   7.1503  129.974   7.2689  464.457   10.058  411.187   11.549 53.27014 15.31502 
1 1 1   24    9   11 o   87.153   21.967   6.1367   2.9295   5.2301   4.4485   6.8309   3.8927   84.450   28.752   92.209   26.296 -7.758797 38.96324 
1 1 1   24    9   12 o  299.448   8.9170   68.819   4.0871   76.631   5.7627   60.912   5.7975  315.638   11.928  281.216   13.469 34.42239 17.99121 
1 1 1   24    9   13 o  259.790   8.4279   51.786   3.3513   54.757   6.6250   50.764   3.8850  265.696   16.370  257.091   9.8727 8.605164 19.11664 
1 1 1   24    9   14 o  317.163   8.3353   77.187   4.0465   83.010   9.3873   75.858   4.4845  326.628   18.857  314.318   9.3213 12.31006 21.03490 
1 1 1   24    9   15 o   67.520   26.312   2.2849   3.9193   2.9985   7.8623   2.0489   4.5212   89.492   36.458   69.920   27.944 19.57204 45.93520 
1 1 1   24    9   16 o  254.484   10.394   49.781   4.0488   55.621   5.7011   43.839   5.7508  268.175   13.937  237.600   15.905 30.57494 21.14721 
1 1 1   24    9   17 o  454.904   7.6295  158.764   5.3123  161.503   10.114  157.720   6.2428  457.357   14.448  453.188   8.9998 4.168579 17.02163 
1 1 1   24    9   18 o  481.754   9.5003  178.328   7.0054  195.196   11.014  166.867   9.0785  502.756   14.313  465.276   12.748 37.47995 19.16647 
1 1 1   24    9   19 o   61.378   22.292   2.4542   2.7055  -1.3346   6.0641   3.3957   3.0231   67.891   29.930   68.716   23.693 -0.8252945 38.17319 
1 1 1   24    9   20 o  305.566   6.2178   71.591   2.9081   82.350   3.8447   57.205   4.4458  327.564   7.6683  272.652   10.653 54.91226 13.12594 
1 1 1   24    9   21 o  295.917   7.1295   67.189   3.2292   71.472   4.4958   62.625   4.6414  304.879   9.6340  285.240   10.631 19.63892 14.34670 
1 1 1   24    9   22 o  254.813   7.8615   49.856   3.0662   49.625   4.3304   50.088   4.3421  253.799   11.147  254.986   11.125 -1.186798 15.74904 
1 1 1   24    9   23 o  221.097   10.598   37.648   3.5867   26.124   6.9552   41.822   4.1862  179.722   26.042  232.567   11.799 -52.84464 28.59039 
1 1 1   24    9   24 o  120.924   14.501   11.486   2.6304   14.039   3.8432   9.2357   3.6078  132.637   19.514  106.309   22.852 26.32808 30.04980 
1 1 1   24    9   25 o  157.173   12.517   19.209   2.9863   16.403   4.6166   21.227   3.9159  142.803   21.813  164.553   15.739 -21.75034 26.89881 
1 1 1   24    9   26 o  330.536   6.6410   83.857   3.3599  100.458   5.5948   74.493   4.2020  361.085   10.123  311.190   8.8218 49.89493 13.42745 
1 1 1   24    9   27 o  236.555   8.2335   43.026   2.9811   43.546   4.9651   42.733   3.7279  236.604   13.769  235.430   10.345 1.173935 17.22259 
1 1 1   24    9   28 o  333.385   6.9657   85.358   3.5545   87.936   5.8277   83.830   4.4855  337.432   11.283  330.031   8.8794 7.401550 14.35828 
1 1 1   24    9   29 o   70.754   18.071   4.0723   1.9641   0.9305   5.0609   4.6294   2.1311   67.888   28.586   75.353   18.592 -7.465881 34.10007 
1 1 1   24    9   30 o  100.428   16.669   8.0816   2.4725   12.359   5.2668   6.8724   2.8002  120.967   28.850   91.567   20.491 29.40044 35.38649 
1 1 1   24    9   31 o  179.777   9.7056   24.996   2.6608   23.367   5.5070   25.492   3.0391  170.324   21.610  181.291   11.004 -10.96681 24.25028 
1 1 1   24    9   32 o  231.904   8.7274   41.425   3.0979   41.048   7.0041   41.517   3.4541  226.793   20.395  231.980   9.7277 -5.186356 22.59596 
1 1 1   24    9   33 o   51.246   20.686   1.0245   2.5046   14.631   6.8308  -1.0890   2.6921  129.367   34.037   43.486   19.507 85.88089 39.23079 
1 1 1   24    9   34 o  297.103   7.6633   67.925   3.4849   62.841   12.436   68.358   3.6304  273.919   30.160  297.985   7.9596 -24.06555 31.19239 
1 1 1   24    9   35 o  174.608   10.479   23.667   2.7876   22.892   7.3459   23.797   3.0130  163.645   30.448  174.886   11.316 -11.24103 32.48277 
1 1 1   24    9   36 o  117.635   15.906   11.046   2.7905   15.811   9.3462   10.579   2.9238  130.992   41.535  114.696   17.184 16.29513 44.94881 
1 1 1   24    9   37 o   54.947   21.614   1.5385   2.6651   9.2987   7.5618   0.4379   2.8478  105.337   37.387   50.830   21.426 54.50727 43.09137 
1 1 1   24    9   38 o  205.291   10.096   32.629   3.1723   26.975   8.1271   33.645   3.4457  176.351   31.252  208.004   10.860 -31.65353 33.08562 
1 1 1   24    9   39 o  114.846   22.244   11.006   3.7689   3.0825   7.9764   13.283   4.2764   85.410   35.922  126.120   23.000 -40.71038 42.65434 
1 1 1   24    9   40 o  209.730   10.602   34.240   3.3924   25.754   7.8683   36.177   3.7598  171.132   31.188  215.298   11.450 -44.16577 33.22328 
1 1 1   24    9   41 o  120.629   18.191   11.874   3.2544   7.3009   5.6529   14.141   3.9802   92.792   32.376  130.800   20.559 -38.00803 38.35201 
1 1 1   24    9   42 o  157.395   13.081   19.578   3.1228   14.145   5.3169   22.440   3.8584  126.486   28.184  167.678   15.199 -41.19165 32.02097 
1 1 1   24    9   43 o   84.518   24.023   6.1673   3.2545   9.6514   5.0313   3.6606   4.2676  103.179   30.037   72.296   27.645 30.88294 40.82287 
1 1 1   24    9   44 o  137.087   15.065   15.110   3.1090   6.6656   5.2884   19.570   3.8433   87.969   31.261  155.552   16.389 -67.58322 35.29661 
1 1 1   24    9   45 o   85.795   23.772   6.4563   3.2295   7.3139   6.4275   6.1667   3.7352   91.244   34.142   83.650   26.223 7.593201 43.05025 
1 1 1   24    9   46 o   77.457   23.571   5.2529   3.0443  -2.2005   4.8032   10.258   3.9359   54.250   24.993  107.326   24.499 -53.07607 34.99797 
1 1 1   24    9   47 f   63.527   24.751   2.7775   3.4675  -5.8665   5.7105   7.8260   4.3641   51.874   24.891   91.415   28.294 -39.54132 37.68436 
1 1 1   24    9   48 o   73.227   23.803   4.7324   3.0557   1.0633   4.6570   7.5064   4.0492   61.664   26.722   89.412   27.179 -27.74739 38.11505 
1 1 1   24   10    0 o  128.812   9.4590   12.920   1.8418   12.920   1.8418   12.920   1.8418  128.812   9.4590  128.812   9.4590 0.000000 0.000000 
1 1 1   24   10    1 o  339.625   5.5128   88.358   2.8657   89.165   5.3693   88.036   3.3888  340.776   10.294  338.942   6.5321 1.834625 12.19139 
1 1 1   24   10    3 o  405.090   7.5847  125.812   4.7028  127.527   7.1672  124.515   6.2321  407.369   11.495  402.717   10.110 4.651794 15.30827 
1 1 1   24   10    4 o  430.490   7.8174  142.102   5.1510  158.773   8.3729  131.951   6.5338  454.444   12.037  414.535   10.298 39.90851 15.84086 
1 1 1   24   10    5 f  611.476   8.3668  286.791   7.8309  319.241   12.509  265.877   10.042  644.211   12.686  588.249   11.153 55.96191 16.89140 
1 1 1   24   10    6 o  237.606   18.297   43.924   6.6031   43.924   6.6031   0.0000   0.0000  237.606   18.297  ?   ?  0.000000 18.29670 
1 1 1   24   10    7 o  551.274   9.5247  233.273   8.0369  233.273   8.0369   0.0000   0.0000  551.274   9.5247  ?   ?  0.000000 9.524680 
1 1 1   24   10    8 o  296.676   11.394   67.653   5.1742   67.653   5.1742   0.0000   0.0000  296.676   11.394  ?   ?  0.000000 11.39449 
1 1 1   24   10    9 o  574.961   7.4748  253.480   6.5782  279.244   8.9782  223.619   9.6658  603.076   9.7263  539.288   11.710 63.78809 15.22230 
1 1 1   24   10   10 o  351.393   8.0827   94.714   4.3473   99.204   5.9670   89.636   6.3465  359.296   10.850  341.353   12.147 17.94260 16.28702 
1 1 1   24   10   11 o  349.309   12.207   93.881   6.5264   0.0000   0.0000   93.881   6.5264  ?   ?   349.309   12.207 0.000000 12.20653 
1 1 1   24   10   12 o  256.599   9.4842   50.558   3.7250   57.918   5.2304   42.983   5.3062  274.313   12.457  235.585   14.790 38.72803 19.33746 
1 1 1   24   10   13 o  217.456   12.312   36.513   4.0811   34.795   6.3516   37.722   5.3260  210.737   19.928  220.395   15.895 -9.658646 25.49036 
1 1 1   24   10   14 o  163.480   14.005   20.759   3.4706   21.072   4.7028   20.385   5.1431  163.692   19.131  160.410   21.487 3.282440 28.76928 
1 1 1   24   10   15 o  205.162   12.082   32.516   3.7774   28.345   5.0656   37.740   5.6694  190.473   17.573  220.148   16.956 -29.67484 24.41957 
1 1 1   24   10   16 o   78.904   23.302   4.9560   3.0088  -7.1999   8.1366   6.8815   3.2384   67.722   31.651   92.024   23.042 -24.30193 39.15051 
1 1 1   24   10   17 o  112.414   18.522   10.064   3.0759   5.8220   8.4876   10.705   3.3003  100.183   38.809  115.850   19.290 -15.66701 43.33895 
1 1 1   24   10   18 o   91.252   25.827   6.7469   3.7698   8.6116   9.1074   6.3613   4.1413  110.864   40.802   89.450   27.542 21.41454 49.22741 
1 1 1   24   10   19 o  152.488   15.155   18.163   3.4903   0.0000   0.0000   18.163   3.4903  ?   ?   152.488   15.155 0.000000 15.15464 
1 1 1   24   10   20 o  216.235   7.6495   35.890   2.5318   46.339   3.4599   23.845   3.7147  245.545   9.2059  175.114   13.975 70.43077 16.73496 
1 1 1   24   10   21 o  430.749   6.3395  142.301   4.1798  163.270   6.0380  123.007   5.7918  460.994   8.5571  399.964   9.4608 61.03003 12.75655 
1 1 1   24   10   22 o   45.443   19.164   0.2076   2.2801  -2.5177   3.2424   2.8737   3.2070   44.205   20.425   66.313   24.241 -22.10831 31.69916 
1 1 1   24   10   23 o   42.012   19.284  -1.9611   2.8232   9.0040   6.2260  -4.7993   3.1676  105.500   33.947   37.897   18.275 67.60270 38.55375 
1 1 1   24   10   24 o  217.243   8.4422   36.277   2.8072   42.968   5.0118   33.218   3.3886  235.136   13.988  207.335   10.714 27.80115 17.62035 
1 1 1   24   10   25 o  112.562   15.360   10.018   2.5774   4.9488   4.7494   12.133   3.0685   83.000   29.612  123.766   16.617 -40.76595 33.95574 
1 1 1   24   10   26 o  317.057   7.8898   77.259   3.8289   81.621   5.5124   73.192   5.3224  325.220   11.074  307.920   11.293 17.30014 15.81618 
1 1 1   24   10   27 o   46.474   20.448  -0.6418   2.8169   1.2951   4.5423  -1.8524   3.5909   66.290   27.433   48.939   22.188 17.35096 35.28297 
1 1 1   24   10   28 o  204.715   9.4572   32.283   2.9633   30.502   5.2324   33.124   3.5956  196.703   17.564  206.755   11.406 -10.05130 20.94214 
1 1 1   24   10   29 o  197.024   11.327   30.095   3.4015   36.232   5.5879   26.482   4.2873  214.548   17.159  183.758   15.385 30.78972 23.04633 
1 1 1   24   10   30 o  150.055   25.729   18.568   5.6967   18.568   5.6967   0.0000   0.0000  150.055   25.729  ?   ?  0.000000 25.72918 
1 1 1   24   10   31 f   54.593   23.070   0.4147   3.3150   9.0823   6.1746  -3.0953   3.9293  104.375   33.830   48.064   22.306 56.31096 40.52187 
1 1 1   24   10   32 o  302.494   8.5424   70.473   3.9552   75.878   7.8299   68.622   4.5829  310.794   16.519  298.134   10.043 12.65982 19.33195 
1 1 1   24   10   33 o   58.397   20.669   2.4087   2.3094  -4.5803   6.9594   3.2736   2.4482   64.362   29.804   65.042   21.314 -0.6804428 36.64107 
1 1 1   24   10   34 o  144.267   12.262   16.269   2.6819   16.423   11.579   16.260   2.7569  133.719   46.355  144.139   12.623 -10.41994 48.04343 
1 1 1   24   10   35 f  108.418   15.820   9.3987   2.5480   15.025   7.3418   8.6281   2.7168  129.695   35.807  103.206   17.844 26.48885 40.00670 
1 1 1   24   10   36 f  147.531   12.463   17.043   2.7879   22.682   10.025   16.570   2.9024  155.810   41.350  145.258   13.198 10.55219 43.40492 
1 1 1   24   10   37 o  144.393   13.174   16.387   2.8795   18.603   8.1338   16.070   3.0789  142.936   36.919  142.646   14.294 0.2890778 39.58905 
1 1 1   24   10   38 o   71.239   22.504   4.1060   2.7456 -13.8547   8.0235   6.4881   2.9220   55.872   27.413   87.995   21.806 -32.12267 35.02771 
1 1 1   24   10   39 o  128.150   19.988   13.456   3.7927   9.0459   8.3551   14.601   4.2565  104.284   38.945  132.863   21.678 -28.57899 44.57214 
1 1 1   24   10   40 o  101.149   19.899   8.4929   2.9711   10.884   6.1632   7.7690   3.3912  109.724   33.568   95.523   23.383 14.20090 40.90937 
1 1 1   24   10   41 o   53.817   22.358   0.9047   3.0337   2.3681   5.1385   0.1216   3.7586   71.169   29.288   55.600   24.051 15.56862 37.89757 
1 1 1   24   10   42 o   95.575   20.442   7.6924   2.8999   4.4810   4.9870   9.3330   3.5645   78.428   29.910  104.460   22.923 -26.03282 37.68362 
1 1 1   24   10   43 o   59.166   23.532   1.9052   3.1916   6.5897   5.1521  -1.0122   4.0658   87.749   30.891   53.578   24.007 34.17145 39.12259 
1 1 1   24   10   44 o   47.551   20.748  -0.1443   2.8474  -0.5818   4.9751   0.0688   3.4723   60.091   26.767   52.933   23.006 7.158768 35.29559 
1 1 1   24   10   45 o  146.921   15.187   17.441   3.3661   4.0832   6.4880   22.360   3.9375   79.690   32.866  166.259   15.657 -86.56901 36.40483 
1 1 1   24   10   46 o   59.587   23.358   2.2594   3.1027   2.3701   4.8414   2.1823   4.0419   67.692   28.193   63.594   26.050 4.098751 38.38587 
1 1 1   24   10   47 o   60.910   23.822   2.4799   3.2214   4.6104   5.8452   1.5506   3.8606   78.061   31.569   59.806   25.064 18.25457 40.30846 
1 1 1   24   10   48 o  104.812   19.695   9.4752   3.0436  -1.6898   4.8032   16.966   3.9343   54.640   25.107  141.762   18.579 -87.12217 31.23335 
1 1 1   24   11    0 f  550.984   7.2538  232.655   6.1152  232.655   6.1152  232.655   6.1152  550.984   7.2538  550.984   7.2538 0.000000 0.000000 
1 1 1   24   11    1 o  192.800   5.3709   28.475   1.5850   28.639   2.2501   28.313   2.2329  193.264   7.6066  192.163   7.5916 1.101318 10.74676 
1 1 1   24   11    2 o  420.942   6.7317  135.807   4.3373  136.468   5.7891  134.962   6.5486  421.725   8.9684  419.230   10.205 2.494293 13.58601 
1 1 1   24   11    3 o  559.355   7.8930  239.937   6.7577  246.395   9.8775  234.254   9.2655  566.209   11.397  552.170   10.963 14.03870 15.81401 
1 1 1   24   11    4 o  254.540   8.8801   49.714   3.4597   47.359   5.4411   51.312   4.4826  247.501   14.425  258.388   11.334 -10.88692 18.34542 
1 1 1   24   11    5 o  177.903   11.514   24.429   3.1184   25.872   5.3561   23.689   3.8354  181.699   19.567  174.740   14.470 6.958984 24.33663 
1 1 1   24   11    6 o  384.424   13.405  113.786   7.8879  113.786   7.8879   0.0000   0.0000  384.424   13.405  ?   ?  0.000000 13.40539 
1 1 1   24   11    7 o  268.855   9.9129   55.506   4.0793   55.161   6.8191   55.698   5.0907  266.670   16.792  269.069   12.361 -2.398224 20.85091 
1 1 1   24   11    8 o  101.357   21.829   8.2905   3.2865   1.4174   5.9340   11.332   3.9472   75.590   31.325  118.756   22.539 -43.16679 38.59106 
1 1 1   24   11    9 f  119.287   34.532   11.623   6.6664   11.623   6.6664   0.0000   0.0000  119.287   34.532  ?   ?  0.000000 34.53202 
1 1 1   24   11   10 o  110.319   36.394   9.4586   7.1334   9.4586   7.1334   0.0000   0.0000  110.319   36.394  ?   ?  0.000000 36.39364 
1 1 1   24   11   11 o   86.740   24.942   6.0317   3.4885  -1.9407   6.8585   8.8140   4.0517   71.274   31.605  104.024   25.617 -32.74964 40.68290 
1 1 1   24   11   12 o  369.177   10.073  104.715   5.6922  106.633   9.4462  103.622   7.1327  371.293   16.621  366.820   12.704 4.473175 20.92024 
1 1 1   24   11   13 o  302.073   13.635   70.352   6.3043   0.0000   0.0000   70.352   6.3043  ?   ?   302.073   13.635 0.000000 13.63490 
1 1 1   24   11   14 o  311.968   11.505   74.890   5.4935   73.062   9.2527   75.886   6.8270  305.880   19.870  313.584   14.224 -7.703827 24.43654 
1 1 1   24   11   15 o  143.535   20.072   16.331   4.2892   23.501   7.7192   13.129   5.1589  169.466   30.898  126.671   27.404 42.79501 41.29950 
1 1 1   24   11   16 o  151.714   12.475   17.854   2.8713   12.537   4.8642   20.698   3.5572  123.868   26.459  163.088   14.398 -39.21973 30.12283 
1 1 1   24   11   17 o  297.487   9.0898   67.987   4.1390   91.048   9.9786   63.195   4.5487  341.531   19.166  286.648   10.367 54.88257 21.79025 
1 1 1   24   11   18 o  302.016   11.354   70.239   5.2486   63.227   9.7612   73.090   6.2251  283.104   22.718  307.750   13.215 -24.64661 26.28180 
1 1 1   24   11   19 o  172.155   11.580   22.935   3.0337   18.999   5.4832   24.672   3.6420  153.651   24.108  178.250   13.448 -24.59837 27.60505 
1 1 1   24   11   20 o   51.909   19.266   1.6420   2.0383  -0.0438   2.6455   4.1048   3.1976   47.612   20.381   73.625   24.370 -26.01345 31.76892 
1 1 1   24   11   21 o  131.491   12.261   13.454   2.4393   13.857   3.3848   13.019   3.5186  132.459   17.094  127.985   18.498 4.473534 25.18663 
1 1 1   24   11   22 o  380.641   6.9455  111.193   4.0466  133.787   6.1037   93.474   5.4052  417.009   9.5626  348.453   10.134 68.55692 13.93381 
1 1 1   24   11   23 o  264.400   10.056   53.830   4.0698   59.669   9.3572   52.467   4.5197  274.207   22.493  260.819   11.321 13.38812 25.18111 
1 1 1   24   11   24 o  153.065   12.795   18.240   2.9702   21.686   4.8096   16.116   3.7764  165.314   19.375  142.677   17.670 22.63670 26.22278 
1 1 1   24   11   25 o  130.658   13.298   13.351   2.6224   18.739   4.6549   10.846   3.1740  153.137   20.364  116.403   18.428 36.73413 27.46428 
1 1 1   24   11   26 o  132.833   13.158   13.795   2.6402   13.751   4.7936   13.814   3.1632  129.260   25.133  132.283   15.944 -3.022842 29.76391 
1 1 1   24   11   27 o   49.678   21.231   0.0506   2.8628   0.3576   4.6030  -0.1431   3.6559   63.287   26.981   55.111   23.779 8.176983 35.96463 
1 1 1   24   11   28 o  181.584   12.290   25.632   3.3957   25.550   5.3209   25.689   4.4106  179.137   19.733  180.790   16.107 -1.652725 25.47241 
1 1 1   24   11   29 o  300.641   12.723   70.053   5.8547   70.053   5.8547   0.0000   0.0000  300.641   12.723  ?   ?  0.000000 12.72282 
1 1 1   24   11   30 o  207.311   10.362   33.179   3.2879   31.383   5.9597   33.965   3.9421  198.433   19.889  209.013   12.377 -10.57993 23.42621 
1 1 1   24   11   31 o  359.946   7.8283   99.673   4.3130  108.240   8.1675   96.360   5.0788  372.834   14.312  353.513   9.3862 19.32138 17.11544 
1 1 1   24   11   32 o  144.113   15.199   16.389   3.3020   1.8292   7.0257   20.517   3.7409   79.894   33.664  161.371   15.330 -81.47743 36.98956 
1 1 1   24   11   33 o  192.371   12.287   28.832   3.5989   28.727   7.8212   28.860   4.0535  185.196   28.506  191.997   13.887 -6.801498 31.70823 
1 1 1   24   11   34 o   50.782   22.422  -0.7420   3.4162   15.247   12.215  -2.0988   3.5582  130.113   47.348   47.615   21.779 82.49747 52.11694 
1 1 1   24   11   35 o   79.679   25.129   5.1726   3.4247   1.3206   7.7116   6.1189   3.8223   80.798   34.697   85.917   26.461 -5.119446 43.63513 
1 1 1   24   11   36 o  165.814   15.612   21.765   3.9156   37.185   10.459   19.252   4.2227  205.993   34.384  154.952   18.148 51.04010 38.87911 
1 1 1   24   11   37 o  116.848   15.925   10.927   2.7741   19.399   8.3931   9.8882   2.9392  145.425   37.473  110.389   18.017 35.03538 41.57925 
1 1 1   24   11   38 o  157.359   12.065   19.390   2.8839   27.992   7.8430   18.045   3.1012  180.456   29.408  151.328   13.531 29.12819 32.37152 
1 1 1   24   11   39 o  139.382   17.491   15.663   3.6494   24.089   6.7996   12.254   4.3252  167.920   27.400  120.236   24.337 47.68436 36.64772 
1 1 1   24   11   40 o  131.634   17.667   14.046   3.4698   10.899   5.4763   16.157   4.4850  110.217   31.105  139.475   21.715 -29.25863 37.93489 
1 1 1   24   11   41 o   60.689   22.826   2.4521   2.8802   8.3476   4.9126  -0.6358   3.5553   96.995   30.019   51.475   22.794 45.52031 37.69196 
1 1 1   24   11   42 o  148.254   14.211   17.511   3.1852   14.184   5.1541   19.566   4.0514  126.804   27.359  155.354   17.333 -28.54970 32.38726 
1 1 1   24   11   43 o   78.734   22.289   5.3065   2.8075   8.2934   4.9179   3.8624   3.4195   95.845   30.096   70.351   25.123 25.49372 39.20408 
1 1 1   24   11   44 o   96.907   19.990   7.9590   2.8667   1.7850   4.8530   11.268   3.5527   66.623   28.020  115.304   20.900 -48.68095 34.95615 
1 1 1   24   11   45 o   45.758   20.895  -1.5017   3.2582   1.6944   6.5432  -2.5554   3.7571   72.597   31.567   46.589   21.685 26.00817 38.29788 
1 1 1   24   11   46 o   68.510   23.502   3.9283   2.9726   3.7065   4.8843   4.0588   3.7462   72.600   29.034   70.959   26.161 1.641510 39.08117 
1 1 1   24   11   47 o   38.335   18.390  -3.7605   3.1127   4.4824   5.8172  -7.0676   3.6846   77.275   31.407   36.791   18.153 40.48428 36.27547 
1 1 1   24   11   48 o   48.718   21.229   0.1535   2.9721   1.5834   4.8320  -0.7168   3.7696   63.855   27.444   51.050   22.976 12.80487 35.79224 
1 1 1   24   12    0 o  100.768   13.225   8.1844   1.9424   8.1844   1.9424   8.1844   1.9424  100.768   13.225  100.768   13.225 0.000000 0.000000 
1 1 1   24   12    1 o  313.488   5.6155   75.292   2.6945   72.610   4.4641   76.829   3.3796  307.551   9.4830  316.580   6.9745 -9.028900 11.77164 
1 1 1   24   12    2 o  354.368   5.7500   96.214   3.1189   95.307   3.6990   98.445   5.8006  352.609   6.8537  357.971   10.587 -5.362213 12.61150 
1 1 1   24   12    3 o  215.431   6.2996   35.567   2.0773   34.136   2.3814   40.122   4.2479  210.999   7.3738  228.060   12.213 -17.06152 14.26672 
1 1 1   24   12    4 o  366.975   7.9227  103.289   4.4502  105.598   6.5980  101.363   6.0277  370.589   11.632  363.193   10.843 7.396606 15.90187 
1 1 1   24   12    5 f  192.341   10.889   28.520   3.1927   32.969   5.1757   25.788   4.0565  205.921   16.561  182.303   14.661 23.61838 22.11848 
1 1 1   24   12    6 o  448.685   12.413  154.915   8.5249  154.915   8.5249   0.0000   0.0000  448.685   12.413  ?   ?  0.000000 12.41296 
1 1 1   24   12    7 o   75.431   21.583   4.5348   2.6179   2.2543   3.6837   6.8620   3.7212   66.086   25.577   92.197   25.508 -26.11080 36.12226 
1 1 1   24   12    8 o  206.548   10.281   32.777   3.2503   34.881   4.4073   30.268   4.8127  212.335   13.633  197.298   16.076 15.03661 21.07843 
1 1 1   24   12    9 o  205.786   10.712   32.636   3.3625   36.286   4.5725   28.338   4.9620  216.529   13.869  190.621   17.192 25.90810 22.08866 
1 1 1   24   12   10 o  169.451   12.692   22.233   3.2678   22.554   4.4689   21.863   4.7907  169.817   17.441  166.809   19.108 3.008377 25.87075 
1 1 1   24   12   11 o  310.482   11.851   74.185   5.6320   74.185   5.6320   0.0000   0.0000  310.482   11.851  ?   ?  0.000000 11.85099 
1 1 1   24   12   12 o  486.587   14.161  182.679   10.547  182.679   10.547   0.0000   0.0000  486.587   14.161  ?   ?  0.000000 14.16102 
1 1 1   24   12   13 o   43.628   20.167  -2.5254   3.1659  -1.9818   4.1932  -3.2461   4.8282   53.702   24.195   55.058   25.252 -1.355255 34.97227 
1 1 1   24   12   14 o  316.558   9.3425   76.981   4.5268   82.686   5.9001   68.818   7.0579  327.718   11.762  297.925   15.531 29.79291 19.48253 
1 1 1   24   12   15 f  337.326   14.586   87.914   7.5311   0.0000   0.0000   87.914   7.5311  ?   ?   337.326   14.586 0.000000 14.58616 
1 1 1   24   12   16 o  141.857   17.681   15.854   3.7557   16.221   5.0001   15.379   5.6890  141.941   23.861  136.973   28.078 4.968063 36.84740 
1 1 1   24   12   17 o  393.637   11.663  119.364   7.0271  119.364   7.0271   0.0000   0.0000  393.637   11.663  ?   ?  0.000000 11.66310 
1 1 1   24   12   18 o  216.232   11.088   36.097   3.6575   52.931   9.2849   33.006   3.9792  258.352   23.746  206.462   12.653 51.89073 26.90637 
1 1 1   24   12   19 o  116.986   18.636   10.914   3.2251  -2.0753   8.5853   13.048   3.4800   79.333   35.261  128.242   18.243 -48.90952 39.70045 
1 1 1   24   12   20 o  591.409   6.6230  268.324   5.9954  319.653   9.3085  231.937   7.8374  644.706   9.4330  549.201   9.3233 95.50409 13.26297 
1 1 1   24   12   21 o   89.256   25.023   6.5002   3.5563   6.5002   3.5563   0.0000   0.0000   89.256   25.023  ?   ?  0.000000 25.02289 
1 1 1   24   12   22 o  184.214   10.325   26.218   2.8996   28.374   4.2655   24.367   3.9535  190.759   14.723  176.685   14.754 14.07361 20.84333 
1 1 1   24   12   23 o  292.492   9.1977   65.825   4.1178   66.166   7.4030   65.672   4.9551  291.021   16.689  291.798   11.094 -0.7776794 20.04019 
1 1 1   24   12   24 o  160.884   12.522   20.132   3.0593   24.152   5.0353   17.780   3.8518  174.561   19.160  150.067   17.073 24.49379 25.66335 
1 1 1   24   12   25 o  194.188   9.9103   29.128   2.9358   32.376   5.3495   27.729   3.5120  202.878   17.395  188.997   12.205 13.88025 21.25007 
1 1 1   24   12   26 o  111.275   17.855   9.9162   2.9382   14.210   5.2701   7.9797   3.5393  130.696   27.228   98.269   23.786 32.42706 36.15456 
1 1 1   24   12   27 o  147.848   14.152   17.124   3.1636   16.320   4.9543   17.677   4.1108  141.440   23.725  149.089   18.405 -7.648300 30.02645 
1 1 1   24   12   28 o  186.330   15.129   27.208   4.2777   27.555   5.2137   26.494   7.4825  186.455   18.513  178.842   28.274 7.612534 33.79603 
1 1 1   24   12   29 o  101.218   23.854   8.5048   3.6351   6.6105   5.3356   10.146   4.9658   91.815   31.487  109.502   29.122 -17.68754 42.89000 
1 1 1   24   12   30 o   69.349   23.152   3.6840   2.8839   10.866   5.6468   1.1498   3.3543  112.720   31.506   58.013   23.744 54.70697 39.45150 
1 1 1   24   12   31 o  103.331   19.971   8.7159   3.0444   8.1453   5.7243   8.9409   3.5950   99.326   32.594  103.786   23.212 -4.459976 40.01408 
1 1 1   24   12   32 o   98.967   21.350   8.0805   3.1391   9.5416   6.5416   7.6434   3.5780  106.300   34.841   95.589   24.379 10.71085 42.52284 
1 1 1   24   12   33 o  184.497   12.629   26.566   3.5449   40.611   7.5161   22.548   4.0201  224.189   22.195  168.982   15.723 55.20799 27.19975 
1 1 1   24   12   34 f  158.254   15.837   19.827   3.7846   0.2693   12.863   21.680   3.9599   96.877   43.104  165.555   15.819 -68.67819 45.91558 
1 1 1   24   12   35 o  160.114   15.222   20.263   3.6858   30.355   7.9274   17.480   4.1631  189.912   28.122  147.334   18.896 42.57828 33.88032 
1 1 1   24   12   36 o  174.798   14.906   24.113   3.9500   36.686   10.027   21.803   4.2976  205.337   33.021  165.309   17.238 40.02765 37.24992 
1 1 1   24   12   37 o  231.645   11.386   41.689   4.0369   19.091   7.3748   51.357   4.8238  146.185   33.656  256.796   12.273 -110.6112 35.82336 
1 1 1   24   12   38 o   97.559   24.370   8.1060   3.6285   5.6011   6.9100   9.0597   4.2636   89.588   34.930  102.426   26.863 -12.83859 44.06501 
1 1 1   24   12   39 o  194.222   12.877   29.630   3.8065   22.349   6.0574   34.382   4.8933  162.730   25.129  208.128   15.471 -45.39754 29.50930 
1 1 1   24   12   40 o   57.268   24.303   0.6656   3.7037   0.1461   5.0313   1.2800   5.4720   63.367   27.616   69.113   29.440 -5.745552 40.36579 
1 1 1   24   12   41 o  162.951   12.797   20.957   3.1661   15.052   5.1134   24.629   4.0320  131.563   26.312  175.700   15.141 -44.13727 30.35710 
1 1 1   24   12   42 o   47.075   20.347   0.0161   2.6859   2.7416   4.9579  -1.1159   3.1953   71.133   28.962   46.958   21.142 24.17519 35.85797 
1 1 1   24   12   43 o  152.719   12.853   18.493   2.9765   7.8092   4.9257   24.638   3.7356   93.088   30.220  175.879   13.992 -82.79008 33.30170 
1 1 1   24   12   44 o  105.104   19.657   9.3304   3.0461   5.1821   4.8905   11.960   3.8937   79.817   29.798  117.823   22.409 -38.00586 37.28421 
1 1 1   24   12   45 o   58.361   23.424   1.9088   3.1920  -5.0258   6.5218   4.0933   3.6604   57.854   27.434   71.200   25.918 -13.34547 37.74108 
1 1 1   24   12   46 o   46.738   20.630  -0.2840   2.8898   3.4490   4.7651  -2.4556   3.6345   70.991   28.576   45.624   21.266 25.36742 35.62051 
1 1 1   24   12   47 o   87.488   22.493   6.8496   3.0288   1.3899   5.4792   9.2520   3.6346   66.167   28.828  101.132   23.865 -34.96464 37.42477 
1 1 1   24   13    0 o  117.214   12.270   10.883   2.1462   10.883   2.1462   10.883   2.1462  117.214   12.270  117.214   12.270 0.000000 0.000000 
1 1 1   24   13    1 o  331.317   5.7948   84.110   2.9387   81.834   4.9181   85.375   3.6649  326.432   9.8432  333.690   7.1754 -7.258606 12.18089 
1 1 1   24   13    2 o  105.026   11.148   8.5738   1.7648   8.4416   2.0493   8.9532   3.4716  103.884   13.185  105.313   22.234 -1.428993 25.84976 
1 1 1   24   13    3 o  218.987   6.8742   36.764   2.3041   38.141   2.7144   33.213   4.3587  222.985   7.9530  207.154   13.826 15.83138 15.95018 
1 1 1   24   13    4 o  284.059   6.1604   61.839   2.6785   62.446   3.1209   60.140   5.2185  285.383   7.1448  279.565   12.195 5.817413 14.13408 
1 1 1   24   13    5 o  249.602   14.059   48.178   5.3495   48.178   5.3495   0.0000   0.0000  249.602   14.059  ?   ?  0.000000 14.05950 
1 1 1   24   13    6 o  547.291   8.4351  229.845   7.0661  266.630   11.089  204.702   9.1683  588.576   12.309  515.875   11.611 72.70111 16.92155 
1 1 1   24   13    7 o  353.080   8.9685   95.701   4.8469  101.269   7.3354   91.387   6.4574  362.556   13.218  344.574   12.243 17.98154 18.01737 
1 1 1   24   13    8 o  582.531   7.5334  260.276   6.7170  276.904   8.8314  237.454   10.346  600.437   9.6093  555.424   12.170 45.01276 15.50616 
1 1 1   24   13    9 o  495.653   7.6098  188.448   5.7733  216.332   7.8033  154.727   8.5813  530.698   9.6064  448.249   12.507 82.44901 15.77071 
1 1 1   24   13   10 o  134.782   15.870   14.233   3.2113   13.175   4.2800   15.595   4.8574  128.087   22.660  139.381   23.611 -11.29427 32.72576 
1 1 1   24   13   11 o   89.193   23.113   6.4539   3.1811   6.8500   4.3280   5.9886   4.6915   92.648   28.085   88.788   29.525 3.859528 40.74877 
1 1 1   24   13   12 o  104.848   24.991   8.9720   3.9539   0.1596   5.7815   16.715   5.4194   70.536   30.159  143.810   25.556 -73.27320 39.53133 
1 1 1   24   13   13 o  333.833   11.810   85.815   6.0347   85.815   6.0347   0.0000   0.0000  333.833   11.810  ?   ?  0.000000 11.81016 
1 1 1   24   13   14 o  114.954   26.467   10.830   4.5607   10.830   4.5607   0.0000   0.0000  114.954   26.467  ?   ?  0.000000 26.46740 
1 1 1   24   13   15 o  310.762   10.267   74.275   4.8834   87.368   6.2066   52.997   7.9124  336.728   12.042  259.978   20.038 76.75027 23.37837 
1 1 1   24   13   16 o  303.832   10.135   71.004   4.7134   81.172   6.3135   58.201   7.0844  324.394   12.715  273.336   17.017 51.05835 21.24320 
1 1 1   24   13   17 o  263.121   14.407   53.698   5.7802   53.698   5.7802   0.0000   0.0000  263.121   14.407  ?   ?  0.000000 14.40688 
1 1 1   24   13   18 o  248.249   11.989   47.524   4.5557   46.146   5.9547   49.467   7.0744  243.386   16.075  251.319   18.521 -7.933182 24.52400 
1 1 1   24   13   19 o  200.874   8.5495   31.005   2.6286   33.084   3.4909   28.283   3.9948  206.928   11.062  190.764   13.774 16.16393 17.66578 
1 1 1   24   13   20 o  372.538   7.1180  106.523   4.0588  121.177   5.9912   94.094   5.5179  396.804   9.8644  349.571   10.313 47.23300 14.27082 
1 1 1   24   13   21 o   54.251   21.624   1.2511   2.7006   3.9847   4.4292  -0.3665   3.4073   77.385   28.458   52.570   22.819 24.81436 36.47724 
1 1 1   24   13   22 o  170.072   12.626   22.479   3.2633   28.100   6.3355   20.449   3.8072  187.416   22.537  161.507   15.595 25.90916 27.40651 
1 1 1   24   13   23 o  184.929   10.429   26.443   2.9400   31.645   4.4897   22.537   3.8901  201.406   14.665  169.683   15.137 31.72296 21.07560 
1 1 1   24   13   24 o   96.315   19.473   7.5290   2.7720   10.560   4.8000   6.0125   3.3954  112.365   28.008   85.765   24.592 26.59949 37.27197 
1 1 1   24   13   25 o  119.980   15.901   11.398   2.8482   15.776   4.5542   8.5852   3.6501  139.678   22.032  101.959   23.819 37.71954 32.44646 
1 1 1   24   13   26 o  270.160   7.8492   56.109   3.2458   71.395   5.5304   48.078   4.0087  303.866   11.891  249.640   10.491 54.22675 15.85728 
1 1 1   24   13   27 o   66.037   24.770   2.7311   3.3870   6.1157   5.3553   0.4746   4.3727   89.752   31.501   62.140   26.390 27.61147 41.09468 
1 1 1   24   13   28 o   70.402   22.891   3.8586   2.8259  -0.9552   5.3881   5.6852   3.3190   63.916   28.193   83.334   24.436 -19.41796 37.30906 
1 1 1   24   13   29 o  153.196   14.933   18.454   3.4571   17.124   5.9697   19.126   4.2406  142.824   28.308  155.002   18.222 -12.17847 33.66583 
1 1 1   24   13   30 o  168.135   13.679   22.121   3.4899   27.468   5.7108   18.935   4.4089  185.123   20.498  153.818   19.140 31.30544 28.04508 
1 1 1   24   13   31 o  284.795   8.4953   62.475   3.7032   63.922   6.4408   61.760   4.5262  285.862   14.771  282.693   10.460 3.169373 18.09947 
1 1 1   24   13   32 o   65.041   23.260   2.9957   2.9321   6.7070   5.4375   1.4741   3.4816   91.879   31.770   60.109   24.345 31.76999 40.02530 
1 1 1   24   13   33 o   49.250   21.721  -0.6797   3.1967  -8.1975   6.7191   1.5199   3.6344   56.592   27.114   61.171   24.839 -4.579666 36.77130 
1 1 1   24   13   34 o  123.900   19.769   12.482   3.6231   16.395   12.320   12.112   3.7907  132.812   47.660  121.518   21.149 11.29461 52.14149 
1 1 1   24   13   35 o  181.593   13.539   25.867   3.7362   33.275   7.9357   23.757   4.2349  199.713   26.624  173.085   16.172 26.62791 31.15049 
1 1 1   24   13   36 o  165.231   14.749   21.566   3.6910   22.676   7.1333   21.161   4.3133  162.249   29.823  162.592   17.613 -0.3428650 34.63536 
1 1 1   24   13   37 o   80.182   25.842   5.2829   3.6066 -10.7717   6.8006   11.565   4.2542   52.969   25.827  116.879   24.560 -63.90947 35.64066 
1 1 1   24   13   38 o  130.449   18.503   13.829   3.5909   18.523   6.3197   11.591   4.3639  145.703   29.352  116.470   25.210 29.23318 38.69215 
1 1 1   24   13   39 o  107.796   21.953   9.7746   3.4991  -0.4280   5.3391   17.456   4.6326   63.540   28.045  145.177   21.498 -81.63710 35.33619 
1 1 1   24   13   40 o  149.988   16.856   18.147   3.8028   14.966   5.0300   22.392   5.8099  131.597   25.894  162.820   24.035 -31.22275 35.32986 
1 1 1   24   13   41 o  112.927   23.508   10.937   3.9313   12.122   5.1886   9.3386   6.0237  116.049   29.227  101.202   33.446 14.84692 44.41677 
1 1 1   24   13   42 o   63.390   25.149   2.3247   3.6369  -1.0118   4.9327   6.2989   5.3836   58.889   26.411   86.642   31.448 -27.75284 41.06759 
1 1 1   24   13   43 o  167.695   15.707   22.684   3.9848   16.013   5.1415   32.718   6.3057  134.882   25.844  197.789   21.157 -62.90721 33.39984 
1 1 1   24   13   44 o   88.393   24.771   6.9689   3.4857   6.7210   4.8572   7.2320   5.0053   86.535   30.021   89.065   30.498 -2.530327 42.79473 
1 1 1   24   13   45 o   78.086   27.107   5.3309   3.9601   4.7287   7.0979   5.6030   4.7718   81.971   34.138   80.466   29.546 1.505089 45.14874 
1 1 1   24   13   46 o   45.116   20.105  -0.5306   2.8099  -3.4470   4.7339   1.0558   3.4915   50.518   23.779   55.827   23.638 -5.309475 33.52893 
1 1 1   24   13   47 o   40.243   18.911  -2.4621   2.9728  -4.1728   5.3674  -1.7051   3.5705   52.478   24.886   46.888   21.582 5.589802 32.94084 
1 1 1   24   14    0 o  248.778   12.318   47.849   4.6644   47.849   4.6644   47.849   4.6644  248.778   12.318  248.778   12.318 0.000000 0.000000 
1 1 1   24   14    1 o  340.135   6.2316   88.672   3.2443   89.380   3.8879   87.048   5.8874  341.384   7.4405  336.419   11.433 4.964813 13.64119 
1 1 1   24   14    2 o   49.412   18.474   1.4300   1.8811   1.5759   2.1639   0.9788   3.8053   52.486   19.777   61.129   25.186 -8.643356 32.02262 
1 1 1   24   14    3 o  157.566   9.1165   19.124   2.1893   21.836   2.5445   11.397   4.2956  168.305   9.9213  118.606   24.474 49.69985 26.40848 
1 1 1   24   14    4 o  364.011   6.4044  101.568   3.5683  107.556   4.2451   87.151   6.5870  374.487   7.4060  336.389   12.793 38.09738 14.78223 
1 1 1   24   14    5 o  370.104   7.2710  105.048   4.1190  105.048   4.1190   0.0000   0.0000  370.104   7.2710  ?   ?  0.000000 7.271024 
1 1 1   24   14    6 o  277.628   6.4629   59.086   2.7464   58.816   3.1156   60.027   5.8165  276.926   7.3503  279.034   13.619 -2.108337 15.47564 
1 1 1   24   14    7 o  228.419   11.256   40.135   3.9352   44.187   5.7952   36.668   5.3607  238.541   15.964  217.143   16.247 21.39876 22.77755 
1 1 1   24   14    8 o  157.383   13.469   19.235   3.2134   16.520   4.1107   23.501   5.1528  144.660   19.027  172.762   19.847 -28.10239 27.49362 
1 1 1   24   14    9 f   55.103   22.585   0.8631   3.0403   0.6287   3.9077   1.2226   4.8395   60.351   25.249   68.526   28.334 -8.174179 37.95169 
1 1 1   24   14   10 o  169.696   13.486   22.347   3.4741   25.594   4.6368   18.193   5.2455  180.999   16.934  150.741   23.501 30.25751 28.96628 
1 1 1   24   14   11 o  321.150   9.1634   79.224   4.5044   88.734   5.8360   65.213   7.0841  339.565   11.229  289.845   16.030 49.71957 19.57164 
1 1 1   24   14   12 o  374.999   10.366  108.145   5.9502  108.704   8.7747  107.669   8.0959  374.903   15.291  373.391   14.166 1.512482 20.84431 
1 1 1   24   14   13 o  279.212   10.320   59.959   4.4104   61.195   5.5741   57.891   7.2123  281.679   12.929  272.594   17.376 9.084747 21.65830 
1 1 1   24   14   14 o  107.351   23.209   9.3780   3.7025   10.950   4.6827   6.7566   6.0475  115.406   26.991   95.737   33.482 19.66888 43.00653 
1 1 1   24   14   15 o  275.984   13.274   58.804   5.6075   58.804   5.6075   0.0000   0.0000  275.984   13.274  ?   ?  0.000000 13.27437 
1 1 1   24   14   16 o  187.298   18.422   27.567   5.2130   27.567   5.2130   0.0000   0.0000  187.298   18.422  ?   ?  0.000000 18.42195 
1 1 1   24   14   17 o  111.292   11.695   9.6513   1.9623   9.6513   1.9623   0.0000   0.0000  111.292   11.695  ?   ?  0.000000 11.69464 
1 1 1   24   14   18 o  414.593   5.6351  131.780   3.5759  137.912   3.9109  100.516   8.8311  424.075   6.0251  359.842   16.034 64.23282 17.12838 
1 1 1   24   14   19 o  238.785   9.3313   43.858   3.4105   46.187   3.8708   35.773   7.2111  244.906   10.326  211.996   22.570 32.91008 24.81998 
1 1 1   24   14   20 o   53.459   20.895   1.4033   2.4775  -0.5521   3.4739   3.4274   3.5344   52.411   22.891   70.783   25.513 -18.37151 34.27760 
1 1 1   24   14   21 o   90.077   23.652   6.6611   3.3027   15.134   8.9059   5.3102   3.5562  132.592   40.308   81.708   25.582 50.88441 47.74076 
1 1 1   24   14   22 o  144.489   16.077   16.439   3.4954   21.233   9.1270   15.615   3.7839  156.270   38.426  140.267   18.043 16.00308 42.45120 
1 1 1   24   14   23 o  272.014   9.7354   56.993   4.0534   44.296   7.1827   62.925   4.9099  236.594   20.022  285.517   11.235 -48.92342 22.95872 
1 1 1   24   14   24 o  350.756   7.7783   94.557   4.1760  108.480   6.4548   84.535   5.4766  374.828   11.251  330.995   10.810 43.83282 15.60231 
1 1 1   24   14   25 o  144.922   18.073   16.688   3.9219   16.239   4.6012   17.882   7.4996  141.735   21.916  144.163   34.456 -2.428085 40.83562 
1 1 1   24   14   26 o  179.236   12.705   25.007   3.4630   25.429   4.9787   24.611   4.8199  179.125   18.422  176.288   18.121 2.837555 25.84017 
1 1 1   24   14   27 o  130.079   14.451   13.315   2.8287   9.8435   4.9104   15.040   3.4605  107.982   29.067  137.725   16.761 -29.74280 33.55307 
1 1 1   24   14   28 o  111.098   17.520   9.8986   2.8806   7.2506   5.0550   11.172   3.5054   94.344   30.613  117.368   20.244 -23.02416 36.70105 
1 1 1   24   14   29 o  152.136   13.966   18.151   3.2159   27.382   5.5259   13.423   3.9546  185.140   19.807  128.637   20.794 56.50317 28.71812 
1 1 1   24   14   30 o  119.749   17.140   11.468   3.0520   6.7958   6.1320   13.006   3.5188   94.042   33.637  127.210   18.623 -33.16777 38.44806 
1 1 1   24   14   31 o   97.203   23.725   7.8917   3.4989   5.8568   6.3057   8.7970   4.2057   90.499   33.826  102.038   26.641 -11.53832 43.05766 
1 1 1   24   14   32 o  137.144   16.542   14.970   3.4023   14.531   7.3293   15.090   3.8413  127.808   35.955  136.949   18.823 -9.141144 40.58387 
1 1 1   24   14   33 o  162.709   15.712   20.942   3.8643  -5.5246   11.410   24.371   4.1070   82.490   38.186  175.728   15.425 -93.23758 41.18373 
1 1 1   24   14   34 o  232.518   10.541   41.861   3.7514   38.986   6.5642   43.256   4.5716  220.485   19.657  235.408   12.735 -14.92288 23.42136 
1 1 1   24   14   35 o   98.733   24.363   8.2437   3.6592   20.682   7.7209   4.6404   4.1556  152.564   33.939   78.156   27.718 74.40714 43.81993 
1 1 1   24   14   36 o   66.372   25.138   2.8451   3.5073   9.0132   6.4954   0.3066   4.1669  102.370   34.743   59.385   25.503 42.98549 43.09893 
1 1 1   24   14   37 o  140.812   17.278   15.949   3.6457   20.277   6.3218   13.793   4.4625  153.664   27.906  128.178   23.616 25.48611 36.55742 
1 1 1   24   14   38 o   57.310   23.622   1.1885   3.3493  -6.9887   5.4541   6.1389   4.2437   50.200   24.150   85.518   28.064 -35.31766 37.02404 
1 1 1   24   14   39 o  153.588   15.236   18.826   3.5345   14.870   5.3755   21.839   4.6911  130.303   27.800  163.713   19.078 -33.40938 33.71672 
1 1 1   24   14   40 o   87.614   28.834   6.6170   4.4787   4.8164   5.2010   11.783   8.8097   80.499   30.582  111.421   40.262 -30.92206 50.55946 
1 1 1   24   14   41 o  100.925   25.181   8.9173   3.8773   11.869   5.2992   5.5161   5.6881  114.220   29.945   84.202   31.983 30.01771 43.81342 
1 1 1   24   14   42 f   89.882   25.076   7.1070   3.5806   5.7143   5.2355   8.3309   4.9079   83.518   30.900   95.751   30.066 -12.23289 43.11329 
1 1 1   24   14   43 f  186.540   13.530   27.726   3.8367   19.879   5.2949   36.402   5.5673  151.825   23.548  211.267   17.370 -59.44244 29.26105 
1 1 1   24   14   44 o  113.209   21.407   11.046   3.5736   9.1649   5.0095   12.996   5.0993   98.320   30.294  118.277   28.503 -19.95695 41.59533 
1 1 1   24   14   45 o   84.956   27.247   6.6222   4.0133   0.4238   7.4067   9.1985   4.7751   71.577   32.211   98.139   29.444 -26.56271 43.64024 
1 1 1   24   14   46 o  116.044   21.556   11.770   3.6879   14.526   5.6283   9.6962   4.8819  122.246   30.245   99.856   29.729 22.38975 42.40981 
1 1 1   24   15    0 o   50.657   25.064   2.9240   2.3375   2.9240   2.3375   2.9240   2.3375   50.657   25.064   50.657   25.064 0.000000 0.000000 
1 1 1   24   15    1 o  132.417   11.627   13.595   2.3326   15.399   2.7401   8.8450   4.4456  140.805   12.856  104.059   27.497 36.74640 30.35428 
1 1 1   24   15    2 o  491.747   6.5036  185.383   4.8951  185.456   5.8959  185.220   8.7825  491.653   7.8347  490.590   11.696 1.063202 14.07740 
1 1 1   24   15    3 o  483.230   6.5348  179.022   4.8334  181.254   5.8131  174.020   8.7001  486.052   7.8137  475.459   11.955 10.59235 14.28180 
1 1 1   24   15    4 o  352.170   7.9609   95.165   4.2913   95.165   4.2913   0.0000   0.0000  352.170   7.9609  ?   ?  0.000000 7.960917 
1 1 1   24   15    5 o  210.739   8.4602   34.090   2.7289   32.043   3.1633   40.046   5.3962  204.184   10.121  227.076   15.620 -22.89221 18.61299 
1 1 1   24   15    6 o  144.757   10.996   16.210   2.4181   17.042   2.7957   13.741   4.8179  148.229   12.437  130.225   25.081 18.00403 27.99517 
1 1 1   24   15    7 o  247.429   7.7557   46.974   2.9372   47.234   3.3856   46.183   5.9061  248.010   8.9186  243.827   15.912 4.183350 18.24139 
1 1 1   24   15    8 o  207.340   7.9461   32.992   2.5218   33.126   2.7918   32.395   5.8779  207.699   8.7816  203.269   19.117 4.430862 21.03740 
1 1 1   24   15    9 o  249.256   10.198   47.768   3.8909   48.424   4.9041   46.653   6.3919  250.303   12.844  244.720   17.173 5.582977 21.44472 
1 1 1   24   15   10 o  441.745   8.0240  149.780   5.4254  153.369   6.8648  143.809   8.8551  446.637   10.042  431.723   13.400 14.91327 16.74529 
1 1 1   24   15   11 o  200.924   15.238   31.404   4.6513   24.244   6.6347   38.324   6.5227  173.618   25.747  221.016   19.480 -47.39761 32.28578 
1 1 1   24   15   12 o  183.632   13.670   26.178   3.8148   23.684   4.6774   31.134   6.5929  173.723   17.844  198.244   22.104 -24.52148 28.40732 
1 1 1   24   15   13 o  427.725   8.7384  140.542   5.7209  145.052   7.1350  132.421   9.5736  434.118   10.738  413.634   15.121 20.48364 18.54606 
1 1 1   24   15   14 o  426.750   8.6478  139.908   5.6487  138.015   6.9416  143.621   9.7189  423.422   10.711  430.816   14.739 -7.393951 18.21931 
1 1 1   24   15   15 o  288.595   6.9162   63.902   3.0551   69.204   3.3414   36.875   7.5438  300.290   7.2697  215.310   23.260 84.98039 24.36975 
1 1 1   24   15   16 o  230.389   6.5081   40.716   2.2950   40.716   2.2950   0.0000   0.0000  230.389   6.5081  ?   ?  0.000000 6.508100 
1 1 1   24   15   17 o  119.311   9.7789   11.026   1.7701   10.379   1.8352   19.670   6.7093  115.629   10.483  154.312   29.481 -38.68387 31.28926 
1 1 1   24   15   18 o  216.878   10.116   36.215   3.3581   36.215   3.3581   0.0000   0.0000  216.878   10.116  ?   ?  0.000000 10.11611 
1 1 1   24   15   19 o  248.035   9.8883   47.366   3.7541   47.366   3.7541   0.0000   0.0000  248.035   9.8883  ?   ?  0.000000 9.888284 
1 1 1   24   15   20 o  113.397   18.754   10.309   3.1413   10.598   3.4682   8.9918   7.4117  114.537   20.537  107.040   37.088 7.496193 42.39425 
1 1 1   24   15   21 o   79.617   28.332   4.5444   4.3452   2.3638   5.7448   7.4596   6.6425   76.629   31.185   99.175   35.058 -22.54653 46.92078 
1 1 1   24   15   22 o  138.829   13.582   15.073   2.8492   16.403   4.3266   14.054   3.7861  143.099   20.325  132.587   19.216 10.51210 27.97064 
1 1 1   24   15   23 o  163.098   12.590   20.703   3.1187   25.110   5.1748   18.189   3.9081  177.860   19.319  151.707   17.130 26.15244 25.81996 
1 1 1   24   15   24 o  206.306   12.451   33.055   3.9133   31.865   4.4166   37.402   8.4414  202.056   14.374  214.419   26.270 -12.36275 29.94565 
1 1 1   24   15   25 o  145.962   17.643   16.911   3.8617   19.208   4.3914   9.0775   8.1106  155.306   18.860  107.802   38.671 47.50380 43.02515 
1 1 1   24   15   26 o  336.206   7.9464   86.934   4.0893   95.380   5.7368   78.211   5.8305  351.468   10.664  317.899   11.983 33.56909 16.04058 
1 1 1   24   15   27 o  193.779   10.113   29.053   2.9891   28.713   4.7967   29.268   3.8219  190.909   16.580  193.829   12.957 -2.920044 21.04207 
1 1 1   24   15   28 o   49.906   21.320   0.0952   2.8846  -4.3224   4.5474   3.0700   3.7316   49.847   23.413   69.275   25.996 -19.42813 34.98531 
1 1 1   24   15   29 o   71.947   22.888   4.1060   2.8362   0.6114   4.8001   5.9805   3.5156   64.954   27.619   85.180   25.198 -20.22581 37.38628 
1 1 1   24   15   30 o  142.480   14.469   15.987   3.1117   17.851   5.4914   15.105   3.7766  146.718   25.371  137.257   18.443 9.461426 31.36573 
1 1 1   24   15   31 o  187.931   11.491   27.469   3.2894   45.252   6.1047   20.193   3.9047  239.428   16.764  159.687   16.200 79.74091 23.31194 
1 1 1   24   15   32 o  205.094   12.755   32.833   3.9841   36.628   6.4208   30.457   5.0805  213.808   19.846  195.975   17.108 17.83299 26.20241 
1 1 1   24   15   33 o   63.584   26.378   1.2934   4.2140   7.1123   12.848   0.5919   4.4608  109.718   45.832   62.485   26.598 47.23351 52.99072 
1 1 1   24   15   34 o  169.151   14.372   22.540   3.6859   31.750   7.1915   19.258   4.2926  196.160   24.485  154.803   18.482 41.35728 30.67718 
1 1 1   24   15   35 o  275.389   10.467   58.776   4.4119   61.505   8.0204   57.592   5.2830  277.177   19.020  271.799   12.699 5.378235 22.86944 
1 1 1   24   15   36 o  291.739   9.5530   65.868   4.2658   66.602   7.0413   65.442   5.3618  290.124   15.917  289.831   12.086 0.2931213 19.98577 
1 1 1   24   15   37 o  227.368   11.234   40.222   3.9098   28.094   6.0245   49.046   5.1390  184.928   21.696  249.839   13.489 -64.91096 25.54700 
1 1 1   24   15   38 o   80.899   24.814   5.5264   3.3653   0.9676   5.1796   8.8568   4.4271   66.769   28.547  100.451   27.833 -33.68235 39.87021 
1 1 1   24   15   39 o  114.454   27.451   11.551   4.7471   5.0871   5.4974   30.503   9.4131   82.561   31.423  181.569   35.141 -99.00799 47.14082 
1 1 1   24   15   40 o  104.231   26.746   9.6018   4.2882   7.2193   5.3939   13.694   7.0690   91.195   31.637  119.657   35.808 -28.46137 47.78146 
1 1 1   24   15   41 o   68.718   25.317   3.5175   3.5078   5.1331   5.4269   2.3582   4.5972   81.743   31.195   67.947   27.802 13.79613 41.78587 
1 1 1   24   15   42 o   64.957   25.139   2.8115   3.5587  -4.4329   5.2504   8.9679   4.8401   52.575   24.837   98.692   29.651 -46.11780 38.67875 
1 1 1   24   15   43 f   67.518   25.267   3.4302   3.5203   1.9708   4.9691   4.9006   4.9879   67.176   28.308   78.385   29.908 -11.20865 41.18078 
1 1 1   24   15   44 o  143.807   16.719   17.016   3.6115   12.355   4.9644   22.256   5.2635  114.935   28.387  160.919   21.941 -45.98461 35.87822 
1 1 1   24   15   45 f  169.571   16.480   23.651   4.2234   17.617   7.1738   26.851   5.2248  130.502   35.134  178.421   19.447 -47.91888 40.15693 
1 1 1   24   16    0 o   41.601   27.835  -1.6593   4.9093  -1.6593   4.9093  -1.6593   4.9093   41.601   27.835   41.601   27.835 0.000000 0.000000 
1 1 1   24   16    1 o  290.986   7.6688   64.966   3.4156   66.623   4.0527   60.902   6.3460  294.534   8.9897  280.384   14.840 14.15070 17.35030 
1 1 1   24   16    2 o  444.603   6.8728  151.591   4.6771  150.667   5.5753  153.785   8.5928  443.052   8.2214  446.741   12.566 -3.689301 15.01678 
1 1 1   24   16    3 o  232.930   10.140   41.709   3.6151   41.709   3.6151   0.0000   0.0000  232.930   10.140  ?   ?  0.000000 10.13957 
1 1 1   24   16    4 o  166.483   10.781   21.408   2.7325   23.419   3.1789   15.717   5.3468  173.974   12.011  139.166   26.059 34.80861 28.69386 
1 1 1   24   16    5 o  154.720   11.825   18.540   2.7792   15.938   3.1858   26.823   5.6848  142.878   14.781  184.432   20.484 -41.55397 25.26011 
1 1 1   24   16    6 o  123.878   14.687   12.019   2.7306   14.930   3.1574   3.3835   5.4386  138.152   15.182   79.739   31.017 58.41284 34.53306 
1 1 1   24   16    7 o  107.320   17.546   9.1606   2.7826   6.9295   3.1697   16.659   5.8107   92.290   22.615  142.869   27.571 -50.57924 35.65947 
1 1 1   24   16    8 o  382.465   6.6683  112.181   3.9037  114.073   4.4437  105.786   8.1706  385.567   7.5297  370.001   14.427 15.56580 16.27383 
1 1 1   24   16    9 o   36.230   17.050  -2.5997   2.4319  -2.4064   2.6961  -3.4437   5.6332   39.491   18.377   59.974   27.421 -20.48297 33.00981 
1 1 1   24   16   10 o  473.433   7.2880  171.979   5.2813  180.466   6.3698  153.315   9.4464  484.732   8.5852  445.511   13.853 39.22147 16.29749 
1 1 1   24   16   11 o  224.904   6.4266   38.791   2.2123   39.100   2.3303   35.962   7.0430  225.777   6.7431  213.201   21.893 12.57521 22.90810 
1 1 1   24   16   12 f  252.868   5.7805   49.020   2.2373   48.863   2.3382   50.719   7.7008  252.443   6.0512  254.119   19.959 -1.675247 20.85603 
1 1 1   24   16   13 o  295.366   5.5655   66.875   2.5161   67.678   2.6535   59.717   7.9234  297.109   5.8349  276.159   18.858 20.95081 19.73983 
1 1 1   24   16   14 o  428.052   5.3594  140.446   3.5114  141.068   3.7591  136.186   9.8363  428.952   5.7255  419.179   15.331 9.773224 16.36496 
1 1 1   24   16   15 f  111.320   10.102   9.6151   1.7026   10.073   1.7580   2.6917   6.8348  113.950   10.187   83.190   33.953 30.75992 35.44832 
1 1 1   24   16   16 o  245.639   6.4722   46.290   2.4334   46.290   2.4334   0.0000   0.0000  245.639   6.4722  ?   ?  0.000000 6.472194 
1 1 1   24   16   17 f  218.674   6.7111   36.696   2.2463   38.038   2.3709   24.922   7.0212  222.616   6.9580  174.847   27.113 47.76868 27.99179 
1 1 1   24   16   18 o  333.362   7.4443   85.343   3.7985   87.857   4.2442   75.227   8.5146  338.111   8.2011  309.902   18.028 28.20953 19.80590 
1 1 1   24   16   19 o   89.554   28.082   6.4468   4.2833   10.115   5.4344   0.4311   6.9598  109.929   30.972   76.785   32.967 33.14454 45.23416 
1 1 1   24   16   20 o  100.189   20.937   8.1814   3.1073   8.1814   3.1073   0.0000   0.0000  100.189   20.937  ?   ?  0.000000 20.93683 
1 1 1   24   16   21 o  197.249   11.789   30.163   3.5430   30.163   3.5430   0.0000   0.0000  197.249   11.789  ?   ?  0.000000 11.78898 
1 1 1   24   16   22 o  234.899   10.947   42.584   3.9360   42.584   3.9360   0.0000   0.0000  234.899   10.947  ?   ?  0.000000 10.94721 
1 1 1   24   16   23 o  222.440   11.943   38.367   4.0514   42.669   4.5909   23.218   8.6142  234.381   12.846  164.288   35.307 70.09291 37.57162 
1 1 1   24   16   24 o  294.020   8.5042   66.522   3.8272   76.551   5.4817   56.984   5.3458  314.731   11.379  271.174   12.879 43.55661 17.18616 
1 1 1   24   16   25 f  162.874   12.018   20.639   2.9749   19.700   4.1007   21.681   4.3222  157.746   17.266  165.552   17.313 -7.806442 24.45069 
1 1 1   24   16   26 o  268.055   8.6710   55.325   3.5577   57.275   4.9120   53.173   5.1597  272.041   11.797  261.840   12.874 10.20193 17.46147 
1 1 1   24   16   27 o  327.386   7.5801   82.424   3.7985   89.666   6.2525   78.187   4.7821  340.235   12.006  318.345   9.8141 21.89069 15.50688 
1 1 1   24   16   28 o  284.188   9.0068   62.246   3.9178   70.670   6.0270   56.081   5.1557  301.648   13.054  268.868   12.528 32.78012 18.09278 
1 1 1   24   16   29 o  117.183   16.156   10.944   2.8208   14.495   4.5849   8.7819   3.5781  132.661   23.437  102.735   23.291 29.92619 33.04189 
1 1 1   24   16   30 o  156.595   12.898   19.185   3.0639   19.853   4.8886   18.753   3.9320  156.644   20.912  153.586   17.012 3.057495 26.95725 
1 1 1   24   16   31 o  200.410   10.757   31.175   3.2877   29.014   5.2914   32.534   4.1959  190.779   18.347  203.928   13.519 -13.14923 22.78975 
1 1 1   24   16   32 o  168.115   14.755   22.271   3.7584   12.003   8.4698   24.788   4.1940  116.755   39.674  177.125   15.630 -60.36980 42.64154 
1 1 1   24   16   33 o   69.707   27.081   2.8750   4.1420 -10.2434   8.5394   6.9110   4.7365   63.064   30.308   91.158   29.636 -28.09347 42.38911 
1 1 1   24   16   34 o  148.801   18.392   17.829   4.0997   17.860   6.9577   17.813   5.0741  142.024   32.685  146.581   23.403 -4.556519 40.19930 
1 1 1   24   16   35 o   85.634   25.553   6.1807   3.6037   11.775   6.7375   3.9389   4.2650  114.342   35.117   74.782   27.846 39.55946 44.81689 
1 1 1   24   16   36 o  167.661   15.228   22.321   3.8653   2.8124   6.4896   33.047   4.8119   78.817   32.718  204.115   15.518 -125.2984 36.21177 
1 1 1   24   16   37 o  147.702   17.341   17.594   3.8458   11.850   6.6788   20.444   4.7039  113.550   34.978  158.149   19.871 -44.59862 40.22855 
1 1 1   24   16   38 f  229.518   16.792   42.205   5.8582   41.423   7.1358   43.820   10.260  224.589   21.002  222.708   30.932 1.880234 37.38825 
1 1 1   24   16   39 o   81.153   26.530   5.5724   3.7939  -0.1454   5.5442   10.608   5.2029   64.901   28.615  108.206   30.242 -43.30508 41.63394 
1 1 1   24   16   40 o   65.786   24.943   2.9735   3.4555   2.9930   5.5356   2.9610   4.4232   74.244   30.458   69.733   27.713 4.511108 41.17872 
1 1 1   24   16   41 o   92.244   25.268   7.5256   3.6728   8.6061   5.5940   6.7069   4.8694   96.688   32.244   87.383   30.074 9.305191 44.09214 
1 1 1   24   16   42 o   57.620   24.117   1.2154   3.5677   3.4446   5.1604  -0.8256   4.9378   73.353   29.663   58.737   26.378 14.61520 39.69507 
1 1 1   24   16   43 o   94.194   24.408   7.9552   3.5477   6.4296   4.9961   9.5067   5.0385   84.757   30.357   99.923   30.305 -15.16572 42.89433 
1 1 1   24   16   44 o   45.924   21.132  -1.7545   3.4196  -0.5331   4.8387  -2.9732   4.8333   58.231   26.134   52.250   24.412 5.981552 35.76194 
1 1 1   24   16   45 o  124.396   25.137   14.047   4.6214   6.0517   9.6551   16.424   5.2636   88.479   38.410  133.468   26.698 -44.98911 46.77683 
1 1 1   24   17    0 o  319.056   14.448   78.756   7.0229   78.756   7.0229   78.756   7.0229  319.056   14.448  319.056   14.448 0.000000 0.000000 
1 1 1   24   17    1 f   68.039   21.690   3.5588   2.5462   5.1413   2.8858  -2.0028   5.4099   79.938   22.587   62.085   27.765 17.85287 35.79152 
1 1 1   24   17    2 o  448.967   8.4145  154.772   5.7825  154.772   5.7825   0.0000   0.0000  448.967   8.4145  ?   ?  0.000000 8.414500 
1 1 1   24   17    3 o  468.629   7.1728  168.477   5.1450  168.594   6.0927  168.185   9.6056  468.567   8.4951  466.822   13.443 1.744751 15.90246 
1 1 1   24   17    4 f  383.586   7.4563  112.902   4.3778  114.624   5.1510  108.422   8.3078  386.317   8.7111  374.544   14.491 11.77267 16.90812 
1 1 1   24   17    5 o  299.501   8.2423   68.871   3.7785   70.472   4.3813   64.225   7.4639  302.808   9.4530  287.224   17.054 15.58386 19.49874 
1 1 1   24   17    6 o  344.242   7.8873   90.963   4.1559   95.105   4.8489   79.500   8.0669  351.833   9.0040  319.792   16.537 32.04117 18.82933 
1 1 1   24   17    7 o  167.233   12.532   21.686   3.1844   22.297   3.6370   19.680   6.5919  169.282   14.167  155.010   28.845 14.27251 32.13595 
1 1 1   24   17    8 o   98.621   18.722   7.8128   2.7228   6.9763   2.9978   11.755   6.5080   92.616   21.552  118.901   34.032 -26.28548 40.28239 
1 1 1   24   17    9 o  623.452   6.6831  298.148   6.3776  305.620   7.3933  276.418   12.607  630.994   7.6550  598.107   13.771 32.88629 15.75573 
1 1 1   24   17   10 o  223.031   10.210   38.275   3.4853   37.854   3.9892   39.632   7.1640  221.291   11.820  224.057   21.139 -2.765869 24.21971 
1 1 1   24   17   11 o  457.591   6.6847  160.629   4.6820  165.036   5.2851  144.562   10.092  463.693   7.4466  431.953   15.265 31.73953 16.98417 
1 1 1   24   17   12 o  134.914   12.992   14.184   2.6498   15.323   2.8314   6.1486   7.5203  140.203   13.355   97.395   36.828 42.80849 39.17470 
1 1 1   24   17   13 o  399.197   6.8404  122.279   4.1796  126.259   4.6253  104.563   9.7590  405.543   7.4513  366.537   17.395 39.00601 18.92348 
1 1 1   24   17   14 o  254.823   6.1241   49.803   2.3886   50.375   2.4938   43.453   8.3150  256.259   6.3578  233.482   23.590 22.77618 24.43216 
1 1 1   24   17   15 o  110.123   10.739   9.4318   1.7872   9.4318   1.7872   0.0000   0.0000  110.123   10.739  ?   ?  0.000000 10.73945 
1 1 1   24   17   16 o  269.626   6.3200   55.774   2.6083   56.918   2.7515   45.637   8.1912  272.346   6.6005  239.489   22.613 32.85771 23.55676 
1 1 1   24   17   17 f   95.364   17.061   7.2915   2.3989   7.2935   2.5287   7.2742   7.5845   95.158   18.021  100.962   37.223 -5.804146 41.35617 
1 1 1   24   17   18 o   87.295   28.042   6.0522   4.2497   9.8104   5.2106  -1.4136   7.3442  108.323   30.261   74.064   32.780 34.25896 44.61222 
1 1 1   24   17   19 o  146.342   12.411   16.674   2.7538   16.782   2.9305   15.859   8.0524  146.657   13.196  135.382   37.547 11.27492 39.79793 
1 1 1   24   17   20 o  211.911   9.8786   34.598   3.2042   34.306   3.4842   36.197   8.1583  210.600   10.846  211.375   25.748 -0.7750092 27.93893 
1 1 1   24   17   21 o  310.134   8.2619   73.965   3.9219   79.849   4.3767   49.985   8.8359  322.113   8.8770  249.822   23.379 72.29091 25.00787 
1 1 1   24   17   22 o  111.406   19.110   10.004   3.1413   9.8004   3.3891   11.247   8.3682  109.736   20.942  116.400   39.436 -6.664459 44.65121 
1 1 1   24   17   23 o  135.042   17.087   14.475   3.4528   14.475   3.4528   0.0000   0.0000  135.042   17.087  ?   ?  0.000000 17.08688 
1 1 1   24   17   24 o  251.304   9.8463   48.698   3.7874   54.667   4.7923   38.766   6.1814  265.832   11.778  221.456   18.403 44.37566 21.84893 
1 1 1   24   17   25 o  248.583   9.8413   47.662   3.7445   49.310   4.7731   45.025   6.0383  252.277   12.361  239.370   16.583 12.90710 20.68283 
1 1 1   24   17   26 o  141.637   13.975   15.748   2.9903   16.224   4.1889   15.253   4.2701  142.053   19.804  137.265   20.991 4.788300 28.85857 
1 1 1   24   17   27 o  180.512   12.137   25.366   3.3340   29.895   4.3075   18.597   5.2656  195.355   14.509  150.742   23.596 44.61284 27.69962 
1 1 1   24   17   28 o  164.880   11.550   21.156   2.8965   21.195   4.3931   21.126   3.8524  163.182   17.881  163.667   15.565 -0.4851074 23.70707 
1 1 1   24   17   29 o  447.113   6.8136  153.663   4.6630  168.380   6.9795  141.798   6.2668  466.963   9.7650  428.604   9.5526 38.35938 13.66047 
1 1 1   24   17   30 o   74.743   23.045   4.5276   2.8983   5.3396   4.5114   3.9569   3.7820   83.075   28.927   73.741   26.412 9.334236 39.17065 
1 1 1   24   17   31 o   51.171   21.698   0.3206   2.9487   8.0677   4.6709  -4.8124   3.8020   97.458   29.094   42.907   20.514 54.55120 35.59889 
1 1 1   24   17   32 o   97.445   26.382   8.0719   4.0315   0.0000   0.0000   8.0719   4.0315  ?   ?    97.445   26.382 0.000000 26.38218 
1 1 1   24   17   33 o   92.551   22.930   7.2003   3.2315  -1.8005   5.1801   12.935   4.1348   59.580   26.863  124.902   22.453 -65.32202 35.01101 
1 1 1   24   17   34 o  111.840   23.330   10.513   3.8645   12.934   6.3328   9.0772   4.8781  120.157   33.287  102.181   29.528 17.97558 44.49639 
1 1 1   24   17   35 o   78.178   26.076   4.9538   3.6585   0.5317   5.4736   8.5248   4.9187   67.348   29.078   98.893   29.931 -31.54430 41.73034 
1 1 1   24   17   36 o  178.482   14.955   25.279   4.0480   23.919   5.7954   26.575   5.6565  169.648   22.904  180.082   20.911 -10.43440 31.01380 
1 1 1   24   17   37 f   78.113   29.674   4.3866   4.8968   8.3544   5.6744  -7.1876   9.6916   97.321   32.476   70.942   33.583 26.37852 46.71769 
1 1 1   24   17   38 o  126.160   20.679   13.254   3.8548  -0.0940   6.8092   19.550   4.6764   71.157   31.525  153.891   20.352 -82.73459 37.52388 
1 1 1   24   17   39 o   63.070   26.179   1.5918   4.1543   0.1542   6.5800   2.5446   5.3569   70.419   31.104   72.115   29.814 -1.695755 43.08528 
1 1 1   24   17   40 o   55.996   24.213   0.2998   3.8069  -7.1604   6.3871   4.4103   4.7410   54.602   26.233   76.712   29.185 -22.11056 39.24210 
1 1 1   24   17   41 o   80.982   26.507   5.7264   3.7868  -2.2455   5.9821   11.057   4.8917   60.999   28.025  109.547   28.795 -48.54783 40.18133 
1 1 1   24   17   42 o   70.882   25.415   4.0888   3.5029  -8.1017   4.8748   17.103   5.0367   43.749   21.445  139.430   24.494 -95.68121 32.55556 
1 1 1   24   17   43 o  112.938   21.083   11.016   3.5105   8.9373   4.9683   13.089   4.9609   96.619   30.236  118.695   27.795 -22.07597 41.07020 
1 1 1   24   17   44 o  166.487   18.801   23.281   4.7071   0.1527   9.5878   30.626   5.4031   77.202   35.473  191.242   18.698 -114.0401 40.09900 
1 1 1   24   18    1 o  285.287   16.560   63.340   7.2001   63.340   7.2001   0.0000   0.0000  285.287   16.560  ?   ?  0.000000 16.56002 
1 1 1   24   18    2 o  243.231   9.4012   45.477   3.5000   46.599   4.0804   42.352   6.8090  246.036   10.835  232.332   19.322 13.70412 22.15300 
1 1 1   24   18    3 o   54.641   21.981   1.1336   2.8177   1.2313   3.1953   0.7918   5.9757   57.835   23.358   73.286   30.972 -15.45113 38.79209 
1 1 1   24   18    4 o  318.368   8.2572   77.838   4.0238   78.330   4.6627   76.403   7.9636  319.188   9.5439  313.346   16.664 5.841797 19.20352 
1 1 1   24   18    5 o   98.378   20.704   7.8400   3.0190   8.0586   3.4122   7.0521   6.4783   99.388   22.901   97.972   34.623 1.416237 41.51149 
1 1 1   24   18    6 o   81.432   23.377   5.3451   3.0666   6.0310   3.4573   2.8150   6.6401   86.351   24.831   82.912   33.606 3.439003 41.78453 
1 1 1   24   18    7 o  261.901   9.4982   52.743   3.8076   53.512   4.3495   50.220   7.8770  263.625   10.779  252.605   20.551 11.01990 23.20608 
1 1 1   24   18    8 o  151.461   12.783   17.832   2.9357   20.108   3.2196   6.6060   7.1500  160.824   13.195   97.978   36.138 62.84531 38.47200 
1 1 1   24   18    9 o  146.692   15.266   16.849   3.3774   14.730   3.8182   24.470   7.2410  136.225   18.814  173.137   28.302 -36.91240 33.98469 
1 1 1   24   18   10 o  383.615   7.1724  112.946   4.2115  113.446   4.6532  110.680   9.9027  384.345   7.9098  377.224   17.151 7.121246 18.88692 
1 1 1   24   18   11 o  154.199   12.279   18.466   2.8741   19.899   3.0936   9.4304   7.7688  160.020   12.736  109.915   37.977 50.10478 40.05591 
1 1 1   24   18   12 o  165.619   11.238   21.242   2.8320   19.659   3.0273   32.338   8.0151  159.066   12.535  199.829   26.887 -40.76312 29.66592 
1 1 1   24   18   13 o  135.122   13.182   14.248   2.6916   15.173   2.8552   6.8676   8.0676  139.401   13.553  101.127   38.167 38.27473 40.50200 
1 1 1   24   18   14 o  297.783   8.4330   68.161   3.8437   68.161   3.8437   0.0000   0.0000  297.783   8.4330  ?   ?  0.000000 8.432998 
1 1 1   24   18   15 o  181.299   10.176   25.398   2.8123   26.560   2.9842   16.179   8.4090  185.342   10.563  136.869   38.515 48.47298 39.93735 
1 1 1   24   18   16 o  345.470   5.9061   91.546   3.1231   92.930   3.3031   79.886   9.5901  348.031   6.2007  318.511   19.769 29.52008 20.71835 
1 1 1   24   18   17 o  129.234   9.8421   12.937   1.9322   13.266   1.9862   7.1349   8.3468  130.850   9.9923  102.339   38.775 28.51156 40.04135 
1 1 1   24   18   18 o  104.576   15.493   8.6800   2.4049   9.3611   2.5063   0.7740   8.5392  108.677   15.507   84.771   36.460 23.90545 39.62064 
1 1 1   24   18   19 o  175.183   10.733   23.761   2.8641   23.911   3.0159   22.381   9.1454  175.632   11.278  160.387   37.861 15.24487 39.50504 
1 1 1   24   18   20 o  106.526   17.740   9.1010   2.7908   10.552   2.9567  -2.7538   8.4503  114.995   17.337   76.344   34.376 38.65159 38.50042 
1 1 1   24   18   21 o  162.848   13.191   20.686   3.2599   21.692   3.5076   14.315   8.8312  166.618   13.880  128.335   40.336 38.28267 42.65703 
1 1 1   24   18   22 f   61.733   23.583   2.2071   3.1035   0.0159   3.3044   18.607   9.0399   53.009   22.736  144.894   39.622 -91.88539 45.68164 
1 1 1   24   18   23 o  120.155   16.903   11.501   3.0226   10.705   3.2037   17.957   9.1210  115.315   18.798  142.002   40.166 -26.68738 44.34765 
1 1 1   24   18   24 o  125.572   16.536   12.533   3.1010   15.354   3.3275  -6.1025   8.5511  139.376   15.881   70.238   32.699 69.13862 36.35196 
1 1 1   24   18   25 o  156.905   15.136   19.371   3.5900   19.371   3.5900   0.0000   0.0000  156.905   15.136  ?   ?  0.000000 15.13603 
1 1 1   24   18   26 o  179.521   12.294   25.101   3.3579   27.305   4.2776   21.562   5.4203  186.465   15.118  163.050   22.304 23.41528 26.94431 
1 1 1   24   18   27 o  182.911   12.178   26.059   3.3901   29.823   4.4389   20.790   5.2514  194.886   14.996  160.050   22.020 34.83653 26.64096 
1 1 1   24   18   28 o   81.005   22.717   5.4219   2.9306   9.7362   3.9959   0.4002   4.3111  107.765   24.747   61.115   26.085 46.65012 35.95613 
1 1 1   24   18   29 o   75.859   22.124   4.7186   2.7272   9.8199   4.0960   0.6562   3.6552  107.985   25.235   57.728   24.300 50.25737 35.03331 
1 1 1   24   18   30 o  137.015   14.053   14.798   2.9056   23.462   4.4369   8.2938   3.8446  171.787   17.101   99.092   25.269 72.69529 30.51233 
1 1 1   24   18   31 o  157.656   16.075   19.727   3.8249   20.079   8.2971   19.632   4.3102  149.103   36.621  156.445   18.348 -7.341812 40.96077 
1 1 1   24   18   32 o   73.654   23.772   4.3603   3.0512   9.7657   4.8993   0.9354   3.8999  106.162   29.226   60.138   25.196 46.02336 38.58792 
1 1 1   24   18   33 o  191.380   11.965   28.609   3.4874   34.992   5.5127   24.351   4.5030  209.499   17.348  174.655   17.062 34.84427 24.33213 
1 1 1   24   18   34 o  188.773   14.290   28.120   4.0984   28.328   6.2256   27.961   5.4447  185.553   22.371  185.911   19.421 -0.3582001 29.62478 
1 1 1   24   18   35 o  266.545   10.785   55.222   4.3999   48.157   5.9813   63.554   6.4954  246.209   15.958  283.546   15.020 -37.33768 21.91427 
1 1 1   24   18   36 o  177.323   18.732   25.518   5.0072   24.755   5.6733   28.207   10.650  172.853   21.937  169.413   41.417 3.440109 46.86798 
1 1 1   24   18   37 o  194.312   12.968   29.759   3.8347   37.186   5.9336   24.433   5.0251  214.378   18.257  172.930   19.315 41.44748 26.57751 
1 1 1   24   18   38 o  113.578   22.820   11.002   3.8295   10.942   5.6244   11.054   5.2287  109.088   31.759  110.326   30.118 -1.238571 43.76910 
1 1 1   24   18   39 o   94.972   24.977   7.9244   3.6793   10.289   5.5753   6.1003   4.8971  105.259   31.868   84.858   30.091 20.40154 43.82967 
1 1 1   24   18   40 o  130.007   18.655   14.017   3.6058   18.221   5.3763   10.580   4.8613  144.303   25.261  107.241   28.944 37.06162 38.41703 
1 1 1   24   18   41 o  136.027   18.708   15.416   3.7920   9.1232   5.6667   20.518   5.1029   97.794   32.445  154.867   22.159 -57.07291 39.29039 
1 1 1   24   18   42 o  143.577   18.892   17.267   4.0510   12.433   6.6325   20.144   5.1162  110.490   34.984  152.566   22.592 -42.07607 41.64447 
1 1 1   24   18   43 o  110.693   24.103   10.994   3.9680   14.212   6.5791   9.1540   4.9745  117.665   34.375   97.303   30.223 20.36148 45.77198 
1 1 1   24   19    0 o  147.487   34.517   19.538   6.7725   19.538   6.7725   19.538   6.7725  147.487   34.517  147.487   34.517 0.000000 0.000000 
1 1 1   24   19    1 o  384.390   15.060  114.445   8.8606   0.0000   0.0000  114.445   8.8606  ?   ?   384.390   15.060 0.000000 15.05987 
1 1 1   24   19    2 o  140.161   14.651   15.366   3.0968   14.408   3.4711   19.106   6.8558  135.117   17.171  151.855   30.554 -16.73773 35.04832 
1 1 1   24   19    3 o  202.234   24.292   32.705   7.3690   0.0000   0.0000   32.705   7.3690  ?   ?   202.234   24.292 0.000000 24.29180 
1 1 1   24   19    4 o  288.431   8.7688   63.934   3.8713   65.910   4.4429   57.702   7.8894  292.685   9.9174  271.276   19.123 21.40857 21.54159 
1 1 1   24   19    5 o  218.270   10.792   36.694   3.6056   33.716   4.1033   46.785   7.5534  208.551   12.918  243.678   20.440 -35.12634 24.18004 
1 1 1   24   19    6 o  343.032   8.3516   90.404   4.3850   91.212   5.0583   87.961   8.7969  344.349   9.5970  335.864   17.169 8.484680 19.66929 
1 1 1   24   19    7 f  187.441   12.331   27.233   3.5180   29.663   3.9940   18.823   7.4304  195.435   13.433  149.597   33.306 45.83797 35.91331 
1 1 1   24   19    8 o   68.486   24.745   3.1652   3.3277   2.6537   3.7397   5.1105   7.2929   67.869   25.897   92.880   35.976 -25.01111 44.32739 
1 1 1   24   19    9 o  423.151   7.1992  137.450   4.6628  141.701   5.1891  119.621   10.626  429.515   7.8931  391.775   17.720 37.73965 19.39854 
1 1 1   24   19   10 o  139.785   14.055   15.277   2.9664   13.314   3.1536   30.352   8.7397  129.924   16.211  191.801   30.813 -61.87700 34.81693 
1 1 1   24   19   11 o  114.934   16.811   10.488   2.8700   10.640   3.0634   9.3946   8.2094  115.513   17.905  110.311   38.976 5.202492 42.89248 
1 1 1   24   19   12 o  191.547   10.747   28.368   3.1381   29.804   3.3540   18.277   8.8905  196.264   11.211  145.181   39.124 51.08321 40.69888 
1 1 1   24   19   13 o  188.087   10.649   27.354   3.0532   27.171   3.2112   29.082   9.8548  187.342   11.251  184.883   36.119 2.458847 37.83116 
1 1 1   24   19   14 o  276.341   9.9190   58.815   4.1955   58.815   4.1955   0.0000   0.0000  276.341   9.9190  ?   ?  0.000000 9.919028 
1 1 1   24   19   15 o  117.605   11.001   10.760   1.9574   11.545   2.0153  -2.2927   8.2213  121.866   10.920   76.461   34.208 45.40472 35.90871 
1 1 1   24   19   16 o  160.557   8.7529   19.888   2.1429   20.704   2.2147   7.8963   8.4897  163.811   8.8657  105.167   39.261 58.64450 40.24974 
1 1 1   24   19   17 o  191.180   7.8346   28.090   2.2926   28.068   2.3684   28.423   9.1323  191.076   8.0981  183.358   33.784 7.718475 34.74135 
1 1 1   24   19   18 o  265.906   7.0158   54.301   2.8555   54.330   2.9906   53.994   9.6089  265.935   7.3470  259.161   24.515 6.773193 25.59190 
1 1 1   24   19   19 o  170.587   10.739   22.544   2.7898   23.118   2.9436   17.487   8.7432  172.659   11.199  141.027   39.128 31.63225 40.69933 
1 1 1   24   19   20 o  215.240   9.7321   35.707   3.2063   38.856   3.4334   14.240   8.9644  224.488   9.9922  128.014   40.686 96.47386 41.89550 
1 1 1   24   19   21 o  131.259   15.323   13.594   3.0206   14.523   3.2034   6.1514   9.0705  135.617   15.724  100.504   39.766 35.11311 42.76176 
1 1 1   24   19   22 f  304.253   8.5293   71.254   3.9721   73.923   4.2809   54.728   10.651  309.793   9.0281  258.695   27.311 51.09857 28.76439 
1 1 1   24   19   23 o  181.460   11.892   25.597   3.2848   26.090   3.4844   21.656   9.8463  183.057   12.511  155.063   40.898 27.99443 42.76834 
1 1 1   24   19   24 o  124.069   16.974   12.272   3.1390   12.336   3.3278   11.755   9.4534  124.083   18.051  118.417   41.827 5.665894 45.55573 
1 1 1   24   19   25 f  174.695   12.919   23.821   3.4300   25.593   3.6872   12.433   9.3480  180.976   13.406  120.332   41.654 60.64426 43.75814 
1 1 1   24   19   26 o   97.114   23.644   7.8678   3.4817   7.8678   3.4817   0.0000   0.0000   97.114   23.644  ?   ?  0.000000 23.64434 
1 1 1   24   19   27 o  284.676   9.0079   62.494   3.9250   69.981   5.3339   53.652   5.7966  300.498   11.597  261.811   14.522 38.68665 18.58406 
1 1 1   24   19   28 o   73.967   24.286   4.3179   3.1780   5.3861   4.0828   2.6757   5.0623   82.305   27.547   73.452   29.493 8.853104 40.35696 
1 1 1   24   19   29 o  290.553   8.3652   65.066   3.7202   64.461   4.9905   65.823   5.5814  288.362   11.307  290.967   12.532 -2.604675 16.87893 
1 1 1   24   19   30 o  126.367   20.350   13.032   3.8024   2.7527   7.5833   16.484   4.3948   83.925   35.147  142.255   20.798 -58.32969 40.83983 
1 1 1   24   19   31 o   65.036   24.897   2.5980   3.4635   13.331   7.7053  -0.1199   3.8773  121.220   37.608   56.114   24.350 65.10626 44.80299 
1 1 1   24   19   32 o  155.303   15.136   19.120   3.5523   15.682   4.9685   22.715   5.0808  136.646   24.663  167.249   20.261 -30.60330 31.91774 
1 1 1   24   19   33 o  100.530   24.591   8.6216   3.7527   16.604   5.7229   2.5999   4.9705  138.737   27.916   71.877   29.096 66.85975 40.32247 
1 1 1   24   19   34 o  315.201   8.5625   76.779   4.1310   82.892   6.0806   71.538   5.6298  325.892   12.190  302.771   12.148 23.12057 17.20953 
1 1 1   24   19   35 o   46.217   21.726  -3.5531   3.9290   1.6577   5.0398 -11.6273   6.2736   68.287   28.628   48.536   23.897 19.75129 37.29172 
1 1 1   24   19   36 o   78.021   26.105   5.0284   3.6664   12.339   5.1741  -2.3441   5.1960  117.648   28.934   57.488   26.304 60.16016 39.10286 
1 1 1   24   19   37 o  144.219   18.927   17.059   4.0772   13.041   5.6906   21.297   5.8445  119.563   30.879  157.745   25.043 -38.18214 39.75739 
1 1 1   24   19   38 o  106.692   23.984   9.8792   3.8215   6.5121   5.5556   12.903   5.2650   87.813   31.936  119.392   29.080 -31.57903 43.19207 
1 1 1   24   19   39 o  182.536   13.549   26.513   3.7585   28.149   5.5875   25.161   5.0795  183.995   20.171  174.411   19.354 9.583679 27.95376 
1 1 1   24   19   40 f   54.519   23.160   0.7568   3.3695  -3.1450   4.9844   4.0408   4.5727   53.336   24.876   73.760   28.510 -20.42391 37.83718 
1 1 1   24   19   41 o   83.745   25.730   6.3077   3.6165   5.2053   5.5863   7.1030   4.7451   80.450   31.396   87.839   29.696 -7.388969 43.21523 
1 1 1   24   19   42 o   69.498   25.199   3.9476   3.4551   10.190   4.9962  -1.7745   4.7834  102.869   29.928   54.744   25.118 48.12442 39.07157 
1 1 1   24   20    0 o  135.811   38.004   17.487   6.8365   17.487   6.8365   17.487   6.8365  135.811   38.004  135.811   38.004 0.000000 0.000000 
1 1 1   24   20    1 o  133.899   24.469   14.593   4.8302   24.734   6.7770   4.1223   6.8861  174.676   26.152   87.997   34.702 86.67911 43.45269 
1 1 1   24   20    2 o  208.145   24.475   34.719   7.6487   0.0000   0.0000   34.719   7.6487  ?   ?   208.145   24.475 0.000000 24.47525 
1 1 1   24   20    3 o  177.564   14.967   24.610   4.0299   25.007   4.7531   23.595   7.6000  178.334   17.645  168.862   30.528 9.471527 35.26029 
1 1 1   24   20    4 o  332.899   8.7973   85.197   4.4826   83.824   5.1631   89.401   9.0335  329.945   10.223  338.336   17.504 -8.390869 20.27064 
1 1 1   24   20    5 o  211.339   11.253   34.533   3.6270   33.587   4.0950   37.976   7.8125  208.079   12.921  217.983   23.802 -9.903839 27.08333 
1 1 1   24   20    6 o   67.694   24.485   3.0891   3.2592   3.0871   3.6266   3.0974   7.4315   69.426   25.711   86.814   35.415 -17.38843 43.76408 
1 1 1   24   20    7 o  120.493   24.007   11.867   4.2722   13.534   5.1850   8.3434   7.5392  127.913   27.314  105.043   37.326 22.86947 46.25214 
1 1 1   24   20    8 o  282.415   9.5721   61.383   4.1377   64.326   4.6449   50.070   9.1068  288.942   10.502  250.347   24.062 38.59489 26.25450 
1 1 1   24   20    9 o  130.022   17.652   13.414   3.4223   13.055   3.7066   15.491   8.9095  127.727   19.584  134.110   40.215 -6.383339 44.72994 
1 1 1   24   20   10 o  319.939   8.9686   78.736   4.3920   78.176   4.8839   81.100   10.042  318.602   10.015  320.671   20.567 -2.069366 22.87610 
1 1 1   24   20   11 o  244.588   9.4292   46.044   3.5300   49.034   3.8273   29.007   9.1358  252.331   9.9095  185.914   33.329 66.41672 34.77076 
1 1 1   24   20   12 o  297.536   8.1872   68.047   3.7286   68.119   4.0213   67.603   9.9548  297.589   8.8284  291.677   22.471 5.911652 24.14277 
1 1 1   24   20   13 o   65.036   23.084   2.9542   2.8826   2.9542   2.8826   0.0000   0.0000   65.036   23.084  ?   ?  0.000000 23.08367 
1 1 1   24   20   14 o  150.971   12.922   17.763   2.9572   21.559   3.1690  -7.8276   8.2280  166.509   12.526   66.316   31.256 100.1930 33.67213 
1 1 1   24   20   15 o  284.699   8.5283   62.341   3.7164   63.827   4.0170   53.514   9.7904  287.970   9.1136  257.848   25.126 30.12259 26.72759 
1 1 1   24   20   16 o   74.718   22.639   4.4723   2.8128   4.8657   2.9702   1.0522   8.7568   77.678   23.203   86.210   36.996 -8.531349 43.66994 
1 1 1   24   20   17 o  267.341   6.7453   54.878   2.7602   55.182   2.8702   51.133   10.067  268.048   6.9956  250.941   26.615 17.10661 27.51915 
1 1 1   24   20   18 f  325.951   8.4337   81.738   4.2076   86.310   4.5513   54.841   11.038  334.849   8.8800  258.860   28.322 75.98828 29.68102 
1 1 1   24   20   19 o  106.376   15.540   8.9927   2.4556   9.3311   2.5426   4.2964   9.4714  108.331   15.799   96.682   39.772 11.64992 42.79539 
1 1 1   24   20   20 o  108.376   16.604   9.3788   2.6666   10.025   2.7769   1.7251   9.5560  112.098   16.693   90.467   38.730 21.63178 42.17429 
1 1 1   24   20   21 o  187.693   10.608   27.289   3.0351   27.774   3.1839   22.465   10.044  189.263   11.039  158.010   41.130 31.25317 42.58521 
1 1 1   24   20   22 o  262.270   9.0282   52.997   3.6243   53.690   3.8552   47.726   10.632  263.875   9.5450  239.786   29.596 24.08937 31.09703 
1 1 1   24   20   23 f  146.957   13.831   16.939   3.0745   16.920   3.2394   17.110   9.7615  146.667   14.625  137.564   42.272 9.103241 44.73078 
1 1 1   24   20   24 o  203.325   11.100   32.076   3.4415   34.409   3.6806   15.840   9.7082  210.518   11.466  132.562   42.363 77.95518 43.88723 
1 1 1   24   20   25 o   90.528   22.721   6.8135   3.1434   6.7729   3.3055   7.1970   10.163   90.153   23.657  105.087   41.929 -14.93410 48.14271 
1 1 1   24   20   26 o  229.067   11.857   40.795   4.1429   40.795   4.1429   0.0000   0.0000  229.067   11.857  ?   ?  0.000000 11.85658 
1 1 1   24   20   27 o  386.292   8.7500  115.057   5.1736  120.097   5.6488   88.827   12.887  394.451   9.3560  329.334   25.770 65.11761 27.41627 
1 1 1   24   20   28 o  143.984   15.039   16.392   3.2655   14.564   4.2713   18.964   5.0660  133.346   21.672  152.217   22.415 -18.87155 31.17821 
1 1 1   24   20   29 o   62.632   26.226   1.0474   4.2215  -0.0148   9.6081   1.3015   4.6994   84.983   37.559   66.290   27.707 18.69272 46.67297 
1 1 1   24   20   30 o   58.733   25.144   0.3390   4.0278   0.6513   7.8272   0.2266   4.6974   79.140   34.469   62.498   26.961 16.64232 43.76077 
1 1 1   24   20   31 o  102.490   21.014   8.7267   3.1859   6.1634   4.5708   11.149   4.4429   86.691   29.146  114.233   25.995 -27.54141 39.05445 
1 1 1   24   20   32 f  139.314   16.344   15.536   3.4190   13.645   4.7977   17.488   4.8734  126.549   25.647  145.171   22.674 -18.62196 34.23273 
1 1 1   24   20   33 o   86.953   29.085   6.3255   4.5513   12.060   5.3377  -8.9476   8.7114  116.672   29.787   64.776   30.992 51.89582 42.98597 
1 1 1   24   20   34 o   82.109   27.418   5.6075   4.0443   9.6163   4.9415  -2.5259   7.0387  104.011   29.615   67.210   30.699 36.80039 42.65563 
1 1 1   24   20   35 o  132.866   18.002   14.383   3.5668   15.293   5.3235   13.641   4.8048  132.354   27.188  125.535   25.866 6.818512 37.52648 
1 1 1   24   20   36 o   65.663   25.043   2.8765   3.4963  -1.2760   5.2712   6.1385   4.6720   60.415   27.182   85.300   29.452 -24.88512 40.07842 
1 1 1   24   20   37 o  179.115   18.559   26.216   5.0143   10.583   8.5777   34.333   6.1803  106.080   39.491  204.161   20.036 -98.08119 44.28294 
1 1 1   24   20   38 o   59.222   24.876   1.1895   3.8174   4.1312   5.2335  -2.1550   5.5803   76.728   30.254   59.335   27.189 17.39252 40.67639 
1 1 1   24   20   39 o   52.219   22.944  -0.1609   3.5363  -4.5972   5.5940   2.7920   4.5640   54.020   25.555   68.665   27.851 -14.64423 37.79879 
1 1 1   24   20   40 o  107.781   22.103   10.108   3.5240   12.380   5.1271   8.0747   4.8516  114.899   29.117   92.853   29.976 22.04533 41.78963 
1 1 1   24   20   41 o   61.042   24.284   2.3158   3.3997   1.5833   4.9472   2.9713   4.6798   65.154   27.879   68.967   28.115 -3.812309 39.59477 
1 1 1   24   21    0 o  256.803   20.207   52.018   7.8296   52.018   7.8296   52.018   7.8296  256.803   20.207  256.803   20.207 0.000000 0.000000 
1 1 1   24   21    1 o  488.098   10.413  183.545   7.7797  172.891   10.626  195.855   11.422  472.169   14.702  502.483   14.850 -30.31378 20.89725 
1 1 1   24   21    2 o  216.920   16.656   36.830   5.4879   32.451   7.3768   42.258   8.2124  200.921   24.494  229.957   23.670 -29.03587 34.06200 
1 1 1   24   21    3 o  236.377   11.074   43.086   4.0066   45.058   4.6207   37.110   8.0429  241.150   12.562  214.845   24.921 26.30450 27.90776 
1 1 1   24   21    4 o  184.810   13.103   26.546   3.6826   26.855   4.1971   25.515   7.6764  185.470   14.910  175.854   29.568 9.616089 33.11510 
1 1 1   24   21    5 o  236.483   23.221   44.620   8.2970   0.0000   0.0000   44.620   8.2970  ?   ?   236.483   23.221 0.000000 23.22137 
1 1 1   24   21    6 o  254.795   22.638   51.651   8.7366   0.0000   0.0000   51.651   8.7366  ?   ?   254.795   22.638 0.000000 22.63751 
1 1 1   24   21    7 o   77.358   23.896   4.7596   3.1146   4.8281   3.3622   4.3453   8.2702   78.326   24.920   93.545   37.649 -15.21861 45.14889 
1 1 1   24   21    8 o  273.020   9.1684   57.355   3.8314   57.575   4.1661   56.150   9.7568  273.411   9.9550  264.877   24.338 8.534210 26.29501 
1 1 1   24   21    9 o  195.983   11.608   29.754   3.4667   30.516   3.7287   24.894   9.4149  198.332   12.344  170.093   37.198 28.23848 39.19297 
1 1 1   24   21   10 o  179.210   12.382   24.941   3.3755   25.502   3.6074   20.997   9.5686  181.066   13.105  154.808   40.071 26.25798 42.15923 
1 1 1   24   21   11 o  114.821   17.744   10.526   3.0179   10.778   3.2083   8.5918   8.8937  115.961   18.713  108.478   40.246 7.483261 44.38369 
1 1 1   24   21   12 o  150.766   14.626   17.806   3.3328   17.806   3.3328   0.0000   0.0000  150.766   14.626  ?   ?  0.000000 14.62636 
1 1 1   24   21   13 o   36.606   17.588  -4.1062   2.8722  -2.1676   3.0435 -19.8867   8.6833   43.317   19.934   54.294   26.979 -10.97772 33.54398 
1 1 1   24   21   14 o  296.239   8.5183   67.507   3.8625   68.446   4.1806   62.032   10.095  298.173   9.1601  278.208   23.939 19.96527 25.63125 
1 1 1   24   21   15 o   99.530   20.570   8.0803   3.0302   7.1310   3.1947   16.593   9.5664   93.031   22.648  137.188   41.791 -44.15697 47.53370 
1 1 1   24   21   16 o  458.382   7.6423  161.496   5.3619  169.711   5.9360  125.080   12.498  469.728   8.2561  397.611   20.606 72.11618 22.19888 
1 1 1   24   21   17 o  291.847   8.7987   65.566   3.9305   66.651   4.2437   59.020   10.424  294.126   9.4263  270.134   25.514 23.99207 27.19962 
1 1 1   24   21   18 o  246.139   8.6677   46.636   3.2655   46.701   3.4430   46.051   10.304  246.232   9.1353  236.260   29.110 9.972382 30.50952 
1 1 1   24   21   19 o  259.847   9.3200   52.031   3.7068   55.748   3.9561   25.298   10.610  268.909   9.6116  167.687   41.551 101.2221 42.64811 
1 1 1   24   21   20 o  153.740   12.672   18.445   2.9553   18.120   3.0647   22.757   11.163  152.225   13.286  157.351   44.410 -5.125900 46.35522 
1 1 1   24   21   21 o   97.670   17.593   7.7017   2.5334   8.1357   2.6116   0.7743   10.434  100.439   17.631   91.175   39.751 9.264053 43.48538 
1 1 1   24   21   22 o   75.723   21.751   4.6837   2.6542   4.6816   2.7506   4.7114   10.114   75.808   22.250   98.892   40.932 -23.08430 46.58837 
1 1 1   24   21   23 o  264.057   9.2910   53.774   3.7552   55.313   4.0079   42.719   10.744  267.696   9.7816  224.452   32.196 43.24417 33.64955 
1 1 1   24   21   24 o   90.366   21.315   6.7557   2.9004   8.0668   3.0330  -7.2563   9.9155   99.043   20.675   74.278   34.787 24.76457 40.46729 
1 1 1   24   21   25 o  217.123   11.902   36.670   3.9405   36.670   3.9405   0.0000   0.0000  217.123   11.902  ?   ?  0.000000 11.90232 
1 1 1   24   21   26 o  108.421   20.711   9.6521   3.3117   8.0918   3.4831   24.348   10.690   98.346   23.466  161.478   42.624 -63.13209 48.65656 
1 1 1   24   21   27 o  143.891   16.411   16.474   3.5498   16.009   3.7463   20.555   11.106  141.391   17.699  146.686   45.092 -5.295120 48.44114 
1 1 1   24   21   28 o  125.653   32.464   13.926   6.2882   13.319   7.5244   15.331   11.450  121.591   37.069  128.723   45.972 -7.132202 59.05531 
1 1 1   24   21   29 o  121.279   24.019   12.335   4.3010   16.451   10.101   11.423   4.7535  131.870   43.298  115.335   27.343 16.53500 51.20842 
1 1 1   24   21   30 o   47.487   21.246  -1.0570   3.1716  -0.2212   4.3106  -2.0435   4.6832   58.511   25.529   55.653   25.273 2.857426 35.92307 
1 1 1   24   21   31 o  206.955   10.901   33.357   3.4410   32.554   4.9382   34.115   4.7975  202.404   16.072  207.624   15.202 -5.220093 22.12262 
1 1 1   24   21   32 o  174.717   15.657   24.302   4.1426   26.109   5.1905   21.130   6.8756  179.457   19.194  155.167   30.035 24.29018 35.64405 
1 1 1   24   21   33 o  217.205   12.735   37.057   4.2153   39.264   5.2428   33.022   7.0891  222.243   15.510  198.815   23.767 23.42769 28.37963 
1 1 1   24   21   34 o  176.090   13.941   24.559   3.7267   30.436   5.1377   18.034   5.4139  194.358   17.456  145.172   25.283 49.18547 30.72402 
1 1 1   24   21   35 o   74.369   25.514   4.4786   3.5033   0.2271   4.8971   8.9353   5.0139   62.544   27.252   99.705   30.229 -37.16114 40.69946 
1 1 1   24   21   36 o  126.986   19.707   13.397   3.7064   16.589   5.0192   9.5690   5.4964  138.827   24.517  102.016   31.782 36.81142 40.13957 
1 1 1   24   21   37 o   97.694   25.721   8.4917   3.8990   7.6043   5.4627   9.4134   5.5669   91.933   31.841  100.428   32.078 -8.494965 45.19762 
1 1 1   24   21   38 o   58.427   24.218   1.4330   3.5480  -3.7656   5.3275   5.5766   4.7563   54.139   25.401   81.205   29.547 -27.06594 38.96422 
1 1 1   24   21   39 o  109.552   23.152   10.539   3.7607   9.5185   5.0285   11.834   5.6650  100.186   30.250  110.557   31.783 -10.37095 43.87770 
1 1 1   24   21   40 o   72.178   25.312   4.4030   3.4573   1.8152   4.8674   7.0380   4.9116   65.640   27.858   87.194   30.192 -21.55379 41.08097 
1 1 1   24   22    0 o  150.008   37.507   20.715   7.4500   20.715   7.4500   20.715   7.4500  150.008   37.507  150.008   37.507 0.000000 0.000000 
1 1 1   24   22    1 o  280.386   13.814   60.905   5.9285   60.291   8.3416   61.533   8.4275  276.536   19.839  279.385   19.836 -2.849396 28.05467 
1 1 1   24   22    2 o  389.183   11.310  116.873   6.7374  133.362   9.5472  100.516   9.5091  414.425   15.051  358.956   17.307 55.46933 22.93618 
1 1 1   24   22    3 o  264.028   14.388   54.219   5.7926   50.371   7.7125   59.199   8.7735  252.523   20.121  273.456   21.125 -20.93297 29.17378 
1 1 1   24   22    4 o  152.036   22.014   18.585   4.9738   22.936   6.3972   11.934   7.9088  167.868   25.717  119.328   38.247 48.53935 46.08877 
1 1 1   24   22    5 o  207.770   12.531   33.494   3.9664   32.691   4.4680   36.479   8.6156  204.823   14.342  211.787   27.207 -6.964020 30.75556 
1 1 1   24   22    6 o  170.745   14.938   22.804   3.8646   22.869   4.3316   22.550   8.5563  170.504   16.817  162.398   35.419 8.106049 39.20876 
1 1 1   24   22    7 o  240.020   10.298   44.400   3.7832   47.803   4.1405   27.199   9.3088  248.949   10.866  178.769   35.273 70.18021 36.90836 
1 1 1   24   22    8 o  304.087   9.0909   71.161   4.2313   71.015   4.6151   71.933   10.598  303.612   9.9310  300.378   23.231 3.234528 25.26458 
1 1 1   24   22    9 o  107.004   26.029   9.5124   4.2223   11.427   4.7922   2.8677   8.9272  117.083   27.251   91.571   38.223 25.51183 46.94318 
1 1 1   24   22   10 f  219.079   16.707   37.646   5.5600   37.646   5.5600   0.0000   0.0000  219.079   16.707  ?   ?  0.000000 16.70677 
1 1 1   24   22   11 o  151.236   23.430   18.554   5.2482   18.554   5.2482   0.0000   0.0000  151.236   23.430  ?   ?  0.000000 23.42968 
1 1 1   24   22   12 o  285.185   11.980   62.883   5.2292   63.627   6.0666   60.733   10.315  286.380   13.840  274.752   24.795 11.62775 28.39586 
1 1 1   24   22   13 o  237.658   13.836   43.970   5.0114   47.951   5.7895   32.075   10.008  247.746   15.343  194.007   34.989 53.73930 38.20515 
1 1 1   24   22   14 o  162.507   19.263   21.029   4.6980   17.477   5.3217   33.571   10.001  146.122   24.673  198.964   34.066 -52.84177 42.06193 
1 1 1   24   22   15 o  206.560   15.614   33.433   4.9001   30.604   5.5739   43.058   10.281  196.555   18.755  227.900   30.217 -31.34569 35.56392 
1 1 1   24   22   16 o  129.608   24.238   13.818   4.6316   14.599   5.2833   11.228   9.6266  132.326   26.999  117.570   42.135 14.75553 50.04336 
1 1 1   24   22   17 o  182.905   12.432   26.031   3.4598   27.264   3.6573   15.539   10.671  187.100   12.849  132.742   44.535 54.35896 46.35155 
1 1 1   24   22   18 o   82.059   23.429   5.5259   3.0884   4.6406   3.2416   14.230   10.165   76.495   24.483  127.841   43.462 -51.34689 49.88377 
1 1 1   24   22   19 f   90.199   19.514   6.6549   2.6158   7.9766   2.7022 -13.0256   10.427   99.216   18.474   69.281   33.345 29.93494 38.12033 
1 1 1   24   22   20 o  122.051   14.784   11.773   2.7055   11.438   2.8011   16.423   10.445  120.065   15.611  134.905   44.016 -14.84058 46.70281 
1 1 1   24   22   21 o   56.213   21.581   1.7860   2.6070   2.0777   2.7015  -2.1647   9.9424   58.489   22.084   83.167   37.383 -24.67872 43.41886 
1 1 1   24   22   22 o  167.234   11.961   21.787   3.0414   21.634   3.1892   23.322   10.106  166.481   12.609  159.854   41.080 6.627182 42.97164 
1 1 1   24   22   23 o  198.914   11.014   30.714   3.3404   31.437   3.5107   23.802   10.857  201.134   11.451  159.880   43.298 41.25415 44.78629 
1 1 1   24   22   24 o   93.176   22.130   7.2172   3.1093   7.2172   3.1093   0.0000   0.0000   93.176   22.130  ?   ?  0.000000 22.13027 
1 1 1   24   22   25 o   81.168   23.361   5.4534   3.0589   4.5376   3.1692   17.920   11.693   75.293   24.219  137.926   46.617 -62.63327 52.53304 
1 1 1   24   22   26 o   54.351   22.706   0.7061   3.1539   1.2711   3.2890  -5.7533   11.120   57.795   23.567   80.846   37.521 -23.05049 44.30809 
1 1 1   24   22   27 o  336.234   14.466   88.489   7.4450   95.713   8.9852   72.667   13.298  348.308   16.854  292.989   30.079 55.31940 34.47863 
1 1 1   24   22   28 o  122.963   20.237   12.381   3.6763   13.175   3.8936   5.8578   11.160  126.707   20.798  102.045   42.678 24.66154 47.47631 
1 1 1   24   22   29 o   60.622   24.760   1.4827   3.6378   0.8947   3.8915   5.5566   10.243   59.768   25.112   98.517   41.018 -38.74912 48.09488 
1 1 1   24   22   30 o  270.951   10.048   56.906   4.1671   62.345   5.5991   50.153   6.2390  282.423   12.952  251.305   16.308 31.11755 20.82572 
1 1 1   24   22   31 o  168.457   16.474   22.704   4.1935   20.856   5.4175   25.466   6.6236  158.200   23.050  173.442   25.730 -15.24174 34.54500 
1 1 1   24   22   32 o  121.983   17.761   12.111   3.2188   19.749   4.6506   5.0876   4.4595  155.193   20.047   80.239   28.687 74.95352 34.99707 
1 1 1   24   22   33 o  117.978   18.692   11.437   3.2629   6.4291   4.5296   16.838   4.7043   86.886   29.016  141.740   22.430 -54.85479 36.67461 
1 1 1   24   22   34 o   71.067   24.230   4.0568   3.1592   4.4030   4.4329   3.6995   4.5035   76.408   28.401   73.454   28.322 2.954025 40.10861 
1 1 1   24   22   35 o   78.464   25.269   5.2342   3.4491   8.6477   5.2044   2.5605   4.6059   97.576   31.000   68.813   27.955 28.76329 41.74260 
1 1 1   24   22   36 o   73.584   26.009   4.3958   3.6560  -1.1524   4.8622   11.613   5.5456   57.789   26.044  111.333   31.260 -53.54313 40.68699 
1 1 1   24   22   37 o   67.607   25.605   3.3323   3.6389   4.3609   4.6964   1.7871   5.7563   75.638   28.983   70.114   30.039 5.523888 41.74149 
1 1 1   24   22   38 o   58.123   24.159   1.4217   3.5446   0.7780   4.6581   2.3072   5.4631   61.661   26.723   70.111   29.621 -8.449387 39.89403 
1 1 1   24   22   39 o  115.092   21.774   11.500   3.6952   7.4104   4.7327   17.886   5.9142   89.121   29.655  138.631   28.812 -49.50967 41.34724 
1 1 1   24   23    0 o   54.471   35.670  -0.5232   7.3884  -0.5232   7.3884  -0.5232   7.3884   54.471   35.670   54.471   35.670 0.000000 0.000000 
1 1 1   24   23    1 o  436.478   10.985  146.996   7.3386  148.421   10.259  145.503   10.502  436.906   15.341  432.353   15.869 4.553192 22.07218 
1 1 1   24   23    2 o  343.126   12.532   91.066   6.5818   93.937   8.9921   87.754   9.6598  346.983   16.931  334.059   18.970 12.92380 25.42684 
1 1 1   24   23    3 o  186.939   19.349   27.696   5.4562   32.009   7.0873   21.421   8.5490  199.498   23.672  157.666   36.191 41.83214 43.24489 
1 1 1   24   23    4 o  376.233   9.1554  108.955   5.2723  107.733   6.0999  112.563   10.483  373.737   10.663  379.287   18.058 -5.550568 20.97115 
1 1 1   24   23    5 o  200.300   13.765   31.248   4.1946   29.599   4.7099   37.571   9.2234  194.330   15.976  213.877   28.916 -19.54691 33.03581 
1 1 1   24   23    6 o  131.697   20.012   13.925   3.9071   12.274   4.3540   20.753   8.8537  122.256   24.124  154.356   37.780 -32.09938 44.82539 
1 1 1   24   23    7 o  173.884   13.555   23.575   3.5792   21.615   3.8784   34.832   9.2936  165.988   15.443  204.919   30.565 -38.93111 34.24436 
1 1 1   24   23    8 o   40.450   19.213  -3.8435   3.2242  -4.7210   3.4506   2.1938   9.0508   40.463   19.398   90.144   38.107 -49.68048 42.76058 
1 1 1   24   23    9 o  290.839   10.045   65.205   4.4718   65.205   4.4718   0.0000   0.0000  290.839   10.045  ?   ?  0.000000 10.04524 
1 1 1   24   23   10 f  190.798   12.995   28.328   3.7724   28.328   3.7724   0.0000   0.0000  190.798   12.995  ?   ?  0.000000 12.99471 
1 1 1   24   23   11 o  120.226   18.281   11.571   3.2581   10.969   3.4552   16.404   9.7871  116.477   20.107  136.293   42.402 -19.81612 46.92797 
1 1 1   24   23   12 o  163.529   13.788   20.898   3.4189   20.656   3.6395   22.720   9.9736  162.315   14.812  159.735   40.682 2.579742 43.29439 
1 1 1   24   23   13 o  208.954   11.316   33.838   3.6057   33.824   3.8492   33.938   10.302  208.725   12.100  199.253   35.058 9.471695 37.08720 
1 1 1   24   23   14 o   67.889   23.989   3.2973   3.1098   4.5655   3.2891  -7.3890   9.5479   76.199   24.690   73.081   34.198 3.118217 42.17947 
1 1 1   24   23   15 o  145.124   15.144   16.579   3.3143   18.611   3.5275   1.2753   9.6794  153.838   15.179   89.800   38.720 64.03797 41.58904 
1 1 1   24   23   16 o  118.486   18.798   11.298   3.2953   13.016   3.5179  -0.9995   9.4127  127.419   18.585   83.722   37.080 43.69674 41.47671 
1 1 1   24   23   17 o  233.358   10.625   42.068   3.7951   42.145   4.0619   41.533   10.647  233.416   11.369  221.822   32.306 11.59483 34.24860 
1 1 1   24   23   18 o  118.567   21.577   11.493   3.7716   13.580   4.0372  -2.8216   10.572  129.282   21.132   84.669   38.257 44.61295 43.70558 
1 1 1   24   23   19 o   90.580   31.206   6.4548   5.2437   10.130   6.0686  -4.3745   10.417  108.898   33.309   81.223   37.193 27.67518 49.92766 
1 1 1   24   23   20 o   92.392   30.912   6.8950   5.1410   3.6842   5.8958   17.082   10.502   81.060   32.064  136.694   44.100 -55.63391 54.52439 
1 1 1   24   23   21 o  120.577   16.082   11.577   2.8941   11.380   3.0093   14.004   10.562  119.275   16.961  126.018   44.238 -6.742905 47.37837 
1 1 1   24   23   22 o   43.736   19.532  -0.9465   2.6672  -0.6067   2.7593  -5.7862   10.414   45.860   20.205   78.510   36.392 -32.65018 41.62467 
1 1 1   24   23   23 o  123.627   17.506   12.261   3.2200   12.261   3.2200   0.0000   0.0000  123.627   17.506  ?   ?  0.000000 17.50562 
1 1 1   24   23   24 o  151.610   14.604   18.126   3.3470   18.302   3.4802   15.962   12.217  152.181   15.142  131.651   47.437 20.53012 49.79528 
1 1 1   24   23   25 o  107.727   33.099   10.103   5.9848   12.877   6.9372   2.0310   11.834  120.137   35.356   96.504   42.198 23.63364 55.05159 
1 1 1   24   23   26 o   83.951   32.697   4.5609   6.0496   0.9794   7.1590   13.506   11.314   77.189   33.291  122.787   45.425 -45.59756 56.31782 
1 1 1   24   23   27 o  334.169   9.5376   86.365   4.8784   90.280   5.2981   64.554   12.505  341.427   10.138  275.102   30.195 66.32544 31.85122 
1 1 1   24   23   28 o  207.203   12.897   33.647   4.0699   35.666   4.4157   22.249   10.491  213.071   13.611  150.995   43.207 62.07552 45.29961 
1 1 1   24   23   29 o  281.808   10.866   61.707   4.6869   75.490   5.4072   20.066   9.3986  311.487   11.341  144.239   40.764 167.2474 42.31205 
1 1 1   24   23   30 o   98.291   25.102   8.3224   3.7900   7.8587   4.1583   10.597   9.2108   95.114   27.196  109.351   40.881 -14.23721 49.10048 
1 1 1   24   23   31 o  100.841   27.297   8.9135   4.3164   8.9947   4.8433   8.6003   9.5166  100.741   29.512  103.118   40.754 -2.376831 50.31699 
1 1 1   24   23   32 o  178.009   18.038   25.656   4.8468   0.0000   0.0000   25.656   4.8468  ?   ?   178.009   18.038 0.000000 18.03777 
1 1 1   24   23   33 o   58.818   23.541   1.7817   3.2141   1.4559   4.5192   2.1152   4.5719   64.557   27.089   67.250   27.645 -2.693436 38.70514 
1 1 1   24   23   34 o   76.346   23.934   4.9515   3.1115   6.2909   4.3566   3.5570   4.4455   85.218   28.456   72.222   28.056 12.99632 39.96149 
1 1 1   24   23   35 o   55.004   22.803   1.1369   3.1462  -2.0554   4.3200   4.7427   4.5912   52.054   23.878   77.505   28.885 -25.45100 37.47662 
1 1 1   24   23   36 o  229.216   11.454   41.275   4.0184   32.187   5.0288   57.331   6.6837  198.990   16.664  266.055   16.494 -67.06551 23.44643 
1 1 1   24   23   37 o   39.750   18.948  -3.5406   3.1931  -4.7439   4.5533  -2.3762   4.4790   47.212   22.538   51.832   23.970 -4.620247 32.90171 
1 1 1   24   23   38 o   54.391   22.759   1.0915   3.1756   4.3510   4.5180  -2.0912   4.4644   74.310   28.438   52.226   24.074 22.08351 37.25936 
1 1 1   24   24    0 o  231.008   23.606   42.879   8.1469   42.879   8.1469   42.879   8.1469  231.008   23.606  231.008   23.606 0.000000 0.000000 
1 1 1   24   24    1 o   60.513   27.079  -1.7430   5.1547  -4.4940   7.2125   1.1294   7.3697   66.536   30.644   80.317   34.189 -13.78047 45.91198 
1 1 1   24   24    2 o  169.848   21.691   23.148   5.5103   22.249   7.1730   24.442   8.6071  163.285   29.798  169.199   34.406 -5.914764 45.51604 
1 1 1   24   24    3 o  196.043   18.551   30.386   5.5004   36.376   7.0907   21.336   8.7159  213.316   22.034  156.709   36.940 56.60745 43.01262 
1 1 1   24   24    4 o  205.858   17.403   33.359   5.4323   36.159   6.9875   29.082   8.6368  212.769   21.762  186.405   31.386 26.36398 38.19238 
1 1 1   24   24    5 o  124.342   21.116   12.519   3.8750   10.690   4.4061   18.767   8.1416  113.351   25.955  146.995   36.382 -33.64371 44.69080 
1 1 1   24   24    6 o  145.116   18.559   16.768   4.0278   18.958   4.5161   8.2540   8.9057  154.111   19.588  106.843   40.148 47.26856 44.67127 
1 1 1   24   24    7 o  158.915   14.803   19.801   3.5593   18.630   3.8404   26.936   9.4777  153.626   16.596  176.659   36.266 -23.03326 39.88246 
1 1 1   24   24    8 o  189.352   14.043   27.990   4.0409   27.990   4.0409   0.0000   0.0000  189.352   14.043  ?   ?  0.000000 14.04270 
1 1 1   24   24    9 o  186.194   12.886   26.989   3.6497   29.366   3.9557   13.383   9.4637  194.127   13.395  125.003   41.940 69.12379 44.02669 
1 1 1   24   24   10 o  186.172   12.778   26.979   3.6192   25.441   3.8789   37.326   10.059  180.412   14.161  210.793   32.198 -30.38118 35.17450 
1 1 1   24   24   11 o  279.935   9.5686   60.400   4.0999   60.122   4.4148   62.145   11.054  279.125   10.333  276.483   26.444 2.642517 28.39122 
1 1 1   24   24   12 o  183.463   13.049   26.232   3.6404   26.522   3.8740   24.037   10.644  184.276   13.836  163.080   42.288 21.19633 44.49405 
1 1 1   24   24   13 o  328.971   8.8406   83.344   4.4515   85.158   4.8362   73.288   11.389  332.368   9.5064  301.144   24.933 31.22415 26.68403 
1 1 1   24   24   14 o  347.455   8.7469   92.973   4.6518   95.413   5.0498   79.302   11.955  351.820   9.3775  313.012   25.165 38.80759 26.85506 
1 1 1   24   24   15 o   53.276   22.678   0.2282   3.2425   2.2884   3.4162 -18.5032   10.301   63.772   24.645   62.860   30.886 0.9116936 39.51299 
1 1 1   24   24   16 o  161.026   14.925   20.385   3.6368   21.293   3.8625   13.289   10.797  164.424   15.531  124.706   44.631 39.71813 47.25607 
1 1 1   24   24   17 o  170.430   16.118   22.922   4.1548   25.001   4.4871   10.428   11.001  177.867   16.676  116.210   44.398 61.65694 47.42663 
1 1 1   24   24   18 o  193.106   13.163   29.109   3.8674   31.965   4.1190   7.8446   11.238  202.336   13.375  109.503   43.952 92.83302 45.94245 
1 1 1   24   24   19 o  203.564   18.097   32.898   5.5799   35.650   6.4746   24.950   11.001  211.018   20.296  163.991   43.219 47.02692 47.74780 
1 1 1   24   24   20 o  119.441   30.060   12.273   5.4913   13.107   6.3145   9.6845   11.123  122.542   32.951  113.619   44.312 8.922462 55.22066 
1 1 1   24   24   21 o  207.527   18.616   34.306   5.8503   41.519   6.9200   16.235   10.954  227.756   20.055  132.905   45.118 94.85106 49.37436 
1 1 1   24   24   22 o  124.666   33.560   13.699   6.5456   13.699   6.5456   0.0000   0.0000  124.666   33.560  ?   ?  0.000000 33.55959 
1 1 1   24   24   23 o  229.021   20.691   42.223   7.1747   42.223   7.1747   0.0000   0.0000  229.021   20.691  ?   ?  0.000000 20.69062 
1 1 1   24   24   24 o   54.634   22.608   0.8951   3.0844   1.5250   3.2083  -6.7867   11.204   58.391   23.467   79.393   37.117 -21.00175 43.91380 
1 1 1   24   24   25 o  123.815   17.844   12.374   3.2841   11.753   3.4252   19.454   11.561  120.104   19.285  140.978   46.322 -20.87357 50.17614 
1 1 1   24   24   26 o  250.430   10.810   48.664   4.1436   53.859   4.5048   20.113   10.561  263.333   11.176  143.587   43.944 119.7467 45.34277 
1 1 1   24   24   27 o  136.855   17.417   15.086   3.5657   16.667   3.8731   6.2945   9.1329  143.707   18.003   97.338   39.427 46.36852 43.34261 
1 1 1   24   24   28 o  142.208   17.250   16.291   3.6779   18.474   4.0189   5.0390   9.1237  151.368   17.679   93.401   38.785 57.96750 42.62425 
1 1 1   24   24   29 o  110.578   22.761   10.334   3.7240   12.651   4.1433   0.5927   8.4954  122.562   22.929   80.279   35.407 42.28302 42.18297 
1 1 1   24   24   30 o  298.245   12.215   69.550   5.5761   78.841   6.7178   48.968   9.9987  316.575   13.864  238.764   27.885 77.81148 31.14096 
1 1 1   24   24   31 o  139.270   20.479   16.056   4.2352   18.212   4.7412   7.5434   9.4212  147.891   21.581   99.276   40.103 48.61533 45.54079 
1 1 1   24   24   32 o   75.238   27.618   4.3415   4.1689   5.6204   4.7516   0.0656   8.6883   82.774   29.609   78.646   35.177 4.128403 45.97980 
1 1 1   24   24   33 o  120.686   18.896   12.072   3.3760   12.177   4.8090   11.971   4.7405  116.704   27.391  115.793   27.208 0.9109192 38.60765 
1 1 1   24   24   34 o   59.258   26.019   0.0339   4.5404   0.0000   0.0000   0.0339   4.5404  ?   ?    59.258   26.019 0.000000 26.01857 
1 1 1   24   24   35 o  195.031   13.349   30.289   3.9611   24.573   5.0298   39.623   6.4276  171.852   19.465  218.655   19.407 -46.80382 27.48645 
1 1 1   24   24   36 o  170.678   13.248   23.263   3.4339   23.444   4.9560   23.096   4.7622  167.252   19.740  166.493   19.029 0.7588654 27.41821 
1 1 1   24   24   37 o  108.090   20.154   10.002   3.2117   11.501   4.6371   8.6196   4.4526  111.508   27.372   95.942   28.351 15.56615 39.40784 
1 1 1   24   25    0 o   90.976   45.551   10.052   7.7577   10.052   7.7577   10.052   7.7577   90.976   45.551   90.976   45.551 0.000000 0.000000 
1 1 1   24   25    1 o  202.400   19.600   32.533   5.9960   33.948   8.2799   30.974   8.6945  203.484   27.270  192.664   30.499 10.82056 40.91262 
1 1 1   24   25    2 o  149.775   25.165   18.404   5.5644   28.385   7.7079   7.5415   8.0411  185.456   28.028  102.227   38.201 83.22874 47.38000 
1 1 1   24   25    3 o  160.847   23.136   20.967   5.5320   24.978   7.3828   15.830   8.3538  173.389   28.830  134.286   38.593 39.10362 48.17283 
1 1 1   24   25    4 o   94.746   31.067   7.2387   5.2011   6.0771   6.5457   9.2281   8.5661   92.889   34.514  109.141   39.661 -16.25191 52.57597 
1 1 1   24   25    5 o  251.495   11.860   48.929   4.5655   45.219   5.1679   62.116   9.7438  240.856   14.079  278.426   23.072 -37.56984 27.02840 
1 1 1   24   25    6 o   97.947   27.661   8.0041   4.3292   8.0041   4.3292   0.0000   0.0000   97.947   27.661  ?   ?  0.000000 27.66085 
1 1 1   24   25    7 o  181.393   14.616   25.757   4.0237   25.757   4.0237   0.0000   0.0000  181.393   14.616  ?   ?  0.000000 14.61626 
1 1 1   24   25    8 o  103.548   22.083   8.8173   3.3931   8.5183   3.6329   10.861   9.4978  101.345   23.822  116.021   41.823 -14.67519 48.13152 
1 1 1   24   25    9 o   88.214   24.326   6.4353   3.3909   8.5861   3.6244  -8.6643   9.6032  101.749   23.711   71.358   33.673 30.39100 41.18355 
1 1 1   24   25   10 o  238.211   10.717   43.831   3.9074   43.844   4.2242   43.754   10.285  238.059   11.593  229.377   30.015 8.682907 32.17563 
1 1 1   24   25   11 o  259.923   10.335   52.159   4.1115   53.157   4.4717   46.700   10.457  262.213   11.142  237.311   29.419 24.90236 31.45790 
1 1 1   24   25   12 o   89.498   24.530   6.6482   3.4602   8.7844   3.7022  -8.1147   9.7322  102.771   23.974   72.577   34.141 30.19414 41.71811 
1 1 1   24   25   13 o  173.739   14.006   23.630   3.6930   25.357   3.9769   12.819   9.9525  179.848   14.572  122.456   42.946 57.39175 45.35101 
1 1 1   24   25   14 o  147.016   16.895   17.153   3.7328   18.475   3.9932   8.0036   10.509  152.471   17.423  108.581   42.853 43.88988 46.25941 
1 1 1   24   25   15 f   89.294   25.196   6.6317   3.5936   7.8838   3.7943  -4.2691   11.196   97.017   25.292   84.463   38.633 12.55393 46.17564 
1 1 1   24   25   16 o  258.334   12.472   51.789   4.9315   53.802   5.4060   41.806   12.037  262.672   13.491  218.437   37.344 44.23488 39.70618 
1 1 1   24   25   17 o   60.197   24.275   1.5342   3.4458   2.7173   3.6336  -9.0314   10.858   66.882   25.525   75.799   35.780 -8.916939 43.95171 
1 1 1   24   25   18 o  195.729   13.070   29.915   3.8930   27.870   4.1357   45.816   11.532  188.472   14.446  231.100   33.585 -42.62849 36.56042 
1 1 1   24   25   19 o   63.920   28.090  -0.6094   5.3023   0.6581   6.0590  -4.7547   10.957   71.683   30.768   82.207   37.828 -10.52359 48.76081 
1 1 1   24   25   20 o  182.321   21.158   26.881   5.7948   32.015   6.6998   11.633   11.546  198.521   22.443  118.946   45.475 79.57527 50.71140 
1 1 1   24   25   21 o   71.818   31.139   0.3071   6.3305   0.3071   6.3305   0.0000   0.0000   71.818   31.139  ?   ?  0.000000 31.13914 
1 1 1   24   25   22 o  281.517   18.047   62.998   7.7355   62.998   7.7355   0.0000   0.0000  281.517   18.047  ?   ?  0.000000 18.04713 
1 1 1   24   25   23 o   56.455   22.497   1.5145   2.9221   1.7580   3.0341  -1.6037   10.858   58.403   23.033   86.144   38.862 -27.74094 45.17477 
1 1 1   24   25   24 o   68.033   23.602   3.5077   3.0020   2.8647   3.1452   10.089   10.062   64.827   23.957  110.678   42.419 -45.85109 48.71694 
1 1 1   24   25   25 f  114.104   19.539   10.679   3.2897   11.932   3.5062   1.4654   9.5093  120.707   19.654   86.746   37.881 33.96073 42.67617 
1 1 1   24   25   26 o   47.940   21.653  -1.4040   3.3831  -3.1125   3.6393   9.4681   9.1802   45.191   21.136  106.460   40.586 -61.26878 45.75937 
1 1 1   24   25   27 o  124.911   19.388   12.794   3.5866   10.757   3.9337   22.833   8.7329  112.614   23.577  156.323   37.061 -43.70889 43.92528 
1 1 1   24   25   28 o  167.390   15.613   22.351   3.9540   24.568   4.4041   13.139   8.9781  175.090   16.633  117.522   40.813 57.56743 44.07259 
1 1 1   24   25   29 o   68.889   25.985   3.2737   3.7380   1.4743   4.1627   10.767   8.4944   63.039   26.189  108.551   39.487 -45.51124 47.38282 
1 1 1   24   25   30 o   74.936   25.725   4.5452   3.5618   1.2591   3.9265   19.811   8.4631   60.710   25.346  142.873   38.028 -82.16376 45.70113 
1 1 1   24   25   31 o   77.122   26.189   4.9337   3.6907   6.1140   4.1359   0.3199   8.1774   84.268   27.707   77.102   34.333 7.165779 44.11840 
1 1 1   24   25   32 o  108.378   24.432   10.271   3.9561   12.595   4.4610   1.7101   8.5613  119.928   25.107   80.800   35.595 39.12822 43.55904 
1 1 1   24   25   33 o   60.630   24.898   1.7191   3.7037  -2.6349   4.6839   8.9829   6.0499   52.874   24.473   97.868   33.529 -44.99349 41.51056 
1 1 1   24   25   34 o   99.135   25.078   8.7885   3.8081   9.2467   5.1349   8.2285   5.6768   99.128   30.692   93.920   32.463 5.208221 44.67496 
1 1 1   24   25   35 o  163.646   14.020   21.507   3.4779   24.371   5.1138   19.042   4.7439  170.330   19.995  149.448   21.345 20.88196 29.24742 
1 1 1   24   25   36 o   75.212   24.075   4.9504   3.1344   7.6902   4.4225   2.1849   4.4431   90.856   28.542   65.228   27.074 25.62861 39.34037 
1 1 1   24   26    0 o  251.957   22.900   50.757   8.6637   50.757   8.6637   50.757   8.6637  251.957   22.900  251.957   22.900 0.000000 0.000000 
1 1 1   24   26    1 o   83.030   31.448   4.4966   5.4894   9.9292   7.7903  -0.8612   7.7363  110.115   38.030   76.650   33.798 33.46449 50.87874 
1 1 1   24   26    2 o  206.104   18.688   33.667   5.8313   29.232   7.8697   39.068   8.6838  187.855   28.243  218.554   26.500 -30.69955 38.72939 
1 1 1   24   26    3 o  296.906   14.066   68.538   6.3924   79.678   8.6529   55.152   9.4847  318.158   17.840  261.540   23.959 56.61823 29.87163 
1 1 1   24   26    4 o  312.347   18.592   76.996   8.8485   76.996   8.8485   0.0000   0.0000  312.347   18.592  ?   ?  0.000000 18.59224 
1 1 1   24   26    5 o  371.232   16.007  107.669   9.0955  107.669   9.0955   0.0000   0.0000  371.232   16.007  ?   ?  0.000000 16.00713 
1 1 1   24   26    6 o  407.257   9.2008  127.814   5.7354  126.611   6.5701  131.668   11.758  404.878   10.602  408.912   18.785 -4.033478 21.57049 
1 1 1   24   26    7 o   98.863   24.059   8.1319   3.6061   7.9826   3.9556   8.8667   8.7753   97.694   25.996  107.789   39.980 -10.09448 47.68861 
1 1 1   24   26    8 f  288.595   9.8292   64.255   4.3419   66.770   4.7931   52.752   10.250  293.984   10.652  253.898   26.780 40.08626 28.82036 
1 1 1   24   26    9 o   49.172   22.113  -1.4387   3.4833  -1.4886   3.7751  -1.1529   9.0356   51.311   23.052   81.624   36.231 -30.31250 42.94323 
1 1 1   24   26   10 o  256.520   10.650   50.848   4.1815   51.117   4.5902   49.533   10.138  256.952   11.671  245.400   27.460 11.55200 29.83750 
1 1 1   24   26   11 o  151.608   16.493   18.200   3.7656   15.685   4.0676   33.279   9.9592  139.648   19.567  196.687   34.330 -57.03880 39.51440 
1 1 1   24   26   12 o  405.304   8.5442  126.527   5.3005  129.507   5.9571  115.198   11.614  409.742   9.4986  380.866   19.992 28.87613 22.13395 
1 1 1   24   26   13 o  221.909   11.821   38.262   4.0006   40.729   4.3668   25.374   9.9795  228.767   12.518  167.955   39.484 60.81194 41.42134 
1 1 1   24   26   14 f  205.027   14.792   32.971   4.6110   32.653   5.1277   34.315   10.540  203.390   16.616  198.217   36.069 5.173080 39.71276 
1 1 1   24   26   15 o  304.626   11.444   71.881   5.3359   72.871   5.8738   67.208   12.764  306.352   12.526  283.687   29.843 22.66504 32.36502 
1 1 1   24   26   16 o  221.279   12.524   38.147   4.2244   38.138   4.5157   38.211   11.956  220.966   13.415  206.664   39.231 14.30202 41.46085 
1 1 1   24   26   17 o  260.723   10.870   52.624   4.3378   52.602   4.6365   52.780   12.283  260.453   11.630  248.145   33.170 12.30766 35.14952 
1 1 1   24   26   18 o  379.654   9.1020  111.230   5.2892  113.418   5.7366   98.822   13.662  383.124   9.7824  347.036   25.907 36.08804 27.69252 
1 1 1   24   26   19 o  180.036   21.817   26.347   5.8893   26.933   6.7813   24.545   11.879  180.331   25.261  159.144   46.105 21.18674 52.57158 
1 1 1   24   26   20 o  131.106   33.649   15.271   6.7864   15.271   6.7864   0.0000   0.0000  131.106   33.649  ?   ?  0.000000 33.64865 
1 1 1   24   26   21 o  175.145   28.020   25.987   7.2584   25.987   7.2584   0.0000   0.0000  175.145   28.020  ?   ?  0.000000 28.01962 
1 1 1   24   26   22 o  107.557   35.226   10.168   6.6874   18.616   9.7792   2.7472   9.1654  139.571   42.195   88.916   37.994 50.65459 56.78041 
1 1 1   24   26   23 o   77.427   32.512   2.2105   6.5171   2.1797   9.4774   2.2381   8.9760   88.301   38.193   86.746   37.346 1.554222 53.41734 
1 1 1   24   26   24 o  147.650   16.260   17.430   3.6138   21.538   3.9505  -3.6291   8.9455  164.440   15.894   74.311   34.189 90.12878 37.70255 
1 1 1   24   26   25 o   58.920   23.305   1.8306   3.1145   3.7196   3.3346 -11.0774   8.7170   70.099   24.833   62.059   30.021 8.039303 38.96099 
1 1 1   24   26   26 o  137.745   16.844   15.284   3.4773   16.584   3.7822   8.1834   8.8407  143.229   17.624  101.232   39.499 41.99770 43.25204 
1 1 1   24   26   27 o  110.262   21.656   10.214   3.5246   10.735   3.8649   7.6394   8.5897  112.428   23.228   98.713   38.812 13.71490 45.23125 
1 1 1   24   26   28 o   60.870   24.603   1.7860   3.5483   6.4731   3.9559 -17.5056   8.0256   86.671   26.957   51.532   25.660 35.13849 37.21697 
1 1 1   24   26   29 o   77.769   25.283   5.0809   3.4475   6.1870   3.8177   0.1923   8.0259   84.669   26.506   76.554   34.056 8.114571 43.15506 
1 1 1   24   26   30 o   62.201   25.022   2.0537   3.6512   2.1234   4.0469   1.7487   8.4653   64.460   26.197   80.974   35.541 -16.51383 44.15217 
1 1 1   24   26   31 o  122.818   20.879   12.735   3.7846   13.847   4.3311   9.1424   7.7828  126.896   23.152   99.595   37.510 27.30186 44.07981 
1 1 1   24   26   32 o   82.333   26.524   5.9594   3.7998   5.7671   4.3476   6.5815   7.8196   81.718   28.400   90.605   36.558 -8.887428 46.29332 
1 1 1   24   26   33 o  261.591   13.705   54.553   5.4684   54.553   5.4684   0.0000   0.0000  261.591   13.705  ?   ?  0.000000 13.70497 
1 1 1   24   26   34 o   89.753   29.123   7.4475   4.5750   5.4226   5.0994   15.802   10.358   80.490   30.353  117.386   43.457 -36.89558 53.00741 
1 1 1   24   27    0 o  259.172   21.747   53.477   8.4871   53.477   8.4871   53.477   8.4871  259.172   21.747  259.172   21.747 0.000000 0.000000 
1 1 1   24   27    1 o  153.226   23.966   19.216   5.4366   21.223   7.5809   17.091   7.8009  157.284   32.562  139.349   36.235 17.93480 48.71591 
1 1 1   24   27    2 o  313.637   19.201   77.890   9.1735   77.890   9.1735   0.0000   0.0000  313.637   19.201  ?   ?  0.000000 19.20137 
1 1 1   24   27    3 o  154.191   33.017   20.480   7.5572   20.480   7.5572   0.0000   0.0000  154.191   33.017  ?   ?  0.000000 33.01665 
1 1 1   24   27    4 o  369.640   12.883  106.047   7.2888   97.128   9.4357  119.245   11.478  351.671   17.529  388.610   19.296 -36.93945 26.06957 
1 1 1   24   27    5 o  355.694   12.605   98.146   6.8624  102.680   8.8386   91.264   10.889  362.362   15.936  338.320   21.134 24.04227 26.46831 
1 1 1   24   27    6 o   55.284   25.445  -3.1913   4.9621  -3.2056   5.9731  -3.1595   8.9141   61.669   28.211   76.982   34.924 -15.31291 44.89499 
1 1 1   24   27    7 o  225.132   12.262   39.409   4.2094   42.156   4.6366   26.531   10.040  232.619   13.075  172.408   38.963 60.21057 41.09847 
1 1 1   24   27    8 o  137.318   18.876   15.132   3.8625   16.547   4.2823   8.9579   8.9453  143.281   20.078  107.965   40.302 35.31630 45.02613 
1 1 1   24   27    9 o  504.323   8.0881  195.786   6.2435  203.402   7.1518  171.385   12.801  513.645   9.0967  466.594   17.924 47.05099 20.10019 
1 1 1   24   27   10 o  274.348   10.612   58.188   4.4562   61.178   4.9775   46.117   10.001  281.041   11.571  235.813   28.272 45.22816 30.54865 
1 1 1   24   27   11 o  262.121   11.100   53.175   4.4534   56.540   4.9198   37.910   10.479  270.063   11.902  210.094   33.726 59.96867 35.76446 
1 1 1   24   27   12 o   70.278   25.898   3.3581   3.6709   2.7251   3.9746   7.0323   9.5758   68.582   26.560  103.078   40.835 -34.49572 48.71290 
1 1 1   24   27   13 o   82.164   28.008   5.2855   4.2212   3.8818   4.6186   12.404   10.401   76.597   28.886  120.467   43.715 -43.86979 52.39645 
1 1 1   24   27   14 o  192.231   13.994   28.962   4.0892   29.179   4.4149   27.651   10.848  192.586   15.098  173.302   41.453 19.28458 44.11687 
1 1 1   24   27   15 o   95.729   25.048   7.7189   3.7125   8.0613   3.9329   4.9194   11.247   97.661   25.890  101.472   42.665 -3.811058 49.90623 
1 1 1   24   27   16 o  143.274   20.195   16.640   4.3060   17.943   4.6767   9.3852   11.035  148.474   21.179  111.778   43.977 36.69595 48.81102 
1 1 1   24   27   17 o  222.746   13.445   38.825   4.5623   39.080   4.9515   37.392   11.740  223.049   14.584  203.148   39.176 19.90085 41.80281 
1 1 1   24   27   18 o  317.776   10.766   78.255   5.2363   83.289   5.8747   58.794   11.551  327.461   11.721  264.189   29.043 63.27173 31.31927 
1 1 1   24   27   19 o  253.861   25.837   53.439   9.8993   53.439   9.8993   0.0000   0.0000  253.861   25.837  ?   ?  0.000000 25.83651 
1 1 1   24   27   20 o  142.805   41.171   19.369   9.4938   19.369   9.4938   0.0000   0.0000  142.805   41.171  ?   ?  0.000000 41.17138 
1 1 1   24   27   21 o   51.974   24.692  -5.6478   5.3315  -3.7049   6.9176  -8.4902   8.3672   64.901   29.934   64.192   30.619 0.7093430 42.82014 
1 1 1   24   27   22 o  100.242   32.094   8.7786   5.5699   12.000   7.3675   4.4818   8.5094  114.610   36.934   90.569   37.520 24.04073 52.64864 
1 1 1   24   27   23 o   78.896   31.310   3.8184   5.6387   3.1647   7.5128   4.6616   8.5330   83.472   34.972   90.815   37.593 -7.343430 51.34461 
1 1 1   24   27   24 o  125.517   29.789   13.964   5.6372   20.859   7.6649   5.8408   8.3198  151.374   33.922   93.266   37.682 58.10797 50.70147 
1 1 1   24   27   25 o  140.041   16.278   15.755   3.4241   18.273   3.7508   3.1632   8.3880  150.838   16.516   85.841   36.506 64.99664 40.06789 
1 1 1   24   27   26 o  219.559   11.528   37.717   3.8606   38.687   4.3312   33.966   8.5155  221.807   12.812  197.367   29.058 24.44075 31.75684 
1 1 1   24   27   27 o   84.126   24.719   6.0898   3.3933   6.6868   3.7517   3.4061   7.9549   87.757   26.046   84.256   35.678 3.501572 44.17400 
1 1 1   24   27   28 o  152.665   16.615   18.850   3.8198   25.025   4.3190  -3.3261   8.1849  176.345   16.182   69.931   32.361 106.4141 36.18163 
1 1 1   24   27   29 o   63.769   24.793   2.5993   3.4737   3.4089   3.9013  -0.4990   7.6319   69.424   26.460   72.728   32.716 -3.304825 42.07675 
1 1 1   24   27   30 o  178.676   15.299   25.681   4.1437   36.225   4.7977  -5.2761   8.2209  212.699   14.830   66.010   31.151 146.6894 34.50090 
1 1 1   24   27   31 o   56.202   23.935   0.7800   3.6150   3.6925   4.1570  -8.2540   7.3214   71.073   27.260   57.272   27.659 13.80117 38.83425 
1 1 1   24   27   32 o   66.984   25.795   3.1851   3.7325   6.4393   4.2791  -7.1660   7.6317   84.696   28.199   59.963   28.773 24.73352 40.28775 
1 1 1   24   27   33 o   35.047   17.593 -11.0647   4.1325 -11.0647   4.1325   0.0000   0.0000   35.047   17.593  ?   ?  0.000000 17.59269 
1 1 1   24   28    2 o  474.870   11.310  174.554   8.2208  180.985   11.451  167.714   11.809  481.123   15.550  462.409   16.684 18.71390 22.80725 
1 1 1   24   28    3 o  215.585   18.350   36.882   5.9976   34.446   7.8897   40.216   9.2312  204.850   25.730  220.228   28.020 -15.37813 38.04151 
1 1 1   24   28    4 o  223.597   18.149   39.631   6.1579   39.020   7.7002   40.715   10.256  219.461   23.279  219.480   31.427 -0.1881409E-01 39.10979 
1 1 1   24   28    5 o  125.600   29.567   13.487   5.5899   21.308   6.9214  -1.1821   9.4794  158.650   29.591   83.052   36.975 75.59731 47.35807 
1 1 1   24   28    6 o   86.005   30.846   5.5422   5.1599   4.8009   6.2772   7.0869   9.0607   86.468   33.409  102.072   39.943 -15.60471 52.07288 
1 1 1   24   28    7 o  191.392   15.115   28.792   4.3920   25.243   4.9261   42.550   9.6977  178.010   18.342  225.965   28.685 -47.95532 34.04803 
1 1 1   24   28    8 o  187.638   16.032   27.779   4.5603   25.865   5.1377   34.889   9.9006  179.947   18.937  201.458   33.269 -21.51086 38.28115 
1 1 1   24   28    9 o  339.589   10.565   89.194   5.4917   89.359   6.2804   88.657   11.320  339.351   12.091  331.871   22.415 7.480469 25.46832 
1 1 1   24   28   10 o   67.500   26.969   2.2310   4.2100   4.0296   4.6892  -5.2451   9.5601   77.472   29.128   75.658   34.999 1.814011 45.53405 
1 1 1   24   28   11 o  154.625   23.905   19.693   5.4752   26.870   6.4859   1.8964   10.214  181.015   24.001   91.727   39.662 89.28820 46.35860 
1 1 1   24   28   12 o  235.188   16.409   43.667   5.8699   47.463   6.8167   32.781   11.545  244.316   18.363  189.027   41.077 55.28894 44.99461 
1 1 1   24   28   13 o   65.024   25.812   2.1497   3.8331   1.4317   4.1424   6.4262   10.110   63.737   26.271  101.924   41.412 -38.18698 49.04174 
1 1 1   24   28   14 o   70.589   26.244   3.3783   3.7857   5.0658   4.1192  -5.7938   9.6034   80.447   27.662   74.558   34.692 5.889130 44.36986 
1 1 1   24   28   15 o   88.355   26.446   6.5521   3.8556   6.5894   4.1885   6.3453   9.8686   88.815   27.756  100.633   40.904 -11.81837 49.43254 
1 1 1   24   28   16 o  236.169   12.127   43.492   4.3689   48.753   4.9423   24.687   9.3442  249.750   12.973  164.384   37.912 85.36603 40.07003 
1 1 1   24   28   17 o  215.971   12.950   36.505   4.2611   37.957   4.7276   30.221   9.8382  219.778   14.128  183.199   36.368 36.57932 39.01588 
1 1 1   24   28   18 o  139.870   21.398   16.081   4.4354   16.081   4.4354   0.0000   0.0000  139.870   21.398  ?   ?  0.000000 21.39776 
1 1 1   24   28   19 o  213.279   12.902   35.648   4.1921   43.357   4.8390   12.461   8.3923  235.026   13.508  116.661   39.493 118.3645 41.73901 
1 1 1   24   28   20 o  135.987   26.825   15.863   5.3852   18.932   7.0875   11.670   8.2832  145.431   32.641  113.286   39.210 32.14465 51.01830 
1 1 1   24   28   21 f  112.653   30.262   11.266   5.3290   14.048   7.0565   7.5726   8.1297  123.386   35.473   98.506   38.032 24.87953 52.00721 
1 1 1   24   28   22 o  215.503   18.201   37.371   5.9475   53.095   8.1084   19.058   8.7503  255.173   20.945  140.974   39.155 114.1996 44.40492 
1 1 1   24   28   23 o   99.422   31.930   8.7472   5.5100   14.730   7.5217   1.8193   8.0944  124.984   36.825   81.568   35.289 43.41608 51.00355 
1 1 1   24   28   24 o   75.807   30.620   3.2754   5.4918   0.2758   7.5804   6.5891   7.9673   75.612   33.392   94.021   37.248 -18.40871 50.02429 
1 1 1   24   28   25 o  153.307   24.826   20.056   5.6264   28.334   8.0671   12.216   7.8511  178.323   30.661  113.162   38.199 65.16148 48.98189 
1 1 1   24   28   26 o  165.408   15.375   21.921   3.8481   24.805   4.4009   12.555   7.9306  175.406   16.589  113.630   38.391 61.77615 41.82186 
1 1 1   24   28   27 o   53.757   22.949   0.5033   3.3379   1.2109   3.6884  -2.6983   7.8459   58.770   24.554   69.344   31.946 -10.57408 40.29184 
1 1 1   24   28   28 o  186.499   13.726   27.685   3.8907   33.607   4.4745   9.3278   7.8775  205.220   14.335  100.240   37.741 104.9798 40.37161 
1 1 1   24   28   29 o  100.402   23.529   8.8365   3.5528   8.3548   4.0814   10.343   7.2183   96.200   26.749  103.122   36.536 -6.921883 45.28112 
1 1 1   24   28   30 o   91.883   25.235   7.5625   3.6576   11.337   4.2951  -2.3971   6.9771  112.605   25.511   65.132   30.048 47.47334 39.41698 
1 1 1   24   28   31 o  129.596   20.020   14.196   3.8433   17.352   4.3868   3.7740   7.9713  143.110   20.622   82.127   35.272 60.98288 40.85809 
1 1 1   24   29    0 o  477.525   17.026  177.597   12.409  177.597   12.409  177.597   12.409  477.525   17.026  477.525   17.026 0.000000 0.000000 
1 1 1   24   29    1 o  133.263   29.712   15.228   5.9060   18.607   7.9114   10.974   8.8764  144.612   35.907  113.961   40.500 30.65072 54.12580 
1 1 1   24   29    2 o  342.330   21.195   93.881   11.051   0.0000   0.0000   93.881   11.051  ?   ?   342.330   21.195 0.000000 21.19539 
1 1 1   24   29    3 o   94.097   38.549   4.6493   8.8522   0.0000   0.0000   4.6493   8.8522  ?   ?    94.097   38.549 0.000000 38.54940 
1 1 1   24   29    4 o  131.734   41.024   15.830   9.1587   0.0000   0.0000   15.830   9.1587  ?   ?   131.734   41.024 0.000000 41.02382 
1 1 1   24   29    5 o  123.696   31.351   13.296   5.9434   6.8987   7.6396   23.105   9.4595   97.490   37.058  159.452   39.066 -61.96203 53.84604 
1 1 1   24   29    6 o  158.247   23.839   20.608   5.5951   16.009   6.8922   29.496   9.5818  134.870   33.530  183.053   35.479 -48.18315 48.81629 
1 1 1   24   29    7 o  200.061   33.482   34.663   9.8904   0.0000   0.0000   34.663   9.8904  ?   ?   200.061   33.482 0.000000 33.48152 
1 1 1   24   29    8 o  357.404   9.5808   98.669   5.2412  105.078   5.9762   77.316   10.908  368.450   10.597  308.766   23.252 59.68356 25.55260 
1 1 1   24   29    9 o  101.508   25.645   8.7278   3.9859   7.7867   4.3748   13.327   9.6708   95.816   28.042  122.072   42.361 -26.25591 50.80135 
1 1 1   24   29   10 o   49.680   23.309  -4.0581   4.4854  -3.8098   5.1094  -4.8921   9.3661   54.517   25.346   75.008   34.678 -20.49145 42.95316 
1 1 1   24   29   11 o  171.961   16.134   23.447   4.1969   27.223   4.5866   4.0150   10.404  185.316   16.337   96.395   40.810 88.92094 43.95855 
1 1 1   24   29   12 o   97.050   25.579   7.9986   3.8533   6.3979   4.2100   16.263   9.5660   87.719   27.883  131.837   42.043 -44.11765 50.44889 
1 1 1   24   29   13 o  176.747   15.391   24.712   4.1222   27.103   4.6174   15.322   9.1495  184.722   16.505  128.307   41.139 56.41466 44.32625 
1 1 1   24   29   14 o  153.801   17.068   18.912   3.9503   17.254   4.4137   25.590   8.8567  145.519   20.375  168.863   35.398 -23.34422 40.84271 
1 1 1   24   29   15 o  104.207   24.497   9.2179   3.8414   8.7301   4.3205   11.059   8.3929  100.669   27.335  111.887   39.423 -11.21853 47.97258 
1 1 1   24   29   16 o  214.483   13.245   36.089   4.3271   36.353   4.9098   35.171   9.1578  214.514   15.048  201.623   30.639 12.89101 34.13479 
1 1 1   24   29   17 o  234.120   13.542   43.050   4.8322   43.050   4.8322   0.0000   0.0000  234.120   13.542  ?   ?  0.000000 13.54227 
1 1 1   24   29   18 o  107.728   23.955   9.8591   3.8477   9.3723   4.2754   11.934   8.8264  104.046   26.710  114.319   40.412 -10.27322 48.44117 
1 1 1   24   29   19 o   82.659   26.684   5.7045   3.8444   9.1291   4.3615  -6.2239   8.1398  102.395   27.321   66.137   31.146 36.25795 41.43087 
1 1 1   24   29   20 o  122.561   29.185   13.262   5.3964   15.540   7.1610   10.268   8.2092  129.496   35.204  107.427   38.858 22.06879 52.43338 
1 1 1   24   29   21 o  178.587   20.668   26.159   5.5452   31.887   7.5127   19.303   8.2191  193.855   25.972  142.777   37.226 51.07747 45.39069 
1 1 1   24   29   22 o  150.187   24.460   19.134   5.4293   37.372   7.4638  -1.3600   7.9121  211.580   23.441   73.375   33.130 138.2049 40.58460 
1 1 1   24   29   23 o   76.533   30.270   3.7866   5.2540   4.6975   7.3660   2.8432   7.4962   86.210   35.224   81.310   34.543 4.899475 49.33492 
1 1 1   24   29   24 f  188.966   20.626   29.514   5.8690   41.139   8.6277   19.501   8.0071  218.658   26.307  142.100   36.593 76.55759 45.06740 
1 1 1   24   29   25 o  102.437   34.544   9.8087   6.4206   10.776   11.540   9.3749   7.7268  108.264   44.145  101.108   37.513 7.156288 57.93111 
1 1 1   24   29   26 o  214.659   18.981   37.831   6.1720   55.375   8.8353   21.110   8.6256  256.329   22.756  144.880   38.311 111.4490 44.55938 
1 1 1   24   29   27 o  148.756   16.667   18.026   3.7297   21.884   4.1906   3.3232   8.1804  163.886   16.951   82.738   35.636 81.14788 39.46186 
1 1 1   24   29   28 o  156.715   15.673   19.894   3.7091   20.578   4.1605   17.242   8.1874  158.392   17.451  128.789   38.535 29.60275 42.30224 
1 1 1   24   29   29 o   62.181   24.305   2.5074   3.3521   1.1331   3.7203   8.4365   7.7273   58.026   24.475   95.487   37.019 -37.46138 44.37859 
1 1 1   24   30    0 o  101.428   47.829   12.734   8.3802   12.734   8.3802   12.734   8.3802  101.428   47.829  101.428   47.829 0.000000 0.000000 
1 1 1   24   30    1 o  252.761   17.072   50.596   6.5660   51.547   8.9493   49.486   9.6631  251.420   23.529  244.520   26.228 6.899750 35.23504 
1 1 1   24   30    2 o  113.076   32.729   11.212   5.9890   9.0577   8.3240   13.524   8.6234  105.785   38.996  122.315   39.998 -16.52957 55.86194 
1 1 1   24   30    3 o  365.524   13.380  104.188   7.4858  108.798   10.337   99.104   10.855  370.591   18.223  351.802   20.244 18.78949 27.23830 
1 1 1   24   30    4 o  107.294   32.692   10.018   5.8537   6.2954   7.7655   14.917   8.9083   95.238   37.058  127.445   40.565 -32.20717 54.94357 
1 1 1   24   30    5 o   69.208   29.600   0.7794   5.5723   4.1496   7.2213  -4.1806   8.7606   86.679   35.076   73.437   33.804 13.24226 48.71412 
1 1 1   24   30    6 o   99.377   29.619   8.4689   4.8439   10.316   5.7316   3.8522   9.0612  108.660   32.181   91.827   38.435 16.83315 50.12838 
1 1 1   24   30    7 o  310.402   16.662   76.182   7.8873   75.886   11.542   76.441   10.803  303.783   25.046  306.388   23.208 -2.604584 34.14591 
1 1 1   24   30    8 o  123.589   33.299   13.590   6.4410   14.861   9.3703   12.452   8.8682  126.598   41.709  117.821   40.583 8.776695 58.19447 
1 1 1   24   30    9 o  118.749   28.857   12.222   5.1936   14.422   6.3461   7.7608   9.0374  127.563   32.431  102.314   39.931 25.24963 51.44205 
1 1 1   24   30   10 o  255.358   14.854   51.333   5.7806   53.246   6.9407   47.001   10.444  258.632   17.638  234.865   29.717 23.76717 34.55703 
1 1 1   24   30   11 f   94.273   31.081   7.5096   5.2031   8.3323   6.1375   5.4079   9.8101   99.072   33.772   97.245   40.286 1.826256 52.56908 
1 1 1   24   30   12 o  109.822   29.331   10.546   5.0237   9.5487   5.9582   12.997   9.3436  104.311   33.172  119.008   41.619 -14.69683 53.22104 
1 1 1   24   30   13 o   82.169   30.599   4.9596   5.1504   3.3439   6.2136   8.5071   9.2072   79.695   32.433  104.032   40.387 -24.33685 51.79782 
1 1 1   24   30   14 o  175.153   20.510   24.999   5.3945   28.250   6.5786   18.324   9.4251  184.434   23.863  137.883   41.366 46.55118 47.75535 
1 1 1   24   30   15 o  125.221   33.306   14.195   6.4947   14.195   6.4947   0.0000   0.0000  125.221   33.306  ?   ?  0.000000 33.30602 
1 1 1   24   30   16 o  163.700   27.087   22.904   6.5498   22.904   6.5498   0.0000   0.0000  163.700   27.087  ?   ?  0.000000 27.08736 
1 1 1   24   30   17 o   71.889   29.314   2.5401   5.0888   2.1130   6.2018   3.4202   8.9030   75.272   31.668   88.495   37.621 -13.22247 49.17501 
1 1 1   24   30   18 o   75.002   29.952   3.2995   5.1902  -0.3875   6.2715   11.313   9.2457   68.479   30.301  111.527   41.101 -43.04781 51.06298 
1 1 1   24   30   19 o  112.618   30.170   11.367   5.3054   22.863   6.7601  -7.0672   8.5605  162.137   28.268   66.382   31.464 95.75475 42.29742 
1 1 1   24   30   20 o  209.379   18.181   35.448   5.7689   44.171   7.5463   23.181   8.9489  231.468   21.547  155.412   37.949 76.05629 43.63917 
1 1 1   24   30   21 o  118.662   29.545   12.687   5.3454   24.613   7.2464  -1.5482   7.9172  166.625   29.492   72.537   32.910 94.08752 44.19085 
1 1 1   24   30   22 o   93.832   31.237   7.8521   5.2507   21.564   7.2440  -7.3260   7.6215  153.462   31.881   60.919   29.103 92.54313 43.16726 
1 1 1   24   30   23 f  129.635   27.943   15.023   5.3812   13.986   7.1396   16.386   8.1882  119.785   36.017  127.677   38.613 -7.892021 52.80340 
1 1 1   24   30   24 o  130.027   34.158   16.255   6.8862   37.966   12.245   6.2135   8.3278  190.768   42.968   91.292   37.394 99.47562 56.96133 
1 1 1   24   30   25 o  118.577   31.965   13.331   5.9335   19.262   7.8816   5.5707   9.0147  139.180   36.534   90.414   38.116 48.76595 52.79746 
1 1 1   24   30   26 o   97.713   32.796   9.0127   5.7869   14.274   7.8009   2.5750   8.6294  117.821   38.008   81.857   35.907 35.96387 52.28703 
1 1 1   24   30   27 o  126.937   30.111   15.085   5.7619   18.162   7.8222   11.435   8.5195  133.358   37.013  105.927   39.372 27.43120 54.03858 
1 1 1   24   31    0 o  248.937   24.879   50.456   9.2623   50.456   9.2623   50.456   9.2623  248.937   24.879  248.937   24.879 0.000000 0.000000 
1 1 1   24   31    1 o  157.079   25.720   20.728   5.9698   17.270   8.3585   24.329   8.5292  136.442   38.401  164.778   34.903 -28.33601 51.89260 
1 1 1   24   31    2 o  240.050   18.134   46.014   6.6138   58.380   9.4623   34.202   9.2480  267.003   23.389  198.671   31.460 68.33199 39.20173 
1 1 1   24   31    3 o  176.938   22.687   25.730   6.0028   19.971   8.0072   33.119   9.0704  148.352   35.696  195.463   31.379 -47.11073 47.52726 
1 1 1   24   31    4 o  121.704   31.605   13.115   5.9399   16.687   8.0794   8.9137   8.7626  134.315   37.737  105.029   39.744 29.28622 54.80620 
1 1 1   24   31    5 o  251.563   17.268   50.356   6.6087   57.232   8.9394   42.070   9.8139  265.013   22.244  221.829   29.645 43.18486 37.06239 
1 1 1   24   31    6 o  115.448   28.009   11.554   4.8990   11.231   5.7270   12.433   9.4587  112.559   31.824  117.178   41.790 -4.619720 52.52824 
1 1 1   24   31    7 o  104.780   30.256   9.6150   5.1235   8.4783   5.9729   12.781   9.9679   99.373   33.319  118.466   42.824 -19.09265 54.25877 
1 1 1   24   31    8 o  185.568   18.962   27.760   5.3103   31.110   6.2038   18.578   10.271  195.418   21.074  138.026   43.518 57.39148 48.35221 
1 1 1   24   31    9 o  234.638   13.049   43.150   4.6680   43.244   5.1645   42.729   10.911  234.265   14.474  220.021   33.453 14.24390 36.44997 
1 1 1   24   31   10 o  326.860   10.432   82.886   5.2190   86.950   5.9036   68.347   11.165  334.273   11.538  286.238   25.761 48.03522 28.22678 
1 1 1   24   31   11 o   84.497   27.844   5.9273   4.1760   7.1327   4.6441   0.8354   9.5450   91.454   29.308   85.167   37.549 6.286545 47.63232 
1 1 1   24   31   12 o   90.634   27.163   7.0436   4.0655   8.0317   4.5065   2.7228   9.4235   96.191   28.546   88.757   38.238 7.434303 47.71792 
1 1 1   24   31   13 o  215.975   15.359   36.982   5.0442   36.982   5.0442   0.0000   0.0000  215.975   15.359  ?   ?  0.000000 15.35879 
1 1 1   24   31   14 o  167.986   19.511   22.964   4.9234   22.964   4.9234   0.0000   0.0000  167.986   19.511  ?   ?  0.000000 19.51149 
1 1 1   24   31   15 o  181.428   15.949   26.263   4.3839   26.183   4.8722   26.607   10.047  180.207   17.901  166.219   39.979 13.98802 43.80324 
1 1 1   24   31   16 o  185.652   17.475   27.746   4.9075   30.066   5.7247   21.317   9.5306  192.036   19.758  147.100   40.866 44.93597 45.39170 
1 1 1   24   31   17 o  154.908   18.530   19.539   4.3065   22.330   4.8702   9.5339   9.2209  165.131   19.655  104.910   40.504 60.22121 45.02101 
1 1 1   24   31   18 o  128.102   22.379   13.844   4.2284   18.500   4.8219  -1.6546   8.7970  148.806   21.818   75.929   34.541 72.87713 40.85520 
1 1 1   24   31   19 o  240.989   12.852   45.767   4.7234   49.249   5.4592   35.397   9.4206  249.119   14.378  197.554   32.269 51.56564 35.32733 
1 1 1   24   31   20 o  129.277   28.078   14.918   5.3969   12.363   6.8138   19.218   8.8408  113.522   35.390  137.857   39.726 -24.33496 53.20340 
1 1 1   24   31   21 o  221.436   17.175   39.694   5.7756   48.832   7.8150   28.696   8.5734  242.299   21.288  175.749   33.085 66.55028 39.34166 
1 1 1   24   31   22 f  124.345   29.795   14.206   5.5966   18.395   7.4640   8.8271   8.4586  137.514   35.286   99.165   38.651 38.34949 52.33572 
1 1 1   24   31   23 o  140.654   32.930   18.806   6.9643   11.341   11.018   23.774   8.9875  107.476   43.384  153.283   38.390 -45.80766 57.93111 
1 1 1   24   31   24 o  138.531   27.637   17.299   5.6548   15.618   7.3101   19.802   8.9231  124.708   36.178  136.982   40.037 -12.27425 53.96136 
1 1 1   24   31   25 o   91.343   32.232   7.6613   5.6122   12.217   7.1290   0.2373   9.1011  110.062   36.386   78.111   35.376 31.95146 50.74862 
1 1 1   24   32    0 o   67.578   41.463   4.1712   8.2562   4.1712   8.2562   4.1712   8.2562   67.578   41.463   67.578   41.463 0.000000 0.000000 
1 1 1   24   32    1 o   79.955   31.655   3.9359   5.7511  -0.7478   7.9234   9.1509   8.3608   75.661   33.735  104.539   38.975 -28.87782 51.54714 
1 1 1   24   32    2 o   57.523   26.802  -4.1167   5.7629 -12.5362   7.7992   6.0084   8.5528   56.011   27.385   95.019   38.271 -39.00851 47.05968 
1 1 1   24   32    3 f   74.371   31.059   2.1461   5.8981   1.4823   7.7349   3.0682   9.1168   80.084   34.572   88.827   37.923 -8.743126 51.31653 
1 1 1   24   32    4 o  105.082   33.788   9.7917   6.1684   5.6912   8.1489   15.294   9.4395   92.984   37.390  126.425   41.873 -33.44110 56.13638 
1 1 1   24   32    5 f   89.153   32.835   6.2148   5.8995   7.2036   7.4905   4.5994   9.5741   96.253   36.669   93.791   39.397 2.462166 53.82084 
1 1 1   24   32    6 o  311.728   12.876   75.965   6.1439   74.922   7.3574   78.370   11.167  307.667   15.675  308.124   23.865 -0.4569397 28.55241 
1 1 1   24   32    7 o  138.860   26.099   16.461   5.3434   14.131   6.2196   23.030   10.442  125.340   32.237  152.895   42.881 -27.55547 53.64662 
1 1 1   24   32    8 o  218.639   17.120   38.206   5.6835   38.083   6.6210   38.550   11.079  216.506   20.213  205.334   36.594 11.17172 41.80560 
1 1 1   24   32    9 o  164.611   21.517   22.322   5.2917   22.432   6.1145   21.995   10.562  162.884   25.350  148.323   43.618 14.56070 50.44895 
1 1 1   24   32   10 o  245.594   12.958   47.345   4.8537   54.197   5.5097   23.604   10.256  262.392   13.767  154.659   42.166 107.7333 44.35662 
1 1 1   24   32   11 o  296.992   11.273   68.706   5.1247   74.332   5.8343   49.703   10.722  308.369   12.361  239.111   29.953 69.25832 32.40336 
1 1 1   24   32   12 o  231.671   14.723   42.509   5.1938   42.509   5.1938   0.0000   0.0000  231.671   14.723  ?   ?  0.000000 14.72314 
1 1 1   24   32   13 o  192.262   15.308   29.437   4.4675   28.768   4.9881   32.150   10.044  188.968   17.442  185.482   36.679 3.485489 40.61471 
1 1 1   24   32   14 o  171.095   17.218   23.623   4.4479   21.640   5.0244   30.804   9.5628  161.835   20.763  181.947   35.612 -20.11281 41.22293 
1 1 1   24   32   15 o  111.198   24.924   10.728   4.1371   11.164   4.7264   9.3005   8.5562  112.126   27.701  102.758   39.180 9.368156 47.98358 
1 1 1   24   32   16 o  213.154   14.113   36.050   4.5784   38.711   5.3189   28.442   8.9953  219.870   15.912  174.341   34.926 45.52905 38.38012 
1 1 1   24   32   17 o  224.447   13.448   39.869   4.5988   43.684   5.3959   29.741   8.7918  233.952   15.150  179.458   33.231 54.49478 36.52122 
1 1 1   24   32   18 o  123.566   23.082   13.084   4.2050   11.006   4.8202   19.698   8.6016  110.331   28.381  140.001   38.798 -29.66991 48.07049 
1 1 1   24   32   19 o   76.571   27.554   4.7447   4.1208   2.5504   4.7151   11.840   8.4787   68.945   28.177  109.409   39.504 -40.46429 48.52328 
1 1 1   24   32   20 o   94.281   31.088   8.1351   5.2054   8.7601   6.7140   7.1933   8.2417   97.345   35.152   93.674   37.625 3.670311 51.49106 
1 1 1   24   32   21 o   80.605   32.671   4.4627   6.2759   6.6003   10.168   3.1472   7.9765   94.825   40.256   81.646   35.177 13.17863 53.45985 
1 1 1   24   32   22 f  109.392   34.034   11.684   6.3054   13.572   10.189   10.513   8.0270  112.781   42.814  103.379   38.259 9.402023 57.41743 
1 1 1   24   33    0 o  124.592   49.064   18.164   8.9836   18.164   8.9836   18.164   8.9836  124.592   49.064  124.592   49.064 0.000000 0.000000 
1 1 1   24   33    1 o   97.806   33.855   8.2869   6.1751  -1.1924   8.4397   19.209   9.0592   76.299   34.355  140.640   40.117 -64.34041 52.81736 
1 1 1   24   33    2 o   95.652   34.108   7.7488   6.3006   10.503   8.9053   4.9881   8.9154  108.620   40.278   92.260   38.328 16.35992 55.59953 
1 1 1   24   33    3 o  280.848   16.974   62.998   7.2622   71.133   10.209   54.662   10.333  293.589   22.898  253.599   27.037 39.98950 35.43092 
1 1 1   24   33    4 o  130.555   32.152   15.445   6.3825   16.527   8.4112   13.976   9.7993  130.954   39.030  120.286   42.575 10.66788 57.75775 
1 1 1   24   33    5 o  211.867   20.672   36.725   6.6184   36.329   8.6395   37.289   10.297  205.236   28.251  202.755   34.409 2.481201 44.52044 
1 1 1   24   33    6 o  139.839   26.118   16.826   5.3847   18.246   6.4800   13.656   9.6795  143.033   30.528  118.857   42.287 24.17548 52.15541 
1 1 1   24   33    7 o   63.844   27.719   0.3272   5.0299  -3.9738   6.0985   9.4775   8.8953   59.269   27.600  104.625   39.935 -45.35581 48.54496 
1 1 1   24   33    8 o   99.246   29.848   8.7694   4.9027   6.6834   5.8023   13.976   9.1671   89.916   32.647  119.589   41.257 -29.67338 52.61150 
1 1 1   24   33    9 o   84.954   29.849   5.9859   4.8088   7.2875   5.6767   2.6785   9.0489   92.190   32.429   86.056   37.271 6.134476 49.40377 
1 1 1   24   33   10 o  161.233   24.779   22.150   5.9194   22.150   5.9194   0.0000   0.0000  161.233   24.779  ?   ?  0.000000 24.77884 
1 1 1   24   33   11 o  174.651   17.156   24.642   4.5270   26.436   5.1357   18.390   9.5863  179.947   18.930  134.050   42.007 45.89635 46.07571 
1 1 1   24   33   12 o   81.136   27.760   5.5168   4.1471   6.2881   4.6811   2.7021   8.9417   85.836   29.489   85.095   36.952 0.7407761 47.27677 
1 1 1   24   33   13 o   84.257   27.157   6.1397   3.9832   6.7607   4.5942   4.2597   7.9938   88.006   29.215   86.002   36.055 2.004608 46.40561 
1 1 1   24   33   14 o  128.553   22.616   14.061   4.2876   15.913   5.0477   9.2619   8.1248  135.332   25.298  101.154   38.272 34.17806 45.87773 
1 1 1   24   33   15 o  164.387   17.865   22.061   4.4227   28.642   5.2824   6.6314   8.0879  186.976   18.709   92.443   37.222 94.53290 41.65955 
1 1 1   24   33   16 o  107.885   26.389   10.379   4.3216   11.352   5.1335   8.0111   8.0073  111.128   29.636   96.254   37.581 14.87423 47.86065 
1 1 1   24   33   17 o  105.867   26.834   10.072   4.3540   13.216   5.1618   2.3190   8.1062  120.607   28.427   80.386   35.043 40.22131 45.12278 
1 1 1   24   33   18 o   62.343   26.143   1.4948   4.2044   2.6423   4.8712  -1.8569   8.3251   69.634   28.570   72.164   33.120 -2.530312 43.73980 
1 1 1   24   33   19 o  167.486   17.653   22.989   4.4573   24.781   5.1909   17.957   8.6972  172.356   20.051  130.645   39.859 41.71120 44.61777 
1 1 1   24   34    0 o  250.906   27.075   52.488   10.091   52.488   10.091   52.488   10.091  250.906   27.075  250.906   27.075 0.000000 0.000000 
1 1 1   24   34    1 o   75.566   31.813   2.4336   6.2656   5.8757   8.7832  -1.1332   8.9408   92.922   38.272   77.336   35.041 15.58572 51.89030 
1 1 1   24   34    2 o   56.582   26.784  -5.4431   6.1628 -17.7785   8.5069   8.1806   8.9401   53.378   26.553   99.710   39.470 -46.33200 47.57075 
1 1 1   24   34    3 o  198.188   22.512   32.813   6.7079   38.606   9.2933   26.512   9.6920  208.863   29.925  164.611   39.055 44.25285 49.20147 
1 1 1   24   34    4 o  175.986   23.515   26.143   6.1757   26.494   8.2400   25.694   9.3283  170.101   32.837  162.739   38.118 7.362045 50.31203 
1 1 1   24   34    5 o  156.500   22.885   20.653   5.3199   19.588   6.5009   22.814   9.2561  147.837   29.759  151.593   39.495 -3.755814 49.45158 
1 1 1   24   34    6 o  178.743   20.187   26.353   5.4263   24.762   6.7378   29.289   9.1536  168.635   27.016  176.788   35.066 -8.153366 44.26557 
1 1 1   24   34    7 o   74.302   31.006   2.6137   5.8717   2.6137   5.8717   0.0000   0.0000   74.302   31.006  ?   ?  0.000000 31.00580 
1 1 1   24   34    8 o  191.617   22.801   30.881   6.5562   30.881   6.5562   0.0000   0.0000  191.617   22.801  ?   ?  0.000000 22.80141 
1 1 1   24   34    9 f   50.534   23.749  -3.8484   4.6898  -5.6627   5.6039   0.3923   8.5674   52.740   25.129   78.405   35.010 -25.66560 43.09528 
1 1 1   24   34   10 o   56.261   25.609  -1.7854   4.8441  -0.0338   5.8090  -5.7844   8.7770   66.035   29.194   68.100   32.153 -2.064461 43.42906 
1 1 1   24   34   11 o  161.534   20.421   21.711   4.9362   20.535   6.0360   24.084   8.5769  152.857   26.774  157.663   36.293 -4.805878 45.10020 
1 1 1   24   34   12 o   94.684   27.551   8.0531   4.2337   12.891   4.9400  -5.3317   8.2165  119.868   27.508   66.195   31.210 53.67248 41.60205 
1 1 1   24   34   13 o  142.507   20.539   17.013   4.3507   20.951   5.0892   6.3208   8.3856  157.650   21.663   91.573   37.518 66.07747 43.32314 
1 1 1   24   34   14 o  221.765   14.043   39.181   4.7420   43.878   5.5765   26.917   9.0117  233.603   15.687  165.881   36.485 67.72261 39.71429 
1 1 1   24   34   15 o  103.818   26.892   9.7287   4.3075   14.098   5.0237  -2.4018   8.3707  125.424   26.970   71.321   32.907 54.10242 42.54670 
1 1 1   24   34   16 o  171.911   17.593   24.193   4.5639   22.950   5.3493   27.519   8.7496  164.654   21.758  168.717   35.027 -4.062347 41.23527 
1 1 1   24   35    0 o   88.799   48.940   11.012   9.6563   11.012   9.6563   11.012   9.6563   88.799   48.940   88.799   48.940 0.000000 0.000000 
1 1 1   24   35    1 o  180.464   26.084   28.281   6.9960   29.656   9.9485   26.936   9.8401  173.374   38.492  163.645   39.692 9.728256 55.29126 
1 1 1   24   35    2 o  130.934   33.549   16.274   6.7539   11.755   9.7674   20.414   9.3493  109.565   41.841  140.330   40.973 -30.76495 58.56142 
1 1 1   24   35    3 o  207.471   21.987   36.074   6.8759   42.079   9.8524   30.371   9.6006  215.966   30.666  177.440   36.565 38.52614 47.72222 
1 1 1   24   35    4 o  163.209   27.350   23.493   6.5906   27.472   8.8475   18.531   9.8786  169.748   35.207  131.756   42.797 37.99222 55.41757 
1 1 1   24   35    5 o  173.677   26.437   26.354   6.8061   26.354   6.8061   0.0000   0.0000  173.677   26.437  ?   ?  0.000000 26.43704 
1 1 1   24   35    6 o  124.083   33.536   14.711   6.5209   14.711   6.5209   0.0000   0.0000  124.083   33.536  ?   ?  0.000000 33.53564 
1 1 1   24   35    7 o  261.602   14.461   54.539   5.7681   53.685   7.0728   56.234   9.9671  256.675   18.119  254.927   25.903 1.747971 31.61158 
1 1 1   24   35    8 o  102.719   30.086   9.7494   5.0340   6.3224   6.0664   17.327   9.0206   87.219   33.054  128.490   40.812 -41.27103 52.51789 
1 1 1   24   35    9 o  129.179   27.191   14.924   5.2063   16.166   6.3014   12.254   9.2416  131.281   31.715  110.129   40.993 21.15292 51.82861 
1 1 1   24   35   10 f   68.237   28.026   2.4482   4.6937   1.0840   5.6227   5.5839   8.5249   67.818   29.376   89.524   37.359 -21.70592 47.52512 
1 1 1   24   35   11 o  130.445   26.217   15.101   5.0529   20.618   6.1460   3.5933   8.8762  152.041   27.418   85.266   36.921 66.77527 45.98836 
1 1 1   25    0    1 o  531.037   7.8037  216.158   6.3400  216.158   6.3400  216.158   6.3400  531.037   7.8037  531.037   7.8037 0.000000 0.000000 
1 1 1   25    0    2 o  274.190   8.2694   57.753   3.4634   57.753   3.4634   57.753   3.4634  274.190   8.2694  274.190   8.2694 0.000000 0.000000 
1 1 1   25    0    3 o  235.340   8.6459   42.607   3.1049   42.607   3.1049   42.607   3.1049  235.340   8.6459  235.340   8.6459 0.000000 0.000000 
1 1 1   25    0    4 o  268.494   8.2514   55.385   3.3838   55.385   3.3838   55.385   3.3838  268.494   8.2514  268.494   8.2514 0.000000 0.000000 
1 1 1   25    0    5 o   69.957   33.573   5.5886   4.1475   5.5886   4.1475   5.5886   4.1475   69.957   33.573   69.957   33.573 0.000000 0.000000 
1 1 1   25    0    6 f  437.918   7.9801  147.061   5.3450  147.061   5.3450  147.061   5.3450  437.918   7.9801  437.918   7.9801 0.000000 0.000000 
1 1 1   25    0    7 o  151.234   12.702   17.916   2.8925   17.916   2.8925   17.916   2.8925  151.234   12.702  151.234   12.702 0.000000 0.000000 
1 1 1   25    0    8 o  246.813   12.224   47.077   4.5921   47.077   4.5921   47.077   4.5921  246.813   12.224  246.813   12.224 0.000000 0.000000 
1 1 1   25    0    9 o   55.210   29.653   3.3816   3.4540   3.3816   3.4540   3.3816   3.4540   55.210   29.653   55.210   29.653 0.000000 0.000000 
1 1 1   25    0   10 o   28.048   19.790  -4.0347   3.3990  -4.0347   3.3990  -4.0347   3.3990   28.048   19.790   28.048   19.790 0.000000 0.000000 
1 1 1   25    0   11 o  277.071   9.4298   59.048   3.9886   59.048   3.9886   59.048   3.9886  277.071   9.4298  277.071   9.4298 0.000000 0.000000 
1 1 1   25    0   12 f  316.245   9.1060   76.845   4.3995   76.845   4.3995   76.845   4.3995  316.245   9.1060  316.245   9.1060 0.000000 0.000000 
1 1 1   25    0   13 o  167.073   14.512   21.924   3.6468   21.924   3.6468   21.924   3.6468  167.073   14.512  167.073   14.512 0.000000 0.000000 
1 1 1   25    0   14 o  109.167   25.506   10.570   3.7048   10.570   3.7048   10.570   3.7048  109.167   25.506  109.167   25.506 0.000000 0.000000 
1 1 1   25    0   15 o  191.835   14.594   28.768   4.2282   28.768   4.2282   28.768   4.2282  191.835   14.594  191.835   14.594 0.000000 0.000000 
1 1 1   25    0   16 o   54.424   30.663   3.0979   3.8919   3.0979   3.8919   3.0979   3.8919   54.424   30.663   54.424   30.663 0.000000 0.000000 
1 1 1   25    0   17 o  542.145   9.4247  225.583   7.8155  225.583   7.8155  225.583   7.8155  542.145   9.4247  542.145   9.4247 0.000000 0.000000 
1 1 1   25    0   18 o   58.721   32.084   3.8078   4.1094   3.8078   4.1094   3.8078   4.1094   58.721   32.084   58.721   32.084 0.000000 0.000000 
1 1 1   25    0   19 o  408.543   10.280  128.299   6.4192  128.299   6.4192  128.299   6.4192  408.543   10.280  408.543   10.280 0.000000 0.000000 
1 1 1   25    0   20 o  163.172   19.965   21.462   4.7867   21.462   4.7867   21.462   4.7867  163.172   19.965  163.172   19.965 0.000000 0.000000 
1 1 1   25    0   21 o  349.197   15.762   94.492   8.3855   94.492   8.3855   94.492   8.3855  349.197   15.762  349.197   15.762 0.000000 0.000000 
1 1 1   25    0   22 o   33.201   22.418  -1.4936   3.3214  -1.4936   3.3214  -1.4936   3.3214   33.201   22.418   33.201   22.418 0.000000 0.000000 
1 1 1   25    0   23 o  169.668   14.380   22.630   3.6728   22.630   3.6728   22.630   3.6728  169.668   14.380  169.668   14.380 0.000000 0.000000 
1 1 1   25    0   24 o  166.411   10.898   21.540   2.7485   21.540   2.7485   21.540   2.7485  166.411   10.898  166.411   10.898 0.000000 0.000000 
1 1 1   25    0   25 o  292.193   7.6670   65.599   3.4237   65.599   3.4237   65.599   3.4237  292.193   7.6670  292.193   7.6670 0.000000 0.000000 
1 1 1   25    0   26 f   27.728   18.850  -1.3121   2.4297  -1.3121   2.4297  -1.3121   2.4297   27.728   18.850   27.728   18.850 0.000000 0.000000 
1 1 1   25    0   27 o   64.162   26.328   4.4838   2.5536   4.4838   2.5536   4.4838   2.5536   64.162   26.328   64.162   26.328 0.000000 0.000000 
1 1 1   25    0   28 o   46.562   27.343   2.0324   3.2913   2.0324   3.2913   2.0324   3.2913   46.562   27.343   46.562   27.343 0.000000 0.000000 
1 1 1   25    0   29 o  143.753   16.863   16.618   3.5768   16.618   3.5768   16.618   3.5768  143.753   16.863  143.753   16.863 0.000000 0.000000 
1 1 1   25    0   30 o  119.409   19.341   11.875   3.2568   11.875   3.2568   11.875   3.2568  119.409   19.341  119.409   19.341 0.000000 0.000000 
1 1 1   25    0   31 o  113.148   19.481   10.758   3.0738   10.758   3.0738   10.758   3.0738  113.148   19.481  113.148   19.481 0.000000 0.000000 
1 1 1   25    0   32 o  195.209   11.349   29.621   3.3647   29.621   3.3647   29.621   3.3647  195.209   11.349  195.209   11.349 0.000000 0.000000 
1 1 1   25    0   33 o   48.243   27.011   2.5219   2.9944   2.5219   2.9944   2.5219   2.9944   48.243   27.011   48.243   27.011 0.000000 0.000000 
1 1 1   25    0   34 o  113.956   20.536   11.020   3.2363   11.020   3.2363   11.020   3.2363  113.956   20.536  113.956   20.536 0.000000 0.000000 
1 1 1   25    0   35 o  274.273   11.176   58.220   4.6742   58.220   4.6742   58.220   4.6742  274.273   11.176  274.273   11.176 0.000000 0.000000 
1 1 1   25    0   36 o  120.967   23.017   12.594   3.8134   12.594   3.8134   12.594   3.8134  120.967   23.017  120.967   23.017 0.000000 0.000000 
1 1 1   25    0   37 o   28.134   19.846  -3.8863   3.4122  -3.8863   3.4122  -3.8863   3.4122   28.134   19.846   28.134   19.846 0.000000 0.000000 
1 1 1   25    0   38 o  168.953   15.466   22.686   3.9225   22.686   3.9225   22.686   3.9225  168.953   15.466  168.953   15.466 0.000000 0.000000 
1 1 1   25    0   39 o   53.211   30.187   3.1111   3.8066   3.1111   3.8066   3.1111   3.8066   53.211   30.187   53.211   30.187 0.000000 0.000000 
1 1 1   25    0   40 o   52.456   32.612   1.9357   5.2717   1.9357   5.2717   1.9357   5.2717   52.456   32.612   52.456   32.612 0.000000 0.000000 
1 1 1   25    0   41 o   76.898   32.997   6.8189   3.9756   6.8189   3.9756   6.8189   3.9756   76.898   32.997   76.898   32.997 0.000000 0.000000 
1 1 1   25    0   42 o  124.721   28.390   14.174   4.7236   14.174   4.7236   14.174   4.7236  124.721   28.390  124.721   28.390 0.000000 0.000000 
1 1 1   25    0   43 o  187.406   15.930   28.015   4.4935   28.015   4.4935   28.015   4.4935  187.406   15.930  187.406   15.930 0.000000 0.000000 
1 1 1   25    0   44 o   30.339   21.493  -4.8853   4.1450  -4.8853   4.1450  -4.8853   4.1450   30.339   21.493   30.339   21.493 0.000000 0.000000 
1 1 1   25    0   45 o   27.531   19.788  -6.4157   4.0410  -6.4157   4.0410  -6.4157   4.0410   27.531   19.788   27.531   19.788 0.000000 0.000000 
1 1 1   25    0   46 o   91.008   36.253   9.6233   4.8837   9.6233   4.8837   9.6233   4.8837   91.008   36.253   91.008   36.253 0.000000 0.000000 
1 1 1   25    0   47 o   90.958   32.732   9.0775   4.1722   9.0775   4.1722   9.0775   4.1722   90.958   32.732   90.958   32.732 0.000000 0.000000 
1 1 1   25    0   48 o   34.740   24.035  -2.7849   4.3627  -2.7849   4.3627  -2.7849   4.3627   34.740   24.035   34.740   24.035 0.000000 0.000000 
1 1 1   25    1    0 o  722.797   8.7139  400.462   9.6373  400.462   9.6373  400.462   9.6373  722.797   8.7139  722.797   8.7139 0.000000 0.000000 
1 1 1   25    1    1 o  282.309   5.7513   61.055   2.4852   64.241   3.5788   58.089   3.4537  289.437   8.0781  275.223   8.1984 14.21466 11.50956 
1 1 1   25    1    2 o  313.596   5.5836   75.334   2.6801   75.817   3.8619   74.886   3.7225  314.440   8.0239  312.521   7.7818 1.919495 11.17768 
1 1 1   25    1    3 o  257.826   7.0603   50.952   2.7863   46.983   5.2046   52.546   3.2988  246.663   13.841  261.757   8.2335 -15.09453 16.10491 
1 1 1   25    1    4 o  488.405   6.3530  182.786   4.7493  189.926   8.8959  179.940   5.6167  497.109   11.691  484.459   7.5745 12.64999 13.93061 
1 1 1   25    1    5 o  475.415   8.3089  173.352   6.0462  190.020   9.0835  160.091   8.1018  497.175   11.936  456.402   11.598 40.77304 16.64273 
1 1 1   25    1    6 o  320.105   6.6881   78.532   3.2769   76.549   4.2126   81.570   5.2146  315.881   8.7129  325.904   10.453 -10.02274 13.60843 
1 1 1   25    1    7 o   66.680   15.087   3.5632   1.5039   7.0902   2.7390   2.0410   1.7993   93.951   19.677   53.556   18.286 40.39456 26.86191 
1 1 1   25    1    8 o  334.850   6.6056   85.935   3.3856   92.225   4.4900   77.646   5.1543  346.728   8.4604  317.930   10.592 28.79761 13.55591 
1 1 1   25    1    9 f  286.637   7.0305   62.984   3.0845   63.596   4.0863   62.173   4.7028  287.849   9.2746  284.462   10.801 3.386353 14.23649 
1 1 1   25    1   10 o  479.762   6.4773  176.410   4.7565  183.997   8.3839  172.809   5.7761  489.264   11.195  474.666   7.9502 14.59836 13.73097 
1 1 1   25    1   11 o  314.980   6.9960   76.061   3.3729   82.643   5.8515   72.786   4.1276  327.820   11.662  307.973   8.7562 19.84738 14.58311 
1 1 1   25    1   12 o  219.429   8.7962   36.954   2.9543   40.432   4.9905   35.077   3.6657  228.551   14.338  213.298   11.268 15.25273 18.23599 
1 1 1   25    1   13 o  107.354   14.998   9.0629   2.3971   11.578   3.5384   6.9294   3.2588  120.588   19.862   92.444   23.097 28.14452 30.46295 
1 1 1   25    1   14 o  237.488   8.1658   43.277   2.9683   44.563   4.2662   42.070   4.1326  240.675   11.581  233.849   11.546 6.826157 16.35301 
1 1 1   25    1   15 o  148.547   12.271   17.104   2.7651   12.624   3.9258   21.515   3.8952  125.675   21.160  166.160   15.494 -40.48524 26.22661 
1 1 1   25    1   16 o  168.809   11.306   22.023   2.9044   26.226   4.2981   18.491   3.9400  183.567   15.441  153.593   17.047 29.97417 23.00038 
1 1 1   25    1   17 o  167.490   11.952   21.711   3.0439   21.587   4.5579   21.811   4.0896  165.781   18.265  167.105   16.192 -1.323944 24.40923 
1 1 1   25    1   18 o  322.144   7.7710   79.641   3.8317   80.479   5.7025   78.951   5.1737  323.302   11.524  320.373   10.551 2.928741 15.62402 
1 1 1   25    1   19 o  154.593   15.076   18.658   3.5220   17.186   6.3922   19.300   4.2204  144.382   29.908  156.633   17.926 -12.25124 34.86893 
1 1 1   25    1   20 o   40.186   19.231  -4.5563   3.3585  -4.5740   6.0097  -4.5483   4.0498   59.882   27.718   46.010   21.759 13.87152 35.23834 
1 1 1   25    1   21 o  176.763   10.397   24.130   2.8006   10.215   5.1050   30.120   3.3496  111.046   29.525  197.437   11.129 -86.39126 31.55292 
1 1 1   25    1   22 o   97.952   13.150   7.5417   1.9217   9.0961   2.8815   6.2965   2.5791  106.611   18.318   88.102   19.628 18.50870 26.84808 
1 1 1   25    1   23 o  185.468   8.1597   26.427   2.3164   21.644   3.7729   29.321   2.9346  166.445   14.969  194.940   9.8673 -28.49452 17.92895 
1 1 1   25    1   24 o  156.404   8.4131   18.856   2.0067   22.430   3.2435   16.640   2.5541  169.928   12.560  146.424   11.488 23.50365 17.02127 
1 1 1   25    1   25 f   51.182   18.584   1.7057   1.8802   4.6045   3.1247   0.0604   2.3540   76.343   23.993   45.331   19.310 31.01192 30.79808 
1 1 1   25    1   26 o  338.849   5.5957   88.060   2.9022   90.796   4.6607   86.327   3.7091  343.520   8.8641  335.259   7.2280 8.260895 11.43749 
1 1 1   25    1   27 o  149.047   9.5510   17.181   2.1675   16.206   3.4811   17.798   2.7699  143.337   16.148  151.248   12.065 -7.910675 20.15767 
1 1 1   25    1   28 o  174.850   11.069   23.702   2.9472   25.236   3.7103   21.080   4.8515  179.872   13.577  162.484   19.925 17.38800 24.11046 
1 1 1   25    1   29 o  124.063   10.689   11.968   2.0100   10.656   2.8724   13.228   2.8136  115.647   16.712  129.677   14.419 -14.03017 22.07237 
1 1 1   25    1   30 o  168.657   9.2598   21.985   2.3813   20.248   3.8691   23.044   3.0212  160.268   15.986  172.227   11.527 -11.95926 19.70844 
1 1 1   25    1   31 o  196.526   7.7654   29.708   2.3359   30.087   3.3582   29.353   3.2513  196.933   11.187  194.561   10.962 2.372162 15.66279 
1 1 1   25    1   32 o  146.331   10.051   16.609   2.2375   16.193   3.1901   17.011   3.1393  143.385   14.745  147.167   14.109 -3.781250 20.40840 
1 1 1   25    1   33 o   74.556   18.792   4.5588   2.1438  -0.9917   3.0214   10.186   3.0423   46.743   20.838  112.326   18.327 -65.58296 27.75052 
1 1 1   25    1   34 o  303.165   6.8039   70.653   3.1572   62.777   4.2826   80.032   4.6729  285.081   9.8145  321.984   9.4817 -36.90286 13.64649 
1 1 1   25    1   35 o   42.711   18.794  -0.5113   2.3802   5.0936   3.9187  -3.7882   2.9963   80.217   26.987   38.295   18.282 41.92234 32.59673 
1 1 1   25    1   36 o  189.447   9.7001   27.812   2.8033   30.558   3.8487   24.710   4.0915  197.719   12.786  176.903   15.260 20.81569 19.90825 
1 1 1   25    1   37 o   50.428   20.746   0.8064   2.5771   2.3053   3.4536  -1.0769   3.8713   63.531   24.715   52.908   23.586 10.62345 34.16373 
1 1 1   25    1   38 f  148.624   11.905   17.291   2.6854   13.079   3.9043   21.073   3.6995  126.080   20.968  163.162   14.981 -37.08220 25.76956 
1 1 1   25    1   39 f   43.408   19.798  -1.6027   2.9137  -6.2174   5.1631   0.5537   3.5294   49.783   23.830   56.002   23.742 -6.219261 33.63849 
1 1 1   25    1   40 o   76.903   23.899   4.9159   3.1100   3.4933   3.9818   7.1415   4.9804   71.213   26.828   91.534   30.420 -20.32083 40.55998 
1 1 1   25    1   41 o   63.547   23.622   2.7881   3.0667   7.3838   4.1157  -2.9484   4.5983   92.114   27.267   52.372   24.243 39.74176 36.48591 
1 1 1   25    1   42 o  142.807   14.247   16.252   3.0727   21.145   4.4930   11.952   4.2115  160.995   18.574  117.927   24.145 43.06838 30.46227 
1 1 1   25    1   43 o  127.774   16.724   13.273   3.1922   13.459   4.8362   13.129   4.2495  123.723   26.345  123.873   23.267 -0.1496429 35.14861 
1 1 1   25    1   44 o   85.540   22.835   6.3430   3.0457   1.2754   4.3107   11.395   4.3038   62.343   26.324  113.765   25.363 -51.42191 36.55450 
1 1 1   25    1   45 o   70.560   23.680   4.1499   3.0170   2.9847   4.2662   5.3155   4.2671   68.402   27.206   79.240   28.089 -10.83775 39.10476 
1 1 1   25    1   46 o   66.800   24.505   3.4813   3.2813   0.0294   4.6819   6.8137   4.6002   59.353   26.226   86.387   29.239 -27.03369 39.27737 
1 1 1   25    1   47 o   50.467   21.694   0.4420   3.0200   2.1486   4.6446  -0.8081   3.9751   65.557   27.483   52.405   23.589 13.15137 36.21856 
1 1 1   25    1   48 o   84.243   22.538   6.3769   2.9631   5.8085   4.1030   6.9965   4.2838   79.699   27.596   86.010   28.194 -6.310516 39.45163 
1 1 1   25    2    0 o  292.682   8.1660   65.779   3.6518   65.779   3.6518   65.779   3.6518  292.682   8.1660  292.682   8.1660 0.000000 0.000000 
1 1 1   25    2    1 o   49.782   18.687   1.4228   1.9284   4.4743   3.5851   0.1806   2.2875   77.606   25.810   45.588   19.208 32.01852 32.17336 
1 1 1   25    2    2 o  170.619   8.7011   22.389   2.2648   14.560   4.2131   25.570   2.6858  135.487   20.995  182.273   9.6615 -46.78638 23.11134 
1 1 1   25    2    3 o  198.202   10.571   30.254   3.1955   34.964   4.8408   26.616   4.2541  212.488   14.980  185.227   15.137 27.26106 21.29601 
1 1 1   25    2    4 f  230.205   7.4135   40.627   2.6122   45.618   5.4525   39.140   2.9760  242.884   14.736  225.886   8.6073 16.99808 17.06579 
1 1 1   25    2    5 o  214.521   6.9881   35.274   2.2946   31.529   5.2423   36.161   2.5520  201.320   17.177  217.168   7.6774 -15.84830 18.81430 
1 1 1   25    2    6 o   41.035   16.415   0.6339   1.5619   0.5143   4.5354   0.6500   1.6636   64.346   27.076   42.173   16.916 22.17391 31.92641 
1 1 1   25    2    7 o  289.425   5.4644   64.171   2.4207   69.132   4.2622   61.808   2.9411  300.128   9.2781  283.974   6.7665 16.15454 11.48340 
1 1 1   25    2    8 o   82.315   11.253   5.3031   1.3807   2.9151   3.0819   5.9028   1.5444   66.328   23.833   86.815   11.938 -20.48703 26.65590 
1 1 1   25    2    9 o   57.282   14.855   2.6243   1.3134   4.9944   3.0531   2.0860   1.4550   79.409   23.480   52.234   16.365 27.17439 28.62001 
1 1 1   25    2   10 o  250.145   6.8553   47.966   2.6248   54.460   4.1248   43.547   3.4025  266.284   10.120  238.178   9.3332 28.10616 13.76693 
1 1 1   25    2   11 o  229.979   8.3585   40.579   2.9423   45.392   5.2866   38.419   3.5415  242.237   14.322  223.627   10.346 18.61043 17.66820 
1 1 1   25    2   12 o  142.848   12.448   15.823   2.6945   18.221   4.7065   14.654   3.2863  151.750   20.811  136.828   15.993 14.92220 26.24664 
1 1 1   25    2   13 o  145.676   12.929   16.470   2.8530   20.931   5.2085   14.558   3.4100  162.633   21.447  136.215   16.706 26.41849 27.18525 
1 1 1   25    2   14 o  213.326   11.659   35.117   3.7925   0.0000   0.0000   35.117   3.7925  ?   ?   213.326   11.659 0.000000 11.65901 
1 1 1   25    2   15 o  590.067   7.3446  267.052   6.6334  270.301   12.540  265.790   7.8166  591.990   13.839  588.414   8.6789 3.575439 16.33539 
1 1 1   25    2   16 o  330.670   8.1022   83.914   4.1008   84.714   7.8265   83.612   4.8146  331.033   15.446  329.897   9.5348 1.136353 18.15219 
1 1 1   25    2   17 o  110.932   18.992   9.8238   3.1087   23.614   6.5044   5.7412   3.5391  171.493   25.560   84.821   25.326 86.67136 35.98230 
1 1 1   25    2   18 o  120.377   12.758   11.295   2.3150   14.029   4.5885   10.362   2.6812  131.861   23.601  114.686   15.685 17.17528 28.33764 
1 1 1   25    2   19 o  225.989   7.9464   39.204   2.7487   32.986   5.2405   41.564   3.2284  205.563   16.802  232.585   9.0686 -27.02142 19.09339 
1 1 1   25    2   20 o   78.838   19.487   5.0359   2.3381   8.1724   4.8027   4.0617   2.6767  100.136   29.403   71.904   22.143 28.23134 36.80831 
1 1 1   25    2   21 o  422.334   7.0046  136.859   4.5280  129.166   7.2087  141.873   5.8193  409.395   11.504  429.669   8.8485 -20.27466 14.51325 
1 1 1   25    2   22 o   86.767   16.399   6.0329   2.0981   6.7551   2.7941   5.0990   3.1771   91.154   20.521   79.867   24.029 11.28724 31.59913 
1 1 1   25    2   23 o  161.255   8.4580   20.038   2.0803   21.369   3.5694   19.353   2.5601  165.533   14.226  158.149   10.638 7.383743 17.76346 
1 1 1   25    2   24 o  227.761   7.0439   39.822   2.4556   41.337   3.7968   38.733   3.2197  231.589   10.711  224.361   9.3755 7.228073 14.23463 
1 1 1   25    2   25 o  442.086   5.5664  149.875   3.7666  151.873   5.6387  148.264   5.0615  444.479   8.2882  439.338   7.5268 5.140991 11.19586 
1 1 1   25    2   26 o  185.873   8.7170   26.578   2.4800   28.917   3.7101   24.689   3.3344  192.932   12.633  178.279   12.294 14.65240 17.62827 
1 1 1   25    2   27 o  242.224   7.4693   45.082   2.7693   51.027   4.1610   40.356   3.7103  257.187   10.570  228.713   10.599 28.47374 14.96855 
1 1 1   25    2   28 o  219.601   7.4557   37.060   2.5061   37.677   4.1802   36.713   3.1311  220.275   12.449  218.311   9.3703 1.963882 15.58164 
1 1 1   25    2   29 o  328.044   6.6507   82.639   3.3394   80.861   4.9930   84.078   4.4919  323.784   10.075  330.449   8.8809 -6.665039 13.43020 
1 1 1   25    2   30 o  239.282   6.6342   43.975   2.4298   43.334   3.5548   44.537   3.3287  237.034   9.7981  240.440   9.0449 -3.406357 13.33463 
1 1 1   25    2   31 o  157.545   9.9819   19.230   2.3946   20.894   3.9999   18.301   2.9896  162.663   16.284  153.048   12.882 9.615341 20.76318 
1 1 1   25    2   32 o   76.238   18.015   4.7517   2.0688   4.9904   3.1150   4.5632   2.7673   78.361   23.842   74.965   22.397 3.395744 32.71208 
1 1 1   25    2   33 o  324.784   6.0329   81.000   2.9991   83.256   4.4727   79.158   4.0425  328.629   8.8920  320.605   8.2378 8.023865 12.12141 
1 1 1   25    2   34 o  100.976   16.086   8.1807   2.4027   10.261   3.4784   6.2824   3.3229  111.770   21.106   86.805   24.135 24.96547 32.06204 
1 1 1   25    2   35 o  131.785   12.518   13.619   2.4947   17.459   4.0307   11.234   3.1761  147.560   18.234  117.958   18.175 29.60214 25.74520 
1 1 1   25    2   36 o   78.588   21.160   5.1216   2.6020  -5.3218   4.1061   12.129   3.3635   44.213   21.186  122.451   18.525 -78.23816 28.14291 
1 1 1   25    2   37 o  201.932   9.5962   31.528   2.9660   33.018   4.0509   29.807   4.3548  205.405   12.951  194.484   14.738 10.92139 19.62002 
1 1 1   25    2   38 o  138.997   12.694   15.185   2.6709   18.066   3.8916   12.620   3.6724  150.144   17.247  124.166   20.003 25.97807 26.41117 
1 1 1   25    2   39 o  212.252   10.239   34.934   3.3263   41.490   6.0419   32.083   3.9845  227.906   17.453  202.234   12.940 25.67165 21.72648 
1 1 1   25    2   40 o  116.598   19.257   11.168   3.3167   9.4991   3.9754   14.989   6.0163  105.129   25.060  129.669   30.775 -24.53966 39.68708 
1 1 1   25    2   41 o  149.561   14.004   17.749   3.1686   23.228   4.3248   11.399   4.6556  170.000   16.842  114.084   27.069 55.91578 31.88071 
1 1 1   25    2   42 f  103.199   19.226   8.8601   2.9252   6.9401   4.2647   10.566   4.0199   89.144   28.032  110.568   24.406 -21.42354 37.16775 
1 1 1   25    2   43 o   62.174   23.444   2.6368   3.0422   7.0016   4.8035  -0.2865   3.9311   89.313   29.880   54.922   24.160 34.39153 38.42536 
1 1 1   25    2   44 o  108.942   18.403   9.8552   2.9593   16.238   4.3217   4.2196   4.0608  139.041   20.957   73.801   27.232 65.23988 34.36255 
1 1 1   25    2   45 o  215.827   9.9233   36.354   3.2782   35.130   4.6601   37.552   4.6123  209.351   14.635  216.913   13.966 -7.561172 20.22959 
1 1 1   25    2   46 o  125.632   16.856   13.024   3.1595   11.332   4.1791   15.283   4.8271  112.433   24.937  131.040   24.978 -18.60658 35.29546 
1 1 1   25    2   47 o   90.963   23.569   7.4452   3.3082   10.831   5.3009   5.2853   4.2340  105.100   30.899   77.685   27.933 27.41534 41.65314 
1 1 1   25    2   48 o   79.272   22.562   5.6382   2.8686   7.6461   3.9667   3.4368   4.1534   90.090   26.792   68.311   26.947 21.77950 37.99946 
1 1 1   25    3    0 o   61.625   31.494   4.3237   3.7529   4.3237   3.7529   4.3237   3.7529   61.625   31.494   61.625   31.494 0.000000 0.000000 
1 1 1   25    3    1 o   45.900   19.883  -0.3396   2.5763  -4.4451   3.9267   2.7632   3.4138   45.459   21.476   67.254   24.938 -21.79443 32.91094 
1 1 1   25    3    2 o  232.532   9.7226   41.503   3.4605   47.613   5.3472   37.100   4.5392  248.261   14.130  219.131   13.600 29.13063 19.61206 
1 1 1   25    3    3 o  171.672   11.096   22.735   2.9000   24.018   4.9638   22.070   3.5733  175.214   18.803  168.736   13.961 6.478287 23.41906 
1 1 1   25    3    4 o  105.650   16.311   8.8109   2.5527   0.4871   4.7237   12.244   3.0338   65.481   27.597  124.945   16.248 -59.46371 32.02539 
1 1 1   25    3    5 o  165.881   7.1045   21.093   1.8039   27.134   5.3929   20.332   1.9141  186.244   19.193  162.839   7.6796 23.40433 20.67231 
1 1 1   25    3    6 o  264.536   5.6199   53.611   2.2755   59.330   4.1824   51.207   2.7121  277.993   9.8292  258.471   6.8553 19.52182 11.98369 
1 1 1   25    3    7 o  176.419   6.1184   23.849   1.6522   26.471   3.5332   23.115   1.8691  185.080   12.546  173.649   7.0321 11.43030 14.38263 
1 1 1   25    3    8 o  176.739   6.1605   23.937   1.6665   21.932   3.5861   24.489   1.8821  168.149   14.062  178.738   6.8796 -10.58841 15.65501 
1 1 1   25    3    9 o  209.021   5.7892   33.475   1.8522   28.509   3.9634   34.863   2.0950  191.927   13.579  213.281   6.4175 -21.35416 15.01920 
1 1 1   25    3   10 o  149.099   6.8806   17.042   1.5703   16.262   3.7782   17.205   1.7264  143.968   17.506  149.593   7.5644 -5.624893 19.07034 
1 1 1   25    3   11 o  175.361   6.3961   23.569   1.7168   16.762   5.1390   24.425   1.8214  144.678   24.051  178.503   6.6665 -33.82526 24.95764 
1 1 1   25    3   12 o  157.755   9.7220   19.185   2.3361   19.507   3.8413   18.996   2.9428  158.095   16.099  156.622   12.376 1.473526 20.30640 
1 1 1   25    3   13 o  201.450   8.2093   31.139   2.5313   33.451   4.1658   29.785   3.1872  207.967   13.155  196.568   10.633 11.39900 16.91434 
1 1 1   25    3   14 o  317.587   7.1735   77.349   3.4871   90.643   7.1149   73.146   4.0006  342.898   13.556  308.714   8.4663 34.18317 15.98259 
1 1 1   25    3   15 o  352.740   7.0590   95.420   3.8112   93.683   7.6134   96.001   4.4026  348.412   14.276  353.693   8.1323 -5.280640 16.43004 
1 1 1   25    3   16 o  141.258   10.011   15.412   2.1504   22.513   6.0770   14.396   2.2992  167.778   24.377  136.346   11.114 31.43201 26.79074 
1 1 1   25    3   17 o  124.890   12.889   12.150   2.4284   14.208   4.4373   11.271   2.9015  133.024   22.602  119.591   16.274 13.43289 27.85099 
1 1 1   25    3   18 o  354.124   5.9412   96.131   3.2203  105.558   6.3197   92.825   3.7427  370.317   11.149  347.867   7.0291 22.45013 13.18024 
1 1 1   25    3   19 o  129.587   11.380   13.030   2.2344   9.2990   4.9557   13.982   2.5033  106.338   29.442  134.117   12.333 -27.77927 31.92081 
1 1 1   25    3   20 o  224.299   7.7104   38.619   2.6471   36.033   5.7508   39.315   2.9818  214.600   17.665  226.225   8.6113 -11.62567 19.65182 
1 1 1   25    3   21 o  389.707   5.8114  116.439   3.4665  123.655   4.9079  109.255   4.8968  401.281   7.9906  377.111   8.4834 24.16977 11.65413 
1 1 1   25    3   22 o  332.678   5.7186   84.856   2.9119   89.604   4.4034   81.167   3.8819  341.491   8.4244  325.109   7.8010 16.38281 11.48153 
1 1 1   25    3   23 o  222.877   6.4490   38.110   2.2000   48.845   3.8127   32.751   2.6937  251.909   9.8882  206.425   8.5256 45.48419 13.05614 
1 1 1   25    3   24 o  409.471   5.8954  128.595   3.6950  133.812   6.0925  125.560   4.6472  416.966   9.5461  404.339   7.5088 12.62704 12.14536 
1 1 1   25    3   25 o   47.562   19.447   0.6872   2.2473  -2.9414   3.0226   5.1722   3.3604   40.947   19.187   80.429   24.817 -39.48237 31.36889 
1 1 1   25    3   26 o   48.103   18.988   1.0529   2.0637   3.8022   3.2401  -0.8236   2.6769   71.574   24.537   44.518   19.743 27.05549 31.49376 
1 1 1   25    3   27 o  314.691   5.7747   75.972   2.7815   78.745   4.7439   74.518   3.4337  319.688   9.6948  311.459   7.2027 8.228912 12.07757 
1 1 1   25    3   28 o  199.946   7.6841   30.731   2.3517   28.201   4.0644   32.004   2.8833  190.062   14.071  203.846   9.2410 -13.78333 16.83417 
1 1 1   25    3   29 o  119.025   13.662   11.137   2.4439   8.5540   3.7968   12.964   3.1935  101.419   24.690  127.754   16.733 -26.33503 29.82641 
1 1 1   25    3   30 o   67.008   19.974   3.6018   2.2027   2.7391   3.9154   4.0012   2.6643   68.615   26.421   70.933   22.133 -2.317894 34.46632 
1 1 1   25    3   31 o  273.617   7.7143   57.586   3.2308   53.112   5.0972   60.590   4.1771  261.645   12.728  280.246   9.7378 -18.60101 16.02552 
1 1 1   25    3   32 o  129.877   13.939   13.274   2.7277   15.915   7.2796   12.843   2.9420  134.585   35.007  127.339   15.408 7.245514 38.24765 
1 1 1   25    3   33 o  159.780   9.6264   19.776   2.3433   18.992   3.6813   20.310   3.0383  155.015   15.733  161.302   12.401 -6.286575 20.03302 
1 1 1   25    3   34 o   49.737   19.924   1.0475   2.3045   3.5859   3.3878  -1.1386   3.1439   70.274   25.016   47.216   21.137 23.05829 32.75007 
1 1 1   25    3   35 o   64.072   20.837   3.2074   2.3415   6.1682   3.8039   1.4012   2.9711   86.187   26.373   56.344   22.605 29.84298 34.73458 
1 1 1   25    3   36 o  144.158   11.484   16.227   2.5130   10.688   3.8625   20.292   3.3091  113.194   23.076  160.714   13.579 -47.51970 26.77461 
1 1 1   25    3   37 o  178.370   9.8509   24.687   2.6790   25.779   4.1426   23.903   3.5124  180.638   15.122  174.540   13.246 6.097382 20.10310 
1 1 1   25    3   38 o  108.293   17.880   9.5320   2.8602   7.8482   4.0163   11.265   4.0742   95.727   26.506  115.671   23.806 -19.94384 35.62653 
1 1 1   25    3   39 o  170.535   12.641   22.825   3.2761   20.941   5.9864   23.631   3.9143  157.387   25.740  172.689   14.957 -15.30176 29.76980 
1 1 1   25    3   40 o  182.831   12.616   26.254   3.5089   26.338   4.3366   26.094   5.9715  181.853   15.735  177.517   22.481 4.335617 27.44049 
1 1 1   25    3   41 o  162.540   12.386   20.787   3.0584   29.534   4.5695   13.688   4.1164  192.440   15.649  127.908   21.808 64.53255 26.84133 
1 1 1   25    3   42 o   96.085   19.921   7.7507   2.8337   7.2115   4.1692   8.2137   3.8631   90.626   27.585   96.833   25.654 -6.207123 37.67068 
1 1 1   25    3   43 o  107.476   18.251   9.5558   2.8950   15.301   4.3317   4.9178   3.8920  134.758   21.740   77.303   26.870 57.45520 34.56383 
1 1 1   25    3   44 o  130.365   16.272   13.814   3.1761   18.068   4.9539   10.845   4.1387  145.483   23.012  111.068   24.953 34.41473 33.94459 
1 1 1   25    3   45 o   72.781   23.627   4.5085   3.0111   4.5618   4.0274   4.4410   4.5342   74.879   27.197   75.529   28.588 -0.6502609 39.45791 
1 1 1   25    3   46 o   53.223   22.091   1.1191   2.9578   5.9838   4.2495  -3.4523   4.1195   81.851   28.099   46.836   22.087 35.01464 35.74042 
1 1 1   25    3   47 o   41.306   19.446  -2.7172   3.1686  -2.3386   4.4220  -3.1167   4.5427   51.085   23.692   50.057   23.476 1.028797 33.35316 
1 1 1   25    3   48 o   42.157   19.265  -1.2504   2.7757  -3.6618   3.7680   1.6110   4.1046   43.450   20.676   60.740   25.669 -17.29044 32.96058 
1 1 1   25    4    1 o   80.564   28.521   4.4799   4.3978   4.4799   4.3978   0.0000   0.0000   80.564   28.521  ?   ?  0.000000 28.52094 
1 1 1   25    4    2 o  250.061   9.4739   47.992   3.6261   50.983   5.7388   46.004   4.6784  256.818   14.660  244.248   12.557 12.57025 19.30228 
1 1 1   25    4    3 o   70.810   22.598   3.8254   2.7632   7.2168   4.9900   2.3256   3.3185   96.136   30.335   64.391   24.436 31.74467 38.95286 
1 1 1   25    4    4 o  177.432   11.200   24.286   3.0260   35.576   5.6459   19.736   3.5843  213.876   17.397  159.342   14.868 54.53404 22.88491 
1 1 1   25    4    5 o  181.945   7.5103   25.382   2.0915   23.698   5.7070   25.643   2.2480  173.284   22.014  182.854   8.0318 -9.569885 23.43320 
1 1 1   25    4    6 o  175.223   6.7291   23.533   1.8048   30.268   6.0115   22.866   1.8921  196.536   20.275  172.705   7.1574 23.83157 21.50093 
1 1 1   25    4    7 o  139.241   12.814   15.044   2.7004   15.958   3.6709   13.967   3.9864  142.701   17.150  132.723   20.265 9.977905 26.54814 
1 1 1   25    4    8 o  260.508   8.4469   52.064   3.3681   52.153   4.4246   51.943   5.1938  260.498   11.097  259.430   13.122 1.068329 17.18525 
1 1 1   25    4    9 o  154.321   12.075   18.429   2.8295   19.884   3.7752   16.564   4.2742  159.761   15.639  144.845   19.797 14.91634 25.22892 
1 1 1   25    4   10 o  206.986   9.6775   32.898   3.0660   35.819   4.0891   29.148   4.6337  215.389   12.456  193.671   15.768 21.71761 20.09484 
1 1 1   25    4   11 o  275.512   8.5919   58.250   3.6233   57.059   4.6005   60.197   5.8798  272.440   11.032  279.488   13.745 -7.047516 17.62452 
1 1 1   25    4   12 o   97.219   22.446   7.6574   3.2726   11.990   4.8765   4.1072   4.4142  121.243   26.974   78.603   28.485 42.64079 39.22949 
1 1 1   25    4   13 o  196.206   8.5425   29.546   2.5655   32.747   4.2232   27.674   3.2297  205.692   13.488  189.370   11.192 16.32166 17.52717 
1 1 1   25    4   14 o  203.695   8.5414   31.848   2.6631   29.772   4.4046   33.044   3.3433  195.825   14.804  207.055   10.585 -11.22928 18.19901 
1 1 1   25    4   15 o  381.921   6.6152  111.836   3.8671  113.397   6.0403  110.752   5.0340  384.081   10.275  379.819   8.6590 4.262634 13.43678 
1 1 1   25    4   16 o  136.756   8.1978   14.406   1.7081   10.993   5.7100   14.741   1.7900  115.459   31.455  138.312   8.4965 -22.85287 32.58274 
1 1 1   25    4   17 o  122.613   10.738   11.653   1.9950   11.492   6.2605   11.671   2.1047  117.890   33.253  122.620   11.342 -4.729340 35.13403 
1 1 1   25    4   18 o  102.276   11.548   8.1563   1.7762   24.517   6.4327   6.8060   1.8480  174.915   24.715   92.986   13.369 81.92886 28.09915 
1 1 1   25    4   19 o  149.054   8.8815   17.129   2.0171   14.453   5.3221   17.578   2.1797  132.824   27.096  150.924   9.4837 -18.10008 28.70776 
1 1 1   25    4   20 o  195.038   8.5179   29.221   2.5429   27.195   5.6936   29.726   2.8421  185.486   20.391  196.632   9.4430 -11.14558 22.47138 
1 1 1   25    4   21 o  166.193   7.4048   21.201   1.8836   20.222   2.8671   21.944   2.4985  161.545   11.674  168.625   9.7214 -7.080002 15.19161 
1 1 1   25    4   22 o  202.964   6.9132   31.612   2.1477   34.633   3.3737   29.554   2.7848  212.079   10.393  196.032   9.2812 16.04672 13.93403 
1 1 1   25    4   23 o  217.413   6.8060   36.275   2.2649   39.210   3.6100   34.370   2.9086  225.615   10.454  211.410   8.9884 14.20531 13.78662 
1 1 1   25    4   24 o  104.582   11.609   8.5427   1.8270   11.873   3.4620   7.2571   2.1508  121.772   19.211   95.553   15.216 26.21910 24.50718 
1 1 1   25    4   25 o  149.536   8.6648   17.256   1.9747   17.243   3.5460   17.261   2.3775  148.057   15.896  149.278   10.472 -1.220520 19.03539 
1 1 1   25    4   26 o  216.651   7.6477   36.069   2.5361   33.736   3.9212   37.747   3.3252  208.493   12.342  221.341   9.8149 -12.84833 15.76899 
1 1 1   25    4   27 o  167.999   8.1279   21.704   2.0901   26.283   3.8006   19.718   2.5024  183.601   13.621  159.577   10.300 24.02412 17.07726 
1 1 1   25    4   28 o   51.629   19.038   1.6854   1.9842   7.3812   3.6302  -0.7413   2.3695   94.336   24.810   41.856   18.568 52.48025 30.98849 
1 1 1   25    4   29 o  155.439   10.776   18.746   2.5480   19.980   4.2435   18.050   3.1864  158.709   17.773  151.833   13.864 6.875809 22.54117 
1 1 1   25    4   30 o   66.756   19.863   3.5762   2.1799   6.2704   4.2718   2.6277   2.5348   87.985   28.099   61.084   21.650 26.90072 35.47236 
1 1 1   25    4   31 o   41.117   18.227  -0.6865   2.2798   6.6204   4.6435  -3.0071   2.6168   90.340   29.342   36.753   17.413 53.58743 34.11979 
1 1 1   25    4   32 o  152.603   12.103   18.165   2.8039   15.642   9.3058   18.417   2.9405  131.785   41.403  153.538   12.624 -21.75258 43.28486 
1 1 1   25    4   33 o   81.698   20.688   5.5117   2.5896   3.9132   4.7161   6.2017   3.0986   77.162   29.167   86.371   23.021 -9.209579 37.15748 
1 1 1   25    4   34 o  248.931   7.9075   47.716   3.0129   54.045   5.6557   45.208   3.5601  262.823   14.111  241.948   9.6134 20.87497 17.07411 
1 1 1   25    4   35 o   86.043   20.281   6.1280   2.6274  -3.1052   5.3418   9.0746   3.0177   57.630   26.479  105.366   19.427 -47.73550 32.84146 
1 1 1   25    4   36 o  111.971   17.106   10.101   2.8387   10.872   6.4414   9.9151   3.1623  111.167   34.369  110.146   19.469 1.020805 39.50027 
1 1 1   25    4   37 o   97.952   16.900   7.7740   2.4422   12.810   3.9100   4.5525   3.1272  124.751   21.238   75.018   24.051 49.73324 32.08566 
1 1 1   25    4   38 o   99.156   21.988   8.2376   3.2497   16.349   5.8251   4.5721   3.9157  137.517   28.606   76.857   26.939 60.66003 39.29375 
1 1 1   25    4   39 f   78.678   21.867   5.1863   2.7282   6.0180   3.9305   4.4131   3.7897   84.695   26.944   75.443   26.498 9.251976 37.79049 
1 1 1   25    4   40 o   53.934   22.100   1.0919   2.9102   0.1942   3.9418   2.1675   4.3147   57.178   24.682   66.759   27.079 -9.580719 36.63971 
1 1 1   25    4   41 o  148.891   12.724   17.492   2.8719   18.497   4.3049   16.686   3.8552  150.414   19.131  143.295   17.973 7.119415 26.24917 
1 1 1   25    4   42 o  183.355   11.073   26.329   3.0931   29.597   4.6145   23.663   4.1681  192.226   15.824  171.640   16.052 20.58641 22.54015 
1 1 1   25    4   43 o  106.185   18.904   9.3835   2.9598   10.947   4.3880   8.0781   4.0091  111.285   26.196   95.431   26.503 15.85441 37.26413 
1 1 1   25    4   44 o  203.579   10.721   32.478   3.3288   34.737   5.2724   30.981   4.2925  207.133   16.774  197.015   14.333 10.11746 22.06334 
1 1 1   25    4   45 o   95.078   21.902   7.8526   3.1217   11.828   4.5100   4.1966   4.3252  114.621   26.269   73.772   27.921 40.84953 38.33592 
1 1 1   25    4   46 o   52.788   21.631   1.2595   2.7882   5.4727   3.8969  -3.1594   3.9909   78.777   26.910   46.569   21.893 32.20763 34.69081 
1 1 1   25    4   47 o   47.991   20.944   0.0451   2.9031   2.1677   4.2784  -1.7661   3.9522   63.973   26.562   49.490   22.753 14.48316 34.97444 
1 1 1   25    4   48 o   99.803   18.781   8.5454   2.7637   6.0107   3.8056   11.374   4.0201   80.674   26.581  111.892   24.179 -31.21796 35.93236 
1 1 1   25    5    1 o  327.414   9.0118   82.257   4.5163   77.109   6.5454   86.935   6.2395  316.487   13.512  336.240   12.124 -19.75204 18.15347 
1 1 1   25    5    2 o  139.951   15.833   15.300   3.3319   12.621   5.2223   17.139   4.3270  124.473   28.079  147.475   19.659 -23.00204 34.27663 
1 1 1   25    5    3 o  249.351   9.7617   47.732   3.7257   44.103   6.1783   49.806   4.6704  238.336   17.048  254.510   11.989 -16.17419 20.84185 
1 1 1   25    5    4 o  512.052   6.1455  200.913   4.8166  218.255   10.264  196.016   5.4545  532.637   12.590  505.674   7.0471 26.96268 14.42797 
1 1 1   25    5    5 o  317.065   7.7194   77.090   3.7463   89.165   7.4202   72.959   4.3401  340.185   14.251  308.324   9.1964 31.86032 16.96031 
1 1 1   25    5    6 o  118.354   18.432   11.091   3.2303   16.197   6.0946   9.0963   3.8094  141.025   29.196  105.954   24.041 35.07133 37.82023 
1 1 1   25    5    7 f  359.884   7.5558   99.315   4.1621  102.826   5.4491   94.398   6.4486  365.955   9.7281  350.339   12.026 15.61603 15.46772 
1 1 1   25    5    8 o   68.831   22.013   3.6125   2.6210   2.7187   3.6646   4.5486   3.7503   68.280   25.735   78.479   26.401 -10.19905 36.86872 
1 1 1   25    5    9 o  139.241   13.364   15.067   2.8133   15.896   3.9687   14.230   3.9884  142.057   18.707  133.989   20.065 8.068893 27.43287 
1 1 1   25    5   10 o  123.486   15.179   11.941   2.8087   15.417   4.0380   8.6831   3.9092  139.693   19.410  103.331   24.990 36.36214 31.64245 
1 1 1   25    5   11 o  280.901   6.9649   60.497   2.9946   61.607   4.9267   59.847   3.7712  283.038   11.372  279.234   8.8235 3.804047 14.39372 
1 1 1   25    5   12 o  295.949   7.4213   67.173   3.3618   81.881   6.7962   62.409   3.8681  325.927   13.623  285.131   8.8631 40.79636 16.25253 
1 1 1   25    5   13 o  300.112   6.9842   69.064   3.2083   72.229   5.2711   67.201   4.0435  306.441   11.238  295.856   8.9291 10.58539 14.35330 
1 1 1   25    5   14 o  116.767   13.466   10.649   2.3626   6.8360   4.1355   12.496   2.8785   92.312   27.334  126.300   15.195 -33.98728 31.27392 
1 1 1   25    5   15 o  350.791   6.7986   94.361   3.6504  105.884   6.0226   87.670   4.5895  371.069   10.604  337.890   8.8740 33.17947 13.82709 
1 1 1   25    5   16 o  249.786   8.1604   47.891   3.1199   45.566   5.2087   49.192   3.8962  242.542   14.091  252.962   10.063 -10.41913 17.31539 
1 1 1   25    5   17 o  445.950   8.0589  152.655   5.5009  156.799   7.1941  146.821   8.5357  451.512   10.410  436.360   12.780 15.15253 16.48289 
1 1 1   25    5   18 f   30.438   13.301  -0.2510   1.1740   2.9957   6.0608  -0.3776   1.1967   81.040   32.366   30.001   13.258 51.03895 34.97572 
1 1 1   25    5   19 o  202.213   7.6633   31.386   2.3719   8.2831   7.2168   34.184   2.5114  104.795   36.581  211.024   7.7753 -106.2296 37.39783 
1 1 1   25    5   20 o  174.285   7.9935   23.325   2.1324  1307.27   40.412   19.740   2.1354  1292.88   20.421  160.045   8.7500 1132.840 22.21666 
1 1 1   25    5   21 o   45.906   17.744   1.0754   1.7711  -3.0203   5.6108   1.5287   1.8666   60.635   27.585   49.871   18.450 10.76410 33.18633 
1 1 1   25    5   22 o  127.097   9.0904   12.484   1.7568   12.355   2.8468   12.564   2.2325  125.359   15.143  127.116   11.602 -1.757042 19.07714 
1 1 1   25    5   23 o  101.126   11.689   7.9938   1.7759   10.927   2.9937   6.4014   2.2059  117.267   17.189   89.310   16.752 27.95637 24.00206 
1 1 1   25    5   24 o  212.201   6.5721   34.557   2.1346   41.647   4.2345   32.142   2.4716  231.913   11.970  204.525   7.8953 27.38719 14.33929 
1 1 1   25    5   25 o  235.703   6.1782   42.627   2.2289   49.165   4.1123   39.908   2.6523  252.497   10.640  227.909   7.6031 24.58746 13.07767 
1 1 1   25    5   26 o   84.823   14.459   5.7369   1.8099   3.4184   3.4225   6.6370   2.1325   70.043   25.121   91.065   15.877 -21.02180 29.71790 
1 1 1   25    5   27 o   60.219   20.067   2.7239   2.1669   4.3640   3.5818   1.7771   2.7213   75.920   25.800   57.093   22.015 18.82747 33.91584 
1 1 1   25    5   28 o  209.918   7.3500   33.862   2.3616   34.618   4.4209   33.561   2.7936  210.736   13.782  208.804   8.7409 1.931885 16.31988 
1 1 1   25    5   29 o   55.637   20.365   2.0179   2.2645   5.3613   4.0769   0.5262   2.7232   82.695   27.525   50.579   21.112 32.11536 34.68871 
1 1 1   25    5   30 o  146.892   10.528   16.748   2.3514   12.590   4.8176   18.049   2.6941  122.659   26.439  152.283   11.646 -29.62486 28.89071 
1 1 1   25    5   31 o   36.533   16.811  -1.5572   2.1644   9.0930   4.4919  -4.7774   2.4700  103.760   27.746   31.145   15.267 72.61488 31.66856 
1 1 1   25    5   32 o   61.571   21.533   2.7419   2.5012  -5.3124   4.7101   5.9050   2.9517   48.889   23.221   84.433   22.451 -35.54429 32.29990 
1 1 1   25    5   33 o  103.255   18.782   8.6671   2.8591   15.004   7.6704   7.6447   3.0811  129.711   36.884   96.117   21.483 33.59412 42.68478 
1 1 1   25    5   34 o  182.135   9.8295   25.704   2.7301   25.552   5.4248   25.756   3.1594  178.123   20.258  181.934   11.403 -3.811493 23.24669 
1 1 1   25    5   35 o  157.523   11.457   19.346   2.7433   23.189   5.6388   18.155   3.1400  168.482   22.422  151.979   13.644 16.50232 26.24707 
1 1 1   25    5   36 o  101.141   19.050   8.3746   2.8409   4.7092   6.5184   9.2341   3.1564   86.093   33.822  105.950   20.201 -19.85655 39.39591 
1 1 1   25    5   37 o   43.868   19.979  -1.6025   2.9538   2.6867   5.7407  -3.1470   3.4448   75.945   31.070   43.678   20.472 32.26672 37.20826 
1 1 1   25    5   38 f  300.228   8.4373   69.582   3.8773   71.483   6.8424   68.683   4.7057  301.608   14.822  297.644   10.329 3.964142 18.06562 
1 1 1   25    5   39 o   56.107   23.304   0.9733   3.2950  -0.5346   6.0066   1.6225   3.9409   67.066   29.666   62.774   25.720 4.291988 39.26261 
1 1 1   25    5   40 o   93.339   21.601   7.3557   3.0249   3.9682   5.6159   8.7401   3.5902   79.057   31.287  101.169   23.615 -22.11187 39.19854 
1 1 1   25    5   41 o  189.024   10.386   27.871   2.9935   31.042   4.4401   25.229   4.0532  197.652   14.783  177.980   15.019 19.67230 21.07398 
1 1 1   25    5   42 o   60.829   22.446   2.6070   2.7590  -1.0820   4.1381   5.5591   3.7018   53.918   24.185   80.829   26.194 -26.91063 35.65194 
1 1 1   25    5   43 o   43.046   19.545  -1.2789   2.7995   1.5712   4.1119  -3.7414   3.8221   62.554   26.012   44.633   21.117 17.92157 33.50466 
1 1 1   25    5   44 o   63.041   23.349   2.8844   2.9909   1.0169   4.6009   4.2511   3.9360   62.783   26.876   73.458   26.855 -10.67494 37.99363 
1 1 1   25    5   45 o   44.462   20.376  -1.6102   3.1354  -4.9587   4.4070   1.8220   4.4618   45.902   21.984   64.409   26.966 -18.50631 34.79116 
1 1 1   25    5   46 o   51.377   21.434   0.9499   2.8049   1.2182   3.8553   0.6481   4.0883   58.706   24.847   57.913   25.067 0.7931671 35.29513 
1 1 1   25    5   47 o  124.070   16.830   12.798   3.1136   16.546   4.5566   9.5147   4.2644  137.432   22.436  100.642   27.086 36.79029 35.17079 
1 1 1   25    5   48 o   45.649   20.149  -0.2171   2.7563  -3.9048   3.6689   4.5607   4.1761   42.172   20.160   73.328   27.504 -31.15647 34.10131 
1 1 1   25    6    0 o   27.301   19.780  -8.8996   4.4445  -8.8996   4.4445  -8.8996   4.4445   27.301   19.780   27.301   19.780 0.000000 0.000000 
1 1 1   25    6    1 o  351.111   11.699   94.775   6.2873   0.0000   0.0000   94.775   6.2873  ?   ?   351.111   11.699 0.000000 11.69899 
1 1 1   25    6    2 o  210.709   10.895   34.203   3.5017   35.886   5.9229   33.298   4.3417  214.620   18.201  207.491   13.749 7.129456 22.81042 
1 1 1   25    6    3 o  465.482   7.9080  166.170   5.6343  159.338   9.0220  170.538   7.2140  455.015   12.954  471.266   10.001 -16.25098 16.36543 
1 1 1   25    6    4 o  257.903   17.743   51.679   6.9615   51.679   6.9615   0.0000   0.0000  257.903   17.743  ?   ?  0.000000 17.74287 
1 1 1   25    6    5 o  394.128   14.348  119.715   8.6557  119.715   8.6557   0.0000   0.0000  394.128   14.348  ?   ?  0.000000 14.34814 
1 1 1   25    6    6 o  209.151   22.543   34.437   7.1026   34.437   7.1026   0.0000   0.0000  209.151   22.543  ?   ?  0.000000 22.54259 
1 1 1   25    6    7 o  205.225   10.181   32.350   3.1980   35.593   4.4152   28.771   4.6383  214.554   13.514  192.402   15.892 22.15227 20.86097 
1 1 1   25    6    8 o  228.038   9.6316   39.930   3.3618   36.536   4.5268   44.103   5.0200  217.347   13.677  238.855   13.790 -21.50755 19.42198 
1 1 1   25    6    9 o  466.347   7.4890  166.781   5.3457  183.807   7.2082  145.974   7.9687  489.246   9.6256  435.599   11.952 53.64618 15.34590 
1 1 1   25    6   10 o  179.248   8.7552   24.660   2.4021   27.228   4.4495   23.604   2.8537  187.123   15.680  174.919   10.710 12.20399 18.98826 
1 1 1   25    6   11 o  114.733   12.556   10.254   2.1690   16.954   4.1754   7.7778   2.5384  146.643   19.052   98.827   17.418 47.81609 25.81400 
1 1 1   25    6   12 o  201.443   8.9543   31.155   2.7609   28.809   5.5912   31.911   3.1750  191.681   19.321  203.780   10.179 -12.09918 21.83823 
1 1 1   25    6   13 o  317.619   6.8791   77.355   3.3443   86.695   5.6718   72.378   4.1407  335.738   11.037  307.041   8.8106 28.69687 14.12240 
1 1 1   25    6   14 o  226.377   8.1086   39.328   2.8096   36.713   4.8239   40.671   3.4564  217.577   14.569  230.060   9.8155 -12.48267 17.56698 
1 1 1   25    6   15 o  184.361   9.4702   26.182   2.6634   27.724   4.6324   25.420   3.2552  188.581   16.206  181.325   11.793 7.255371 20.04270 
1 1 1   25    6   16 o  146.219   11.830   16.572   2.6250   21.493   4.8138   14.489   3.1317  165.103   19.420  136.042   15.305 29.06059 24.72593 
1 1 1   25    6   17 o  204.652   12.074   32.383   3.7653   26.445   5.1358   39.284   5.5366  183.522   18.537  224.615   16.213 -41.09288 24.62680 
1 1 1   25    6   18 o  237.556   10.593   43.427   3.8517   53.303   5.5279   34.108   5.3698  262.330   13.816  208.988   16.932 53.34224 21.85348 
1 1 1   25    6   19 o  377.903   7.2156  109.587   4.1737  119.406   6.9956  104.160   5.2008  393.638   11.611  368.115   9.2303 25.52261 14.83259 
1 1 1   25    6   20 o  209.318   10.066   33.714   3.2249   31.147   6.1252   34.699   3.7933  198.539   20.449  211.828   11.745 -13.28870 23.58168 
1 1 1   25    6   21 o  211.618   5.9299   34.340   1.9207   31.546   3.3348   35.727   2.3496  202.079   10.821  215.756   7.1149 -13.67729 12.95027 
1 1 1   25    6   22 o   61.400   17.088   3.0212   1.6648  -5.4917   7.9391   3.4128   1.7026   69.035   31.920   65.036   16.937 3.998901 36.13525 
1 1 1   25    6   23 f  209.389   6.3686   33.639   2.0411   33.906   3.5776   33.510   2.4853  209.375   11.204  208.860   7.7741 0.5156708 13.63708 
1 1 1   25    6   24 o  116.483   9.6823   10.519   1.7106   13.228   3.5727   9.7126   1.9485  128.764   18.672  111.582   11.577 17.18266 21.96957 
1 1 1   25    6   25 o   35.159   15.447  -0.3908   1.6023  -1.5578   3.3315  -0.0396   1.8276   47.736   21.531   39.565   16.938 8.170128 27.39495 
1 1 1   25    6   26 o  308.760   5.6645   73.127   2.6770   82.339   5.5428   70.325   3.0573  326.574   11.089  302.662   6.5994 23.91180 12.90380 
1 1 1   25    6   27 o  325.702   5.7246   81.383   2.8539   93.735   5.8501   77.526   3.2693  348.421   10.969  317.744   6.7221 30.67685 12.86535 
1 1 1   25    6   28 o  159.238   10.921   19.673   2.6458   22.798   4.7101   18.232   3.1980  169.472   18.456  152.630   13.839 16.84132 23.06850 
1 1 1   25    6   29 o  236.940   7.8273   43.177   2.8387   51.367   5.6217   40.374   3.2888  256.562   14.373  228.874   9.3879 27.68822 17.16756 
1 1 1   25    6   30 o  170.835   9.1573   22.555   2.3858   27.314   4.7547   20.954   2.7581  185.998   16.885  164.274   11.033 21.72421 20.17030 
1 1 1   25    6   31 o   44.148   18.790   0.1021   2.2257  -6.0963   4.6893   1.9047   2.5287   47.292   22.656   56.432   21.351 -9.140087 31.13186 
1 1 1   25    6   32 o   76.095   21.282   4.7525   2.5757   0.2254   5.0694   6.3278   2.9904   65.179   28.063   87.327   22.295 -22.14782 35.84159 
1 1 1   25    6   33 o  158.705   11.597   19.624   2.7976   16.747   8.3556   19.987   2.9690  136.190   38.417  160.021   12.214 -23.83139 40.31153 
1 1 1   25    6   34 o  132.751   12.868   13.833   2.5819   15.063   5.7167   13.518   2.8938  132.629   28.971  130.715   14.720 1.913742 32.49608 
1 1 1   25    6   35 o  161.900   11.236   20.420   2.7670   22.913   5.9368   19.728   3.1275  166.694   23.957  158.650   12.993 8.044693 27.25329 
1 1 1   25    6   36 o   38.797   18.389  -3.2845   2.9234   2.7303   6.9404  -4.5819   3.2233   81.178   33.778   38.486   18.527 42.69141 38.52581 
1 1 1   25    6   37 o  157.986   13.357   19.627   3.1996   22.905   6.1337   18.401   3.7503  165.680   24.962  151.914   16.388 13.76572 29.86049 
1 1 1   25    6   38 o   45.073   20.060  -0.8058   2.7874  -1.4992   6.0768  -0.6210   3.1369   65.194   29.271   48.680   21.491 16.51371 36.31326 
1 1 1   25    6   39 o   65.056   24.597   2.7816   3.3546   7.5862   6.1471   0.7440   4.0032   95.128   33.715   59.659   25.289 35.46867 42.14512 
1 1 1   25    6   40 o  100.550   20.418   8.4490   3.0351   4.5785   5.6037   10.056   3.6105   81.242   31.517  109.120   22.369 -27.87808 38.64787 
1 1 1   25    6   41 o  131.321   17.783   14.052   3.4824   11.541   5.6012   15.634   4.4463  112.484   31.357  136.563   22.020 -24.07906 38.31625 
1 1 1   25    6   42 o   39.662   18.793  -3.2243   3.0483  -7.4664   5.4248  -1.2667   3.6851   48.784   23.619   50.195   22.642 -1.411453 32.71926 
1 1 1   25    6   43 o   84.146   24.616   6.1648   3.3717   4.2815   6.6312   6.8215   3.9157   81.826   33.425   87.953   26.725 -6.126816 42.79569 
1 1 1   25    6   44 o  107.574   21.711   9.9261   3.4517   4.8772   5.4015   13.411   4.4874   79.918   30.960  123.802   24.548 -43.88448 39.51089 
1 1 1   25    6   45 o   37.588   18.011  -3.6491   2.9665  -4.0345   4.4711  -3.3461   3.9649   48.099   22.781   46.126   21.727 1.972771 31.48090 
1 1 1   25    6   46 o  134.704   14.537   14.720   2.9497   13.313   3.9934   16.410   4.3758  123.814   21.871  138.058   21.400 -14.24319 30.59944 
1 1 1   25    6   47 o   39.795   18.790  -2.7315   2.9980   0.1372   4.3152  -5.4079   4.1681   57.030   25.190   42.936   20.768 14.09413 32.64692 
1 1 1   25    6   48 o   39.828   18.542  -1.9102   2.7496  -0.6249   3.7648  -3.3796   4.0255   51.189   23.007   45.775   21.662 5.414375 31.60015 
1 1 1   25    7    0 o  776.569   12.627  463.144   15.000  463.144   15.000  463.144   15.000  776.569   12.627  776.569   12.627 0.000000 0.000000 
1 1 1   25    7    1 o  334.156   11.124   85.815   5.6895   0.0000   0.0000   85.815   5.6895  ?   ?   334.156   11.124 0.000000 11.12379 
1 1 1   25    7    2 f  572.669   7.9436  251.525   6.9629  242.819   10.464  258.442   9.3275  561.858   12.168  580.023   10.506 -18.16486 16.07619 
1 1 1   25    7    3 o  184.450   8.2720   26.099   2.3354   27.152   6.1287   25.920   2.5260  185.588   22.003  183.778   8.9797 1.810333 23.76529 
1 1 1   25    7    4 o  259.307   17.390   52.225   6.8621   52.225   6.8621   0.0000   0.0000  259.307   17.390  ?   ?  0.000000 17.38971 
1 1 1   25    7    5 o  248.074   19.105   47.971   7.1983   47.971   7.1983   0.0000   0.0000  248.074   19.105  ?   ?  0.000000 19.10451 
1 1 1   25    7    6 o  251.498   19.030   49.298   7.2714   49.298   7.2714   0.0000   0.0000  251.498   19.030  ?   ?  0.000000 19.03009 
1 1 1   25    7    7 o   84.365   18.299   5.7217   2.2950   7.4697   4.0360   4.8865   2.7899   96.090   26.556   78.212   22.247 17.87767 34.64330 
1 1 1   25    7    8 o  146.030   11.666   16.505   2.5858   21.587   4.2529   13.524   3.2570  166.237   16.952  131.265   16.580 34.97194 23.71214 
1 1 1   25    7    9 o  120.577   15.958   11.423   2.8727   18.476   4.2999   5.7373   3.8608  153.277   18.717   85.567   26.633 67.70980 32.55233 
1 1 1   25    7   10 o  415.686   7.7225  132.546   4.9135  133.491   6.5055  131.292   7.4971  416.810   10.197  413.072   11.858 3.738129 15.63910 
1 1 1   25    7   11 o  241.872   9.4477   44.931   3.4977   45.516   4.9924   44.366   4.9018  242.632   13.496  239.552   13.423 3.080032 19.03461 
1 1 1   25    7   12 o   79.458   18.836   5.0951   2.2559   10.146   5.0079   3.8092   2.5268  111.212   29.088   69.872   21.513 41.33997 36.17888 
1 1 1   25    7   13 o  375.478   7.1915  108.131   4.1331  112.845   7.9905  106.409   4.8293  382.499   13.648  372.319   8.4742 10.18008 16.06500 
1 1 1   25    7   14 o  186.873   9.4609   26.898   2.6973   21.154   4.6170   29.874   3.3235  164.000   18.729  196.741   11.081 -32.74094 21.76143 
1 1 1   25    7   15 o  156.208   11.260   18.876   2.6741   27.315   4.7544   14.971   3.2342  187.021   16.787  138.273   15.551 48.74759 22.88340 
1 1 1   25    7   16 o   38.714   17.714  -1.5842   2.3566   0.1326   4.5107  -2.2287   2.7638   62.520   26.683   40.701   18.824 21.81905 32.65493 
1 1 1   25    7   17 o  138.851   16.300   15.140   3.3984   17.165   4.9924   13.393   4.6392  146.254   23.066  128.459   24.488 17.79445 33.64081 
1 1 1   25    7   18 o  147.713   15.883   17.098   3.5347   12.196   5.0497   21.807   4.9495  121.626   27.739  166.046   19.869 -44.42055 34.12127 
1 1 1   25    7   19 o  359.757   7.2950   99.329   4.0170  110.819   6.8428   93.287   4.9620  379.142   11.791  348.339   9.3064 30.80313 15.02149 
1 1 1   25    7   20 o  144.931   13.021   16.353   2.8577   11.959   5.4839   17.990   3.3482  119.803   29.978  151.756   14.594 -31.95368 33.34215 
1 1 1   25    7   21 f  301.471   6.3315   69.716   2.9216   77.690   3.9030   59.554   4.4063  318.023   8.0180  278.097   10.352 39.92538 13.09360 
1 1 1   25    7   22 o   90.572   15.429   6.5385   2.0623   6.9577   2.7175   5.9693   3.1668   92.578   19.778   85.523   23.477 7.054436 30.69796 
1 1 1   25    7   23 o   87.394   22.732   6.2587   3.0696   9.6092   7.7772   5.6405   3.3408  110.091   38.000   83.430   24.531 26.66098 45.22990 
1 1 1   25    7   24 o  244.359   5.6969   45.797   2.1308   52.960   4.3688   43.561   2.4407  262.020   10.893  238.222   6.6937 23.79863 12.78548 
1 1 1   25    7   25 o  155.021   7.6895   18.468   1.8246   17.348   3.9378   18.774   2.0589  147.953   17.742  155.977   8.6579 -8.024185 19.74207 
1 1 1   25    7   26 o  178.671   7.3100   24.526   1.9991   22.158   4.3910   25.146   2.2453  167.488   17.381  180.833   8.1122 -13.34398 19.18111 
1 1 1   25    7   27 o  189.318   7.4674   27.545   2.1639   34.685   4.9227   25.834   2.4091  210.495   15.385  183.223   8.5902 27.27167 17.62103 
1 1 1   25    7   28 o  238.870   7.9952   43.886   2.9232   52.033   4.8302   39.178   3.6720  259.249   12.172  225.260   10.650 33.98965 16.17389 
1 1 1   25    7   29 o  198.266   8.3921   30.257   2.5468   31.212   4.8532   29.894   2.9918  199.259   16.049  196.594   9.9751 2.664825 18.89606 
1 1 1   25    7   30 o   89.456   16.996   6.4683   2.2420   7.7780   4.9104   6.1234   2.5200   96.735   30.024   86.440   19.510 10.29432 35.80619 
1 1 1   25    7   31 o  304.000   7.1746   71.051   3.3384   74.377   6.0156   69.571   4.0131  309.535   12.697  300.489   8.7253 9.045959 15.40589 
1 1 1   25    7   32 o  153.888   10.529   18.393   2.4651   19.060   5.2876   18.207   2.7865  152.504   23.399  152.771   12.013 -0.2670593 26.30282 
1 1 1   25    7   33 o  148.512   11.283   17.183   2.5456   9.6144   5.4826   19.263   2.8741  105.797   31.506  157.105   12.044 -51.30796 33.72976 
1 1 1   25    7   34 o  116.587   15.470   10.827   2.6924   20.979   8.5479   9.7088   2.8368  152.627   36.979  109.707   17.481 42.91999 40.90229 
1 1 1   25    7   35 o  176.102   11.170   24.142   2.9953   33.585   6.1222   21.170   3.4344  204.415   19.816  164.118   13.800 40.29721 24.14773 
1 1 1   25    7   36 f  151.855   12.591   18.076   2.9002   21.926   7.2852   17.351   3.1615  158.876   31.071  148.313   14.096 10.56319 34.11917 
1 1 1   25    7   37 o   66.602   22.413   3.4412   2.7028   3.9693   6.2448   3.3195   2.9982   82.161   32.839   66.845   23.561 15.31538 40.41720 
1 1 1   25    7   38 o  118.418   16.002   11.256   2.8262   12.505   6.5948   10.975   3.1280  117.412   34.449  116.142   18.193 1.269859 38.95804 
1 1 1   25    7   39 o  157.802   12.856   19.602   3.0782   9.9125   6.3026   22.637   3.5275  105.213   34.185  169.332   13.728 -64.11903 36.83820 
1 1 1   25    7   40 o  256.811   10.139   51.228   3.9853   48.641   6.1548   53.095   5.2297  246.858   16.382  259.821   13.194 -12.96266 21.03445 
1 1 1   25    7   41 o  140.749   15.664   15.918   3.3174   15.267   5.4743   16.295   4.1703  131.386   28.074  140.436   19.963 -9.049347 34.44760 
1 1 1   25    7   42 o  116.118   18.672   11.146   3.2061   16.873   6.5370   9.3313   3.6790  135.051   32.096  103.858   23.670 31.19259 39.88043 
1 1 1   25    7   43 o  113.742   18.673   10.741   3.1381   7.3686   5.5290   12.343   3.8115   91.176   32.008  120.725   21.410 -29.54922 38.50845 
1 1 1   25    7   44 o   64.760   24.558   2.9698   3.3502   3.8012   5.2956   2.4150   4.3260   75.281   30.187   66.345   27.038 8.936073 40.52509 
1 1 1   25    7   45 o   83.680   24.231   6.2382   3.2820   8.1442   5.9121   5.3892   3.9458   92.890   33.049   78.603   27.071 14.28662 42.72049 
1 1 1   25    7   46 o   64.456   23.668   3.2445   3.0619   0.3231   4.6711   5.4454   4.0543   59.768   26.313   78.430   27.416 -18.66221 37.99976 
1 1 1   25    7   47 o   91.832   23.807   7.6650   3.3741   6.8999   5.9098   8.0350   4.1097   85.883   32.606   92.207   27.235 -6.324539 42.48374 
1 1 1   25    8    0 o  343.295   10.891   90.652   5.7095   90.652   5.7095   90.652   5.7095  343.295   10.891  343.295   10.891 0.000000 0.000000 
1 1 1   25    8    1 o  334.003   7.6034   85.550   3.8871   91.114   6.1612   81.871   5.0101  344.216   11.694  326.498   10.025 17.71765 15.40306 
1 1 1   25    8    2 o  377.323   8.9637  109.269   5.1769   0.0000   0.0000  109.269   5.1769  ?   ?   377.323   8.9637 0.000000 8.963685 
1 1 1   25    8    3 o  309.532   14.117   73.843   6.6882   73.843   6.6882   0.0000   0.0000  309.532   14.117  ?   ?  0.000000 14.11682 
1 1 1   25    8    4 o  331.840   14.418   84.902   7.3234   84.902   7.3234   0.0000   0.0000  331.840   14.418  ?   ?  0.000000 14.41837 
1 1 1   25    8    5 o  459.380   8.1411  161.892   5.7243  175.055   9.7690  155.009   7.0642  476.720   13.388  449.190   10.275 27.53015 16.87617 
1 1 1   25    8    6 o  321.421   16.227   80.027   7.9576   80.027   7.9576   0.0000   0.0000  321.421   16.227  ?   ?  0.000000 16.22713 
1 1 1   25    8    7 o  178.604   10.172   24.586   2.7694   22.230   4.4994   26.023   3.5138  168.553   17.705  183.433   12.591 -14.87953 21.72544 
1 1 1   25    8    8 o  190.918   9.8865   28.073   2.8792   32.842   4.6416   25.091   3.6707  205.774   14.837  179.963   13.422 25.81093 20.00711 
1 1 1   25    8    9 o  203.448   9.6926   31.793   3.0183   35.844   4.8283   29.195   3.8671  215.011   14.761  194.237   13.083 20.77403 19.72424 
1 1 1   25    8   10 f  234.060   9.2662   42.070   3.3197   45.627   5.0475   39.359   4.4070  242.898   13.631  225.687   12.810 17.21083 18.70614 
1 1 1   25    8   11 f  224.887   8.0640   38.808   2.7758   44.079   5.0316   36.502   3.3280  238.671   13.833  217.949   9.9760 20.72174 17.05460 
1 1 1   25    8   12 o  149.438   13.462   17.357   3.0462   15.755   4.4222   18.804   4.2021  140.680   21.195  154.682   18.090 -14.00218 27.86510 
1 1 1   25    8   13 o  273.340   10.362   57.446   4.3352   55.933   6.8345   58.465   5.6078  268.220   16.731  275.340   13.306 -7.120209 21.37696 
1 1 1   25    8   14 o  213.150   8.6968   34.888   2.8374   36.450   4.9713   34.133   3.4555  216.628   15.087  210.372   10.767 6.256607 18.53509 
1 1 1   25    8   15 o   68.243   20.801   3.6548   2.3694   2.0118   4.3427   4.3512   2.8273   68.569   27.393   74.342   22.734 -5.772736 35.59795 
1 1 1   25    8   16 o  221.049   10.846   37.606   3.6698   40.101   5.2634   35.246   5.1193  227.153   15.226  212.763   15.833 14.39052 21.96657 
1 1 1   25    8   17 o  164.290   11.076   20.876   2.7690   33.952   5.1541   15.570   3.2831  208.647   16.267  140.980   15.469 67.66708 22.44785 
1 1 1   25    8   18 o   73.641   24.300   4.1144   3.1803   1.5564   4.9600   5.9001   4.1442   70.152   28.811   86.665   27.677 -16.51318 39.95095 
1 1 1   25    8   19 o  149.669   12.647   17.413   2.8702   14.502   5.3713   18.576   3.3956  132.765   27.342  154.247   14.554 -21.48172 30.97481 
1 1 1   25    8   20 o  482.971   7.0923  179.028   5.2430  209.034   8.9033  163.098   6.4870  520.783   11.169  460.537   9.2026 60.24677 14.47207 
1 1 1   25    8   21 o   83.687   15.564   5.6049   1.9202   7.2033   2.3213   2.1407   3.4174   94.930   16.579   63.511   24.620 31.41840 29.68147 
1 1 1   25    8   22 o  201.003   8.2301   31.051   2.5321   35.749   3.3335   24.643   3.8931  215.443   10.109  177.727   14.436 37.71658 17.62337 
1 1 1   25    8   23 o   49.478   21.269  -0.0932   2.9030   3.4518   6.0860  -1.1373   3.3030   82.025   32.536   48.918   21.799 33.10669 39.16300 
1 1 1   25    8   24 o  162.128   11.663   20.406   2.8749   24.489   4.6117   17.811   3.6767  176.283   17.315  150.374   16.232 25.90857 23.73329 
1 1 1   25    8   25 o   46.898   19.578   0.4126   2.3422   0.0222   4.2850   0.5790   2.7971   60.109   25.840   51.515   21.440 8.594288 33.57627 
1 1 1   25    8   26 o   78.919   19.733   5.0903   2.3773   5.8037   4.1563   4.7434   2.8982   85.476   27.760   76.675   22.924 8.801895 36.00154 
1 1 1   25    8   27 o  275.191   6.0890   58.121   2.5648   71.496   5.7795   54.841   2.8620  303.866   12.426  267.192   6.9981 36.67355 14.26131 
1 1 1   25    8   28 o   86.356   14.603   5.9559   1.8614   5.5529   4.3773   6.0448   2.0566   84.428   28.522   86.671   16.095 -2.242165 32.75020 
1 1 1   25    8   29 o  180.768   11.844   25.403   3.2589   31.527   5.0430   21.012   4.2703  200.046   16.620  162.809   17.406 37.23616 24.06637 
1 1 1   25    8   30 o   46.833   18.987   0.7855   2.1200  -7.3624   4.9990   2.5721   2.3409   47.288   22.841   59.735   20.835 -12.44679 30.91631 
1 1 1   25    8   31 f  129.292   12.987   13.112   2.5354   8.0822   5.4374   14.509   2.8660   98.548   31.726  135.817   13.986 -37.26899 34.67248 
1 1 1   25    8   32 o  115.727   13.543   10.561   2.3536   8.6515   5.4732   10.994   2.6070  101.167   31.747  117.783   14.786 -16.61635 35.02203 
1 1 1   25    8   33 o  174.780   9.9246   23.680   2.6441   24.575   5.6536   23.430   2.9914  174.042   21.694  173.517   11.325 0.5253143 24.47218 
1 1 1   25    8   34 o   58.829   22.227   2.1366   2.7379   7.3919   8.2958   1.4942   2.9004  100.305   38.500   56.331   22.424 43.97403 44.55378 
1 1 1   25    8   35 o  135.403   12.873   14.404   2.6359   25.743   6.3205   12.017   2.9001  176.679   23.993  122.732   15.805 53.94694 28.73047 
1 1 1   25    8   36 o   49.685   20.753   0.5671   2.6342   4.1484   7.4981   0.0628   2.8135   87.288   35.587   48.860   20.969 38.42744 41.30533 
1 1 1   25    8   37 o  151.650   12.543   18.050   2.8854   21.233   6.9412   17.385   3.1725  156.294   30.107  148.311   14.147 7.982178 33.26537 
1 1 1   25    8   38 o   72.773   22.817   4.3369   2.8278   0.3695   6.5808   5.2353   3.1317   72.274   31.538   79.152   23.867 -6.878479 39.55107 
1 1 1   25    8   39 o  315.934   7.5060   76.985   3.6297   77.575   6.8318   76.752   4.2845  314.018   14.214  314.968   8.8872 -0.9492188 16.76347 
1 1 1   25    8   40 o  180.656   13.080   25.737   3.5923   26.645   5.6961   25.138   4.6288  179.733   21.107  176.581   17.350 3.151855 27.32262 
1 1 1   25    8   41 o   58.348   23.577   1.6330   3.2574  -0.2937   6.2637   2.3471   3.8136   67.969   30.168   64.552   25.707 3.417183 39.63588 
1 1 1   25    8   42 o   54.603   22.328   1.2526   2.9627   5.1812   5.4502  -0.3951   3.5297   82.065   31.275   51.820   22.841 30.24501 38.72753 
1 1 1   25    8   43 o  120.889   18.967   12.150   3.3942   10.563   5.3385   13.227   4.3974  106.503   30.922  123.407   24.145 -16.90372 39.23219 
1 1 1   25    8   44 o  122.954   19.308   12.676   3.5139   16.721   5.2163   9.3157   4.7546  137.307   25.767  100.119   29.215 37.18785 38.95405 
1 1 1   25    8   45 o   92.813   23.370   7.6646   3.3180   7.3398   6.0684   7.8031   3.9628   89.330   33.224   92.213   26.604 -2.882591 42.56297 
1 1 1   25    8   46 o   80.938   24.117   5.8973   3.2119   6.1617   5.6308   5.7698   3.9104   83.313   31.780   79.935   26.959 3.377251 41.67385 
1 1 1   25    8   47 o   51.294   22.210   0.3980   3.2118   6.9295   5.6600  -2.7039   3.9005   85.648   32.041   46.580   21.816 39.06881 38.76295 
1 1 1   25    9    0 o  149.632   14.866   17.703   3.3277   17.703   3.3277   17.703   3.3277  149.632   14.866  149.632   14.866 0.000000 0.000000 
1 1 1   25    9    1 o  210.624   8.0559   34.031   2.5971   40.799   4.3836   30.371   3.2238  229.901   12.504  198.518   10.648 31.38342 16.42397 
1 1 1   25    9    2 o  242.855   8.6310   45.260   3.2083   0.0000   0.0000   45.260   3.2083  ?   ?   242.855   8.6310 0.000000 8.630959 
1 1 1   25    9    3 o  110.495   13.965   9.5571   2.3090   15.633   4.7097   7.6347   2.6493  139.892   22.779   97.728   18.386 42.16425 29.27339 
1 1 1   25    9    4 f  200.197   9.7282   30.781   2.9810   39.246   6.0650   28.084   3.4230  224.457   17.799  190.712   11.784 33.74454 21.34662 
1 1 1   25    9    5 o  362.277   8.2305  100.699   4.5639  102.774   7.9230   99.669   5.5833  365.080   14.179  360.184   10.127 4.896240 17.42401 
1 1 1   25    9    6 o  149.874   29.496   18.324   6.5254   18.324   6.5254   0.0000   0.0000  149.874   29.496  ?   ?  0.000000 29.49563 
1 1 1   25    9    7 o  497.338   8.3819  189.812   6.3806  200.655   10.635  183.714   7.9756  510.210   13.618  488.874   10.659 21.33624 17.29304 
1 1 1   25    9    8 o  374.460   8.6948  107.633   4.9835  116.516   8.8637  103.527   6.0261  388.486   14.906  366.964   10.729 21.52182 18.36581 
1 1 1   25    9    9 o  292.132   8.3231   65.495   3.7216   64.280   5.3854   66.606   5.1489  288.950   12.176  294.236   11.433 -5.285522 16.70254 
1 1 1   25    9   10 o  150.424   12.729   17.555   2.9034   21.375   4.5103   14.851   3.7939  165.051   18.153  137.144   18.549 27.90718 25.95426 
1 1 1   25    9   11 o   42.864   19.288  -1.2732   2.6552  -7.3860   4.3967   2.2362   3.3314   43.393   21.069   63.807   24.419 -20.41407 32.25202 
1 1 1   25    9   12 o  136.570   12.355   14.484   2.5547   18.430   4.6010   12.726   3.0716  152.577   20.198  127.252   16.132 25.32547 25.84970 
1 1 1   25    9   13 o  195.700   9.9769   29.517   2.9786   29.863   5.9511   29.401   3.4406  194.760   20.260  195.080   11.574 -0.3207703 23.33279 
1 1 1   25    9   14 o  173.686   12.582   23.375   3.3221   26.126   4.8147   20.875   4.5898  182.691   17.429  162.813   18.761 19.87846 25.60777 
1 1 1   25    9   15 o  399.859   11.016  123.074   6.7425  123.074   6.7425   0.0000   0.0000  399.859   11.016  ?   ?  0.000000 11.01646 
1 1 1   25    9   16 o  386.090   11.508  114.832   6.8010  114.832   6.8010   0.0000   0.0000  386.090   11.508  ?   ?  0.000000 11.50837 
1 1 1   25    9   17 f  468.092   11.118  168.758   7.9659  168.758   7.9659   0.0000   0.0000  468.092   11.118  ?   ?  0.000000 11.11814 
1 1 1   25    9   18 o  192.205   12.592   28.633   3.6841   23.480   5.4471   32.978   5.0016  171.900   21.148  205.569   16.022 -33.66890 26.53241 
1 1 1   25    9   19 o  272.019   8.3547   56.851   3.4786   67.418   6.2905   52.196   4.1750  295.202   13.922  260.354   10.477 34.84741 17.42347 
1 1 1   25    9   20 o  236.158   9.4141   42.903   3.4029   46.008   6.6344   41.795   3.9641  242.264   18.020  232.849   11.122 9.414169 21.17630 
1 1 1   25    9   21 o  188.827   8.2397   27.402   2.3815   29.817   3.0838   23.834   3.7484  196.480   10.290  174.856   14.126 21.62457 17.47657 
1 1 1   25    9   22 o  205.964   8.3973   32.613   2.6473   33.427   3.6029   31.658   3.9027  207.823   11.370  201.956   12.690 5.867630 17.03798 
1 1 1   25    9   23 o  173.558   9.8015   23.275   2.5931   27.270   3.6138   19.034   3.7232  187.339   12.677  155.627   15.851 31.71152 20.29725 
1 1 1   25    9   24 o   67.162   21.756   3.4828   2.5539   1.9172   3.9539   4.6036   3.3455   65.374   26.130   76.750   24.904 -11.37600 36.09697 
1 1 1   25    9   25 o  322.737   6.4599   79.955   3.1911   90.200   5.0835   73.293   4.0995  342.143   9.7069  308.624   8.6782 33.51935 13.02060 
1 1 1   25    9   26 o   58.299   20.931   2.3139   2.3766   0.1213   4.0267   3.4860   2.9441   58.648   25.125   68.447   23.390 -9.799572 34.32745 
1 1 1   25    9   27 o  364.923   6.5963  102.262   3.6844  110.455   5.9628   97.202   4.6861  378.341   10.297  355.356   8.6154 22.98526 13.42560 
1 1 1   25    9   28 o  119.339   15.378   11.281   2.7436   13.291   5.3492   10.563   3.1960  125.465   28.503  114.449   18.904 11.01580 34.20227 
1 1 1   25    9   29 o   90.770   22.174   6.8157   3.0543   8.8151   5.3709   5.8601   3.7132  102.384   31.339   84.743   26.077 17.64125 40.76921 
1 1 1   25    9   30 o  209.432   8.5556   33.785   2.7426   22.846   6.2030   36.443   3.0577  166.677   25.092  217.408   9.1887 -50.73091 26.72167 
1 1 1   25    9   31 o   84.734   17.339   5.8389   2.1731   11.668   5.2233   4.6187   2.3897  116.791   29.275   75.007   20.314 41.78357 35.63269 
1 1 1   25    9   32 o  122.078   14.634   11.795   2.6799   14.575   6.3632   11.196   2.9547  129.303   32.257  118.280   16.792 11.02316 36.36643 
1 1 1   25    9   33 o  108.820   16.739   9.5143   2.6988   8.2581   6.1501   9.8139   3.0034   99.694   33.807  110.015   18.492 -10.32027 38.53449 
1 1 1   25    9   34 o  104.724   16.389   8.8176   2.5409   6.9667   8.4600   9.0011   2.6639   99.201   38.657  105.630   17.058 -6.429024 42.25354 
1 1 1   25    9   35 o  121.160   14.347   11.637   2.6090   27.585   6.4216   8.4843   2.8553  183.183   23.441  101.807   19.023 81.37558 30.18813 
1 1 1   25    9   36 o   96.497   19.324   7.6697   2.7546   16.370   7.8311   6.4413   2.9426  133.524   37.026   87.665   21.973 45.85927 43.05465 
1 1 1   25    9   37 o   63.851   22.554   3.0056   2.7486  -3.6646   6.7544   4.3293   3.0090   64.070   29.561   73.140   23.607 -9.070900 37.83007 
1 1 1   25    9   38 o  137.438   14.191   14.984   2.9423   19.180   6.6665   13.968   3.2790  147.475   30.538  131.796   16.624 15.67896 34.76990 
1 1 1   25    9   39 o   85.305   21.107   6.1391   2.7410   8.4383   5.5284   5.3898   3.1562   97.886   32.027   79.896   23.930 17.99020 39.97963 
1 1 1   25    9   40 o  163.140   17.009   21.470   4.1848   18.816   6.2240   23.659   5.6535  145.917   28.889  168.260   22.516 -22.34299 36.62758 
1 1 1   25    9   41 o  175.284   11.279   24.098   3.0099   16.374   5.3001   27.774   3.6568  137.082   26.216  187.588   12.812 -50.50630 29.17899 
1 1 1   25    9   42 o   70.189   22.970   4.0705   2.8437   6.4320   5.1515   3.0356   3.4103   86.752   30.852   65.789   24.819 20.96317 39.59531 
1 1 1   25    9   43 o  110.987   19.788   10.365   3.2383   4.1938   5.1911   14.296   4.1433   76.724   30.170  129.730   21.627 -53.00594 37.12098 
1 1 1   25    9   44 o  128.636   15.520   13.468   2.9940   12.357   5.0307   14.078   3.7257  115.450   28.613  129.490   19.395 -14.03980 34.56686 
1 1 1   25    9   45 o   51.664   21.686   0.8804   2.8978  -4.6487   4.7286   4.2059   3.6672   48.297   23.032   71.495   25.955 -23.19785 34.70045 
1 1 1   25    9   46 o  113.758   18.983   11.010   3.1888   8.6132   5.6270   12.144   3.8703   93.478   32.320  117.443   22.347 -23.96490 39.29276 
1 1 1   25    9   47 o   89.595   24.224   7.3656   3.4016   7.3583   5.6486   7.3698   4.2608   87.224   32.129   87.904   28.062 -0.6794968 42.65818 
1 1 1   25   10    0 o   58.600   27.014   3.8738   2.6636   3.8738   2.6636   3.8738   2.6636   58.600   27.014   58.600   27.014 0.000000 0.000000 
1 1 1   25   10    1 o  137.519   7.4522   14.546   1.5628   17.487   3.3475   13.727   1.7671  149.827   14.790  133.452   8.6987 16.37428 17.15857 
1 1 1   25   10    2 o  186.949   6.9342   26.797   1.9842   0.0000   0.0000   26.797   1.9842  ?   ?   186.949   6.9342 0.000000 6.934230 
1 1 1   25   10    3 o   90.784   16.438   6.5644   2.2001   0.9397   4.2897   8.5721   2.5629   64.173   26.617  104.022   16.659 -39.84907 31.40010 
1 1 1   25   10    4 o   78.961   18.871   5.0286   2.2496   8.0648   4.9080   4.2211   2.5312  100.142   29.807   72.937   21.326 27.20521 36.65003 
1 1 1   25   10    5 o  153.018   12.088   18.132   2.8080   16.508   5.4496   18.720   3.2765  142.965   25.856  155.196   13.942 -12.23024 29.37484 
1 1 1   25   10    6 o  100.067   33.147   7.7071   5.9152   7.7071   5.9152   0.0000   0.0000  100.067   33.147  ?   ?  0.000000 33.14699 
1 1 1   25   10    7 o  152.974   11.320   18.099   2.6317   25.479   4.2763   13.600   3.3389  180.923   15.594  131.489   16.987 49.43410 23.05946 
1 1 1   25   10    8 o  271.799   9.6717   56.755   4.0236   67.011   7.4944   52.601   4.7693  293.756   16.737  261.405   11.920 32.35153 20.54785 
1 1 1   25   10    9 o  394.767   9.0249  119.676   5.4532  130.445   9.3193  114.068   6.7247  410.960   14.815  385.015   11.411 25.94455 18.70048 
1 1 1   25   10   10 o  340.194   8.2977   88.833   4.3207   86.288   5.9023   91.772   6.3422  334.827   11.517  345.220   12.003 -10.39301 16.63422 
1 1 1   25   10   11 o  378.342   7.9504  109.854   4.6041  113.728   6.3305  105.504   6.7082  384.513   10.756  370.150   11.840 14.36258 15.99638 
1 1 1   25   10   12 o   76.819   23.152   4.6732   2.9475   6.9895   4.4640   2.8828   3.9246   93.497   28.562   70.218   26.592 23.27865 39.02496 
1 1 1   25   10   13 o  220.871   11.917   37.689   4.0140   38.362   6.4763   37.270   5.1148  221.173   19.324  218.958   15.359 2.214661 24.68454 
1 1 1   25   10   14 f  147.846   15.073   17.080   3.3634   14.153   4.6804   20.207   4.8364  132.278   24.001  159.732   20.235 -27.45412 31.39271 
1 1 1   25   10   15 o  332.844   12.145   85.408   6.1873   85.408   6.1873   0.0000   0.0000  332.844   12.145  ?   ?  0.000000 12.14478 
1 1 1   25   10   16 o  365.378   10.489  102.751   5.8662  113.127   10.594   98.163   7.0447  381.239   18.155  356.609   12.906 24.62918 22.27519 
1 1 1   25   10   17 o  180.914   15.342   25.540   4.2085   27.105   9.3113   25.138   4.7179  179.734   35.105  178.973   17.444 0.7617493 39.20055 
1 1 1   25   10   18 o   96.836   25.044   7.7013   3.7398   5.7806   9.1973   8.0817   4.0935  101.474   40.077   99.101   26.481 2.372780 48.03529 
1 1 1   25   10   19 o   46.803   20.722  -0.8726   2.9376  -2.8988   9.2294  -0.6441   3.0987   80.399   36.088   49.048   21.516 31.35109 42.01500 
1 1 1   25   10   20 o  313.447   8.1052   75.492   3.8886   73.007   6.8120   76.693   4.7361  306.903   14.501  315.640   9.8031 -8.736908 17.50378 
1 1 1   25   10   21 o  290.015   6.4315   64.539   2.8550   68.341   3.7232   59.113   4.4479  298.196   8.1572  276.951   10.492 21.24506 13.29029 
1 1 1   25   10   22 f  227.187   7.6296   39.654   2.6531   40.187   3.4870   38.920   4.0885  228.398   9.9744  224.136   11.961 4.262024 15.57400 
1 1 1   25   10   23 o  164.079   10.502   20.844   2.6237   22.709   3.6881   18.932   3.7333  170.491   14.264  155.150   15.948 15.34094 21.39621 
1 1 1   25   10   24 o  256.623   10.498   50.797   4.1234   50.832   9.7711   50.790   4.5482  250.672   25.837  256.385   11.590 -5.713120 28.31722 
1 1 1   25   10   25 o  181.488   10.937   25.520   3.0241   22.555   4.3004   28.420   4.2534  169.131   16.836  190.656   14.689 -21.52525 22.34252 
1 1 1   25   10   26 o  143.822   12.047   16.114   2.6275   15.907   4.4455   16.226   3.2573  140.306   21.375  143.627   15.040 -3.320877 26.13628 
1 1 1   25   10   27 o   89.335   19.616   6.5261   2.6088   8.2286   4.8134   5.8179   3.1044   99.242   29.513   84.060   23.313 15.18205 37.60998 
1 1 1   25   10   28 o  161.527   11.713   20.296   2.8762   23.587   5.1526   18.807   3.4665  171.704   19.979  154.693   14.822 17.01195 24.87656 
1 1 1   25   10   29 o  318.212   9.9143   78.152   4.8289   82.871   6.2053   70.907   7.6890  326.903   12.402  300.317   16.794 26.58588 20.87700 
1 1 1   25   10   30 o  101.797   22.700   8.5951   3.4469   9.3013   6.3418   8.2989   4.1064  105.130   34.297   99.273   26.521 5.857079 43.35497 
1 1 1   25   10   31 o  217.031   12.628   36.706   4.1770   30.324   7.8526   39.224   4.9327  190.761   27.704  223.757   14.480 -32.99643 31.25976 
1 1 1   25   10   32 o  119.060   18.605   11.455   3.2795   14.757   7.5078   10.676   3.6457  128.495   36.475  113.828   21.718 14.66758 42.45089 
1 1 1   25   10   33 o   45.645   20.701  -1.5572   3.1289 -11.3800   6.3109   1.6442   3.6028   49.702   24.370   61.457   24.809 -11.75559 34.77640 
1 1 1   25   10   34 o   47.812   20.176   0.3387   2.5298  -9.5622   12.486   0.7626   2.5833   80.564   38.133   50.301   20.741 30.26355 43.40847 
1 1 1   25   10   35 o  117.424   14.837   10.970   2.6072   17.852   9.4344   10.401   2.7128  137.609   41.409  113.942   15.996 23.66714 44.39116 
1 1 1   25   10   36 o   52.888   21.102   1.2999   2.5739   7.7194   7.8253   0.5211   2.7256   99.284   37.561   50.121   21.035 49.16254 43.05028 
1 1 1   25   10   37 o   83.268   20.701   5.8020   2.6271   9.6958   6.6772   5.0889   2.8576  104.882   35.228   78.037   22.614 26.84549 41.86171 
1 1 1   25   10   38 o  263.677   8.4286   53.724   3.4017   57.017   7.4523   52.857   3.8232  266.334   18.393  261.182   9.5635 5.152069 20.73119 
1 1 1   25   10   39 o   75.137   22.321   4.7344   2.7543   1.0344   5.9709   5.7345   3.1043   70.647   30.437   82.087   23.507 -11.43936 38.45736 
1 1 1   25   10   40 o  164.132   15.361   21.550   3.8141   16.725   5.1725   27.300   5.6464  139.447   25.160  181.911   20.645 -42.46410 32.54546 
1 1 1   25   10   41 o   46.261   20.150  -0.1513   2.6755   9.3972   5.0638  -3.8492   3.1513  101.629   30.282   39.046   18.671 62.58235 35.57539 
1 1 1   25   10   42 f  119.294   17.861   11.721   3.1611   9.8470   5.1915   12.825   3.9849  103.266   30.637  122.787   22.012 -19.52115 37.72459 
1 1 1   25   10   43 o  147.456   13.501   17.369   3.0134   15.937   5.1858   18.099   3.7027  133.867   26.247  149.046   16.507 -15.17966 31.00645 
1 1 1   25   10   44 o   82.656   23.162   6.0380   3.0477   2.5597   4.9281   8.1922   3.8783   68.793   28.531   94.918   25.950 -26.12579 38.56713 
1 1 1   25   10   45 o   90.585   21.062   7.1758   2.8650   1.6452   4.6321   10.602   3.6461   63.852   27.140  109.778   22.456 -45.92664 35.22606 
1 1 1   25   10   46 o   52.652   22.382   0.8127   3.1509  -3.6759   5.4179   3.1067   3.8733   53.774   25.350   66.101   26.039 -12.32743 36.34068 
1 1 1   25   11    0 o   44.066   20.277   2.1792   1.5004   2.1792   1.5004   2.1792   1.5004   44.066   20.277   44.066   20.277 0.000000 0.000000 
1 1 1   25   11    1 o  118.355   6.7789   10.775   1.2229   10.738   1.7452   10.811   1.7142  117.828   9.7647  118.258   9.5518 -0.4293365 13.65967 
1 1 1   25   11    2 o  484.802   10.112  180.608   7.5039   0.0000   0.0000  180.608   7.5039  ?   ?   484.802   10.112 0.000000 10.11243 
1 1 1   25   11    3 o  356.331   7.5083   97.393   4.0951   93.504   6.1366  100.516   5.4985  348.613   11.500  361.691   9.9320 -13.07776 15.19550 
1 1 1   25   11    4 o  243.955   8.6643   45.686   3.2353   56.639   5.5932   40.178   3.9661  271.047   13.482  228.532   11.338 42.51503 17.61591 
1 1 1   25   11    5 o   54.759   21.205   1.5186   2.5330   3.8484   4.8590   0.6492   2.9683   79.203   29.676   53.568   22.173 25.63522 37.04474 
1 1 1   25   11    6 o  126.639   29.670   13.204   5.6505   13.204   5.6505   0.0000   0.0000  126.639   29.670  ?   ?  0.000000 29.67009 
1 1 1   25   11    7 o  180.972   11.846   25.319   3.2634   27.990   6.1502   24.272   3.8500  188.196   21.751  176.754   14.355 11.44177 26.06117 
1 1 1   25   11    8 o  272.009   9.8679   56.862   4.1085   70.963   7.4907   50.794   4.9134  302.375   16.244  256.764   12.502 45.61124 20.49822 
1 1 1   25   11    9 o  258.197   10.552   51.269   4.1703   66.352   7.7698   45.166   4.9426  291.999   17.464  241.617   13.417 50.38164 22.02349 
1 1 1   25   11   10 o  110.942   20.876   9.9012   3.4149   8.5024   6.8075   10.372   3.9474  105.138   35.569  113.017   23.582 -7.879387 42.67614 
1 1 1   25   11   11 o  215.691   12.634   35.985   4.1529   42.926   7.8119   33.251   4.9031  233.243   22.147  206.719   15.611 26.52419 27.09630 
1 1 1   25   11   12 o  110.227   27.480   9.9951   4.6201   0.0000   0.0000   9.9951   4.6201  ?   ?   110.227   27.480 0.000000 27.47961 
1 1 1   25   11   13 o  182.962   15.602   26.103   4.3274   19.237   7.9110   29.035   5.1694  151.373   34.863  192.531   17.741 -41.15814 39.11771 
1 1 1   25   11   14 o  105.455   21.891   9.0207   3.4179   7.3657   4.9084   10.579   4.7621   96.008   30.054  113.237   27.703 -17.22898 40.87430 
1 1 1   25   11   15 o  294.310   9.7875   66.621   4.4091   65.601   5.9049   67.905   6.6283  291.452   13.237  296.230   14.618 -4.778503 19.72071 
1 1 1   25   11   16 o  253.173   8.6668   49.253   3.3585   52.621   5.8134   47.566   4.1146  260.314   14.650  248.520   10.817 11.79433 18.21046 
1 1 1   25   11   17 o  162.809   13.917   20.650   3.4348   30.312   5.5424   14.626   4.3766  196.276   18.674  134.839   21.962 61.43732 28.82731 
1 1 1   25   11   18 o  105.127   20.349   8.9372   3.1560   16.340   5.3949   5.0860   3.8912  141.413   25.878   81.316   26.882 60.09772 37.31382 
1 1 1   25   11   19 o  214.766   11.720   35.697   3.8382   39.948   6.0887   32.894   4.9444  225.659   17.772  205.170   15.868 20.48860 23.82483 
1 1 1   25   11   20 o  232.444   11.315   41.686   4.0256   44.382   6.3239   39.849   5.2197  237.915   17.488  226.053   15.174 11.86171 23.15343 
1 1 1   25   11   21 o  200.747   7.8911   30.969   2.4247   30.098   3.0710   32.409   3.9509  197.378   10.200  204.318   12.696 -6.940018 16.28602 
1 1 1   25   11   22 o  266.776   7.1497   54.658   2.9195   63.976   4.0407   44.480   4.2229  288.300   9.1567  239.995   11.496 48.30450 14.69675 
1 1 1   25   11   23 o   53.647   20.675   1.5501   2.3992  -0.7257   3.4745   3.6242   3.3170   51.659   22.719   70.780   24.795 -19.12157 33.62951 
1 1 1   25   11   24 o  180.729   13.394   25.458   3.6789   20.433   8.8017   26.522   4.0496  152.828   37.829  184.210   14.479 -31.38220 40.50561 
1 1 1   25   11   25 o  237.197   8.9619   43.320   3.2537   51.861   5.0091   37.085   4.2795  258.758   12.647  218.406   12.858 40.35222 18.03560 
1 1 1   25   11   26 o  415.788   7.1189  132.836   4.5306  149.901   6.5854  117.500   6.2428  440.919   9.7578  390.154   10.454 50.76520 14.30029 
1 1 1   25   11   27 o  285.594   7.6462   62.720   3.3424   66.922   5.6536   60.462   4.1443  293.819   12.571  280.009   9.6695 13.81036 15.85986 
1 1 1   25   11   28 o  181.103   16.475   25.874   4.5168   25.231   6.0367   26.691   6.8082  176.424   22.895  180.440   25.350 -4.015839 34.15834 
1 1 1   25   11   29 o  129.137   21.043   13.560   4.0162   16.815   6.0671   11.021   5.3582  140.874   29.100  113.451   30.288 27.42278 42.00228 
1 1 1   25   11   30 o   46.660   20.742  -0.8958   2.9718  -8.9059   6.2357   1.4581   3.3803   52.800   25.506   59.437   24.018 -6.637291 35.03399 
1 1 1   25   11   31 o  207.927   10.757   33.542   3.4117   34.157   6.7748   33.333   3.9489  205.587   21.865  206.778   12.536 -1.190582 25.20375 
1 1 1   25   11   32 o  263.070   9.4144   53.436   3.7908   52.417   7.0782   53.846   4.4889  256.932   18.115  263.616   11.125 -6.684052 21.25794 
1 1 1   25   11   33 o   77.962   25.095   4.9093   3.4021   14.889   7.8873   2.6281   3.7709  128.159   37.694   66.852   25.876 61.30704 45.72130 
1 1 1   25   11   34 o  173.538   15.863   23.862   4.1670   0.0000   0.0000   23.862   4.1670  ?   ?   173.538   15.863 0.000000 15.86294 
1 1 1   25   11   35 o   52.524   23.361  -0.9556   3.7744   0.0000   0.0000  -0.9556   3.7744  ?   ?    52.524   23.361 0.000000 23.36081 
1 1 1   25   11   36 o   82.466   25.343   5.6863   3.5083   7.2610   8.2954   5.3433   3.8716   98.497   38.308   80.929   26.817 17.56802 46.76208 
1 1 1   25   11   37 o   61.560   24.595   1.9141   3.5015  -0.9254   7.3215   2.7561   3.9871   72.430   32.352   67.883   26.515 4.547401 41.82922 
1 1 1   25   11   38 o  106.627   17.552   9.2825   2.7649   15.919   5.5665   7.1089   3.1857  135.145   27.837   91.381   22.839 43.76396 36.00697 
1 1 1   25   11   39 o  192.506   10.032   28.870   2.9458   20.709   5.2852   32.547   3.5480  157.287   22.603  203.913   11.413 -46.62640 25.32091 
1 1 1   25   11   40 o  154.189   16.107   19.137   3.7452   14.103   5.0012   25.564   5.6512  126.835   26.610  175.295   21.513 -48.46059 34.21893 
1 1 1   25   11   41 o  134.425   14.507   14.476   2.9376   8.7474   5.0349   17.432   3.6170   98.119   30.394  146.793   16.377 -48.67458 34.52565 
1 1 1   25   11   42 o   90.825   19.833   6.9991   2.6799   1.3397   4.7744   9.6024   3.2382   64.769   27.543  106.402   20.628 -41.63324 34.41081 
1 1 1   25   11   43 o  102.591   17.988   8.7941   2.7216   12.812   4.7358   6.8125   3.3257  119.129   26.640   87.663   24.057 31.46583 35.89450 
1 1 1   25   11   44 o   71.381   22.640   4.3961   2.7767   1.4556   4.8637   5.8179   3.3820   64.547   27.632   80.722   24.895 -16.17490 37.19255 
1 1 1   25   11   45 o   93.392   21.723   7.6940   3.0467  -0.2485   5.0283   12.302   3.8299   59.810   26.756  118.649   21.895 -58.83862 34.57300 
1 1 1   25   11   46 o   52.310   21.986   0.9899   2.9848 -11.9993   5.9706   5.3179   3.4464   44.777   22.270   76.784   25.295 -32.00647 33.70120 
1 1 1   25   12    0 o   28.359   17.712   0.3649   1.5730   0.3649   1.5730   0.3649   1.5730   28.359   17.712   28.359   17.712 0.000000 0.000000 
1 1 1   25   12    1 o  245.062   5.6043   46.022   2.1022   46.503   3.4462   45.736   2.6529  246.071   9.1497  244.205   7.0974 1.865875 11.57976 
1 1 1   25   12    2 o   72.222   12.805   4.1372   1.3637   4.4776   1.5668   3.0738   2.7694   74.967   14.174   65.669   22.675 9.298775 26.74088 
1 1 1   25   12    3 o  217.042   6.2072   36.110   2.0621   34.376   2.4128   40.809   3.9717  211.691   7.4463  230.301   11.267 -18.60945 13.50541 
1 1 1   25   12    4 o   84.407   19.323   5.7550   2.4426   8.9344   4.0170   3.8898   3.0767  104.596   25.355   72.076   23.907 32.51991 34.84839 
1 1 1   25   12    5 o  385.986   8.1418  114.346   4.8102  125.739   7.4399  106.163   6.3053  404.080   12.029  371.467   11.090 32.61282 16.36081 
1 1 1   25   12    6 o  166.143   21.182   21.863   5.2641   21.863   5.2641   0.0000   0.0000  166.143   21.182  ?   ?  0.000000 21.18212 
1 1 1   25   12    7 o  110.565   16.282   9.6605   2.6730   11.645   3.7677   7.6497   3.7929  120.484   21.205   96.844   25.307 23.63957 33.01658 
1 1 1   25   12    8 o  359.005   7.7484   98.904   4.2578  109.567   5.9615   87.801   6.0832  377.469   10.318  337.659   11.770 39.81052 15.65255 
1 1 1   25   12    9 o  190.476   10.968   28.011   3.1842   34.819   4.5970   21.731   4.4149  211.846   14.260  166.442   17.597 45.40390 22.64909 
1 1 1   25   12   10 o  193.717   11.132   28.980   3.2869   26.851   4.5374   31.331   4.7678  185.501   16.141  200.595   15.652 -15.09410 22.48422 
1 1 1   25   12   11 o  273.144   10.807   57.420   4.5180   70.982   8.0405   51.161   5.4618  301.852   17.478  256.987   13.937 44.86487 22.35443 
1 1 1   25   12   12 o  101.571   28.464   8.4535   4.6027   0.0000   0.0000   8.4535   4.6027  ?   ?   101.571   28.464 0.000000 28.46398 
1 1 1   25   12   13 o  363.172   8.7484  101.335   4.8631  103.596   6.5411   98.539   7.2716  366.651   11.655  357.219   13.299 9.431702 17.68385 
1 1 1   25   12   14 o  341.173   9.0766   89.468   4.7399   91.775   6.2206   86.276   7.3189  345.032   11.779  333.958   14.318 11.07428 18.54049 
1 1 1   25   12   15 o  191.286   13.190   28.398   3.8383   32.391   5.2102   23.661   5.6759  203.487   16.880  172.286   22.028 31.20078 27.75202 
1 1 1   25   12   16 o  345.241   9.4453   91.677   4.9912   92.824   6.6352   90.182   7.5752  346.744   12.502  341.259   14.502 5.484680 19.14725 
1 1 1   25   12   17 o  162.884   14.549   20.712   3.5890   22.611   5.6100   19.397   4.6697  168.108   22.357  156.212   19.988 11.89598 29.98946 
1 1 1   25   12   18 o  216.487   9.7606   36.076   3.2343   35.744   5.8445   36.222   3.8831  213.287   18.072  216.330   11.771 -3.043640 21.56786 
1 1 1   25   12   19 o  121.775   15.444   11.695   2.8140   14.487   5.4977   10.704   3.2756  132.074   28.061  115.489   19.204 16.58497 34.00334 
1 1 1   25   12   20 o  207.712   10.532   33.344   3.3374   38.707   6.1637   31.119   3.9697  221.745   18.324  200.122   13.031 21.62280 22.48488 
1 1 1   25   12   21 o   90.469   17.998   6.6153   2.4045   7.2880   2.9458   5.2724   4.1623   94.430   20.931   82.762   27.813 11.66769 34.80920 
1 1 1   25   12   22 o  209.283   9.6661   33.741   3.0964   36.761   3.9097   28.658   5.0715  217.799   11.771  190.695   17.573 27.10304 21.15117 
1 1 1   25   12   23 o  187.929   10.340   27.319   2.9630   31.387   4.3787   23.882   4.0243  200.532   14.361  174.566   15.213 25.96619 20.92066 
1 1 1   25   12   24 o  138.144   17.134   15.137   3.5453   15.219   9.0136   15.122   3.8561  131.767   40.642  137.592   18.802 -5.825470 44.78065 
1 1 1   25   12   25 o  296.008   8.1576   67.405   3.6960   64.331   5.3757   70.162   5.0900  288.265   12.184  301.356   11.035 -13.09076 16.43795 
1 1 1   25   12   26 o  229.814   10.547   40.783   3.7100   49.632   6.3496   36.195   4.5715  251.372   16.596  215.361   13.943 36.01141 21.67590 
1 1 1   25   12   27 o  104.646   27.924   9.2391   4.5559   15.427   6.0490   1.1284   6.9255  134.644   30.106   77.712   33.113 56.93169 44.75311 
1 1 1   25   12   28 o  239.142   9.3584   44.101   3.4255   49.990   6.7393   42.050   3.9777  251.637   17.608  233.144   11.146 18.49355 20.83972 
1 1 1   25   12   29 o  108.864   20.546   9.6918   3.2981   19.063   6.2956   6.1472   3.8719  150.432   28.383   86.475   26.632 63.95645 38.92063 
1 1 1   25   12   30 o   52.062   21.965   0.4174   2.9973  -6.2630   6.1666   2.4839   3.4297   56.589   26.789   64.621   24.766 -8.032124 36.48288 
1 1 1   25   12   31 o  181.450   12.238   25.680   3.3791   33.377   6.9102   23.261   3.8738  202.699   22.660  171.875   14.872 30.82484 27.10457 
1 1 1   25   12   32 o  120.897   18.465   11.811   3.3085   11.080   6.6929   12.048   3.8061  112.431   35.079  121.128   21.307 -8.696747 41.04256 
1 1 1   25   12   33 o   94.682   22.905   7.5150   3.2833   14.750   6.9796   5.4591   3.7207  128.431   34.689   81.757   26.236 46.67313 43.49313 
1 1 1   25   12   34 o   41.626   19.876  -4.3861   3.5453   6.4018   13.034  -5.2480   3.6842  107.629   45.628   40.984   19.749 66.64520 49.71846 
1 1 1   25   12   35 o  189.971   15.051   28.527   4.3405   0.0000   0.0000   28.527   4.3405  ?   ?   189.971   15.051 0.000000 15.05068 
1 1 1   25   12   36 o  107.547   24.050   9.8212   3.8597   9.9763   10.079   9.7946   4.1782  109.428   42.319  106.745   25.848 2.683357 49.58810 
1 1 1   25   12   37 o  125.108   19.630   12.856   3.6354   22.201   7.0157   9.4254   4.2506  159.128   29.902  104.166   26.574 54.96133 40.00383 
1 1 1   25   12   38 o   87.195   24.988   6.5361   3.5065   12.157   6.1090   3.7745   4.2822  115.141   32.977   73.358   27.778 41.78236 43.11743 
1 1 1   25   12   39 o  152.227   14.873   18.505   3.4212   17.420   5.1817   19.343   4.5552  142.756   24.602  153.258   19.887 -10.50217 31.63498 
1 1 1   25   12   40 o   81.462   26.126   5.6817   3.6900  -0.7905   4.9997   13.425   5.4686   59.976   26.766  121.728   29.630 -61.75171 39.92904 
1 1 1   25   12   41 o   50.567   22.740  -1.0840   3.6837  -4.5172   4.8906   3.4181   5.6004   50.369   23.848   75.589   30.780 -25.22025 38.93702 
1 1 1   25   12   42 o   37.848   17.746  -2.2879   2.5933   0.1026   4.7028  -3.3324   3.1086   60.235   26.463   39.684   18.854 20.55025 32.49208 
1 1 1   25   12   43 o   94.267   21.167   7.7013   2.9794   14.881   4.8909   3.4646   3.7570  128.988   25.675   68.326   25.984 60.66232 36.52889 
1 1 1   25   12   44 o   48.079   21.028  -0.0395   2.9401  -0.9596   4.9109   0.4745   3.6707   57.549   26.032   54.844   23.746 2.704910 35.23543 
1 1 1   25   12   45 o   63.259   22.824   3.1983   2.8295   5.5666   5.0317   2.1030   3.4217   79.758   30.133   59.807   24.165 19.95037 38.62553 
1 1 1   25   13    0 o  145.777   9.6292   16.508   2.1271   16.508   2.1271   16.508   2.1271  145.777   9.6292  145.777   9.6292 0.000000 0.000000 
1 1 1   25   13    1 o  231.067   6.0625   40.928   2.1442   37.816   3.4922   42.811   2.7165  221.772   10.288  236.221   7.5131 -14.44870 12.73918 
1 1 1   25   13    2 o  506.690   5.9855  196.794   4.6421  198.177   5.6371  193.879   8.1823  508.281   7.2458  502.064   10.647 6.216309 12.87900 
1 1 1   25   13    3 o  434.935   5.8604  144.994   3.9014  148.602   4.7393  137.409   6.8717  440.165   7.0345  422.669   10.622 17.49579 12.73982 
1 1 1   25   13    4 o   63.550   13.034   3.2269   1.2253   3.0494   1.3196   4.3359   3.2991   61.627   14.271   75.537   24.742 -13.90939 28.56244 
1 1 1   25   13    5 o  282.143   13.050   61.392   5.6358   61.392   5.6358   0.0000   0.0000  282.143   13.050  ?   ?  0.000000 13.05008 
1 1 1   25   13    6 o  352.876   8.5317   95.616   4.6081  107.480   7.1460   87.170   6.0292  373.417   12.503  336.437   11.708 36.98013 17.12872 
1 1 1   25   13    7 o  366.123   7.5843  102.862   4.2503  112.439   5.7483   91.311   6.3128  382.443   9.8198  344.268   11.980 38.17508 15.49027 
1 1 1   25   13    8 o  239.684   9.4034   44.150   3.4498   47.127   4.7220   40.743   5.0523  246.922   12.535  229.153   14.479 17.76950 19.15094 
1 1 1   25   13    9 o  352.684   8.1009   95.497   4.3731  106.053   5.9355   82.963   6.4676  371.277   10.445  327.934   12.885 43.34320 16.58660 
1 1 1   25   13   10 o  148.167   14.284   17.123   3.1993   17.303   4.4607   16.931   4.5909  147.578   20.284  145.712   21.206 1.866425 29.34532 
1 1 1   25   13   11 f  232.001   10.392   41.418   3.6904   50.454   5.2373   32.508   5.2009  255.247   13.453  203.979   16.808 51.26843 21.52837 
1 1 1   25   13   12 o   67.150   26.252   2.2799   3.9109   1.1473   6.7597   2.8498   4.7949   78.338   33.015   74.279   29.059 4.058983 43.98209 
1 1 1   25   13   13 o  303.512   11.553   71.005   5.3669   75.707   8.7039   68.121   6.8171  311.206   18.354  296.172   15.088 15.03415 23.75924 
1 1 1   25   13   14 o  196.570   13.043   29.977   3.9020   34.211   5.3506   25.167   5.7026  209.148   16.857  177.934   21.366 31.21368 27.21496 
1 1 1   25   13   15 o  166.215   15.787   21.628   3.9682   23.215   5.3223   19.642   5.9546  170.916   20.771  155.396   25.950 15.52011 33.23913 
1 1 1   25   13   16 o  103.653   23.694   8.8148   3.6772   6.3587   5.0001   11.708   5.4269   90.739   30.485  118.360   29.935 -27.62145 42.72508 
1 1 1   25   13   17 f  177.519   20.623   25.050   5.4991   25.050   5.4991   0.0000   0.0000  177.519   20.623  ?   ?  0.000000 20.62259 
1 1 1   25   13   18 o  280.763   10.896   60.784   4.6823   72.082   6.5028   48.620   6.7476  305.018   13.929  248.943   17.826 56.07449 22.62267 
1 1 1   25   13   19 o  274.267   8.6997   57.857   3.6521   56.141   6.3036   58.724   4.4808  268.323   15.413  275.981   10.607 -7.658203 18.71042 
1 1 1   25   13   20 o  326.960   6.5415   82.053   3.2737   92.472   4.3791   68.853   4.9290  346.801   8.2496  298.765   10.778 48.03604 13.57318 
1 1 1   25   13   21 o  313.119   7.0179   75.293   3.3634   81.129   4.5761   68.436   4.9604  324.623   9.2097  297.801   10.882 26.82187 14.25631 
1 1 1   25   13   22 o  121.223   14.631   11.577   2.6599   8.9757   3.9288   13.778   3.6142  104.003   24.991  131.379   18.484 -27.37646 31.08401 
1 1 1   25   13   23 o  190.697   13.697   28.358   3.9713   34.434   6.8763   25.317   4.8646  207.380   21.999  178.898   18.010 28.48196 28.43086 
1 1 1   25   13   24 o   83.440   24.078   5.7044   3.2458   7.3817   5.1504   4.5994   4.1804   95.318   30.898   78.997   27.824 16.32072 41.57944 
1 1 1   25   13   25 o  346.458   8.5685   92.403   4.5439  106.525   6.0424   74.022   6.8933  371.409   10.629  308.381   14.604 63.02850 18.06239 
1 1 1   25   13   26 o  111.023   26.810   10.363   4.5045   5.2758   5.7680   18.315   7.2118   87.040   32.388  145.741   33.085 -58.70127 46.29901 
1 1 1   25   13   27 o  175.641   11.674   23.988   3.1207   22.431   6.2733   24.500   3.5974  164.964   25.681  177.084   13.371 -12.12006 28.95276 
1 1 1   25   13   28 o   38.644   18.264  -3.1174   2.8452  -2.8334   5.9782  -3.2006   3.2351   62.467   28.439   41.978   19.727 20.48910 34.61142 
1 1 1   25   13   29 o  128.666   17.657   13.257   3.3857   11.871   6.2222   13.839   4.0354  116.796   33.224  130.409   20.924 -13.61335 39.26348 
1 1 1   25   13   30 o  187.274   11.873   27.313   3.3857   35.134   6.6662   24.594   3.9304  208.845   21.145  176.861   14.651 31.98404 25.72487 
1 1 1   25   13   31 o   88.985   23.215   6.6206   3.1952   7.1315   6.1639   6.4328   3.7364   94.868   33.746   87.767   25.981 7.101112 42.58858 
1 1 1   25   13   32 o  124.751   17.841   12.530   3.3098   17.962   6.6140   10.716   3.8228  143.875   30.952  113.491   22.798 30.38426 38.44196 
1 1 1   25   13   33 f  148.401   15.454   17.467   3.4589   20.054   6.9213   16.606   3.9933  152.035   30.798  143.540   18.614 8.494888 35.98576 
1 1 1   25   13   34 o   48.128   21.995  -2.0109   3.6193  -5.7552   13.559  -1.7237   3.7556   88.446   41.176   50.013   22.681 38.43322 47.00969 
1 1 1   25   13   35 o  198.404   13.089   30.887   3.9526   37.505   8.2891   28.939   4.4967  211.432   26.173  191.070   15.509 20.36165 30.42281 
1 1 1   25   13   36 o  182.295   13.041   26.126   3.6147   23.976   6.1393   27.267   4.4720  169.150   24.419  185.061   15.943 -15.91003 29.16331 
1 1 1   25   13   37 o   45.991   20.993  -1.7330   3.2843  -0.5592   5.2120  -2.5061   4.2298   62.416   27.620   50.994   23.479 11.42194 36.25095 
1 1 1   25   13   38 o  180.873   12.862   25.788   3.5376   13.772   5.1260   36.717   4.8884  125.160   27.508  214.928   14.953 -89.76801 31.30902 
1 1 1   25   13   39 o   76.287   25.795   4.7990   3.5802   9.9819   5.9401   1.8420   4.4867  104.120   33.123   65.766   27.245 38.35335 42.88810 
1 1 1   25   13   40 o   44.817   21.627  -5.9758   4.4552  -1.2972   5.7180 -13.2045   7.1075   62.463   28.188   50.807   25.095 11.65581 37.74010 
1 1 1   25   13   41 f   42.331   20.028  -3.3892   3.4373   0.4157   5.6055  -5.6820   4.3513   65.944   28.933   44.447   21.430 21.49687 36.00479 
1 1 1   25   13   42 o  139.690   18.175   16.159   3.7941   10.966   5.0030   23.188   5.8206  108.337   29.414  163.512   23.968 -55.17541 37.94265 
1 1 1   25   13   43 o   90.342   25.709   7.4225   3.7250   5.5436   4.8278   10.186   5.8557   80.333   29.682  101.735   32.942 -21.40148 44.34205 
1 1 1   25   13   44 o  121.241   19.480   12.509   3.4925   4.4471   4.8534   21.167   5.0297   75.047   29.270  156.697   21.540 -81.64966 36.34184 
1 1 1   25   13   45 o   55.350   23.237   1.2196   3.3277   1.3396   4.7124   1.1004   4.6997   62.682   27.022   61.862   26.826 0.8202896 38.07687 
1 1 1   25   14    0 o  512.616   10.545  201.879   8.2660  201.879   8.2660  201.879   8.2660  512.616   10.545  512.616   10.545 0.000000 0.000000 
1 1 1   25   14    1 o   77.753   14.926   4.8280   1.7117   2.7848   2.0252   9.9386   3.2030   60.439   19.352  111.437   19.488 -50.99792 27.46450 
1 1 1   25   14    2 o  265.752   6.3796   54.152   2.5950   55.191   3.1028   51.736   4.7338  268.185   7.5587  259.141   11.934 9.043793 14.12675 
1 1 1   25   14    3 o   47.572   17.333   1.4370   1.6375   1.5541   1.8697   1.0513   3.3930   50.144   18.482   58.447   23.896 -8.303181 30.20977 
1 1 1   25   14    4 o  217.319   6.9336   36.226   2.3064   37.810   2.6921   31.858   4.4713  221.941   7.9249  202.516   14.521 19.42464 16.54280 
1 1 1   25   14    5 o  107.106   10.873   8.9184   1.7578   8.9184   1.7578   0.0000   0.0000  107.106   10.873  ?   ?  0.000000 10.87280 
1 1 1   25   14    6 o  157.630   13.429   19.317   3.2092   22.513   4.8341   16.800   4.2912  169.029   19.015  145.533   19.776 23.49568 27.43459 
1 1 1   25   14    7 o  219.171   11.246   37.087   3.7600   39.745   5.6363   34.955   5.0471  225.823   16.419  211.878   15.674 13.94460 22.69909 
1 1 1   25   14    8 o  143.187   14.021   15.992   3.0335   19.191   4.0091   11.708   4.6396  156.339   17.029  119.489   26.099 36.84906 31.16301 
1 1 1   25   14    9 o   93.776   21.717   7.1579   3.0559   7.6906   4.1415   6.5213   4.5275   96.965   26.939   90.859   28.919 6.105423 39.52256 
1 1 1   25   14   10 o  151.775   14.380   17.974   3.3009   22.643   4.5127   12.602   4.8408  169.766   17.624  123.914   26.334 45.85166 31.68736 
1 1 1   25   14   11 o  193.254   14.111   29.035   4.1452   38.973   6.8571   23.312   5.2036  222.338   20.376  171.564   20.203 50.77376 28.69367 
1 1 1   25   14   12 o  234.870   13.295   42.759   4.7598   49.110   7.2989   38.060   6.2784  250.102   19.213  220.120   18.815 29.98212 26.89185 
1 1 1   25   14   13 o  131.956   18.900   13.851   3.7083   15.892   4.9764   11.303   5.5607  140.038   24.085  116.368   30.755 23.67031 39.06360 
1 1 1   25   14   14 o   67.418   27.445   1.6469   4.4513  -0.5482   7.2217   2.9919   5.6528   75.829   33.066   78.735   31.317 -2.906151 45.54179 
1 1 1   25   14   15 o  300.619   12.561   69.820   5.7797   80.290   8.9575   62.352   7.5651  320.175   18.355  282.297   17.596 37.87793 25.42639 
1 1 1   25   14   16 o  125.659   27.316   13.087   5.1040   13.087   5.1040   0.0000   0.0000  125.659   27.316  ?   ?  0.000000 27.31611 
1 1 1   25   14   17 o  108.568   30.339   9.8486   5.2369   9.8486   5.2369   0.0000   0.0000  108.568   30.339  ?   ?  0.000000 30.33948 
1 1 1   25   14   18 o  225.564   12.849   39.489   4.4178   43.139   5.9947   35.152   6.5356  234.657   16.802  210.465   20.550 24.19165 26.54418 
1 1 1   25   14   19 o  174.320   8.4801   23.370   2.2626   24.493   2.4082   14.917   6.6078  178.423   8.8182  132.369   32.785 46.05331 33.95003 
1 1 1   25   14   20 o  355.820   6.6458   97.195   3.6195  106.999   4.8791   85.197   5.3974  372.959   8.5469  332.341   10.610 40.61826 13.62469 
1 1 1   25   14   21 o  119.373   14.695   11.233   2.6283   6.8395   3.7331   15.553   3.7012   91.063   25.675  139.960   17.671 -48.89713 31.16825 
1 1 1   25   14   22 o  225.147   9.0989   39.034   3.1356   40.188   4.5579   37.996   4.3205  227.329   13.155  221.113   12.821 6.216263 18.36945 
1 1 1   25   14   23 o  170.229   13.837   22.646   3.5741   16.235   8.8684   23.890   3.9053  135.516   40.002  174.628   14.749 -39.11179 42.63407 
1 1 1   25   14   24 o  137.230   14.589   14.813   3.0174   18.548   4.6763   12.147   3.9497  151.879   20.651  122.001   21.959 29.87797 30.14389 
1 1 1   25   14   25 o  183.829   14.874   26.495   4.1493   28.851   4.9569   20.978   7.5847  191.159   17.123  156.419   32.731 34.74019 36.93896 
1 1 1   25   14   26 o  214.577   11.709   35.753   3.8311   39.284   5.2841   31.839   5.5627  223.763   15.524  200.342   18.344 23.42151 24.03126 
1 1 1   25   14   27 o  318.233   9.5587   78.132   4.6560   82.148   6.1576   72.770   7.1149  325.431   12.362  305.242   15.229 20.18976 19.61428 
1 1 1   25   14   28 o  146.442   15.016   16.917   3.3182   16.845   5.7316   16.953   4.0696  141.521   27.450  145.427   18.717 -3.906815 33.22394 
1 1 1   25   14   29 o  136.029   15.215   14.643   3.1137   12.733   5.7219   15.446   3.7113  121.342   30.765  138.921   17.868 -17.57824 35.57752 
1 1 1   25   14   30 o  249.796   9.6361   48.196   3.6843   54.229   6.4786   45.313   4.4791  262.312   16.216  241.259   12.169 21.05283 20.27362 
1 1 1   25   14   31 o  246.208   11.239   47.001   4.2355   37.570   6.5778   53.681   5.5358  216.258   20.102  261.898   13.859 -45.64061 24.41625 
1 1 1   25   14   32 o   62.720   24.055   2.3601   3.2371   3.6928   6.1811   1.8564   3.7999   81.413   32.625   63.423   25.522 17.98965 41.42157 
1 1 1   25   14   33 o   53.746   22.628   0.5711   3.1704   8.4152   5.9134  -2.5931   3.7558   99.402   33.152   47.621   21.996 51.78189 39.78577 
1 1 1   25   14   34 o  167.411   15.331   22.225   3.8847   33.345   9.3145   19.883   4.2742  195.134   32.317  157.196   18.094 37.93796 37.03746 
1 1 1   25   14   35 o   50.239   22.422  -0.9960   3.5094   7.2941   7.1229  -3.6535   4.0329   95.837   35.926   46.947   22.050 48.89040 42.15317 
1 1 1   25   14   36 o  112.310   20.311   10.461   3.3631   10.408   5.3825   10.495   4.3074  107.897   30.970  110.149   25.972 -2.251656 40.41831 
1 1 1   25   14   37 o  106.795   20.848   9.5541   3.2857   8.6106   5.0850   10.230   4.3050   98.424   30.554  108.275   26.249 -9.850578 40.28105 
1 1 1   25   14   38 o   56.414   23.279   1.1981   3.2574  -1.9736   5.0092   3.5219   4.2877   57.135   26.020   71.904   27.659 -14.76887 37.97472 
1 1 1   25   14   39 o  170.570   15.389   23.310   3.9745   21.109   5.2838   26.178   6.0316  158.401   22.419  176.318   22.890 -17.91711 32.03984 
1 1 1   25   14   40 o  105.893   22.982   9.6855   3.6181   6.5505   4.9516   13.277   5.2996   86.863   30.302  120.843   29.018 -33.97993 41.95497 
1 1 1   25   14   41 o   53.401   23.363  -0.0274   3.6319   0.8028   4.8092  -1.1295   5.5408   62.913   27.209   61.281   27.692 1.631676 38.82284 
1 1 1   25   14   42 f  100.252   24.213   8.9624   3.6736   2.7581   5.6496   13.507   4.8354   72.183   30.289  122.029   26.636 -49.84615 40.33456 
1 1 1   25   14   43 o  137.963   17.921   15.864   3.6950   19.259   5.5592   13.177   4.9454  146.349   25.758  119.093   27.659 27.25655 37.79558 
1 1 1   25   14   44 o   57.587   24.097   1.4250   3.5605  -0.2827   5.2966   2.8328   4.8092   60.881   27.332   68.401   28.261 -7.520885 39.31555 
1 1 1   25   15    0 o  168.075   10.150   21.909   2.5895   21.909   2.5895   21.909   2.5895  168.075   10.150  168.075   10.150 0.000000 0.000000 
1 1 1   25   15    1 o  405.391   6.2501  126.016   3.8782  130.948   4.7198  115.762   6.8048  413.079   7.4648  387.667   11.468 25.41214 13.68347 
1 1 1   25   15    2 o  111.987   12.306   9.7835   2.0746   10.770   2.4239   7.0813   4.0113  117.300   13.762   93.351   26.718 23.94936 30.05404 
1 1 1   25   15    3 o  302.638   6.5708   70.246   3.0437   69.374   3.5767   72.535   5.7958  300.625   7.7729  306.698   12.346 -6.073181 14.58925 
1 1 1   25   15    4 o  133.520   12.042   13.852   2.4346   13.852   2.4346   0.0000   0.0000  133.520   12.042  ?   ?  0.000000 12.04207 
1 1 1   25   15    5 o   84.002   15.987   5.6463   1.9804   6.6028   2.2287   2.0564   4.3175   90.878   16.635   68.496   27.330 22.38167 31.99424 
1 1 1   25   15    6 o  292.103   6.6348   65.448   2.9664   65.145   3.4021   66.408   6.0585  291.320   7.6298  293.199   13.500 -1.879211 15.50690 
1 1 1   25   15    7 o   78.720   24.290   4.8994   3.2191   5.5557   4.6295   4.2851   4.4792   86.041   29.331   79.270   28.699 6.770424 41.03574 
1 1 1   25   15    8 o   73.147   23.680   4.1149   3.0259   10.437   3.9439  -4.9326   4.7179  113.160   23.537   50.261   23.682 62.89878 33.38911 
1 1 1   25   15    9 o  224.581   10.729   38.840   3.6882   36.897   4.7695   41.731   5.8170  217.897   14.381  231.241   16.544 -13.34418 21.92091 
1 1 1   25   15   10 o  293.816   9.2709   66.381   4.1694   73.478   5.4984   56.780   6.3955  308.703   11.637  270.159   15.532 38.54413 19.40729 
1 1 1   25   15   11 o  150.504   18.569   17.923   4.1870   19.670   6.6270   16.762   5.4017  154.448   29.100  143.446   25.538 11.00204 38.71699 
1 1 1   25   15   12 o   70.672   25.484   3.4020   3.5269   1.2319   4.4871   6.9100   5.7049   66.035   27.292   95.041   32.559 -29.00587 42.48486 
1 1 1   25   15   13 o  182.393   14.427   25.931   3.9947   31.018   5.2836   19.143   6.1033  198.767   17.547  152.848   27.079 45.91968 32.26702 
1 1 1   25   15   14 o  177.157   14.654   24.496   3.9378   23.580   4.9985   25.995   6.3933  172.576   19.251  179.788   23.819 -7.211868 30.62571 
1 1 1   25   15   15 o  182.903   17.810   26.348   4.9228   32.103   7.7563   22.465   6.3704  199.096   26.079  166.119   25.899 32.97653 36.75402 
1 1 1   25   15   16 o  257.933   22.145   52.893   8.6581   52.893   8.6581   0.0000   0.0000  257.933   22.145  ?   ?  0.000000 22.14511 
1 1 1   25   15   17 o   80.493   27.128   4.9499   3.9596   4.0382   5.2174   6.1881   6.0807   80.599   30.628   92.468   33.444 -11.86914 45.34917 
1 1 1   25   15   18 o  275.154   6.1767   58.093   2.6014   60.611   2.7855   40.912   7.2766  281.016   6.4758  226.836   21.204 54.18039 22.17059 
1 1 1   25   15   19 o  351.161   6.2799   94.636   3.3754   98.672   3.6773   73.034   8.5069  358.503   6.7014  304.830   18.317 53.67325 19.50486 
1 1 1   25   15   20 o  118.129   18.478   11.183   3.2315   11.304   3.6619   10.757   6.8703  118.052   21.037  113.091   35.582 4.960472 41.33570 
1 1 1   25   15   21 o   53.946   21.210   1.4067   2.5654   2.9779   3.9597   0.2701   3.3678   70.137   26.675   54.516   23.156 15.62112 35.32355 
1 1 1   25   15   22 o  290.163   9.4249   64.877   4.1859   69.151   7.5727   62.997   5.0230  296.961   16.728  285.453   11.496 11.50842 20.29796 
1 1 1   25   15   23 o  149.039   19.151   17.753   4.2678   21.576   5.2604   10.390   7.2999  163.681   21.518  111.397   36.819 52.28413 42.64600 
1 1 1   25   15   24 o  163.701   16.220   21.142   4.0107   24.116   4.7187   13.402   7.6127  174.381   17.934  123.924   37.176 50.45696 41.27563 
1 1 1   25   15   25 o  188.613   11.457   27.628   3.2918   32.957   5.1248   23.885   4.2950  204.539   16.510  173.987   16.318 30.55162 23.21362 
1 1 1   25   15   26 o  180.902   12.330   25.493   3.3938   20.982   5.1692   28.911   4.4993  161.090   21.501  191.773   15.459 -30.68341 26.48204 
1 1 1   25   15   27 o  190.236   11.985   28.167   3.4719   26.225   5.1026   29.842   4.7378  181.385   18.644  194.570   16.052 -13.18488 24.60233 
1 1 1   25   15   28 o   79.789   23.614   5.2326   3.0871  -0.2690   4.7729   9.1894   4.0477   61.769   26.909  104.422   25.537 -42.65368 37.09766 
1 1 1   25   15   29 o  179.452   13.053   25.185   3.5608   28.895   5.8684   23.023   4.4797  189.421   20.571  170.096   17.454 19.32442 26.97782 
1 1 1   25   15   30 o  105.945   21.310   9.2738   3.3359   14.228   5.8285   6.8602   4.0682  128.200   30.200   90.434   27.187 37.76599 40.63441 
1 1 1   25   15   31 o  106.146   19.844   9.2411   3.1056   9.0195   5.3216   9.3555   3.8243  102.337   31.169  105.402   24.214 -3.064529 39.46891 
1 1 1   25   15   32 o   88.178   22.889   6.5296   3.1162   12.697   5.5264   3.6545   3.7734  120.613   30.046   71.769   26.286 48.84455 39.92154 
1 1 1   25   15   33 o   85.662   23.676   6.1831   3.2077   1.5535   5.6772   8.3544   3.8878   71.767   30.251   98.895   25.515 -27.12768 39.57441 
1 1 1   25   15   34 o  164.917   15.975   21.664   3.9820   21.101   9.0634   21.798   4.4327  149.445   39.153  164.635   17.878 -15.19043 43.04148 
1 1 1   25   15   35 o  169.375   14.798   22.758   3.7979   22.373   6.3643   22.971   4.7331  161.904   26.606  168.454   18.671 -6.549667 32.50345 
1 1 1   25   15   36 o  253.274   9.8575   49.783   3.8214   38.752   5.5942   59.433   5.2325  220.053   16.734  275.624   12.403 -55.57147 20.82950 
1 1 1   25   15   37 o   66.762   24.862   3.1501   3.4004  -3.4645   5.1718   8.1869   4.5130   54.736   25.465   96.162   28.573 -41.42635 38.27388 
1 1 1   25   15   38 o   90.961   26.422   7.2610   3.8969   13.184   5.2764   0.1536   5.7801  121.209   28.856   66.748   29.331 54.46047 41.14545 
1 1 1   25   15   39 o  129.195   34.400   15.953   6.9237   0.0000   0.0000   15.953   6.9237  ?   ?   129.195   34.400 0.000000 34.40039 
1 1 1   25   15   40 o   64.596   25.278   2.6767   3.6289   2.0979   4.9381   3.3563   5.3507   68.010   28.412   74.071   30.115 -6.061020 41.40204 
1 1 1   25   15   41 f   38.467   18.550  -4.4126   3.2640  -4.0695   4.7380  -4.7225   4.5030   49.817   23.552   46.999   22.430 2.818928 32.52416 
1 1 1   25   15   42 o   68.389   24.787   3.7577   3.3428   2.8632   4.6624   4.7038   4.7952   68.674   28.037   76.526   29.295 -7.852074 40.54974 
1 1 1   25   15   43 o   47.806   21.479  -0.7749   3.2779  -3.7388   4.4721   2.6661   4.8186   48.298   22.849   68.045   28.216 -19.74707 36.30682 
1 1 1   25   15   44 o   94.482   23.602   8.0859   3.4034  -0.9365   4.6617   18.384   4.9803   55.780   25.286  143.982   23.402 -88.20180 34.45336 
1 1 1   25   16    0 o  346.073   12.279   92.365   6.4860   92.365   6.4860   92.365   6.4860  346.073   12.279  346.073   12.279 0.000000 0.000000 
1 1 1   25   16    1 o   85.121   17.736   5.8393   2.2358   5.4094   2.6087   7.0286   4.3394   81.606   20.818   93.292   28.086 -11.68595 34.96028 
1 1 1   25   16    2 o  465.573   6.5744  166.266   4.6850  171.331   5.7122  155.856   8.1891  472.373   7.9004  449.601   11.900 22.77237 14.28364 
1 1 1   25   16    3 o   66.531   22.056   3.3225   2.6188   3.3225   2.6188   0.0000   0.0000   66.531   22.056  ?   ?  0.000000 22.05607 
1 1 1   25   16    4 o   94.056   16.694   7.0674   2.3153   7.6854   2.6640   5.1594   4.6808   97.792   18.475   84.189   29.456 13.60300 34.77034 
1 1 1   25   16    5 o  114.774   13.993   10.334   2.4073   11.184   2.7704   7.7119   4.8641  119.144   15.564   97.599   29.815 21.54469 33.63264 
1 1 1   25   16    6 o  127.080   12.980   12.599   2.4893   12.870   2.8543   11.736   5.0880  128.090   14.833  118.993   28.341 9.096336 31.98767 
1 1 1   25   16    7 o   51.223   20.189   1.1981   2.3295   0.2551   2.6423   4.4884   4.9358   48.907   20.628   81.867   30.051 -32.95980 36.44983 
1 1 1   25   16    8 o  205.251   8.2827   32.366   2.6021   33.640   2.9262   27.548   5.6886  209.166   9.1399  186.565   20.245 22.60104 22.21301 
1 1 1   25   16    9 o  225.890   7.9244   39.192   2.7399   42.158   3.0882   28.225   5.9385  234.204   8.6148  188.617   20.922 45.58691 22.62634 
1 1 1   25   16   10 o  195.596   15.367   29.860   4.5636   37.486   7.1550   24.630   5.9253  217.307   21.805  175.477   22.585 41.83044 31.39376 
1 1 1   25   16   11 o   88.565   28.622   6.1915   4.4221   6.4733   6.4249   5.9378   6.0956   94.966   34.373   91.829   33.443 3.137398 47.95789 
1 1 1   25   16   12 o  220.770   12.281   37.761   4.1334   40.248   5.2379   33.656   6.7295  227.240   15.146  205.700   21.701 21.53937 26.46411 
1 1 1   25   16   13 o   87.937   26.618   6.2571   3.8899   5.6279   4.7457   7.5453   6.7906   86.335   29.691  100.046   35.438 -13.71090 46.23186 
1 1 1   25   16   14 o  127.207   21.842   13.092   4.0996   17.647   5.2313   5.8427   6.5997  147.435   24.008   92.772   34.620 54.66302 42.12939 
1 1 1   25   16   15 o  188.609   15.370   27.825   4.3987   26.607   5.3782   30.286   7.6446  183.214   19.477  192.912   26.597 -9.697906 32.96601 
1 1 1   25   16   16 o  125.512   9.7679   12.206   1.8618   12.206   1.8618   0.0000   0.0000  125.512   9.7679  ?   ?  0.000000 9.767866 
1 1 1   25   16   17 o  186.706   7.6776   26.787   2.1941   29.477   2.3150   3.0334   6.8792  195.852   7.7224   83.812   34.119 112.0400 34.98177 
1 1 1   25   16   18 o  297.491   6.1549   67.913   2.8026   71.169   2.9869   43.933   8.1053  304.505   6.4085  234.295   22.894 70.21005 23.77410 
1 1 1   25   16   19 o  281.269   6.4448   60.729   2.7746   59.848   2.9333   68.215   8.5508  279.165   6.8648  294.103   19.098 -14.93808 20.29455 
1 1 1   25   16   20 f  150.093   14.252   17.654   3.2350   19.776   3.6285   9.4304   7.1427  158.709   15.120  107.570   36.434 51.13966 39.44650 
1 1 1   25   16   21 o  180.041   18.357   25.695   4.9881   22.638   6.5305   29.976   7.7282  165.758   26.642  190.937   27.214 -25.17862 38.08388 
1 1 1   25   16   22 o  219.350   12.653   37.410   4.2300   38.186   4.9989   35.453   7.9377  220.968   14.866  208.667   25.375 12.30145 29.40924 
1 1 1   25   16   23 o  202.147   10.871   31.666   3.3513   36.465   5.0931   28.001   4.4505  215.627   15.535  188.812   15.538 26.81488 21.97194 
1 1 1   25   16   24 o  168.331   12.111   22.065   3.0996   26.102   4.5647   18.610   4.2223  181.865   16.580  152.742   18.433 29.12326 24.79245 
1 1 1   25   16   25 o  207.880   10.589   33.482   3.3582   39.840   4.9379   28.011   4.5807  225.689   14.369  188.564   16.023 37.12509 21.52185 
1 1 1   25   16   26 o  202.671   11.264   31.895   3.4803   38.299   5.3501   27.196   4.5825  220.619   15.951  185.612   16.294 35.00687 22.80220 
1 1 1   25   16   27 o  283.172   10.254   61.980   4.4444   63.014   5.8968   60.620   6.7624  284.481   13.542  277.673   15.978 6.808014 20.94537 
1 1 1   25   16   28 o  111.640   21.993   10.295   3.6244   11.603   5.0139   8.8629   5.2454  116.461   28.385  101.933   30.922 14.52740 41.97525 
1 1 1   25   16   29 o  135.462   14.829   14.517   3.0244   9.9643   4.7862   17.543   3.9021  107.753   28.559  148.157   17.548 -40.40375 33.51971 
1 1 1   25   16   30 o   63.908   23.098   2.8647   2.8997   1.3226   4.7681   3.7697   3.6527   66.753   27.905   72.079   25.942 -5.325806 38.10093 
1 1 1   25   16   31 o   64.051   24.094   2.6494   3.2093  -1.2109   4.9831   5.3856   4.1953   59.959   26.743   82.132   27.922 -22.17279 38.66263 
1 1 1   25   16   32 o   64.770   24.685   2.6333   3.3956   1.2048   5.4857   3.5205   4.3234   69.771   29.591   73.148   27.860 -3.377075 40.64236 
1 1 1   25   16   33 o  124.888   22.552   13.006   4.1523   26.514   8.6265   8.9331   4.7372  172.197   33.936  101.263   29.050 70.93396 44.67212 
1 1 1   25   16   34 o  228.361   15.051   41.269   5.2315   19.698   13.491   45.087   5.6756  137.413   49.797  238.424   15.639 -101.0106 52.19505 
1 1 1   25   16   35 o   95.473   23.318   7.7846   3.3781   10.714   5.2235   5.6783   4.4290  109.480   30.193   83.156   28.678 26.32460 41.64176 
1 1 1   25   16   36 o   61.693   24.056   2.2680   3.2776   9.2824   5.2631  -2.1756   4.1890  101.610   31.008   51.410   23.557 50.19976 38.94165 
1 1 1   25   16   37 o  141.476   22.381   16.845   4.6852   14.942   5.3764   22.851   9.5522  129.980   27.861  151.110   40.483 -21.13063 49.14407 
1 1 1   25   16   38 o   69.912   26.129   3.5652   3.7621   3.0662   5.3776   4.0435   5.2649   73.834   30.124   77.069   30.359 -3.235153 42.76812 
1 1 1   25   16   39 o  102.777   24.078   9.2492   3.7214   5.1047   5.0239   14.288   5.5395   80.212   30.151  124.947   29.447 -44.73517 42.14539 
1 1 1   25   16   40 o   76.986   24.955   5.1285   3.3597   1.3417   4.9104   8.4615   4.6067   65.004   27.794   95.751   28.964 -30.74607 40.14243 
1 1 1   25   16   41 o   87.892   23.883   6.8904   3.2967   5.3648   4.6159   8.4789   4.7101   79.344   29.071   95.027   29.391 -15.68376 41.33952 
1 1 1   25   16   42 o   75.737   24.684   5.0586   3.2852  -0.5605   4.5720   11.056   4.7235   56.723   25.434  108.348   28.207 -51.62530 37.98050 
1 1 1   25   16   43 f   42.288   19.819  -2.4991   3.2286  -2.0580   4.5930  -2.9301   4.5394   52.679   24.330   50.340   23.564 2.339062 33.87056 
1 1 1   25   17    0 f  203.250   18.755   32.715   5.7206   32.715   5.7206   32.715   5.7206  203.250   18.755  203.250   18.755 0.000000 0.000000 
1 1 1   25   17    1 o  375.219   7.1382  108.055   4.0996  107.035   4.8556  110.586   7.6505  373.223   8.4998  378.286   13.213 -5.063385 15.71071 
1 1 1   25   17    2 o   70.237   22.975   3.7639   2.8452   3.7639   2.8452   0.0000   0.0000   70.237   22.975  ?   ?  0.000000 22.97532 
1 1 1   25   17    3 o  309.099   7.6782   73.363   3.6327   73.556   4.2776   72.865   6.8795  309.307   9.0353  306.705   14.654 2.602173 17.21595 
1 1 1   25   17    4 o  138.301   12.977   14.905   2.7149   15.883   3.1302   11.934   5.4548  142.488   14.557  119.606   29.882 22.88296 33.23899 
1 1 1   25   17    5 f   44.675   19.561  -0.5157   2.5506  -2.7780   2.8844   7.5970   5.4621   40.164   18.795   97.773   31.826 -57.60822 36.96175 
1 1 1   25   17    6 o  124.303   15.121   12.151   2.8177   11.335   3.1971   14.993   5.9631  119.302   18.074  134.135   29.817 -14.83296 34.86700 
1 1 1   25   17    7 o  356.864   7.5965   97.797   4.1494   96.516   4.8375  101.363   8.0717  354.291   8.9206  361.664   14.581 -7.373230 17.09350 
1 1 1   25   17    8 o  252.752   8.2717   49.092   3.2001   49.432   3.6222   47.886   6.8304  253.482   9.3359  247.065   18.190 6.416687 20.44583 
1 1 1   25   17    9 o  309.094   7.5039   73.370   3.5502   77.146   4.0305   60.300   7.4985  316.825   8.3114  277.501   17.747 39.32343 19.59664 
1 1 1   25   17   10 o  200.704   11.121   31.159   3.4030   32.809   3.9646   26.541   6.6327  205.650   12.657  181.407   24.515 24.24243 27.58945 
1 1 1   25   17   11 o   89.081   19.923   6.4607   2.6484   5.8237   2.8876   9.8351   6.6458   84.394   22.094  109.407   35.059 -25.01359 41.44055 
1 1 1   25   17   12 o   70.575   13.981   3.9917   1.4568   3.7519   1.4899   9.2168   6.9552   68.267   14.694  107.092   35.954 -38.82536 38.84052 
1 1 1   25   17   13 o  171.602   7.2037   22.614   1.8921   22.648   1.9635   22.174   7.0821  171.709   7.4708  163.516   29.376 8.192825 30.31145 
1 1 1   25   17   14 o   94.486   11.763   6.9994   1.6643   6.7758   1.7186   10.372   6.6745   92.817   12.408  111.564   35.067 -18.74661 37.19698 
1 1 1   25   17   15 o  208.489   6.9953   33.378   2.2323   33.378   2.2323   0.0000   0.0000  208.489   6.9953  ?   ?  0.000000 6.995311 
1 1 1   25   17   16 o   96.993   11.678   7.3700   1.6989   7.6512   1.7543   3.1294   6.8135   98.820   11.834   83.800   34.015 15.01967 36.01509 
1 1 1   25   17   17 o   30.240   14.232  -1.8105   1.6950  -1.9861   1.7510   0.8019   6.7530   30.336   14.335   76.493   32.648 -46.15653 35.65617 
1 1 1   25   17   18 o  358.315   6.1927   98.536   3.3964  100.351   3.6763   87.961   8.8748  361.522   6.6436  334.890   17.373 26.63290 18.60017 
1 1 1   25   17   19 o   71.155   20.879   4.0817   2.4225   4.2467   2.5880   2.9138   6.8832   72.638   21.650   83.134   34.018 -10.49567 40.32304 
1 1 1   25   17   20 o   80.328   29.224   4.5465   4.6528   9.8761   6.1534  -2.5684   7.1098  108.307   33.609   69.741   31.455 38.56661 46.03301 
1 1 1   25   17   21 f  145.783   14.811   16.711   3.2590   16.784   3.5786   16.357   7.8896  145.693   16.328  136.482   36.888 9.211319 40.34035 
1 1 1   25   17   22 o  184.833   13.677   26.688   3.8420   30.775   4.3028   10.616   8.5332  198.379   14.266  113.450   39.767 84.92864 42.24877 
1 1 1   25   17   23 o  126.055   20.311   12.869   3.7857   10.459   4.1918   23.529   8.8163  111.927   25.088  163.874   36.121 -51.94688 43.97912 
1 1 1   25   17   24 o  368.289   7.9492  104.382   4.4811  111.980   6.3327   96.763   6.3417  380.541   10.872  353.446   11.722 27.09473 15.98809 
1 1 1   25   17   25 f   73.760   23.573   4.3302   3.0059  -0.5652   4.3811   8.6843   4.1319   58.416   25.606  101.479   26.363 -43.06260 36.75125 
1 1 1   25   17   26 o   70.984   22.971   3.9775   2.8477   11.228   4.0874  -2.8613   3.9696  116.186   23.785   48.826   22.574 67.36002 32.79208 
1 1 1   25   17   27 o  279.572   9.3895   60.334   4.0180   62.087   5.0943   57.448   6.5360  282.916   11.764  270.236   15.871 12.67953 19.75557 
1 1 1   25   17   28 o  190.057   11.572   28.120   3.3503   33.969   4.7009   22.082   4.7762  207.858   14.874  165.818   19.172 42.04083 24.26512 
1 1 1   25   17   29 o  277.584   8.6160   59.431   3.6608   61.950   5.4690   57.386   4.9275  282.138   12.664  271.831   11.843 10.30695 17.33876 
1 1 1   25   17   30 o  219.036   10.453   37.162   3.5046   35.729   5.2863   38.285   4.6813  212.357   16.390  220.898   13.916 -8.540649 21.50148 
1 1 1   25   17   31 o  183.668   12.204   26.374   3.4115   29.096   5.3539   24.514   4.4264  190.382   18.611  175.435   16.685 14.94681 24.99494 
1 1 1   25   17   32 o  198.157   11.674   30.656   3.5251   31.844   5.4774   29.815   4.6056  199.252   18.159  193.901   15.651 5.351120 23.97325 
1 1 1   25   17   33 o   88.842   25.750   6.7454   3.7049   4.9417   8.1796   7.2110   4.1556   90.655   37.088   91.581   27.465 -0.9260559 46.15060 
1 1 1   25   17   34 o   73.845   26.628   4.1344   3.8506   3.9267   6.1280   4.2699   4.9499   80.676   32.429   78.014   29.787 2.661865 44.03364 
1 1 1   25   17   35 o   56.733   24.028   0.7058   3.6088  -2.7720   5.3092   3.6927   4.9203   57.205   26.326   75.191   29.431 -17.98611 39.48738 
1 1 1   25   17   36 o  113.784   31.346   11.846   5.6336   11.846   5.6336   0.0000   0.0000  113.784   31.346  ?   ?  0.000000 31.34599 
1 1 1   25   17   37 o   64.134   24.829   2.6262   3.4721   9.6511   5.4373  -2.2109   4.5119  102.614   31.552   53.249   24.418 49.36513 39.89692 
1 1 1   25   17   38 o   99.096   25.638   8.7038   3.9183   11.822   5.1181   4.2888   6.0905  113.732   29.239   80.093   32.283 33.63916 43.55527 
1 1 1   25   17   39 o  145.435   17.587   17.378   3.8355   13.974   4.9873   22.306   6.0006  124.691   26.920  159.565   25.422 -34.87460 37.02620 
1 1 1   25   17   40 o  137.768   16.856   15.598   3.4803   10.576   4.8200   21.070   5.0305  106.336   28.871  157.279   21.456 -50.94274 35.97102 
1 1 1   25   17   41 o  190.354   12.433   28.837   3.6026   17.785   4.9355   41.442   5.2708  142.409   23.459  226.172   15.316 -83.76274 28.01623 
1 1 1   25   17   42 o  107.051   21.289   10.001   3.3654   6.3019   4.7030   13.882   4.8179   82.978   29.481  122.863   26.406 -39.88478 39.57785 
1 1 1   25   18    0 o  236.241   18.176   43.877   6.4830   43.877   6.4830   43.877   6.4830  236.241   18.176  236.241   18.176 0.000000 0.000000 
1 1 1   25   18    1 o  156.326   25.050   19.830   5.7915   19.830   5.7915   0.0000   0.0000  156.326   25.050  ?   ?  0.000000 25.05002 
1 1 1   25   18    2 o  312.402   8.0641   74.983   3.8560   75.251   4.5060   74.248   7.4529  312.741   9.4132  308.773   15.823 3.967957 18.41096 
1 1 1   25   18    3 o  237.006   9.4713   43.222   3.4359   43.719   3.9403   41.646   7.0189  238.170   10.809  229.651   20.172 8.519089 22.88561 
1 1 1   25   18    4 o  135.719   14.911   14.452   3.0465   11.930   3.4123   24.357   6.7628  122.208   18.848  173.063   26.363 -50.85481 32.40798 
1 1 1   25   18    5 o  340.924   7.9232   89.295   4.1345   89.842   4.7732   87.650   8.2741  341.753   9.1248  335.760   16.100 5.993134 18.50586 
1 1 1   25   18    6 o  158.176   13.203   19.485   3.1673   19.939   3.5771   17.835   6.8151  159.673   14.804  145.770   31.467 13.90369 34.77544 
1 1 1   25   18    7 o  179.528   12.023   24.999   3.2848   23.159   3.7014   31.821   7.1269  172.314   14.159  199.113   23.860 -26.79950 27.74476 
1 1 1   25   18    8 o  281.038   8.1886   60.705   3.5225   62.512   3.9548   53.768   7.7482  285.053   9.0641  261.230   19.519 23.82312 21.52079 
1 1 1   25   18    9 o  258.627   9.6708   51.499   3.8283   50.841   4.4591   53.345   7.4662  256.678   11.350  260.406   18.859 -3.727570 22.01132 
1 1 1   25   18   10 o  338.103   7.4448   87.803   3.8528   89.443   4.2851   80.883   8.8021  341.113   8.2071  321.244   17.973 19.86899 19.75845 
1 1 1   25   18   11 o  145.052   13.473   16.431   2.9571   16.656   3.2165   15.200   7.5161  145.799   14.610  132.962   36.033 12.83629 38.88194 
1 1 1   25   18   12 o  154.288   12.292   18.517   2.8787   18.920   3.1178   16.188   7.4961  155.779   13.200  137.206   35.443 18.57320 37.82136 
1 1 1   25   18   13 o   93.519   12.193   6.8719   1.7038   7.0134   1.7493   4.2597   7.5166   94.450   12.400   90.229   36.041 4.220490 38.11444 
1 1 1   25   18   14 o  105.095   11.316   8.6242   1.7916   8.6242   1.7916   0.0000   0.0000  105.095   11.316  ?   ?  0.000000 11.31595 
1 1 1   25   18   15 o  206.859   7.1108   32.866   2.2515   33.375   2.3441   26.804   8.0886  208.430   7.3476  179.245   30.579 29.18422 31.44933 
1 1 1   25   18   16 o  236.995   6.8593   43.133   2.4882   44.307   2.6081   31.237   8.3007  240.171   7.0948  194.538   28.742 45.63277 29.60480 
1 1 1   25   18   17 o  171.845   10.805   22.886   2.8275   22.620   3.0383   24.602   7.7248  170.657   11.702  171.302   30.583 -0.6447906 32.74573 
1 1 1   25   18   18 o  253.742   8.6967   49.561   3.3776   53.025   3.6784   30.936   8.5287  262.378   9.1593  192.768   29.872 69.61037 31.24446 
1 1 1   25   18   19 o  132.924   10.784   13.733   2.1752   14.299   2.2699   7.3683   7.6122  135.605   11.032  100.365   37.234 35.24068 38.83416 
1 1 1   25   18   20 o   82.475   22.873   5.5944   2.9883   3.1178   3.2345   20.028   7.8086   67.329   24.386  152.102   34.352 -84.77290 42.12765 
1 1 1   25   18   21 o  127.597   19.030   13.089   3.6031   14.795   3.9764   5.2611   8.5167  135.581   19.741   95.731   38.319 39.84952 43.10540 
1 1 1   25   18   22 o  216.788   11.684   36.490   3.8628   36.234   4.2628   37.665   9.1339  215.667   12.974  212.920   28.763 2.746948 31.55342 
1 1 1   25   18   23 o   44.982   20.437  -1.6412   3.0672  -1.9759   3.3114   0.3799   8.1372   46.043   21.041   80.958   35.203 -34.91510 41.01221 
1 1 1   25   18   24 o  162.684   14.256   20.781   3.5141   22.492   3.8492   12.216   8.6110  169.063   15.032  118.612   40.005 50.45126 42.73556 
1 1 1   25   18   25 o   37.044   17.438  -2.6303   2.5471  -1.2976   3.3938  -4.3492   3.8543   48.775   21.889   44.388   21.061 4.387447 30.37552 
1 1 1   25   18   26 o  169.367   11.953   22.366   3.0789   21.139   4.0802   23.989   4.6919  163.248   16.558  173.501   17.926 -10.25233 24.40338 
1 1 1   25   18   27 o  137.892   15.712   15.093   3.2570   15.585   4.1424   14.296   5.2713  138.630   20.109  129.749   27.402 8.881149 33.98875 
1 1 1   25   18   28 f  236.777   9.9085   43.349   3.5910   50.295   4.8974   35.272   5.2812  254.245   12.585  211.103   16.475 43.14186 20.73141 
1 1 1   25   18   29 o  195.894   11.989   29.941   3.5776   29.799   4.9083   30.102   5.2255  193.701   16.719  194.235   17.774 -0.5336761 24.40123 
1 1 1   25   18   30 o   39.240   18.783  -4.1518   3.2076  -6.4712   4.5396  -1.8393   4.5329   45.188   21.813   55.244   24.998 -10.05548 33.17668 
1 1 1   25   18   31 o  191.589   11.648   28.659   3.3996   27.919   5.1093   29.246   4.5539  186.508   18.127  192.053   15.627 -5.544739 23.93270 
1 1 1   25   18   32 o   65.339   25.437   2.5389   3.6602   9.4385   7.8325   0.6112   4.1401  104.585   37.937   60.052   25.595 44.53300 45.76365 
1 1 1   25   18   33 o  138.017   17.041   15.363   3.5236   18.514   5.5880   13.284   4.5399  147.325   25.716  124.850   24.632 22.47556 35.60934 
1 1 1   25   18   34 o  133.003   19.049   14.502   3.7673   14.665   5.3748   14.343   5.2818  129.174   27.993  127.825   27.789 1.348961 39.44381 
1 1 1   25   18   35 o   90.826   27.360   7.2179   4.1170   10.692   5.4014   2.4013   6.3599  108.431   30.993   75.966   32.020 32.46474 44.56281 
1 1 1   25   18   36 o  114.008   20.670   10.907   3.4742   11.615   5.5515   10.451   4.4543  112.425   31.174  108.594   26.930 3.831192 41.19531 
1 1 1   25   18   37 o   63.401   25.049   2.3982   3.5941   2.3384   5.2319   2.4517   4.9458   70.482   29.328   69.675   28.711 0.8074722 41.04165 
1 1 1   25   18   38 o   66.179   25.394   3.0379   3.6085  -2.7122   4.8906   9.9089   5.3461   53.947   24.982  102.692   31.232 -48.74482 39.99461 
1 1 1   25   18   39 o  133.804   19.016   14.969   3.7849   14.922   4.8298   15.044   6.0930  129.636   25.249  125.259   31.741 4.377113 40.55837 
1 1 1   25   18   40 o   60.903   24.616   2.1062   3.5520   0.7164   4.6097   4.1374   5.5728   60.950   26.500   76.264   30.831 -15.31377 40.65407 
1 1 1   25   18   41 o  154.891   15.014   19.516   3.5149   15.156   4.8497   24.341   5.1014  129.514   25.371  169.404   20.064 -39.88896 32.34616 
1 1 1   25   19    1 o   79.300   32.520   2.3331   6.3072   0.0000   0.0000   2.3331   6.3072  ?   ?    79.300   32.520 0.000000 32.51951 
1 1 1   25   19    2 o  220.083   10.316   37.320   3.4752   39.880   3.9836   29.167   7.1094  227.037   11.501  190.022   25.054 37.01480 27.56759 
1 1 1   25   19    3 o   73.421   23.244   4.2282   2.9280   4.9010   3.2559   1.3835   6.6947   78.550   24.460   78.200   32.901 0.3504944 40.99663 
1 1 1   25   19    4 o  125.606   16.795   12.498   3.1480   13.108   3.5480   10.240   6.8248  128.208   18.625  111.329   35.513 16.87940 40.10061 
1 1 1   25   19    5 o  312.324   8.6702   75.016   4.1448   78.087   4.7959   65.956   8.2385  318.429   9.8399  289.757   18.675 28.67206 21.10882 
1 1 1   25   19    6 o  241.150   10.264   44.811   3.7885   43.375   4.3222   49.571   7.8704  236.671   11.970  250.235   20.735 -13.56384 23.94253 
1 1 1   25   19    7 o  261.488   9.5193   52.641   3.8100   51.494   4.3143   56.705   8.1209  258.384   10.909  268.038   19.937 -9.654419 22.72611 
1 1 1   25   19    8 o   58.822   25.032   0.2736   3.9488   1.8663   4.8070  -3.0315   6.9246   70.034   28.516   68.121   30.855 1.912842 42.01421 
1 1 1   25   19    9 o  180.632   12.362   25.341   3.3972   24.076   3.7550   31.049   7.9751  175.657   14.084  194.921   27.494 -19.26427 30.89163 
1 1 1   25   19   10 o  225.849   10.721   39.342   3.7061   39.608   4.0976   38.145   8.6883  226.110   11.881  216.649   26.770 9.461349 29.28812 
1 1 1   25   19   11 o  240.516   10.231   44.591   3.7666   45.892   4.1528   38.559   8.9439  243.839   11.127  217.430   27.488 26.40878 29.65499 
1 1 1   25   19   12 o  111.106   19.158   9.9436   3.1404   8.7393   3.4229   16.348   7.8937  103.221   22.315  137.309   36.808 -34.08752 43.04406 
1 1 1   25   19   13 o   69.492   23.510   3.6241   2.9740   2.0842   3.1452   16.630   9.1404   61.400   23.670  137.541   40.614 -76.14066 47.00779 
1 1 1   25   19   14 f  271.059   6.9456   56.428   2.8817   56.428   2.8817   0.0000   0.0000  271.059   6.9456  ?   ?  0.000000 6.945631 
1 1 1   25   19   15 o  317.716   6.4841   77.496   3.1532   81.097   3.3630   51.303   9.0705  324.969   6.7610  252.679   23.731 72.28998 24.67512 
1 1 1   25   19   16 o   42.448   17.386   0.5246   1.8000   0.8876   1.8502  -5.8926   7.7790   45.188   17.934   66.853   31.145 -21.66445 35.93970 
1 1 1   25   19   17 f  152.020   9.3302   17.872   2.1605   18.046   2.2359   15.426   8.3931  152.711   9.6145  132.435   38.865 20.27626 40.03650 
1 1 1   25   19   18 o  289.382   6.5055   64.306   2.8815   64.384   3.0181   63.500   9.6878  289.511   6.8109  281.524   22.675 7.986816 23.67541 
1 1 1   25   19   19 o  221.197   7.5958   37.623   2.5717   37.636   2.6833   37.477   9.0116  221.189   7.9257  212.884   28.361 8.304703 29.44809 
1 1 1   25   19   20 o  136.043   15.291   14.613   3.1289   15.418   3.2992   7.4135   9.8673  139.668   15.705  105.634   41.577 34.03405 44.44438 
1 1 1   25   19   21 o  105.003   21.452   9.0626   3.3313   8.6624   3.5444   12.094   9.7547  102.151   23.198  119.665   42.465 -17.51425 48.38792 
1 1 1   25   19   22 o  124.801   16.225   12.389   3.0261   13.079   3.2058   6.7528   9.1669  128.124   16.748  101.509   40.036 26.61475 43.39764 
1 1 1   25   19   23 o  121.932   16.831   11.877   3.0575   13.199   3.2604   2.2353   8.8041  128.602   16.979   87.929   37.397 40.67354 41.07067 
1 1 1   25   19   24 o   69.198   24.005   3.5724   3.1054   3.2823   3.3323   5.4870   8.5605   68.396   24.755   95.705   38.379 -27.30875 45.67015 
1 1 1   25   19   25 o  123.067   18.045   12.188   3.2981   11.472   3.5753   16.273   8.5432  118.538   20.444  133.812   39.194 -15.27345 44.20555 
1 1 1   25   19   26 o  170.368   12.708   22.697   3.2900   23.348   3.9827   21.298   5.8378  172.001   15.287  160.480   24.547 11.52199 28.91756 
1 1 1   25   19   27 o  127.612   16.061   12.986   3.0677   14.450   4.0168   10.937   4.7520  133.200   20.348  112.960   27.697 20.24001 34.36788 
1 1 1   25   19   28 o  123.868   17.221   12.335   3.1766   11.042   4.2156   14.033   4.8321  114.350   24.799  129.023   25.372 -14.67371 35.47900 
1 1 1   25   19   29 o  332.486   8.4126   85.299   4.2813   88.969   5.6821   80.479   6.5117  338.600   10.963  321.021   13.252 17.57922 17.19938 
1 1 1   25   19   30 f  143.502   15.305   16.379   3.3098   17.212   4.4349   15.331   4.9727  145.049   20.550  134.721   25.036 10.32858 32.39040 
1 1 1   25   19   31 o  185.312   15.923   27.326   4.4725   27.498   7.8570   27.244   5.4399  177.850   29.925  183.208   19.709 -5.357758 35.83207 
1 1 1   25   19   32 o   50.143   23.130  -2.5810   4.1317  -5.3672   7.7439  -1.4722   4.8851   65.467   30.687   58.060   26.141 7.407837 40.31160 
1 1 1   25   19   33 o   41.819   19.788  -3.4819   3.3577  -6.5047   5.4935  -1.6792   4.2423   51.057   24.476   53.180   24.113 -2.123711 34.35904 
1 1 1   25   19   34 o  265.107   11.521   54.893   4.6750   59.422   6.0280   48.057   7.4054  273.924   14.428  242.412   20.141 31.51169 24.77518 
1 1 1   25   19   35 o  140.486   16.783   15.988   3.5375   18.911   5.4661   13.882   4.6403  148.399   24.950  126.799   24.797 21.59983 35.17677 
1 1 1   25   19   36 o  152.564   15.711   18.753   3.6163   21.851   5.5039   16.400   4.7971  160.468   23.072  138.450   23.475 22.01802 32.91508 
1 1 1   25   19   37 o   54.887   23.161   0.8493   3.3335  -0.1650   4.8174   1.7812   4.6175   60.159   26.591   65.413   27.412 -5.254135 38.19056 
1 1 1   25   19   38 o  121.635   19.845   12.486   3.5673   16.722   4.6333   6.3201   5.5902  139.432   22.474   85.466   31.868 53.96627 38.99551 
1 1 1   25   19   39 o   53.561   22.978   0.5690   3.3764  -2.8166   4.7042   4.1662   4.8489   52.066   24.244   74.516   29.203 -22.45017 37.95517 
1 1 1   25   19   40 o   43.982   20.878  -3.6424   3.7966  -3.8574   5.3797  -3.4292   5.3589   53.562   25.253   54.293   25.474 -0.7314568 35.87004 
1 1 1   25   20    0 o  223.431   22.467   39.962   7.5052   39.962   7.5052   39.962   7.5052  223.431   22.467  223.431   22.467 0.000000 0.000000 
1 1 1   25   20    1 o  274.163   13.181   58.188   5.5315   62.540   7.6687   53.467   7.9864  282.376   17.835  260.095   20.220 22.28119 26.96130 
1 1 1   25   20    2 o  352.371   16.984   96.845   9.1601   0.0000   0.0000   96.845   9.1601  ?   ?   352.371   16.984 0.000000 16.98356 
1 1 1   25   20    3 o  118.205   18.483   11.179   3.2346   11.794   3.6150   8.7067   7.2441  121.001   20.233  105.415   36.658 15.58665 41.87115 
1 1 1   25   20    4 o  145.225   15.411   16.572   3.3733   16.934   3.8122   15.266   7.2413  146.319   17.361  133.423   35.016 12.89612 39.08374 
1 1 1   25   20    5 o  210.975   11.746   34.484   3.7782   35.095   4.3248   32.517   7.7638  212.463   13.367  200.211   25.945 12.25169 29.18593 
1 1 1   25   20    6 o  143.924   16.128   16.322   3.4918   18.557   3.9666   8.6238   7.3605  153.286   17.203  105.229   36.931 48.05763 40.74112 
1 1 1   25   20    7 f  308.734   9.9753   73.443   4.7139   76.086   5.5539   66.634   8.9142  313.876   11.560  290.416   20.179 23.46005 23.25579 
1 1 1   25   20    8 o  102.139   20.357   8.4814   3.0708   7.2565   3.3416   15.134   7.7875   93.830   23.358  132.298   37.007 -38.46799 43.76208 
1 1 1   25   20    9 o  143.307   14.851   16.122   3.2103   14.486   3.4507   26.654   8.7551  135.209   17.053  177.459   33.459 -42.24976 37.55442 
1 1 1   25   20   10 o  211.563   10.673   34.618   3.4450   34.472   3.7238   35.482   9.0733  210.921   11.579  207.366   29.410 3.555359 31.60757 
1 1 1   25   20   11 o  304.420   8.3710   71.283   3.9005   73.340   4.2883   61.429   9.3869  308.643   9.0773  277.566   22.282 31.07663 24.06032 
1 1 1   25   20   12 o   80.603   22.251   5.3150   2.8354   5.6891   3.0077   2.3284   8.4977   83.282   22.888   88.162   37.078 -4.880226 43.57352 
1 1 1   25   20   13 o  219.859   10.577   37.303   3.5594   37.303   3.5594   0.0000   0.0000  219.859   10.577  ?   ?  0.000000 10.57709 
1 1 1   25   20   14 o  170.624   11.766   22.618   3.0541   22.239   3.2457   25.552   9.0235  168.985   12.640  172.181   35.421 -3.196259 37.60867 
1 1 1   25   20   15 o  234.642   9.4251   42.427   3.3850   43.920   3.6161   31.849   9.6238  238.652   9.8994  193.516   33.716 45.13635 35.13957 
1 1 1   25   20   16 o  186.113   8.0099   26.644   2.2818   26.370   2.3564   30.766   9.1370  185.116   8.3165  190.641   32.476 -5.525284 33.52441 
1 1 1   25   20   17 o  266.910   6.7564   54.724   2.7602   54.990   2.8802   51.736   9.6645  267.515   7.0341  252.409   25.358 15.10643 26.31576 
1 1 1   25   20   18 o   86.656   15.482   6.0280   1.9781   6.3099   2.0417   1.7157   7.9859   88.673   15.613   83.934   35.655 4.739120 38.92408 
1 1 1   25   20   19 o   52.940   19.063   1.8913   1.9726   1.9970   2.0283   0.0452   8.4744   54.041   19.344   81.792   35.738 -27.75090 40.63713 
1 1 1   25   20   20 o  180.291   11.750   25.282   3.2247   26.078   3.4379   19.454   9.3006  182.969   12.348  146.621   40.228 36.34833 42.08069 
1 1 1   25   20   21 o  215.267   10.982   35.943   3.6066   39.360   3.8915   15.134   9.6032  225.200   11.326  129.751   42.199 95.44881 43.69196 
1 1 1   25   20   22 o  206.928   11.335   33.258   3.5765   32.712   3.8425   36.799   9.7830  204.948   12.306  208.035   31.727 -3.086334 34.03042 
1 1 1   25   20   23 o   81.156   22.731   5.4493   2.9361   4.1138   3.0976   17.261   9.2123   72.504   23.985  137.326   40.828 -64.82128 47.35176 
1 1 1   25   20   24 o  179.924   12.773   25.296   3.4949   24.211   3.7405   32.752   9.8059  175.629   14.032  193.916   34.292 -18.28712 37.05137 
1 1 1   25   20   25 o  243.661   11.614   46.064   4.3315   46.064   4.3315   0.0000   0.0000  243.661   11.614  ?   ?  0.000000 11.61406 
1 1 1   25   20   26 o  103.968   22.959   9.0407   3.5561   11.817   3.7709 -13.2609   10.687  119.830   21.342   69.143   33.398 50.68646 39.63466 
1 1 1   25   20   27 o  233.592   11.754   42.505   4.1892   41.029   4.5270   51.303   11.051  229.055   12.965  245.580   30.026 -16.52516 32.70586 
1 1 1   25   20   28 o  167.496   13.083   22.025   3.3275   28.468   4.3740   13.173   5.1269  189.765   15.186  123.653   27.768 66.11193 31.64903 
1 1 1   25   20   29 o  181.512   12.474   25.813   3.4446   28.506   4.5168   22.071   5.3250  189.533   15.711  163.919   21.762 25.61400 26.84053 
1 1 1   25   20   30 o   97.163   22.023   7.9515   3.1997   6.5063   4.1584   10.049   5.0097   87.600   27.697  106.767   29.617 -19.16713 40.54989 
1 1 1   25   20   31 o  121.979   23.675   12.604   4.2608   13.127   7.8544   12.386   5.0719  118.079   38.143  118.692   28.314 -0.6131897 47.50370 
1 1 1   25   20   32 o   84.968   26.114   6.1783   3.7251   12.168   5.3903   0.7031   5.1538  116.470   30.040   65.660   28.283 50.80926 41.25932 
1 1 1   25   20   33 o  145.652   18.536   17.320   4.0388   18.336   5.1211   15.649   6.5691  147.275   23.508  130.185   32.940 17.08954 40.46846 
1 1 1   25   20   34 o  120.366   19.238   11.989   3.4249   8.5234   5.0816   14.874   4.6361   97.351   30.597  131.923   23.837 -34.57259 38.78636 
1 1 1   25   20   35 o  181.493   13.462   26.137   3.7132   27.032   5.4071   25.338   5.1081  180.947   19.849  175.452   19.343 5.495010 27.71472 
1 1 1   25   20   36 o   55.879   23.310   1.1059   3.3172  -2.3330   4.7615   4.3490   4.6240   54.112   24.913   75.723   28.819 -21.61127 38.09494 
1 1 1   25   20   37 o  164.451   15.239   21.848   3.7924   20.180   4.9326   24.259   5.9308  154.134   21.492  167.409   23.817 -13.27515 32.08077 
1 1 1   25   20   38 o   61.453   24.651   2.2228   3.5328   2.3102   5.1729   2.1463   4.8364   68.821   28.936   66.902   28.046 1.918900 40.29715 
1 1 1   25   20   39 o   58.154   24.007   1.6115   3.4663   5.9416   5.3530  -1.5153   4.5488   82.445   31.096   54.062   24.688 28.38357 39.70485 
1 1 1   25   21    0 o  375.805   16.601  109.739   9.5066  109.739   9.5066  109.739   9.5066  375.805   16.601  375.805   16.601 0.000000 0.000000 
1 1 1   25   21    1 f   69.510   28.875   1.3629   5.0594  -6.0968   7.0151   9.4492   7.3038   62.505   29.269  108.288   36.842 -45.78278 47.05308 
1 1 1   25   21    2 o  155.912   22.516   19.608   5.2177   16.809   7.0888   22.917   7.7079  140.275   33.481  165.108   31.652 -24.83263 46.07364 
1 1 1   25   21    3 o   65.888   24.357   2.8068   3.2515   3.9637   3.5903  -2.4696   7.6675   73.765   25.799   73.154   32.860 0.6107483 41.77753 
1 1 1   25   21    4 o  290.614   11.950   65.284   5.3156   66.756   6.6098   62.587   8.9435  292.744   14.799  280.970   20.946 11.77377 25.64698 
1 1 1   25   21    5 o  257.223   13.183   51.387   5.1730   56.677   6.5249   42.437   8.4876  269.292   15.901  229.508   24.541 39.78438 29.24234 
1 1 1   25   21    6 o  489.894   10.229  185.044   7.6702  193.691   10.208  173.832   11.624  499.912   13.340  472.251   16.081 27.66034 20.89439 
1 1 1   25   21    7 f  123.047   17.902   12.083   3.2728   11.614   3.5729   14.531   8.1577  119.944   20.178  129.374   38.410 -9.430305 43.38743 
1 1 1   25   21    8 o  164.109   13.840   21.041   3.4441   23.359   3.7554   8.7669   8.6400  172.853   14.323  107.987   39.742 64.86646 42.24385 
1 1 1   25   21    9 o  163.066   14.046   20.791   3.4717   21.396   3.7596   17.289   9.0459  165.188   15.034  139.949   40.142 25.23901 42.86510 
1 1 1   25   21   10 o  455.478   7.4711  159.433   5.2086  160.330   5.7698  155.479   12.107  456.550   8.2567  445.530   17.754 11.01978 19.57981 
1 1 1   25   21   11 o   85.809   24.687   6.0437   3.4166   4.9831   3.6814   12.630   9.1741   79.725   26.137  122.097   41.291 -42.37199 48.86843 
1 1 1   25   21   12 o  150.808   15.034   17.873   3.4240   17.873   3.4240   0.0000   0.0000  150.808   15.034  ?   ?  0.000000 15.03364 
1 1 1   25   21   13 o  101.613   19.608   8.3928   2.9392   7.1034   3.1023   19.698   9.1861   92.800   22.148  148.810   39.625 -56.01010 45.39458 
1 1 1   25   21   14 o  142.151   14.105   15.856   3.0284   15.970   3.2140   14.955   9.0422  142.448   14.964  130.238   40.796 12.20963 43.45361 
1 1 1   25   21   15 o   63.749   23.084   2.7716   2.8983   3.4519   3.0780  -2.5487   8.6077   68.626   23.893   77.027   34.688 -8.401306 42.12110 
1 1 1   25   21   16 o   87.861   21.757   6.3727   2.9106   6.7400   3.0813   3.3308   8.8669   90.261   22.407   91.559   38.146 -1.298676 44.24010 
1 1 1   25   21   17 o   47.560   18.533   1.1415   1.9444   0.7499   1.9904   9.3297   9.1015   45.507   18.415  109.726   40.713 -64.21909 44.68378 
1 1 1   25   21   18 o   73.995   18.025   4.4755   2.0227   4.7505   2.0770  -0.5811   8.9059   76.230   18.075   82.123   36.235 -5.892593 40.49270 
1 1 1   25   21   19 f  107.273   13.702   9.0922   2.1984   9.4753   2.2574   2.0442   9.6821  109.527   13.770   90.845   38.941 18.68146 41.30361 
1 1 1   25   21   20 o  114.314   16.115   10.425   2.7414   10.168   2.8631   13.252   9.5067  112.576   17.158  122.868   42.031 -10.29172 45.39815 
1 1 1   25   21   21 o   91.862   19.796   6.9340   2.7014   7.0963   2.8125   5.0004   9.7064   92.814   20.358   97.779   40.248 -4.965652 45.10369 
1 1 1   25   21   22 o  105.451   18.415   9.0202   2.8642   9.4204   2.9978   4.8291   9.7008  107.676   18.878   97.102   40.130 10.57459 44.34840 
1 1 1   25   21   23 o  203.425   12.205   32.252   3.7828   33.736   4.0879   23.407   9.9789  207.847   12.913  159.252   40.765 48.59525 42.76171 
1 1 1   25   21   24 o  172.730   13.381   23.389   3.5101   26.027   3.7920   7.6027   9.2763  182.161   13.700  103.103   40.396 79.05798 42.65591 
1 1 1   25   21   25 o  213.415   12.815   35.597   4.1666   35.597   4.1666   0.0000   0.0000  213.415   12.815  ?   ?  0.000000 12.81461 
1 1 1   25   21   26 o  195.970   13.036   30.079   3.8880   29.851   4.1545   31.689   11.034  194.875   14.022  184.937   40.132 9.937653 42.51122 
1 1 1   25   21   27 o  140.115   18.277   15.847   3.8264   15.217   4.0868   20.320   10.894  136.511   20.166  143.927   44.728 -7.415359 49.06416 
1 1 1   25   21   28 o   72.892   25.764   4.0403   3.5873   5.1535   3.8301  -3.9152   10.239   79.720   26.681   79.126   36.468 0.5935669 45.18653 
1 1 1   25   21   29 o  289.132   21.013   67.990   9.2358   67.990   9.2358   0.0000   0.0000  289.132   21.013  ?   ?  0.000000 21.01306 
1 1 1   25   21   30 o  179.418   17.111   25.848   4.6421   30.919   8.4296   23.641   5.5614  187.732   30.373  168.981   22.026 18.75049 37.51868 
1 1 1   25   21   31 o  158.993   17.614   20.438   4.2145   24.609   4.7161   3.8973   9.3916  174.462   17.915   90.275   38.515 84.18714 42.47762 
1 1 1   25   21   32 o   65.040   26.974   1.7079   4.4049   3.4277   4.9411  -4.9505   9.7221   74.064   29.336   74.008   34.592 0.5657196E-01 45.35626 
1 1 1   25   21   33 o   75.787   25.327   4.7580   3.4511   1.8399   4.6830   8.2264   5.1055   66.682   27.747   95.835   30.731 -29.15240 41.40382 
1 1 1   25   21   34 o   57.977   23.577   1.5761   3.2804   5.1053   4.7800  -1.5658   4.5102   79.985   29.539   54.758   24.842 25.22631 38.59607 
1 1 1   25   21   35 o  127.671   17.519   13.402   3.3332   17.297   4.8219   9.8371   4.6128  142.091   22.953  103.794   28.270 38.29681 36.41484 
1 1 1   25   21   36 o   80.756   25.106   5.7436   3.4318   6.5923   5.0263   5.0024   4.6971   86.123   30.491   78.334   29.211 7.788246 42.22538 
1 1 1   25   21   37 o   73.268   26.204   4.4635   3.7213   7.7422   5.0117   0.4343   5.5557   91.058   30.520   64.825   28.610 26.23263 41.83316 
1 1 1   25   21   38 o   38.499   18.540  -4.2008   3.2352  -7.1013   4.6202  -1.4105   4.5316   43.383   21.183   54.271   24.728 -10.88772 32.56079 
1 1 1   25   22    0 o  197.221   28.743   32.395   8.1386   32.395   8.1386   32.395   8.1386  197.221   28.743  197.221   28.743 0.000000 0.000000 
1 1 1   25   22    1 o  115.737   29.889   11.315   5.3317   16.000   7.4025   6.2644   7.6857  136.045   35.259   97.096   37.107 38.94820 51.18737 
1 1 1   25   22    2 o  357.791   12.212   99.039   6.6877  102.116   9.1609   95.528   9.7856  361.680   16.548  348.561   18.407 13.11838 24.75165 
1 1 1   25   22    3 o  143.446   25.520   16.920   5.3979   18.936   7.1500   14.249   8.2313  149.256   32.240  128.110   38.708 21.14590 50.37549 
1 1 1   25   22    4 o  129.539   26.977   13.968   5.1752   1.5689   6.5411   34.719   8.4619   77.600   32.578  205.814   27.552 -128.2136 42.66687 
1 1 1   25   22    5 o  240.416   15.951   45.254   5.8365   53.015   7.6660   34.550   9.0023  258.913   19.487  204.230   29.666 54.68297 35.49350 
1 1 1   25   22    6 o  208.557   16.688   34.181   5.2826   31.999   6.4072   38.813   9.3352  200.134   21.241  217.054   28.810 -16.92058 35.79389 
1 1 1   25   22    7 o  186.265   15.660   27.222   4.4232   30.580   5.1148   17.261   8.8091  197.034   17.130  139.831   39.446 57.20277 43.00497 
1 1 1   25   22    8 o   81.200   27.758   5.0331   4.1464   7.1863   4.6822  -2.7934   8.9268   93.725   29.356   78.270   35.279 15.45492 45.89558 
1 1 1   25   22    9 o  278.475   11.884   59.995   5.0654   60.772   5.9379   57.919   9.7069  279.727   13.869  268.339   23.883 11.38809 27.61781 
1 1 1   25   22   10 o  211.875   11.285   34.793   3.6466   36.832   3.9297   22.155   9.7837  217.878   11.828  157.499   40.391 60.37967 42.08683 
1 1 1   25   22   11 o  185.960   13.188   26.959   3.7294   26.959   3.7294   0.0000   0.0000  185.960   13.188  ?   ?  0.000000 13.18807 
1 1 1   25   22   12 f  228.316   10.242   40.232   3.5792   41.885   3.8514   29.759   9.6927  232.850   10.806  185.730   35.387 47.11951 37.00037 
1 1 1   25   22   13 o  401.437   7.8765  123.958   4.8397  126.448   5.2923  111.245   11.961  405.270   8.5316  374.052   20.975 31.21796 22.64408 
1 1 1   25   22   14 o  174.410   12.925   23.729   3.4260   23.240   3.6622   27.152   9.6971  172.314   14.006  175.914   37.178 -3.600159 39.72876 
1 1 1   25   22   15 o  100.436   21.058   8.2861   3.1338   7.7708   3.3266   12.348   9.3397   96.802   22.824  120.249   41.635 -23.44693 47.48019 
1 1 1   25   22   16 o  117.892   18.355   11.184   3.2043   10.959   3.4398   12.659   8.8112  116.147   20.075  120.781   40.468 -4.633743 45.17396 
1 1 1   25   22   17 o   67.757   27.611   1.8522   4.5110  -0.2692   5.3089   7.3617   8.5557   65.132   28.377  101.853   39.097 -36.72174 48.30986 
1 1 1   25   22   18 o  139.764   12.622   15.285   2.6710   15.739   2.7831   9.9763   9.5081  141.758   12.970  111.962   41.598 29.79655 43.57343 
1 1 1   25   22   19 o   85.027   21.384   5.9862   2.7803   6.4119   2.8860   0.4900   10.369   87.953   21.596   89.656   39.344 -1.702927 44.88096 
1 1 1   25   22   20 o   83.482   21.208   5.7715   2.7153   7.4366   2.8190 -15.6138   10.103   95.120   19.997   64.450   31.437 30.67027 37.25787 
1 1 1   25   22   21 o  163.101   12.380   20.780   3.0677   20.255   3.2135   26.164   10.300  160.806   13.172  169.016   40.369 -8.209763 42.46365 
1 1 1   25   22   22 o  161.764   12.887   20.487   3.1644   21.501   3.3287   10.974   10.198  165.639   13.240  115.042   43.014 50.59619 45.00605 
1 1 1   25   22   23 o  162.481   13.611   20.736   3.3538   21.614   3.5632   13.920   9.9284  165.727   14.184  123.879   42.925 41.84839 45.20761 
1 1 1   25   22   24 o  101.071   23.372   8.5853   3.5436   8.5853   3.5436   0.0000   0.0000  101.071   23.372  ?   ?  0.000000 23.37230 
1 1 1   25   22   25 o  111.378   21.404   10.280   3.5164   10.330   3.7516   9.9198   10.090  111.136   22.818  110.416   42.441 0.7198563 48.18588 
1 1 1   25   22   26 o   95.807   23.869   7.7825   3.4873   6.4255   3.7184   17.694   10.049   87.171   25.944  135.348   43.084 -48.17662 50.29239 
1 1 1   25   22   27 f  162.020   15.441   20.866   3.7828   23.809   4.0821   2.9684   10.065  173.105   15.573   91.513   39.472 81.59158 42.43277 
1 1 1   25   22   28 o  130.836   32.304   15.435   6.4306   26.458   8.3976  -0.1937   9.9992  171.831   33.130   84.295   37.719 87.53644 50.20222 
1 1 1   25   22   29 o  141.256   29.643   17.628   6.2047   14.514   8.1466   21.929   9.5750  123.192   38.744  149.650   40.717 -26.45799 56.20520 
1 1 1   25   22   30 o   45.967   21.372  -2.7092   3.6334  -3.5736   3.9758   1.6706   8.9494   46.468   21.847   83.770   36.661 -37.30182 42.67694 
1 1 1   25   22   31 o  137.502   17.504   15.359   3.6004   19.819   4.8858   10.059   5.3261  154.505   21.220  105.365   30.971 49.13972 37.54325 
1 1 1   25   22   32 o  165.672   14.352   21.860   3.6034   25.139   4.8659   17.879   5.3620  175.644   18.371  143.992   25.250 31.65147 31.22557 
1 1 1   25   22   33 o   68.300   24.925   3.5298   3.3884   1.8223   4.4921   5.7838   5.1611   65.341   27.181   83.748   30.731 -18.40721 41.02685 
1 1 1   25   22   34 o   86.077   25.647   6.5586   3.6323   6.5636   4.9305   6.5527   5.3714   86.437   30.232   86.872   31.431 -0.4357529 43.61076 
1 1 1   25   22   35 o  102.078   21.458   8.9873   3.2462   11.493   4.7585   6.8059   4.4398  111.927   27.880   86.869   28.714 25.05785 40.02227 
1 1 1   25   22   36 o   56.681   23.600   1.2986   3.3911   6.2103   4.4153  -5.7658   5.2952   83.300   28.639   49.931   23.962 33.36903 37.34097 
1 1 1   25   22   37 o   71.538   24.473   4.3623   3.2232   2.3376   4.4211   6.6594   4.7091   65.594   27.099   85.254   29.561 -19.65999 40.10213 
1 1 1   25   23    0 o   97.486   45.063   11.294   7.4141   11.294   7.4141   11.294   7.4141   97.486   45.063   97.486   45.063 0.000000 0.000000 
1 1 1   25   23    1 o  205.898   17.885   33.470   5.5807   28.263   7.8115   38.898   7.9756  184.740   28.545  219.457   24.143 -34.71628 37.38588 
1 1 1   25   23    2 o  114.752   30.521   11.178   5.4539   10.588   7.2762   11.934   8.2392  112.377   36.741  118.594   39.112 -6.216797 53.66240 
1 1 1   25   23    3 o  214.400   17.950   36.285   5.8363   31.388   7.7091   42.860   8.9330  195.860   26.386  229.578   25.872 -33.71841 36.95431 
1 1 1   25   23    4 o  125.786   21.308   12.842   3.9561   12.946   4.4304   12.433   8.7878  125.450   23.946  120.853   40.415 4.597168 46.97647 
1 1 1   25   23    5 o  144.660   18.249   16.668   3.9507   18.999   4.4257   7.5199   8.7659  154.294   19.151  103.767   39.635 50.52722 44.01968 
1 1 1   25   23    6 o  116.047   22.744   11.056   3.8955   14.187   4.3667  -1.1520   8.6216  131.952   22.423   80.144   35.492 51.80805 41.98147 
1 1 1   25   23    7 o  126.843   18.940   12.914   3.5644   12.059   3.8263   18.531   9.8036  121.760   21.307  143.575   41.967 -21.81518 47.06583 
1 1 1   25   23    8 o   65.315   24.677   2.6196   3.3747   0.7215   3.5959   16.640   9.7730   57.885   24.219  136.449   42.359 -78.56418 48.79346 
1 1 1   25   23    9 o  101.838   24.463   8.6322   3.7654   8.6322   3.7654   0.0000   0.0000  101.838   24.463  ?   ?  0.000000 24.46300 
1 1 1   25   23   10 o  114.101   21.502   10.644   3.6174   10.644   3.6174   0.0000   0.0000  114.101   21.502  ?   ?  0.000000 21.50159 
1 1 1   25   23   11 o   96.711   22.765   7.7469   3.3140   7.5178   3.5324   9.4304   9.5738   95.032   24.215  111.095   41.650 -16.06287 48.17720 
1 1 1   25   23   12 o  125.079   17.961   12.528   3.3399   9.5895   3.5508   35.086   9.8379  107.897   22.240  203.202   32.743 -95.30431 39.58181 
1 1 1   25   23   13 o  196.489   12.462   30.058   3.7286   30.023   4.0340   30.268   9.7679  196.077   13.524  186.728   35.473 9.348770 37.96352 
1 1 1   25   23   14 o  219.351   11.152   37.319   3.7320   37.142   4.0376   38.352   9.7781  218.570   12.116  213.491   30.815 5.078842 33.11158 
1 1 1   25   23   15 o   50.225   21.696  -0.1384   3.0502   0.4748   3.2456  -4.7754   8.9254   54.238   22.868   73.937   34.066 -19.69907 41.02994 
1 1 1   25   23   16 o  123.862   18.170   12.326   3.3423   11.608   3.5617   17.618   9.6722  119.485   20.194  138.829   41.962 -19.34403 46.56842 
1 1 1   25   23   17 o   97.149   22.400   7.8391   3.2627   9.9940   3.4721  -8.4224   9.5380  110.276   21.342   70.817   33.461 39.45824 39.68770 
1 1 1   25   23   18 o  242.403   11.933   45.582   4.4275   49.055   4.8528   28.329   10.815  250.950   12.675  176.039   40.914 74.91138 42.83270 
1 1 1   25   23   19 f  302.663   9.4281   70.716   4.3677   75.396   4.7378   44.225   11.273  312.376   9.9090  226.635   33.506 85.74066 34.94027 
1 1 1   25   23   20 o  110.503   17.641   9.8534   2.8834   8.8398   3.0056   21.562   10.215  103.939   19.611  151.752   42.362 -47.81224 46.68085 
1 1 1   25   23   21 o  301.100   8.9803   69.970   4.1388   71.920   4.4580   57.797   11.138  305.102   9.5460  263.033   28.100 42.06915 29.67694 
1 1 1   25   23   22 o  101.117   20.069   8.4204   2.9966   8.0545   3.1305   12.423   10.354   98.449   21.387  118.992   43.549 -20.54306 48.51731 
1 1 1   25   23   23 o  166.913   14.024   21.936   3.5498   21.936   3.5498   0.0000   0.0000  166.913   14.024  ?   ?  0.000000 14.02445 
1 1 1   25   23   24 o  163.830   14.297   21.183   3.5492   22.814   3.8113   10.532   9.7401  169.880   14.805  111.500   41.969 58.38002 44.50394 
1 1 1   25   23   25 f  128.668   18.458   13.433   3.5311   13.208   3.8448   14.644   8.9255  126.754   20.518  124.732   40.688 2.021927 45.56879 
1 1 1   25   23   26 o  120.757   35.587   13.413   7.0239   13.167   10.855   13.590   9.2128  119.216   44.416  120.182   41.366 -0.9663391 60.69529 
1 1 1   25   23   27 o  116.586   33.155   12.375   6.1974   12.549   8.1202   12.132   9.5911  115.839   38.849  114.592   41.917 1.247337 57.15141 
1 1 1   25   23   28 o  241.301   11.798   45.448   4.3576   48.358   4.7922   31.557   10.472  248.242   12.654  182.393   38.708 65.84897 40.72361 
1 1 1   25   23   29 o  161.960   16.131   21.034   3.9457   20.391   4.3027   24.432   9.8931  158.549   18.052  157.358   40.751 1.191177 44.57046 
1 1 1   25   23   30 o   88.539   27.421   6.8216   4.0983   6.2540   4.5364   9.3419   9.5592   85.767   29.036  104.203   40.952 -18.43634 50.20077 
1 1 1   25   23   31 o   81.785   25.779   5.7464   3.6045   8.0761   5.0381   3.3036   5.1590   94.923   30.537   73.996   29.751 20.92706 42.63395 
1 1 1   25   23   32 o   43.819   20.415  -2.5220   3.3427   1.2107   4.4262  -7.4769   5.0996   62.727   26.590   46.527   22.614 16.19918 34.90613 
1 1 1   25   23   33 o  122.668   18.212   12.466   3.3157   8.6235   4.7674   16.066   4.6145   96.787   29.506  136.817   22.840 -40.02930 37.31331 
1 1 1   25   23   34 o  152.863   14.869   18.852   3.4349   22.564   4.5104   13.727   5.2999  165.390   18.113  121.854   28.860 43.53654 34.07344 
1 1 1   25   23   35 o  191.461   13.508   29.309   3.9333   25.329   4.5883   40.338   7.6386  175.544   17.301  216.017   23.481 -40.47314 29.16644 
1 1 1   25   23   36 o  154.770   14.184   19.325   3.3227   20.510   4.5729   18.000   4.8363  156.013   19.581  143.839   22.721 12.17433 29.99443 
1 1 1   25   24    0 o  332.544   18.783   86.624   9.4909   86.624   9.4909   86.624   9.4909  332.544   18.783  332.544   18.783 0.000000 0.000000 
1 1 1   25   24    1 o  183.319   20.530   26.885   5.6616   35.369   7.7004   16.903   8.3526  208.740   24.572  138.261   38.201 70.47871 45.42091 
1 1 1   25   24    2 o  139.971   26.999   16.325   5.5747   20.226   7.5644   11.689   8.2474  153.427   33.177  117.312   39.153 36.11484 51.31903 
1 1 1   25   24    3 o  127.200   29.213   13.702   5.5678   11.755   7.5258   16.056   8.2756  117.084   37.286  134.792   38.306 -17.70835 53.45673 
1 1 1   25   24    4 o  163.660   23.270   21.765   5.6650   15.087   7.3052   31.839   8.9726  131.458   35.481  194.551   31.184 -63.09274 47.23740 
1 1 1   25   24    5 o  175.319   16.371   24.234   4.3424   22.465   4.8945   30.776   9.4117  167.741   19.423  189.818   33.624 -22.07724 38.83088 
1 1 1   25   24    6 o   60.260   25.294   0.7505   3.9420   2.2914   4.4079  -5.4051   8.8100   69.137   27.605   72.616   33.593 -3.479050 43.48055 
1 1 1   25   24    7 o  192.109   13.073   28.774   3.8211   29.713   4.1668   23.811   9.5808  194.955   14.058  163.576   38.844 31.37915 41.30996 
1 1 1   25   24    8 o   41.192   19.891  -5.6829   3.7835  -5.6829   3.7835   0.0000   0.0000   41.192   19.891  ?   ?  0.000000 19.89063 
1 1 1   25   24    9 o   52.286   23.098  -0.8347   3.6298  -0.8347   3.6298   0.0000   0.0000   52.286   23.098  ?   ?  0.000000 23.09813 
1 1 1   25   24   10 o  137.096   17.530   14.985   3.5943   15.728   3.8116   9.0172   10.799  140.301   18.176  111.983   43.665 28.31839 47.29705 
1 1 1   25   24   11 o  174.523   13.690   23.831   3.6276   23.388   3.8548   27.265   10.724  172.583   14.734  173.489   41.027 -0.9061584 43.59270 
1 1 1   25   24   12 o  212.222   11.673   34.988   3.7773   35.280   4.0430   32.978   10.595  212.891   12.462  193.805   37.068 19.08661 39.10683 
1 1 1   25   24   13 o  248.937   10.583   47.907   4.0325   49.238   4.3705   40.291   10.456  252.188   11.322  217.673   32.368 34.51447 34.29137 
1 1 1   25   24   14 o  233.708   11.104   42.276   3.9721   45.864   4.3141   22.296   10.179  243.304   11.584  155.676   41.827 87.62769 43.40173 
1 1 1   25   24   15 o  188.170   13.044   27.657   3.7338   27.507   4.0107   28.630   10.226  187.344   14.090  178.818   38.500 8.525085 40.99690 
1 1 1   25   24   16 o   69.670   24.994   3.4722   3.3880   5.4969   3.6170 -11.0210   9.6772   82.116   25.815   67.843   32.514 14.27345 41.51561 
1 1 1   25   24   17 o   69.553   25.931   3.2139   3.7008   1.7151   3.9365   14.616   10.858   63.799   25.870  127.438   44.847 -63.63918 51.77317 
1 1 1   25   24   18 o  167.768   13.907   22.103   3.5391   22.040   3.7483   22.616   10.742  167.252   14.795  154.715   43.530 12.53734 45.97561 
1 1 1   25   24   19 o   81.285   24.346   5.4645   3.2667   4.2120   3.4268   17.938   10.815   73.850   25.235  137.641   44.782 -63.79061 51.40237 
1 1 1   25   24   20 o  246.287   16.674   48.010   6.2487   52.645   7.5398   37.844   11.166  256.513   19.346  205.976   36.766 50.53700 41.54509 
1 1 1   25   24   21 o   53.424   21.891   0.9942   2.8552   1.9986   2.9847  -9.8351   9.8004   59.363   23.009   69.289   33.074 -9.926071 40.29061 
1 1 1   25   24   22 o  125.520   18.288   12.754   3.4104   12.754   3.4104   0.0000   0.0000  125.520   18.288  ?   ?  0.000000 18.28827 
1 1 1   25   24   23 o   93.099   23.789   7.3472   3.4025   7.3472   3.4025   0.0000   0.0000   93.099   23.789  ?   ?  0.000000 23.78898 
1 1 1   25   24   24 o  206.913   18.781   34.472   5.8834   38.593   7.9789   29.562   8.7097  215.332   24.653  183.075   32.261 32.25665 40.60157 
1 1 1   25   24   25 o  112.873   31.971   11.452   5.7747   16.641   7.7053   4.8027   8.7222  133.428   36.619   91.610   37.972 41.81765 52.75245 
1 1 1   25   24   26 o  108.913   22.073   9.9845   3.5536   9.8599   3.8980   10.597   8.6468  107.316   24.296  108.694   39.794 -1.377800 46.62468 
1 1 1   25   24   27 o  287.438   10.922   64.326   4.8055   74.662   5.5236   32.150   9.7460  309.299   11.667  186.979   35.349 122.3199 37.22447 
1 1 1   25   24   28 o   47.825   21.990  -2.1716   3.6930  -2.4464   4.0760  -0.9122   8.7258   49.910   23.005   77.377   34.878 -27.46662 41.78193 
1 1 1   25   24   29 o  114.272   23.601   11.196   3.9914   10.662   4.4660   13.317   8.8977  109.936   26.786  116.451   40.620 -6.515053 48.65660 
1 1 1   25   24   30 o  144.534   20.708   17.422   4.4503   16.743   5.2682   19.115   8.3158  138.660   25.771  138.967   38.002 -0.3068542 45.91587 
1 1 1   25   24   31 f   54.414   23.826  -0.0849   3.7841   1.5768   4.3280  -5.4775   7.7966   63.458   26.562   64.056   30.262 -0.5981674 40.26582 
1 1 1   25   24   32 o  179.093   13.068   25.494   3.5576   31.456   4.7865   18.134   5.3177  197.273   15.989  143.912   25.051 53.36131 29.71894 
1 1 1   25   24   33 o  107.194   20.769   9.8343   3.2846   6.3863   4.2569   14.908   5.1637   84.491   28.126  128.324   27.137 -43.83251 39.08302 
1 1 1   25   24   34 o  143.230   15.142   16.651   3.2694   16.002   4.5968   17.314   4.6508  135.637   22.961  141.748   22.162 -6.111343 31.91137 
1 1 1   25   24   35 o  127.917   19.674   13.871   3.7286   12.066   4.4755   17.967   6.7414  115.100   26.016  135.030   32.916 -19.93044 41.95564 
1 1 1   25   25    0 o  174.774   33.465   26.682   8.0018   26.682   8.0018   26.682   8.0018  174.774   33.465  174.774   33.465 0.000000 0.000000 
1 1 1   25   25    1 o  271.614   15.235   57.747   6.3084   55.604   8.5483   60.309   9.3481  263.702   21.362  274.077   22.481 -10.37543 31.01208 
1 1 1   25   25    2 o  103.460   32.081   9.0136   5.6076   18.296   7.3930  -3.5623   8.6050  145.129   33.894   74.854   34.095 70.27525 48.07592 
1 1 1   25   25    3 o  108.771   30.871   10.088   5.3784   8.6445   7.1246   12.000   8.2010  103.675   36.337  118.061   39.026 -14.38567 53.32346 
1 1 1   25   25    4 o   95.144   31.514   7.3617   5.3468   9.3692   7.1564   4.8253   8.0441  106.595   36.467   92.744   37.199 13.85052 52.09271 
1 1 1   25   25    5 o  241.003   16.089   45.635   5.9008   46.484   7.7585   44.470   9.0884  240.958   21.254  233.197   25.900 7.760361 33.50392 
1 1 1   25   25    6 o  138.908   20.277   15.578   4.1842   14.694   4.6829   19.077   9.3180  133.587   23.774  145.237   40.429 -11.65034 46.90056 
1 1 1   25   25    7 o  371.941   9.7751  106.762   5.5650  106.762   5.5650   0.0000   0.0000  371.941   9.7751  ?   ?  0.000000 9.775133 
1 1 1   25   25    8 o  280.205   10.491   60.675   4.4994   60.308   4.9354   62.484   10.949  279.068   11.554  276.438   26.188 2.630219 28.62374 
1 1 1   25   25    9 o  393.523   8.5692  119.298   5.1615  122.801   5.7320  104.280   11.869  398.998   9.3857  361.101   21.572 37.89618 23.52532 
1 1 1   25   25   10 o  222.665   11.820   38.529   4.0141   39.581   4.3369   32.244   10.603  225.454   12.618  191.023   37.601 34.43173 39.66217 
1 1 1   25   25   11 o   75.253   25.762   4.3326   3.5714   5.5510   3.8145  -4.3246   10.168   82.858   26.562   80.013   36.678 2.844406 45.28604 
1 1 1   25   25   12 o  246.831   11.110   47.166   4.1974   47.218   4.5430   46.860   10.973  246.725   12.030  235.469   31.215 11.25620 33.45251 
1 1 1   25   25   13 o  108.962   22.769   9.8480   3.6750   10.771   3.9315   3.4606   10.344  113.879   23.339   95.910   40.653 17.96871 46.87587 
1 1 1   25   25   14 o  339.835   9.1728   89.106   4.7713   92.147   5.2286   73.966   11.666  345.357   9.8911  300.587   25.601 44.76999 27.44513 
1 1 1   25   25   15 o   67.067   25.034   2.9556   3.4516   3.6245   3.6532  -2.6080   10.536   71.459   25.911   83.992   38.049 -12.53292 46.03379 
1 1 1   25   25   16 o  153.266   17.733   18.776   4.0832   19.675   4.4057   13.299   10.873  156.553   18.760  122.829   44.676 33.72392 48.45478 
1 1 1   25   25   17 o  208.986   12.138   34.051   3.8661   35.776   4.1259   21.637   11.070  214.062   12.649  150.155   44.781 63.90741 46.53259 
1 1 1   25   25   18 o  374.944   8.8329  108.497   5.0692  111.159   5.5390   94.775   12.577  379.251   9.5420  340.517   24.289 38.73364 26.09609 
1 1 1   25   25   19 o  116.345   20.099   11.092   3.4499   10.359   3.6847   16.301   9.8209  111.535   22.362  131.547   42.668 -20.01162 48.17305 
1 1 1   25   25   20 o  338.269   12.747   89.226   6.5998  109.295   8.5751   60.065   10.337  373.043   15.018  269.324   25.374 103.7189 29.48532 
1 1 1   25   25   21 o  158.240   30.934   21.889   7.2238   21.889   7.2238   0.0000   0.0000  158.240   30.934  ?   ?  0.000000 30.93379 
1 1 1   25   25   22 o  135.619   34.629   16.757   7.2136   16.757   7.2136   0.0000   0.0000  135.619   34.629  ?   ?  0.000000 34.62942 
1 1 1   25   25   23 o   86.335   31.748   5.7886   5.5123   11.404   7.4439  -1.0296   8.2022  111.797   37.191   75.971   34.066 35.82591 50.43488 
1 1 1   25   25   24 o   57.528   23.605   1.2780   3.3257   1.9780   3.6270  -2.4178   8.3337   62.425   25.000   73.510   33.510 -11.08508 41.80791 
1 1 1   25   25   25 o   79.809   25.097   5.3479   3.4182   5.1440   3.7407   6.3801   8.4155   79.037   26.368   94.695   38.025 -15.65787 46.27275 
1 1 1   25   25   26 o  116.376   21.043   11.315   3.6104   15.406   3.9643  -8.5730   8.7419  136.975   19.455   64.938   31.064 72.03666 36.65340 
1 1 1   25   25   27 o  133.642   18.788   14.646   3.7370   16.144   4.1980   8.9250   8.2026  139.717   20.218  101.400   38.434 38.31736 43.42694 
1 1 1   25   25   28 o  120.631   22.161   12.327   3.9410   15.431   4.4727   1.5510   8.3342  135.151   22.406   80.511   35.303 54.63994 41.81284 
1 1 1   25   25   29 o  248.147   12.214   48.369   4.6392   57.376   5.5542   27.585   8.4370  269.522   13.463  172.217   33.211 97.30489 35.83588 
1 1 1   25   25   30 o  144.774   17.549   17.173   3.8092   19.484   4.3279   9.2309   8.0248  153.596   18.802   99.812   37.971 53.78338 42.37073 
1 1 1   25   25   31 o  235.813   12.219   43.939   4.3954   53.816   5.2110   19.586   8.1827  260.420   13.115  138.649   37.606 121.7712 39.82742 
1 1 1   25   25   32 o  128.074   20.735   13.946   3.9258   12.428   4.5447   18.409   7.7921  117.553   25.952  134.126   36.831 -16.57261 45.05584 
1 1 1   25   25   33 o   90.718   24.007   7.3593   3.3854   1.7777   4.4952   14.673   5.1458   64.086   26.961  126.585   27.356 -62.49938 38.40921 
1 1 1   25   26    0 o  327.258   19.494   84.205   9.6855   84.205   9.6855   84.205   9.6855  327.258   19.494  327.258   19.494 0.000000 0.000000 
1 1 1   25   26    1 o  182.311   20.828   26.724   5.7077   32.423   7.9949   20.800   8.1511  197.956   27.098  153.886   35.350 44.07018 44.54062 
1 1 1   25   26    2 o  232.135   16.854   42.496   5.9475   43.491   8.1518   41.364   8.6966  231.811   23.290  224.687   25.752 7.123856 34.72153 
1 1 1   25   26    3 o  203.917   18.452   33.041   5.6968   32.366   7.6850   33.863   8.4877  198.359   25.933  201.686   28.271 -3.326126 38.36370 
1 1 1   25   26    4 o  223.897   17.345   39.625   5.8977   34.343   7.6998   47.124   9.1737  204.820   25.085  240.158   25.339 -35.33858 35.65535 
1 1 1   25   26    5 o  182.657   28.260   27.877   7.6459   27.877   7.6459   0.0000   0.0000  182.657   28.260  ?   ?  0.000000 28.26048 
1 1 1   25   26    6 o  261.411   14.116   53.400   5.6272   53.400   5.6272   0.0000   0.0000  261.411   14.116  ?   ?  0.000000 14.11594 
1 1 1   25   26    7 o   97.010   25.077   7.8987   3.7509   6.7667   4.0998   13.713   9.2915   90.236   27.330  124.352   41.557 -34.11546 49.73835 
1 1 1   25   26    8 o  286.881   10.205   63.598   4.4809   63.814   4.9274   62.568   10.773  287.080   11.214  276.522   25.748 10.55719 28.08362 
1 1 1   25   26    9 o  165.569   15.913   21.663   3.9832   19.981   4.3034   31.717   10.522  158.223   18.095  188.961   37.700 -30.73837 41.81774 
1 1 1   25   26   10 o  257.635   10.865   51.374   4.2845   50.703   4.6853   54.804   10.587  255.638   11.974  257.428   27.285 -1.789505 29.79662 
1 1 1   25   26   11 o  292.450   10.062   66.103   4.5039   71.666   4.9468   39.143   10.890  304.337   10.619  212.172   34.735 92.16528 36.32229 
1 1 1   25   26   12 o  128.782   19.370   13.423   3.6999   15.101   3.9590   1.8447   10.399  136.700   19.471   92.139   39.930 44.56072 44.42487 
1 1 1   25   26   13 o  144.279   17.758   16.663   3.8388   17.805   4.0803   7.8596   11.326  149.021   18.271  108.431   43.911 40.59061 47.56108 
1 1 1   25   26   14 o  109.626   25.124   10.147   4.1254   12.802   4.4229  -7.6224   11.442  123.792   24.210   79.392   37.242 44.39983 44.41903 
1 1 1   25   26   15 o  252.536   12.501   49.621   4.8323   51.786   5.2627   37.985   12.200  257.343   13.407  203.424   40.606 53.91879 42.76167 
1 1 1   25   26   16 o  125.871   19.276   12.870   3.5955   13.285   3.8123   9.5339   10.815  127.577   20.196  110.991   43.579 16.58660 48.03073 
1 1 1   25   26   17 o  294.793   9.8949   67.246   4.4648   71.730   4.9130   45.985   10.698  304.234   10.551  231.491   30.970 72.74234 32.71780 
1 1 1   25   26   18 o  257.072   10.636   51.247   4.1850   56.585   4.6966   30.672   9.2203  269.878   11.370  186.432   33.545 83.44633 35.41921 
1 1 1   25   26   19 o  293.881   9.7063   66.852   4.3661   75.161   5.0300   41.458   8.7933  311.288   10.557  222.433   26.339 88.85565 28.37608 
1 1 1   25   26   20 o   85.820   37.590   1.2809   9.4260   1.2809   9.4260   0.0000   0.0000   85.820   37.590  ?   ?  0.000000 37.58955 
1 1 1   25   26   21 o  102.474   40.917   7.9170   9.6844   7.9170   9.6844   0.0000   0.0000  102.474   40.917  ?   ?  0.000000 40.91701 
1 1 1   25   26   22 o  141.997   29.853   17.770   6.2824   23.858   10.139   13.976   8.0041  156.077   41.662  121.635   38.423 34.44223 56.67497 
1 1 1   25   26   23 f  150.671   15.578   18.137   3.5407   18.154   3.9219   18.061   8.2323  149.977   17.408  137.650   37.881 12.32671 41.68935 
1 1 1   25   26   24 o  124.979   17.992   12.732   3.3425   15.925   3.6765  -2.4865   8.0267  140.218   17.512   71.701   32.763 68.51695 37.14980 
1 1 1   25   26   25 o   86.246   23.764   6.3873   3.2374   6.1010   3.5540   7.7834   7.8475   84.307   25.426   97.295   37.421 -12.98850 45.24168 
1 1 1   25   26   26 o  171.524   14.504   23.426   3.7723   26.699   4.2303   10.720   8.3348  182.819   15.257  107.189   39.096 75.63044 41.96737 
1 1 1   25   26   27 o   66.448   24.776   3.1732   3.3789   5.4286   3.7402  -6.8375   7.8798   79.893   26.353   62.714   29.859 17.17933 39.82458 
1 1 1   25   26   28 o  124.766   21.980   13.246   4.0442   15.670   4.7786   7.1274   7.5919  134.682   24.064   92.771   36.484 41.91080 43.70506 
1 1 1   25   26   29 o  138.602   19.786   16.056   4.0784   22.264   4.7505  -1.3459   7.9536  163.849   19.313   71.649   32.691 92.20051 37.96923 
1 1 1   25   26   30 o  128.294   19.155   13.766   3.6462   15.940   4.2166   7.3222   7.2602  137.282   20.711   91.630   35.783 45.65200 41.34404 
1 1 1   25   26   31 o   83.524   25.706   6.2412   3.6081   6.1871   4.1881   6.3971   7.1060   83.199   27.900   87.746   35.045 -4.546722 44.79458 
1 1 1   25   26   32 o   79.582   26.544   5.6147   3.7910   6.3959   4.3880   3.3157   7.5278   84.076   28.556   79.298   34.169 4.777603 44.53101 
1 1 1   25   27    0 o  137.954   43.727   19.378   8.1232   19.378   8.1232   19.378   8.1232  137.954   43.727  137.954   43.727 0.000000 0.000000 
1 1 1   25   27    1 o  189.687   21.046   28.997   6.0076   33.590   8.5268   24.470   8.4657  200.312   28.624  167.441   34.188 32.87093 44.58897 
1 1 1   25   27    2 o  171.412   23.464   24.025   5.9945   18.748   8.3068   29.759   8.6592  144.575   37.293  186.757   31.407 -42.18176 48.75615 
1 1 1   25   27    3 o  282.718   21.077   64.074   9.0554   64.074   9.0554   0.0000   0.0000  282.718   21.077  ?   ?  0.000000 21.07741 
1 1 1   25   27    4 o  162.278   31.677   22.663   7.5857   22.663   7.5857   0.0000   0.0000  162.278   31.677  ?   ?  0.000000 31.67685 
1 1 1   25   27    5 o  236.026   17.757   44.161   6.3680   45.016   8.2696   42.917   9.9815  235.471   23.248  226.005   29.563 9.465958 37.60865 
1 1 1   25   27    6 o   50.758   24.259  -6.4478   5.3062 -10.1739   6.5838   0.4584   8.9632   52.962   25.731   84.033   36.735 -31.07070 44.84982 
1 1 1   25   27    7 o  102.396   24.297   8.8045   3.7507   11.698   4.1235  -5.0625   9.0269  118.606   23.544   73.484   33.998 45.12242 41.35498 
1 1 1   25   27    8 o   81.450   26.047   5.3902   3.6696   3.9247   3.9926   13.364   9.3132   74.276   27.064  122.331   41.602 -48.05456 49.63038 
1 1 1   25   27    9 o  170.515   15.417   22.961   3.9802   23.350   4.3491   20.950   9.8756  171.486   16.784  149.940   41.579 21.54649 44.83902 
1 1 1   25   27   10 o   76.187   26.288   4.4679   3.7218   4.3520   4.0270   5.1472   9.7471   76.498   27.269   97.566   40.266 -21.06823 48.63103 
1 1 1   25   27   11 o  270.547   10.812   56.706   4.4774   59.597   4.9441   43.519   10.558  277.086   11.657  225.567   31.434 51.51915 33.52563 
1 1 1   25   27   12 o   42.323   20.320  -5.1385   3.8184  -4.7830   4.1799  -6.9316   9.3869   45.845   21.805   71.733   33.675 -25.88739 40.11819 
1 1 1   25   27   13 o  131.819   24.394   14.533   4.7405   16.800   5.4127   7.0681   9.8220  141.210   26.001  102.298   41.079 38.91274 48.61606 
1 1 1   25   27   14 o   96.919   27.589   8.0404   4.2892   7.5443   4.8629   9.7786   9.1024   94.345   29.965  108.740   40.642 -14.39500 50.49394 
1 1 1   25   27   15 o  264.114   11.406   54.191   4.6109   61.051   5.2701   31.802   9.5211  279.995   12.297  189.637   34.053 90.35770 36.20546 
1 1 1   25   27   16 o  160.027   16.189   20.396   3.9108   24.576   4.4574   6.4187   8.1504  175.551   16.794   95.753   37.756 79.79828 41.32204 
1 1 1   25   27   17 o  202.197   13.573   32.134   4.1764   36.547   4.9075   20.545   7.9530  215.077   15.001  150.318   35.188 64.75941 38.25202 
1 1 1   25   27   18 o  160.071   16.273   20.459   3.9316   20.016   4.4487   22.042   8.4018  157.211   18.864  154.826   36.115 2.385162 40.74523 
1 1 1   25   27   19 o  207.149   13.929   33.821   4.3909   33.821   4.3909   0.0000   0.0000  207.149   13.929  ?   ?  0.000000 13.92928 
1 1 1   25   27   20 o   66.536   25.993   2.6455   3.8322   2.6455   3.8322   0.0000   0.0000   66.536   25.993  ?   ?  0.000000 25.99299 
1 1 1   25   27   21 o  144.628   25.736   17.872   5.4885   18.685   7.2488   16.781   8.4020  142.965   33.680  132.080   38.921 10.88527 51.47031 
1 1 1   25   27   22 o   83.423   31.192   5.3098   5.3629   6.0166   7.3483   4.5044   7.8445   90.950   35.853   87.616   36.137 3.333298 50.90559 
1 1 1   25   27   23 o   50.650   24.130  -5.5110   5.1630 -11.0830   7.1009   0.7384   7.5202   53.596   26.189   76.280   33.489 -22.68344 42.51310 
1 1 1   25   27   24 o   83.199   23.902   5.9483   3.2048   5.1120   3.5261   9.9198   7.6843   78.092   25.579  104.115   37.606 -26.02261 45.48038 
1 1 1   25   27   25 o   89.086   23.112   6.8603   3.1785   7.2627   3.4790   4.8281   7.8184   91.254   24.425   87.057   36.007 4.196465 43.50911 
1 1 1   25   27   26 o   65.396   24.257   3.1109   3.2305   4.2383   3.5789  -1.8494   7.5068   72.691   25.729   69.408   31.704 3.283165 40.83029 
1 1 1   25   27   27 o   71.773   25.349   4.1619   3.4721   5.9537   3.9856  -1.4786   7.0714   82.588   27.201   67.944   30.932 14.64407 41.19105 
1 1 1   25   27   28 o  193.837   13.453   29.921   3.9666   36.022   4.5877   11.859   7.8943  212.296   14.200  108.326   38.227 103.9691 40.77914 
1 1 1   25   27   29 o  160.165   16.502   20.932   3.9876   24.542   4.6605   11.068   7.7040  172.626   17.898  104.751   37.677 67.87528 41.71264 
1 1 1   25   27   30 o  107.160   23.285   10.118   3.7101   16.265   4.3566  -6.1081   7.0781  137.938   21.322   58.789   28.075 79.14941 35.25381 
1 1 1   25   28    1 o  184.998   33.162   29.731   9.0452   29.731   9.0452   0.0000   0.0000  184.998   33.162  ?   ?  0.000000 33.16175 
1 1 1   25   28    2 o  140.055   37.691   17.807   8.2578   17.807   8.2578   0.0000   0.0000  140.055   37.691  ?   ?  0.000000 37.69067 
1 1 1   25   28    3 o  236.600   17.946   44.491   6.4507   38.879   8.4911   52.150   9.9199  216.668   26.131  251.243   26.180 -34.57509 36.98948 
1 1 1   25   28    4 o   58.098   26.851  -3.6369   5.6086  -1.9143   7.1660  -6.3604   9.0106   70.515   31.713   71.075   33.247 -0.5598145 45.94640 
1 1 1   25   28    5 o  111.965   32.599   10.969   5.9257   9.9292   7.7595   12.423   9.1783  108.207   37.922  118.505   41.260 -10.29800 56.03978 
1 1 1   25   28    6 o   73.139   29.933   2.3225   5.3305   3.5990   6.6072  -0.0573   9.0216   82.804   33.537   82.682   36.476 0.1220016 49.54990 
1 1 1   25   28    7 o  165.751   16.163   21.799   4.0485   22.465   4.4930   18.927   9.3349  167.673   17.778  142.431   40.756 25.24246 44.46459 
1 1 1   25   28    8 o   72.112   26.478   3.6596   3.8321   3.4010   4.2474   4.7914   8.8862   72.531   27.617   93.757   38.542 -21.22591 47.41452 
1 1 1   25   28    9 o   92.210   26.316   7.2078   3.8973   4.4740   4.3324   18.804   8.9229   77.879   28.220  142.241   39.551 -64.36153 48.58651 
1 1 1   25   28   10 o  242.559   12.038   45.761   4.4692   53.421   5.1202   21.251   9.1584  261.810   12.777  151.282   39.224 110.5284 41.25268 
1 1 1   25   28   11 o   86.548   26.326   6.2875   3.7981   5.8199   4.3138   7.9001   8.0103   84.563   28.316  100.575   38.014 -16.01126 47.40094 
1 1 1   25   28   12 o   52.983   23.941  -1.6717   4.1404   3.5221   4.8881 -14.8609   7.7895   75.422   29.386   53.599   26.436 21.82283 39.52762 
1 1 1   25   28   13 o   70.832   25.650   3.6484   3.5783   3.6149   4.0436   3.7693   7.6835   72.416   27.084   86.403   35.712 -13.98663 44.82051 
1 1 1   25   28   14 o  158.069   16.022   19.909   3.8228   22.130   4.3053   11.633   8.3111  166.261   17.165  113.517   39.277 52.74386 42.86366 
1 1 1   25   28   15 o  189.929   13.596   28.391   3.9264   26.656   4.4574   34.399   8.2955  183.005   16.076  201.104   27.683 -18.09894 32.01252 
1 1 1   25   28   16 o  342.557   9.3280   90.826   4.8910  106.045   5.7267   49.797   9.4027  369.780   10.118  243.906   25.566 125.8742 27.49545 
1 1 1   25   28   17 o  225.885   12.132   39.925   4.1794   46.024   4.7834   20.244   8.5924  242.207   12.950  146.422   38.007 95.78578 40.15213 
1 1 1   25   28   18 o  106.272   25.722   9.7601   4.1391   9.7601   4.1391   0.0000   0.0000  106.272   25.722  ?   ?  0.000000 25.72238 
1 1 1   25   28   19 o   79.423   26.092   5.2246   3.6679   6.7857   4.1275  -0.6378   7.9985   88.831   27.520   75.555   33.776 13.27677 43.56791 
1 1 1   25   28   20 f  101.540   24.694   8.8972   3.8010   11.578   4.3894   0.8616   7.6000  115.753   25.466   77.134   33.770 38.61906 42.29539 
1 1 1   25   28   21 o  114.711   29.399   11.791   5.1856   18.833   7.1824   4.1242   7.4946  142.939   33.425   85.096   35.229 57.84356 48.56268 
1 1 1   25   28   22 o   99.598   31.394   8.9694   5.3457   13.602   7.5522   4.3180   7.5679  118.620   37.304   85.430   35.387 33.19016 51.41784 
1 1 1   25   28   23 o   68.591   29.128   1.5696   5.3266  -3.8660   7.4019   7.4079   7.6711   65.467   30.460   94.676   36.834 -29.20940 47.79705 
1 1 1   25   28   24 o  116.076   30.031   12.386   5.3762   16.997   7.8335   8.2794   7.3919  130.857   37.297   96.680   36.523 34.17777 52.20142 
1 1 1   25   28   25 o  271.370   10.184   57.457   4.2300   72.241   5.0212   21.317   7.8508  303.927   10.794  148.391   35.112 155.5359 36.73401 
1 1 1   25   28   26 o   51.304   22.149   0.2361   3.1754   1.3768   3.5977  -3.7844   6.7546   58.563   24.340   61.741   28.850 -3.177860 37.74602 
1 1 1   25   28   27 o   58.540   23.324   1.9589   3.1407   1.2150   3.5150   4.9044   6.9942   57.264   23.951   83.319   34.215 -26.05566 41.76510 
1 1 1   25   28   28 o  100.563   23.649   8.9516   3.5790   11.136   4.0564   1.2762   7.6040  112.035   24.350   75.077   33.285 36.95845 41.24125 
1 1 1   25   29    0 o   62.513   39.414   2.4065   7.9914   2.4065   7.9914   2.4065   7.9914   62.513   39.414   62.513   39.414 0.000000 0.000000 
1 1 1   25   29    1 o   72.776   33.104  -2.7661   8.0779   0.0000   0.0000  -2.7661   8.0779  ?   ?    72.776   33.104 0.000000 33.10424 
1 1 1   25   29    2 o  260.787   25.586   56.281   10.082   0.0000   0.0000   56.281   10.082  ?   ?   260.787   25.586 0.000000 25.58578 
1 1 1   25   29    3 o  195.957   32.264   33.383   9.3403   0.0000   0.0000   33.383   9.3403  ?   ?   195.957   32.264 0.000000 32.26401 
1 1 1   25   29    4 o  120.286   32.141   12.806   6.0305   15.849   8.3271   9.4492   8.7452  130.887   38.795  107.096   39.874 23.79013 55.63232 
1 1 1   25   29    5 o  161.818   24.401   21.774   5.8560   19.953   7.9035   23.990   8.7198  148.733   35.255  163.035   35.913 -14.30211 50.32514 
1 1 1   25   29    6 o  133.701   25.352   15.081   4.9983   17.385   6.0078   9.9010   9.0089  142.139   28.605  108.774   40.476 33.36438 49.56358 
1 1 1   25   29    7 o  139.951   23.694   16.324   4.8945   17.690   5.9604   13.496   8.5763  143.587   28.126  121.108   39.903 22.47953 48.81913 
1 1 1   25   29    8 o   72.564   26.853   3.7095   3.9544   4.9251   4.4936  -0.4631   8.3254   80.286   28.786   78.298   34.766 1.987999 45.13626 
1 1 1   25   29    9 o  144.257   19.300   16.895   4.1546   17.952   4.7718   13.581   8.4465  147.675   21.763  121.096   39.585 26.57870 45.17311 
1 1 1   25   29   10 o  150.101   22.079   18.592   4.9211   21.197   5.9005   12.640   8.9191  158.865   25.099  117.364   40.684 41.50117 47.80304 
1 1 1   25   29   11 o  268.511   13.053   56.365   5.3648   62.566   6.6484   44.790   9.0830  281.299   15.501  231.071   26.141 50.22844 30.39120 
1 1 1   25   29   12 o  183.603   14.976   26.701   4.1719   26.595   4.8266   27.011   8.2963  182.118   17.531  174.781   32.198 7.336441 36.66108 
1 1 1   25   29   13 o   52.844   23.309  -0.5866   3.6827   0.7910   4.2014  -5.1557   7.6515   61.052   25.895   65.630   30.680 -4.578094 40.14753 
1 1 1   25   29   14 o  100.605   25.367   8.7135   3.9054   13.908   4.3838 -11.2657   8.5978  128.726   23.098   61.256   29.677 67.47050 37.60599 
1 1 1   25   29   15 o  217.893   12.860   37.274   4.2699   40.752   4.8836   25.985   8.7982  227.292   14.107  168.454   35.254 58.83725 37.97201 
1 1 1   25   29   16 o  212.491   13.049   35.499   4.2236   35.038   4.7655   37.185   9.1200  210.259   14.904  206.787   29.664 3.471924 33.19726 
1 1 1   25   29   17 o   94.232   28.101   7.7593   4.3592   7.7593   4.3592   0.0000   0.0000   94.232   28.101  ?   ?  0.000000 28.10074 
1 1 1   25   29   18 o   47.455   21.805  -2.1204   3.6226  -1.6620   4.1507  -3.5858   7.4211   52.572   23.843   66.749   30.863 -14.17633 38.99974 
1 1 1   25   29   19 o  171.513   15.291   23.495   3.9720   26.566   4.6816   15.604   7.5042  181.561   17.046  127.589   36.552 53.97163 40.33098 
1 1 1   25   29   20 o   54.613   23.792  -0.0199   3.7308   2.7966   4.3735  -7.5453   7.1490   68.962   27.509   58.358   27.962 10.60335 39.22552 
1 1 1   25   29   21 o   98.533   30.870   8.8397   5.1772   11.401   7.1887   6.0799   7.4623  109.045   36.553   89.867   35.906 19.17715 51.23782 
1 1 1   25   29   22 f  115.178   29.442   12.137   5.2104   16.124   7.1276   7.5603   7.6360  128.981   35.145   94.467   36.751 34.51370 50.85083 
1 1 1   25   29   23 o   57.335   26.202  -1.9421   5.1359  -3.3547   6.9300  -0.2209   7.6496   63.638   29.564   73.049   32.817 -9.411194 44.16951 
1 1 1   25   29   24 o  144.340   25.255   18.264   5.3764   22.324   7.6480   14.296   7.5596  152.831   33.608  118.738   37.319 34.09364 50.22181 
1 1 1   25   29   25 o   87.669   32.814   6.6960   5.9382   12.461   10.985   4.3162   7.0582  109.171   43.583   81.808   34.054 27.36378 55.30949 
1 1 1   25   29   26 o  118.643   18.691   11.781   3.2820   13.129   3.6742   6.4611   7.3002  124.678   19.924   88.493   35.458 36.18552 40.67196 
1 1 1   25   30    0 o  435.967   17.958  149.080   11.938  149.080   11.938  149.080   11.938  435.967   17.958  435.967   17.958 0.000000 0.000000 
1 1 1   25   30    1 f   69.897   30.003   0.8632   5.7618  -0.3217   8.1915   2.0235   8.1062   77.833   34.526   83.009   35.608 -5.175240 49.59753 
1 1 1   25   30    2 o  297.476   15.758   69.986   7.1495   81.128   10.237   59.378   9.9891  316.232   21.274  267.755   24.650 48.47705 32.56107 
1 1 1   25   30    3 o   99.982   33.780   8.6193   6.1397   19.746   8.8988  -1.4889   8.4820  144.596   39.216   76.538   34.454 68.05780 52.20160 
1 1 1   25   30    4 o  146.566   29.034   18.635   6.2831   16.207   8.8269   21.129   8.9456  130.639   40.207  149.957   38.710 -19.31779 55.81225 
1 1 1   25   30    5 o  121.345   41.188   13.807   9.1287   0.0000   0.0000   13.807   9.1287  ?   ?   121.345   41.188 0.000000 41.18823 
1 1 1   25   30    6 o  121.646   33.514   13.390   6.4395   17.920   9.4966   9.5339   8.7615  136.130   41.672  106.289   39.844 29.84094 57.65541 
1 1 1   25   30    7 o  175.811   25.973   26.093   6.7790   28.799   9.9463   23.745   9.2639  176.101   38.014  159.090   38.467 17.01083 54.08120 
1 1 1   25   30    8 o   50.522   24.693 -10.4444   6.3243  -5.5651   9.2985 -14.6444   8.6270   72.476   33.861   57.670   28.321 14.80573 44.14316 
1 1 1   25   30    9 o  129.981   25.492   14.408   4.8905   8.4999   5.7199   30.465   9.4296   98.784   32.589  183.570   34.834 -84.78569 47.70188 
1 1 1   25   30   10 o  146.056   19.331   17.385   4.2153   12.658   4.7149   36.216   9.4099  121.260   26.170  203.273   31.244 -82.01311 40.75598 
1 1 1   25   30   11 o   89.682   27.278   6.9057   4.0779   5.9900   4.5145   10.965   9.5049   85.113   28.965  110.976   41.520 -25.86234 50.62494 
1 1 1   25   30   12 o  215.669   13.641   36.642   4.4799   39.778   5.0430   24.903   9.7564  224.195   14.779  160.989   39.815 63.20613 42.46974 
1 1 1   25   30   13 o  133.767   20.279   14.751   4.0219   13.506   4.4697   20.047   9.2187  126.140   24.028  143.307   40.327 -17.16732 46.94247 
1 1 1   25   30   14 o  297.401   10.491   68.769   4.7757   73.277   5.4678   54.267   9.8072  306.430   11.658  253.587   25.618 52.84322 28.14576 
1 1 1   25   30   15 o   56.010   24.936  -0.8413   4.3116  -0.8413   4.3116   0.0000   0.0000   56.010   24.936  ?   ?  0.000000 24.93611 
1 1 1   25   30   16 f  220.432   14.582   38.564   4.8921   38.564   4.8921   0.0000   0.0000  220.432   14.582  ?   ?  0.000000 14.58166 
1 1 1   25   30   17 f  113.951   23.394   11.127   3.9436   12.444   4.4750   6.5467   8.3434  119.718   25.217   93.717   37.781 26.00109 45.42355 
1 1 1   25   30   18 o  134.604   20.233   15.074   4.0397   19.395   4.6748   2.3350   8.0274  152.811   20.504   81.161   35.128 71.65028 40.67376 
1 1 1   25   30   19 o  121.443   22.517   12.583   4.0314   13.926   4.7636   9.1942   7.5674  126.160   25.545  100.296   37.141 25.86357 45.07787 
1 1 1   25   30   20 o   42.967   21.163  -9.2065   4.9351  -7.3494   6.5039 -11.7268   7.5769   54.862   26.387   54.590   26.754 0.2721329 37.57759 
1 1 1   25   30   21 o   62.888   27.861  -0.1562   5.3177   2.8165   6.9573  -4.3331   8.2468   77.901   33.190   67.666   31.702 10.23488 45.89769 
1 1 1   25   30   22 f   91.532   31.777   7.6227   5.4424   9.1784   7.0820   5.3787   8.5056   98.620   36.028   88.559   37.162 10.06155 51.75946 
1 1 1   25   30   23 o  118.968   29.695   13.195   5.3902   14.706   7.0691   11.096   8.3314  121.068   35.708  105.124   38.963 15.94356 52.84995 
1 1 1   25   30   24 o   93.675   34.709   8.1495   6.6104   24.480   10.855  -1.4748   8.3337  146.148   44.518   72.157   33.124 73.99063 55.48899 
1 1 1   25   31    0 o  241.895   26.330   48.291   9.4557   48.291   9.4557   48.291   9.4557  241.895   26.330  241.895   26.330 0.000000 0.000000 
1 1 1   25   31    1 o  146.287   29.712   18.769   6.4259   24.997   8.9464   12.132   9.2356  164.466   36.493  114.828   41.258 49.63780 55.08124 
1 1 1   25   31    2 o   92.346   33.050   7.0234   5.9208   9.4963   8.4515   4.6399   8.2973  105.277   39.198   89.993   37.147 15.28351 54.00356 
1 1 1   25   31    3 f  202.047   21.084   33.386   6.4243   36.545   9.4248   30.644   8.7800  204.262   31.129  186.160   31.965 18.10143 44.61805 
1 1 1   25   31    4 o   76.164   31.192   2.9057   5.7933   2.7538   7.9812   3.0748   8.4225   83.853   35.633   86.154   36.608 -2.301003 51.08724 
1 1 1   25   31    5 o   54.187   25.824  -6.3268   5.9245  -3.6997   7.9960  -9.5245   8.8218   69.691   32.157   64.447   30.928 5.244232 44.61639 
1 1 1   25   31    6 o   39.992   19.965 -12.3241   4.9906 -12.6541   6.0147 -11.5951   8.9411   45.939   22.762   62.343   30.218 -16.40336 37.83175 
1 1 1   25   31    7 o   50.816   24.076  -4.9764   5.0014  -2.0108   5.9902 -11.8021   9.0877   63.096   28.626   62.708   30.411 0.3882103 41.76450 
1 1 1   25   31    8 o   92.934   31.071   7.4377   5.1939   15.857   6.1883 -12.6304   9.5539  133.057   30.966   63.745   30.975 69.31197 43.79937 
1 1 1   25   31    9 o  123.180   28.027   13.326   5.1653   15.307   6.1033   8.3255   9.6967  130.523   31.009  102.671   40.959 27.85266 51.37336 
1 1 1   25   31   10 o   42.691   20.596  -5.6237   4.0351  -8.4031   4.5420   4.7849   8.7896   41.820   20.540   90.929   37.939 -49.10944 43.14233 
1 1 1   25   31   11 o  101.268   30.602   9.1858   5.1446   6.3896   6.1573   15.651   9.3630   89.382   33.423  125.445   41.710 -36.06228 53.44901 
1 1 1   25   31   12 o  107.539   30.880   10.487   5.3504   12.177   6.6020   7.2526   9.1327  114.067   34.711   97.805   39.493 16.26186 52.57877 
1 1 1   25   31   13 o   96.964   31.274   8.4207   5.2817   9.0964   6.5581   7.1735   8.9103  100.351   34.880   96.808   39.037 3.542915 52.35014 
1 1 1   25   31   14 o  166.479   28.301   24.397   6.9535   24.397   6.9535   0.0000   0.0000  166.479   28.301  ?   ?  0.000000 28.30129 
1 1 1   25   31   15 o   78.391   30.164   4.4959   5.1003   6.4996   6.4999   1.2856   8.2273   89.484   34.142   79.298   34.916 10.18565 48.83416 
1 1 1   25   31   16 o  223.481   16.950   40.339   5.7549   46.339   7.3948   31.124   9.1642  236.711   20.615  182.487   34.062 54.22427 39.81470 
1 1 1   25   31   17 o  153.723   17.766   19.322   4.1032   19.222   4.7741   19.604   8.0272  151.356   21.188  141.091   36.790 10.26491 42.45499 
1 1 1   25   31   18 o  215.543   13.360   36.865   4.3859   47.449   5.2576   12.649   7.9530  244.124   14.131  112.297   38.443 131.8277 40.95790 
1 1 1   25   31   19 o  226.598   12.822   40.658   4.4288   48.051   5.2466   22.334   8.2603  245.606   14.014  150.497   36.283 95.10913 38.89520 
1 1 1   25   31   20 o  238.501   12.527   45.004   4.5570   53.944   5.3720   22.061   8.6058  260.482   13.520  147.344   37.933 113.1384 40.27010 
1 1 1   25   31   21 o   87.108   31.272   6.7420   5.3047   10.476   6.8884   1.3007   8.3155  103.227   35.755   77.879   34.654 25.34814 49.79307 
1 1 1   25   31   22 o  157.126   23.577   21.389   5.4954   24.203   7.1562   17.346   8.5792  161.824   29.996  127.353   39.712 34.47125 49.76761 
1 1 1   25   32    0 o   76.282   44.714   7.0107   8.7729   7.0107   8.7729   7.0107   8.7729   76.282   44.714   76.282   44.714 0.000000 0.000000 
1 1 1   25   32    1 o  426.001   12.665  142.185   8.2580  137.597   11.835  146.538   11.528  413.448   18.702  427.873   17.602 -14.42532 25.68254 
1 1 1   25   32    2 o   81.558   32.028   4.5357   5.8427   6.6559   8.4334   2.5788   8.1023   95.113   38.110   83.052   35.612 12.06100 52.15938 
1 1 1   25   32    3 o  199.694   21.128   32.837   6.3599   41.844   9.2330   24.705   8.7732  220.109   28.042  162.238   36.243 57.87068 45.82536 
1 1 1   25   32    4 o  126.301   31.987   14.570   6.1903   21.280   9.1322   8.8667   8.4201  147.323   39.632  101.801   38.855 45.52177 55.50103 
1 1 1   25   32    5 o  119.122   32.380   13.041   6.0588   19.369   8.5130   6.5458   8.6248  141.219   38.380   94.923   38.361 46.29619 54.26470 
1 1 1   25   32    6 o  135.698   26.772   16.042   5.3631   14.122   6.5670   19.887   9.2934  123.044   33.821  141.007   40.758 -17.96303 52.96324 
1 1 1   25   32    7 o   68.316   28.669   1.7472   5.0623   4.0196   6.0735  -3.4239   9.1620   80.099   32.254   74.176   34.295 5.922691 47.07968 
1 1 1   25   32    8 o   92.085   30.815   7.4410   5.1088   4.8428   6.1276   13.364   9.2524   83.040   32.739  116.482   41.354 -33.44213 52.74481 
1 1 1   25   32    9 o   78.785   29.733   4.6711   4.8959   10.428   5.9640  -7.2243   8.5733  106.136   33.113   65.559   31.194 40.57735 45.49227 
1 1 1   25   32   10 o  140.417   20.376   16.388   4.2514   17.411   4.8338   12.894   8.9334  143.458   22.775  114.337   40.631 29.12108 46.57853 
1 1 1   25   32   11 o  156.992   18.424   20.171   4.3430   22.383   5.0522   13.910   8.5001  164.222   20.549  117.942   39.746 46.27979 44.74404 
1 1 1   25   32   12 o   67.280   27.837   2.0940   4.6754   2.0940   4.6754   0.0000   0.0000   67.280   27.837  ?   ?  0.000000 27.83703 
1 1 1   25   32   13 o   97.333   29.202   8.5942   4.6970   8.5942   4.6970   0.0000   0.0000   97.333   29.202  ?   ?  0.000000 29.20197 
1 1 1   25   32   14 o  174.498   16.069   24.576   4.2435   26.688   4.8908   18.146   8.5355  180.788   17.910  133.271   39.217 47.51672 43.11285 
1 1 1   25   32   15 o  107.981   25.127   10.302   4.0749   11.560   4.7374   6.7227   7.9892  113.112   27.606   91.905   36.998 21.20733 46.16220 
1 1 1   25   32   16 o  108.368   25.823   10.472   4.2224   13.327   4.9812   3.1839   7.9587  121.589   27.419   81.799   35.191 39.78956 44.61182 
1 1 1   25   32   17 o   90.172   27.154   7.3246   4.0558   4.7224   4.7744   14.070   7.6872   77.547   29.339  117.446   37.714 -39.89901 47.78204 
1 1 1   25   32   18 o   80.205   27.301   5.5800   4.0108   7.8150   4.7047  -0.3648   7.6730   92.271   29.491   72.256   32.625 20.01482 43.97892 
1 1 1   25   32   19 o   74.436   27.216   4.4870   4.0425   9.1872   4.7396  -8.0591   7.7436   99.370   29.218   59.382   28.619 39.98789 40.89962 
1 1 1   25   33    0 o   79.441   44.029   8.2916   7.8655   8.2916   7.8655   8.2916   7.8655   79.441   44.029   79.441   44.029 0.000000 0.000000 
1 1 1   25   33    1 o  103.933   32.685   9.9988   5.7979   16.809   8.4663   3.9839   7.9565  129.426   39.290   85.162   35.851 44.26416 53.18813 
1 1 1   25   33    2 o  144.939   27.778   18.568   5.9382   21.656   8.7784   15.962   8.0628  148.049   38.409  126.810   38.308 21.23948 54.24776 
1 1 1   25   33    3 o  127.464   30.412   14.836   5.8506   16.404   8.4082   13.364   8.1461  127.807   39.226  116.239   38.911 11.56773 55.25181 
1 1 1   25   33    4 o   87.672   33.004   6.2762   6.0237   9.0652   8.9071   3.9256   8.1772  101.447   39.629   85.489   36.185 15.95737 53.66397 
1 1 1   25   33    5 o  206.258   20.866   35.271   6.4969   42.042   9.4706   29.251   8.9294  217.909   29.123  176.857   34.223 41.05231 44.93750 
1 1 1   25   33    6 o  131.437   26.576   15.219   5.1628   13.893   6.2972   17.938   9.0170  121.359   33.021  132.064   40.636 -10.70510 52.36085 
1 1 1   25   33    7 o   92.488   30.543   7.6679   5.0237   11.416   6.2151   0.6044   8.5325  109.720   33.733   78.525   35.011 31.19546 48.61743 
1 1 1   25   33    8 o  212.675   16.582   36.501   5.3551   32.687   6.6673   43.434   8.9893  197.003   22.515  223.309   26.837 -26.30553 35.03096 
1 1 1   25   33    9 o  188.390   18.242   29.017   5.1943   28.513   6.5101   29.901   8.6168  182.767   23.839  179.756   32.515 3.010986 40.31755 
1 1 1   25   33   10 o  267.832   17.185   58.088   7.0078   58.088   7.0078   0.0000   0.0000  267.832   17.185  ?   ?  0.000000 17.18496 
1 1 1   25   33   11 o   91.461   30.411   7.5575   4.9773   7.5575   4.9773   0.0000   0.0000   91.461   30.411  ?   ?  0.000000 30.41105 
1 1 1   25   33   12 o  181.092   16.090   26.514   4.4135   36.296   5.1596  -0.1639   8.5209  212.121   16.009   76.181   34.391 135.9394 37.93475 
1 1 1   25   33   13 o  137.259   20.860   15.895   4.2446   16.861   4.9074   13.026   8.4570  139.568   23.827  112.582   39.582 26.98636 46.20054 
1 1 1   25   33   14 o  102.514   26.142   9.4495   4.1147   9.5015   4.7263   9.2864   8.3634  101.424   28.992   99.575   38.538 1.849167 48.22586 
1 1 1   25   33   15 o  255.000   12.490   51.331   4.8751   54.176   5.7271   43.849   9.2895  260.297   14.431  221.531   28.023 38.76527 31.52032 
1 1 1   25   34    0 o   46.997   32.729  -5.7815   8.4437  -5.7815   8.4437  -5.7815   8.4437   46.997   32.729   46.997   32.729 0.000000 0.000000 
1 1 1   25   34    1 o   72.894   30.805   2.3298   5.9113  -0.0641   8.1164   5.0343   8.6267   75.188   33.788   88.597   37.315 -13.40930 50.33965 
1 1 1   25   34    2 f  215.657   20.130   38.533   6.5680   34.861   8.9803   42.757   9.6309  195.395   31.067  218.189   29.602 -22.79333 42.91192 
1 1 1   25   34    3 o   76.339   31.569   3.3229   6.0087   11.049   8.4235  -4.6813   8.5737  106.254   39.218   68.517   32.171 37.73726 50.72526 
1 1 1   25   34    4 o  235.665   18.934   45.600   6.7720   56.366   9.9611   36.348   9.2342  254.959   25.884  199.183   31.323 55.77649 40.63348 
1 1 1   25   34    5 o  272.423   14.357   59.159   5.9656   61.063   7.5271   55.942   9.7826  273.636   18.073  254.373   25.468 19.26311 31.22886 
1 1 1   25   34    6 o  142.698   25.255   17.813   5.3144   16.909   6.6388   19.426   8.8672  133.374   32.758  136.576   39.910 -3.201828 51.63195 
1 1 1   25   34    7 o  134.096   25.740   15.860   5.0911   21.123   6.2899   5.8606   8.6694  153.670   27.763   90.420   37.699 63.24973 46.81876 
1 1 1   25   34    8 o   83.944   33.106   5.4348   6.2678   5.4348   6.2678   0.0000   0.0000   83.944   33.106  ?   ?  0.000000 33.10598 
1 1 1   25   34    9 o  102.309   33.266   9.9996   5.9681   9.9996   5.9681   0.0000   0.0000  102.309   33.266  ?   ?  0.000000 33.26610 
1 1 1   25   34   10 o  124.017   27.080   13.853   4.9963   13.975   6.1206   13.609   8.6497  120.775   32.427  114.171   40.037 6.603867 51.52128 
1 1 1   26    0    0 o  572.551   11.309  251.478   9.9019  251.478   9.9019  251.478   9.9019  572.551   11.309  572.551   11.309 0.000000 0.000000 
1 1 1   26    0    1 o  229.387   8.7971   40.506   3.0784   40.506   3.0784   40.506   3.0784  229.387   8.7971  229.387   8.7971 0.000000 0.000000 
1 1 1   26    0    2 o  126.763   12.849   12.710   2.4343   12.710   2.4343   12.710   2.4343  126.763   12.849  126.763   12.849 0.000000 0.000000 
1 1 1   26    0    3 o   36.095   21.813   0.9696   2.2107   0.9696   2.2107   0.9696   2.2107   36.095   21.813   36.095   21.813 0.000000 0.000000 
1 1 1   26    0    4 o  156.077   10.765   18.949   2.5436   18.949   2.5436   18.949   2.5436  156.077   10.765  156.077   10.765 0.000000 0.000000 
1 1 1   26    0    5 o  316.388   7.8065   76.840   3.7753   76.840   3.7753   76.840   3.7753  316.388   7.8065  316.388   7.8065 0.000000 0.000000 
1 1 1   26    0    6 o  124.795   14.875   12.467   2.7348   12.467   2.7348   12.467   2.7348  124.795   14.875  124.795   14.875 0.000000 0.000000 
1 1 1   26    0    7 o  379.665   8.2495  110.623   4.7889  110.623   4.7889  110.623   4.7889  379.665   8.2495  379.665   8.2495 0.000000 0.000000 
1 1 1   26    0    9 o   53.737   29.378   3.1623   3.4477   3.1623   3.4477   3.1623   3.4477   53.737   29.378   53.737   29.378 0.000000 0.000000 
1 1 1   26    0   10 o  115.449   17.647   10.950   2.9021   10.950   2.9021   10.950   2.9021  115.449   17.647  115.449   17.647 0.000000 0.000000 
1 1 1   26    0   11 o   54.221   27.696   3.3529   2.9014   3.3529   2.9014   3.3529   2.9014   54.221   27.696   54.221   27.696 0.000000 0.000000 
1 1 1   26    0   12 f   76.408   28.548   6.0824   3.1117   6.0824   3.1117   6.0824   3.1117   76.408   28.548   76.408   28.548 0.000000 0.000000 
1 1 1   26    0   13 o  177.164   13.532   24.539   3.6202   24.539   3.6202   24.539   3.6202  177.164   13.532  177.164   13.532 0.000000 0.000000 
1 1 1   26    0   14 o  293.638   10.496   66.414   4.7039   66.414   4.7039   66.414   4.7039  293.638   10.496  293.638   10.496 0.000000 0.000000 
1 1 1   26    0   15 o  235.814   12.446   43.074   4.4637   43.074   4.4637   43.074   4.4637  235.814   12.446  235.814   12.446 0.000000 0.000000 
1 1 1   26    0   16 o  126.612   23.003   13.554   4.0218   13.554   4.0218   13.554   4.0218  126.612   23.003  126.612   23.003 0.000000 0.000000 
1 1 1   26    0   17 o  259.246   12.801   52.035   5.0512   52.035   5.0512   52.035   5.0512  259.246   12.801  259.246   12.801 0.000000 0.000000 
1 1 1   26    0   18 o   58.457   36.195   2.1675   6.4274   2.1675   6.4274   2.1675   6.4274   58.457   36.195   58.457   36.195 0.000000 0.000000 
1 1 1   26    0   19 o  209.342   24.588   35.453   7.5940   35.453   7.5940   35.453   7.5940  209.342   24.588  209.342   24.588 0.000000 0.000000 
1 1 1   26    0   20 o   90.879   35.083   8.8342   4.6303   8.8342   4.6303   8.8342   4.6303   90.879   35.083   90.879   35.083 0.000000 0.000000 
1 1 1   26    0   21 o  198.037   22.293   31.585   6.5372   31.585   6.5372   31.585   6.5372  198.037   22.293  198.037   22.293 0.000000 0.000000 
1 1 1   26    0   23 o  365.758   8.1324  102.771   4.5477  102.771   4.5477  102.771   4.5477  365.758   8.1324  365.758   8.1324 0.000000 0.000000 
1 1 1   26    0   24 o   89.693   24.340   7.4659   2.8885   7.4659   2.8885   7.4659   2.8885   89.693   24.340   89.693   24.340 0.000000 0.000000 
1 1 1   26    0   25 o  203.255   9.6144   31.938   2.9759   31.938   2.9759   31.938   2.9759  203.255   9.6144  203.255   9.6144 0.000000 0.000000 
1 1 1   26    0   26 o  187.176   10.444   27.174   2.9708   27.174   2.9708   27.174   2.9708  187.176   10.444  187.176   10.444 0.000000 0.000000 
1 1 1   26    0   27 f   46.920   27.306   2.1498   3.2337   2.1498   3.2337   2.1498   3.2337   46.920   27.306   46.920   27.306 0.000000 0.000000 
1 1 1   26    0   28 o   25.057   17.581  -2.6983   2.5690  -2.6983   2.5690  -2.6983   2.5690   25.057   17.581   25.057   17.581 0.000000 0.000000 
1 1 1   26    0   29 o  410.225   8.9279  129.421   5.5998  129.421   5.5998  129.421   5.5998  410.225   8.9279  410.225   8.9279 0.000000 0.000000 
1 1 1   26    0   30 o   40.821   24.579   1.3560   2.7865   1.3560   2.7865   1.3560   2.7865   40.821   24.579   40.821   24.579 0.000000 0.000000 
1 1 1   26    0   31 o   47.343   26.363   2.4467   2.8350   2.4467   2.8350   2.4467   2.8350   47.343   26.363   47.343   26.363 0.000000 0.000000 
1 1 1   26    0   32 o  275.961   8.9707   58.700   3.7801   58.700   3.7801   58.700   3.7801  275.961   8.9707  275.961   8.9707 0.000000 0.000000 
1 1 1   26    0   33 o   63.075   28.986   4.5936   3.0658   4.5936   3.0658   4.5936   3.0658   63.075   28.986   63.075   28.986 0.000000 0.000000 
1 1 1   26    0   34 o  270.848   10.475   56.728   4.3280   56.728   4.3280   56.728   4.3280  270.848   10.475  270.848   10.475 0.000000 0.000000 
1 1 1   26    0   35 o   43.482   26.405   1.5017   3.2709   1.5017   3.2709   1.5017   3.2709   43.482   26.405   43.482   26.405 0.000000 0.000000 
1 1 1   26    0   36 o  220.261   13.101   37.900   4.3812   37.900   4.3812   37.900   4.3812  220.261   13.101  220.261   13.101 0.000000 0.000000 
1 1 1   26    0   37 o   65.557   31.232   5.0939   3.5828   5.0939   3.5828   5.0939   3.5828   65.557   31.232   65.557   31.232 0.000000 0.000000 
1 1 1   26    0   38 o  177.272   15.038   24.926   4.0129   24.926   4.0129   24.926   4.0129  177.272   15.038  177.272   15.038 0.000000 0.000000 
1 1 1   26    0   39 o  251.878   14.816   49.828   5.6667   49.828   5.6667   49.828   5.6667  251.878   14.816  251.878   14.816 0.000000 0.000000 
1 1 1   26    0   40 o   34.093   23.356  -2.2239   3.8869  -2.2239   3.8869  -2.2239   3.8869   34.093   23.356   34.093   23.356 0.000000 0.000000 
1 1 1   26    0   41 o  164.359   18.033   21.949   4.3976   21.949   4.3976   21.949   4.3976  164.359   18.033  164.359   18.033 0.000000 0.000000 
1 1 1   26    0   42 o   55.603   32.145   3.4803   4.4358   3.4803   4.4358   3.4803   4.4358   55.603   32.145   55.603   32.145 0.000000 0.000000 
1 1 1   26    0   43 o   37.405   25.162  -1.2400   4.1108  -1.2400   4.1108  -1.2400   4.1108   37.405   25.162   37.405   25.162 0.000000 0.000000 
1 1 1   26    0   44 o   85.974   33.559   8.3910   4.2177   8.3910   4.2177   8.3910   4.2177   85.974   33.559   85.974   33.559 0.000000 0.000000 
1 1 1   26    0   45 o  119.615   26.202   13.097   4.2002   13.097   4.2002   13.097   4.2002  119.615   26.202  119.615   26.202 0.000000 0.000000 
1 1 1   26    0   46 o   45.355   29.214   0.9029   4.6783   0.9029   4.6783   0.9029   4.6783   45.355   29.214   45.355   29.214 0.000000 0.000000 
1 1 1   26    0   47 f   55.698   31.401   3.8923   4.0849   3.8923   4.0849   3.8923   4.0849   55.698   31.401   55.698   31.401 0.000000 0.000000 
1 1 1   26    1    0 o   92.781   19.179   7.4081   2.4041   7.4081   2.4041   7.4081   2.4041   92.781   19.179   92.781   19.179 0.000000 0.000000 
1 1 1   26    1    1 o  436.694   5.4164  146.109   3.6204  148.022   5.1518  144.243   5.0888  439.298   7.6618  433.654   7.6666 5.644287 10.83884 
1 1 1   26    1    2 o  234.334   6.0544   42.084   2.1716   40.401   3.0904   43.725   3.0520  229.423   8.8006  238.709   8.3532 -9.285889 12.13372 
1 1 1   26    1    3 o  640.187   5.8407  314.067   5.7233  318.265   8.2043  310.087   7.9879  644.018   8.3229  635.713   8.2092 8.305054 11.69019 
1 1 1   26    1    4 o  376.075   6.3824  108.411   3.6739  124.798   7.3185  102.890   4.2480  402.717   11.873  366.256   7.5775 36.46127 14.08485 
1 1 1   26    1    5 o  172.919   7.1253   22.929   1.8859   23.529   4.7707   22.818   2.0531  173.290   18.261  172.466   7.7775 0.8236389 19.84840 
1 1 1   26    1    6 o  302.615   6.0193   70.185   2.7881   69.457   4.0651   70.832   3.8313  300.792   8.8294  303.816   8.2388 -3.024200 12.07625 
1 1 1   26    1    7 o  170.553   8.1875   22.322   2.1374   20.151   3.2033   24.064   2.8695  161.186   13.097  176.600   10.666 -15.41353 16.89063 
1 1 1   26    1    8 o  242.968   7.5077   45.284   2.7921   48.404   3.7498   41.402   4.1827  251.000   9.7604  231.624   11.837 19.37538 15.34247 
1 1 1   26    1    9 o  227.698   7.7543   39.779   2.7026   44.027   4.8702   37.889   3.2486  238.586   13.390  222.077   9.5571 16.50911 16.45112 
1 1 1   26    1   10 o  400.577   6.5719  123.032   4.0295  132.798   7.1816  118.546   4.8679  415.419   11.294  393.017   8.0921 22.40182 13.89411 
1 1 1   26    1   11 o  451.684   5.9040  156.378   4.0818  159.966   5.9532  153.195   5.6074  456.457   8.5208  446.744   8.2004 9.712158 11.82585 
1 1 1   26    1   12 o   71.581   19.695   4.1147   2.2256   8.0836   3.2196   0.4828   3.0799   99.862   21.685   53.632   22.424 46.23013 31.19443 
1 1 1   26    1   13 o   33.140   15.861  -3.1503   2.2855  -5.4365   3.2608  -0.9426   3.2043   37.519   18.200   48.992   21.669 -11.47306 28.29856 
1 1 1   26    1   14 o  223.541   8.6404   38.381   2.9564   32.502   4.1651   44.350   4.1970  204.776   13.362  239.975   11.426 -35.19925 17.58109 
1 1 1   26    1   15 o  118.145   15.350   10.982   2.7102   9.6857   3.9191   12.170   3.7518  108.901   24.145  123.245   20.617 -14.34428 31.74980 
1 1 1   26    1   16 o  298.917   9.0462   68.672   4.1389   70.719   5.1939   65.109   6.8509  303.001   11.199  289.479   15.518 13.52182 19.13735 
1 1 1   26    1   17 o  242.807   10.865   45.406   4.0379   47.114   5.0508   42.380   6.7218  246.567   13.434  232.324   19.071 14.24303 23.32736 
1 1 1   26    1   18 o   60.055   23.230   1.9048   3.0373   3.1212   4.5451   0.9233   4.0828   74.089   28.483   62.386   25.929 11.70305 38.51736 
1 1 1   26    1   19 o  394.577   8.6111  119.669   5.2007  110.774   9.3606  123.640   6.2550  377.570   16.197  400.724   10.198 -23.15384 19.14004 
1 1 1   26    1   20 o  237.171   13.805   43.691   4.9898   0.0000   0.0000   43.691   4.9898  ?   ?   237.171   13.805 0.000000 13.80481 
1 1 1   26    1   21 o  159.993   20.856   20.442   4.9859   21.665   7.8190   19.604   6.4727  160.276   32.972  153.979   28.513 6.297134 43.59108 
1 1 1   26    1   22 o  368.183   9.4679  104.369   5.3356  108.986   9.9614  102.511   6.3185  373.585   17.421  364.422   11.328 9.162994 20.77951 
1 1 1   26    1   23 o  153.728   10.244   18.298   2.3966   15.959   3.1338   21.593   3.7196  142.643   14.557  166.078   14.787 -23.43550 20.75037 
1 1 1   26    1   24 o  391.570   5.5771  117.609   3.3427  120.559   4.9689  115.171   4.5177  395.931   8.1991  387.111   7.6245 8.820679 11.19640 
1 1 1   26    1   25 o  134.223   10.020   13.967   2.0437   14.446   3.2883   13.666   2.6086  135.150   16.220  132.164   13.066 2.986069 20.82824 
1 1 1   26    1   26 o  357.448   5.5886   98.021   3.0576  103.185   4.9213   94.774   3.9022  366.094   8.7825  351.186   7.2593 14.90714 11.39430 
1 1 1   26    1   27 o   81.675   16.979   5.4082   2.0533   6.2103   3.3382   4.9200   2.6043   86.713   24.220   77.517   21.295 9.196129 32.25027 
1 1 1   26    1   28 o  355.465   6.5460   97.051   3.5616   95.643   4.2450  100.399   6.5454  352.595   7.8657  360.060   11.876 -7.465820 14.24498 
1 1 1   26    1   29 o  199.178   7.4337   30.508   2.2663   28.488   3.2346   32.457   3.1763  191.596   11.077  205.019   10.122 -13.42279 15.00490 
1 1 1   26    1   30 o   32.758   15.615  -2.7523   2.1686  -3.4165   3.6017  -2.3746   2.7160   44.536   20.892   39.467   18.392 5.069477 27.83454 
1 1 1   26    1   31 o  175.548   8.4441   23.745   2.2689   27.820   3.2528   19.884   3.1664  189.191   11.284  159.378   13.096 29.81332 17.28674 
1 1 1   26    1   32 o  127.112   11.530   12.628   2.2189   9.1364   3.1472   16.079   3.1288  105.544   20.217  142.763   14.521 -37.21928 24.89155 
1 1 1   26    1   33 o  257.014   6.9494   50.809   2.7339   54.858   3.9227   46.985   3.8122  266.446   9.6185  246.464   10.105 19.98186 13.95105 
1 1 1   26    1   34 f  109.985   15.596   9.6751   2.5520   8.5478   3.6254   10.782   3.5928  100.728   23.879  114.290   21.322 -13.56245 32.01276 
1 1 1   26    1   35 o  150.148   11.445   17.608   2.6105   18.980   3.9433   16.538   3.4831  154.121   16.999  144.081   16.067 10.03949 23.39066 
1 1 1   26    1   36 o   68.488   20.887   3.8196   2.3885   3.3637   3.5469   4.1980   3.2310   69.179   25.463   72.880   24.505 -3.700668 35.33896 
1 1 1   26    1   37 o   80.068   20.920   5.3683   2.5922   4.8998   3.5630   5.8952   3.7783   77.655   25.726   83.824   26.390 -6.169304 36.85396 
1 1 1   26    1   38 o  146.927   12.169   16.965   2.7121   19.336   3.9149   14.777   3.7607  155.197   16.746  134.643   18.758 20.55403 25.14500 
1 1 1   26    1   39 o   96.525   24.016   8.0149   3.5338   1.7529   5.2011   13.384   4.8161   69.261   29.062  124.262   26.149 -55.00163 39.09467 
1 1 1   26    1   40 o   54.539   21.711   1.5207   2.7189  -2.5384   3.8662   5.4927   3.8245   48.035   22.233   80.682   26.649 -32.64689 34.70591 
1 1 1   26    1   41 o  169.333   12.594   22.651   3.2408   19.509   4.2580   26.978   4.9965  154.378   18.381  181.938   18.186 -27.55991 25.85704 
1 1 1   26    1   42 o   58.861   23.235   1.9989   3.0899  -2.9129   4.1442   8.1481   4.6369   48.818   22.740   94.856   29.133 -46.03773 36.95673 
1 1 1   26    1   43 o   74.118   23.985   4.6877   3.1047  -0.5853   4.6750   8.8480   4.1526   58.024   25.889   98.887   26.776 -40.86351 37.24559 
1 1 1   26    1   44 o   60.043   22.728   2.5370   2.8660  -0.8052   4.1034   5.7206   4.0048   53.578   24.055   80.440   27.281 -26.86230 36.37150 
1 1 1   26    1   45 o   96.520   21.098   8.1351   3.0300   6.2618   3.9606   10.779   4.7052   82.810   27.108  106.751   28.327 -23.94107 39.20818 
1 1 1   26    1   46 o   55.002   22.281   1.6479   2.9171   2.2998   4.3669   1.1227   3.9200   64.544   26.820   58.138   24.846 6.406048 36.55971 
1 1 1   26    1   47 o   60.394   22.491   2.8078   2.7825   6.3588   3.9753  -0.6030   3.8960   82.264   27.170   51.987   23.382 30.27615 35.84538 
1 1 1   26    2    0 o   36.400   21.930   1.0115   2.2211   1.0115   2.2211   1.0115   2.2211   36.400   21.930   36.400   21.930 0.000000 0.000000 
1 1 1   26    2    1 o  107.819   10.519   9.0183   1.7139   8.8801   2.4563   9.1493   2.3926  106.130   15.585  107.893   14.884 -1.762657 21.55066 
1 1 1   26    2    2 o  137.435   10.221   14.593   2.1346   13.816   4.1439   14.873   2.4905  131.633   21.294  138.533   11.860 -6.899704 24.37418 
1 1 1   26    2    3 o  243.661   9.3700   45.591   3.4946   48.470   5.1760   43.180   4.7372  250.414   13.555  236.385   13.145 14.02837 18.88152 
1 1 1   26    2    4 o  257.262   9.3284   50.823   3.6733   52.658   5.5085   49.354   4.9292  260.977   13.839  252.826   12.779 8.150635 18.83701 
1 1 1   26    2    5 o  189.569   6.6734   27.551   1.9364   37.703   5.2777   25.972   2.0815  220.333   15.753  184.020   7.3900 36.31355 17.40055 
1 1 1   26    2    6 o   57.873   16.974   2.6376   1.6013   9.4586   4.6485   1.7193   1.7057  107.522   27.977   50.340   17.768 57.18193 33.14266 
1 1 1   26    2    7 o  284.838   6.2004   62.189   2.7033   60.451   6.1728   62.602   3.0069  279.494   14.479  285.730   6.8754 -6.236450 16.02820 
1 1 1   26    2    8 o  283.356   5.5179   61.525   2.3932   62.493   6.3605   61.365   2.5830  284.123   14.676  282.958   5.9639 1.165253 15.84130 
1 1 1   26    2    9 o  208.365   5.7443   33.273   1.8320   30.345   3.6788   34.239   2.1126  198.135   12.190  211.325   6.5313 -13.19005 13.82905 
1 1 1   26    2   10 o  133.288   7.9642   13.682   1.6174   11.520   4.3706   14.025   1.7410  119.026   24.795  134.900   8.4747 -15.87466 26.20335 
1 1 1   26    2   11 f  142.582   10.623   15.722   2.3017   19.006   3.5323   13.299   3.0343  156.118   14.965  130.233   15.528 25.88515 21.56571 
1 1 1   26    2   12 o  188.775   8.8012   27.369   2.5431   26.608   3.8881   27.938   3.3619  185.155   13.819  190.132   11.608 -4.977219 18.04707 
1 1 1   26    2   13 o  292.425   8.2376   65.653   3.6871   77.919   7.4975   61.740   4.2346  317.307   15.437  283.395   9.7622 33.91229 18.26480 
1 1 1   26    2   14 o  219.895   12.101   37.379   4.0573   33.599   6.3961   39.924   5.2485  206.482   20.509  226.638   15.218 -20.15642 25.53846 
1 1 1   26    2   15 o   98.851   24.044   7.9916   3.6030   10.353   5.7230   6.4413   4.6374  111.924   31.872   90.692   29.310 21.23229 43.30014 
1 1 1   26    2   16 o  318.734   8.4808   78.040   4.1375   72.959   7.9812   79.908   4.8384  305.979   17.110  322.323   9.8071 -16.34418 19.72130 
1 1 1   26    2   17 o  120.581   17.517   11.535   3.1385   17.157   6.2452   9.6357   3.6302  144.074   29.317  108.831   22.534 35.24256 36.97714 
1 1 1   26    2   18 o  142.979   13.580   15.946   2.9363   13.412   4.5982   17.690   3.8155  128.325   24.300  149.924   16.923 -21.59959 29.61221 
1 1 1   26    2   19 o  317.146   7.8331   77.254   3.8024   88.660   6.2477   70.544   4.7922  338.922   12.043  302.655   10.345 36.26740 15.87630 
1 1 1   26    2   20 o  135.562   12.084   14.299   2.4812   11.600   4.9164   15.222   2.8740  118.148   27.672  139.598   13.624 -21.44945 30.84421 
1 1 1   26    2   21 o  334.531   7.5623   85.962   3.8722   77.851   6.4586   90.514   4.8382  317.140   13.305  342.969   9.2163 -25.82867 16.18530 
1 1 1   26    2   22 o  182.884   10.473   25.869   2.9195   22.738   8.7015   26.266   3.0992  162.746   35.895  184.180   11.045 -21.43330 37.55595 
1 1 1   26    2   23 o  110.795   12.996   9.6315   2.1621   9.3755   3.3091   9.8221   2.8561  107.344   20.892  110.862   17.405 -3.518074 27.19179 
1 1 1   26    2   24 o   84.078   15.480   5.6702   1.9188   1.1851   3.3443   7.8713   2.3428   58.277   23.764   99.322   15.950 -41.04441 28.62046 
1 1 1   26    2   25 o  206.972   7.6717   32.929   2.4304   33.173   3.7441   32.752   3.1949  206.769   11.880  206.076   10.129 0.6931763 15.61207 
1 1 1   26    2   26 o   65.836   20.100   3.4447   2.2112   5.1166   3.3732   2.1850   2.9280   79.820   24.903   60.574   22.962 19.24560 33.87324 
1 1 1   26    2   27 o  138.413   11.652   14.925   2.4456   14.283   3.6628   15.442   3.2850  133.643   18.393  139.850   15.613 -6.206741 24.12628 
1 1 1   26    2   28 o  282.386   7.1225   61.289   3.0785   62.607   4.6421   60.255   4.1131  284.653   10.654  279.503   9.6143 5.150757 14.35095 
1 1 1   26    2   29 o   60.198   20.070   2.7433   2.1673   4.8234   3.6421   1.6028   2.6968   78.382   26.012   55.769   21.800 22.61228 33.93905 
1 1 1   26    2   30 o   41.040   17.922  -0.3459   2.1284   0.1788   3.5748  -0.6340   2.6492   55.410   23.704   44.797   19.764 10.61288 30.86282 
1 1 1   26    2   31 o  193.800   9.8997   29.087   2.9268   23.987   6.7255   30.278   3.2508  169.677   26.785  197.523   10.793 -27.84642 28.87738 
1 1 1   26    2   32 o   88.408   16.449   6.3261   2.1439   7.2051   3.1457   5.5636   2.9297   92.964   22.377   81.867   22.626 11.09703 31.82231 
1 1 1   26    2   33 o   62.102   20.757   2.9524   2.3181   4.0696   3.2765   1.8327   3.2800   72.560   24.676   60.369   23.904 12.19016 34.35572 
1 1 1   26    2   34 o  170.825   9.9690   22.650   2.5953   22.204   3.9269   22.996   3.4581  167.486   15.493  171.207   13.301 -3.721069 20.41951 
1 1 1   26    2   35 o   87.858   18.804   6.3600   2.4523   8.2606   3.7414   4.9285   3.2470   98.633   24.806   77.595   24.468 21.03856 34.84334 
1 1 1   26    2   36 o   56.055   20.914   2.0270   2.4083   4.6565   3.5696  -0.1698   3.2627   76.423   25.757   51.364   22.313 25.05942 34.07770 
1 1 1   26    2   37 o  108.970   15.489   9.5356   2.5107   7.9344   3.7311   10.861   3.3940   96.227   25.078  114.766   20.051 -18.53957 32.10843 
1 1 1   26    2   38 o   68.781   24.039   3.6321   3.1171   5.2803   5.1649   2.6879   3.9093   83.053   30.698   67.048   26.236 16.00529 40.38256 
1 1 1   26    2   39 o   63.284   22.285   3.0174   2.6815   2.7735   3.9343   3.2291   3.6645   67.316   26.326   68.349   25.740 -1.032257 36.81835 
1 1 1   26    2   40 o  167.870   12.671   22.239   3.2317   24.611   4.2432   18.962   4.9871  175.114   16.008  150.241   22.369 24.87267 27.50670 
1 1 1   26    2   41 o   68.020   23.278   3.7027   2.9159   4.2406   3.9545   3.0618   4.3168   73.901   26.933   69.649   27.473 4.252007 38.47272 
1 1 1   26    2   42 o  114.249   17.304   10.729   2.9312   15.033   4.2261   6.7381   4.0691  133.424   21.418   87.255   27.372 46.16876 34.75608 
1 1 1   26    2   43 o  150.821   12.919   18.106   2.9537   15.289   4.2067   20.846   4.1481  134.262   21.171  159.600   17.255 -25.33836 27.31240 
1 1 1   26    2   44 o   68.113   23.432   3.8451   2.9559   5.0796   4.6075   2.9816   3.8533   78.004   28.962   66.268   26.014 11.73568 38.93007 
1 1 1   26    2   45 o   57.139   22.423   2.0715   2.8619   0.9193   3.7729   3.6328   4.3918   56.943   24.356   70.448   27.735 -13.50493 36.91117 
1 1 1   26    2   46 o  165.491   12.512   21.930   3.1459   22.365   4.8283   21.610   4.1470  161.890   19.904  161.287   17.057 0.6030731 26.21307 
1 1 1   26    2   47 o   70.294   23.439   4.3560   2.9559  -1.9410   4.4188   9.4554   3.9765   51.513   23.817  100.396   25.752 -48.88254 35.07745 
1 1 1   26    3    0 o   98.368   29.838   9.2836   3.9209   9.2836   3.9209   9.2836   3.9209   98.368   29.838   98.368   29.838 0.000000 0.000000 
1 1 1   26    3    1 o  214.036   7.8530   35.144   2.5727   32.432   4.7996   36.237   3.0475  204.348   15.459  217.247   9.1649 -12.89822 17.97182 
1 1 1   26    3    2 o  189.817   10.807   27.788   3.1269   25.938   4.7951   29.157   4.1245  182.230   17.403  193.960   13.987 -11.73029 22.32663 
1 1 1   26    3    3 o  273.162   6.9583   57.214   2.9093   61.693   5.8489   55.741   3.3536  282.915   13.507  269.531   8.1290 13.38361 15.76426 
1 1 1   26    3    4 o  278.668   6.9098   59.543   2.9473   61.138   6.0518   59.048   3.3745  281.547   14.043  277.422   7.9469 4.125305 16.13579 
1 1 1   26    3    5 o  267.584   6.3955   54.887   2.6194   52.987   6.0709   55.321   2.9036  261.486   15.234  268.593   7.0627 -7.106415 16.79186 
1 1 1   26    3    6 o  210.359   6.2656   33.920   2.0174   35.274   3.7572   33.371   2.3914  213.808   11.523  208.581   7.4905 5.226883 13.74378 
1 1 1   26    3    7 o  144.259   6.9616   15.958   1.5372   18.465   3.4103   15.319   1.7220  153.976   14.647  141.070   8.0081 12.90585 16.69287 
1 1 1   26    3    8 o  110.483   8.6033   9.4270   1.4434   8.5844   3.2972   9.6268   1.6054  103.060   21.593  111.546   9.4933 -8.486473 23.58799 
1 1 1   26    3    9 o  165.309   6.4284   20.951   1.6266   27.171   3.6441   19.403   1.8177  187.343   12.785  159.037   7.4670 28.30652 14.80550 
1 1 1   26    3   10 o  105.436   8.5785   8.5912   1.3724   9.3597   3.3869   8.4402   1.5012  107.732   21.294  104.384   9.4997 3.348015 23.31690 
1 1 1   26    3   11 o  148.839   6.9643   16.991   1.5866   21.844   4.8002   16.396   1.6811  166.533   19.182  145.987   7.5489 20.54617 20.61421 
1 1 1   26    3   12 o  390.123   5.2740  116.627   3.1493  126.635   5.7431  112.324   3.7660  405.979   9.2421  382.739   6.4285 23.24078 11.25797 
1 1 1   26    3   13 o  286.439   7.4936   62.959   3.2854   58.241   4.6992   67.472   4.5952  275.051   11.162  296.200   10.136 -21.14877 15.07707 
1 1 1   26    3   14 o  185.027   8.5076   26.293   2.4094   27.214   4.1189   25.815   2.9707  187.066   14.498  182.845   10.661 4.221313 17.99620 
1 1 1   26    3   15 o  230.189   7.7094   40.674   2.7163   44.248   4.6935   38.874   3.3307  239.110   12.872  224.844   9.6780 14.26601 16.10410 
1 1 1   26    3   16 o  125.687   12.388   12.302   2.3522   8.5748   4.3500   13.843   2.7962  102.080   27.307  133.109   13.931 -31.02891 30.65544 
1 1 1   26    3   17 o  177.895   8.2956   24.311   2.2588   19.182   4.7386   25.819   2.5695  155.315   20.429  183.254   9.1608 -27.93945 22.38858 
1 1 1   26    3   18 o  131.007   10.850   13.312   2.1561   10.118   4.8292   14.107   2.4097  110.412   28.410  134.731   11.804 -24.31909 30.76469 
1 1 1   26    3   19 o  262.968   6.8504   53.070   2.7573   50.183   5.7838   53.920   3.1367  253.970   14.944  264.963   7.7343 -10.99326 16.82718 
1 1 1   26    3   20 o  136.697   12.007   14.536   2.4868   15.370   5.3119   14.302   2.8143  136.747   26.334  135.234   13.789 1.513245 29.72544 
1 1 1   26    3   21 o  196.749   8.4376   29.762   2.5410   43.596   5.7820   26.451   2.8287  236.173   16.091  185.040   10.025 51.13252 18.95810 
1 1 1   26    3   22 o  113.969   13.454   10.197   2.3018   0.1347   5.5117   12.323   2.5333   68.113   29.294  125.441   13.401 -57.32853 32.21351 
1 1 1   26    3   23 o  208.636   7.4204   33.443   2.3697   32.889   3.8786   33.773   2.9933  205.832   12.368  209.425   9.3379 -3.593246 15.49747 
1 1 1   26    3   24 o  184.848   8.4579   26.287   2.3930   30.950   3.9757   23.638   2.9967  199.437   13.096  174.579   11.275 24.85748 17.28114 
1 1 1   26    3   25 o   94.076   15.976   7.0843   2.2182   5.6627   3.5422   8.0015   2.8452   83.535   25.426   99.249   19.425 -15.71345 31.99728 
1 1 1   26    3   26 o   64.070   20.177   3.2188   2.2087  -1.5111   3.6109   6.0461   2.7918   50.045   22.509   85.725   21.356 -35.67926 31.02782 
1 1 1   26    3   27 o  161.620   8.9566   20.183   2.2070   18.421   3.8862   21.022   2.6814  152.493   16.936  164.626   10.699 -12.13310 20.03241 
1 1 1   26    3   28 o  301.282   6.8329   69.744   3.1510   78.848   4.9158   63.395   4.1052  319.609   10.049  286.746   9.3534 32.86258 13.72817 
1 1 1   26    3   29 o  197.140   8.2119   29.921   2.4779   30.564   4.1900   29.574   3.0729  197.685   13.937  195.398   10.311 2.286804 17.33636 
1 1 1   26    3   30 f  232.043   7.4036   41.416   2.6295   39.835   4.4404   42.270   3.2632  226.070   12.886  234.120   9.1063 -8.050598 15.77877 
1 1 1   26    3   31 o   77.796   19.113   4.9775   2.2595   2.5200   3.9620   6.1620   2.7506   67.501   26.413   86.267   21.024 -18.76626 33.75848 
1 1 1   26    3   32 o  244.347   8.3548   46.015   3.1247   51.878   7.7192   44.866   3.4172  254.600   19.968  241.085   9.2605 13.51517 22.01109 
1 1 1   26    3   33 o   62.916   21.912   2.9188   2.5888   1.0583   4.8794   3.6477   3.0541   66.465   28.032   69.284   23.819 -2.819046 36.78508 
1 1 1   26    3   34 o  140.657   12.297   15.504   2.6208   14.389   4.8663   15.959   3.1105  130.789   25.223  142.086   14.506 -11.29692 29.09641 
1 1 1   26    3   35 o  136.226   12.313   14.561   2.5397   15.016   4.0125   14.256   3.2804  135.786   19.896  133.533   16.394 2.253784 25.78034 
1 1 1   26    3   36 o  211.955   8.4071   34.678   2.7275   35.717   4.2044   33.924   3.5839  213.497   12.927  208.639   11.264 4.858932 17.14616 
1 1 1   26    3   37 o  180.777   9.8118   25.395   2.7048   34.045   4.2862   19.670   3.4867  208.050   13.533  157.529   14.627 50.52150 19.92778 
1 1 1   26    3   38 o  123.456   17.625   12.377   3.2359   14.737   5.4027   11.057   4.0408  129.879   28.001  113.955   23.929 15.92419 36.83286 
1 1 1   26    3   39 o   97.856   18.582   7.9243   2.6815   4.1771   4.0157   10.940   3.6022   74.329   27.133  114.189   21.396 -39.86063 34.55422 
1 1 1   26    3   40 o   43.147   20.084  -2.4752   3.2240  -1.6070   4.0327  -4.0129   5.3670   51.710   23.471   54.627   25.587 -2.916447 34.72121 
1 1 1   26    3   41 o   95.797   19.846   7.7311   2.8143   8.2200   4.1772   7.3246   3.8085   96.046   27.187   91.156   26.014 4.889832 37.62833 
1 1 1   26    3   42 o   49.091   20.968   0.3416   2.7893   6.8074   4.1869  -4.8175   3.7400   87.597   27.802   41.637   20.022 45.96022 34.26160 
1 1 1   26    3   43 o  126.377   15.226   12.950   2.8860   11.170   4.0433   14.799   4.1206  112.673   24.169  132.045   21.098 -19.37207 32.08210 
1 1 1   26    3   44 o   32.194   15.898  -5.8054   2.8462  -2.1902   4.3015  -8.6208   3.7960   51.035   23.562   35.584   17.707 15.45156 29.47381 
1 1 1   26    3   45 o  146.730   13.735   17.365   3.0488   10.842   4.0561   25.836   4.6225  109.399   24.796  176.709   17.313 -67.31028 30.24159 
1 1 1   26    3   46 o  141.924   15.533   16.553   3.3191   18.678   5.4378   15.291   4.1902  142.935   25.805  132.466   21.395 10.46928 33.52067 
1 1 1   26    4    0 o  245.081   13.634   46.559   5.0782   46.559   5.0782   46.559   5.0782  245.081   13.634  245.081   13.634 0.000000 0.000000 
1 1 1   26    4    1 f  229.600   15.071   40.875   5.2671   40.875   5.2671   0.0000   0.0000  229.600   15.071  ?   ?  0.000000 15.07124 
1 1 1   26    4    2 o  193.804   11.179   28.982   3.3020   29.317   5.2463   28.762   4.2492  193.708   17.897  192.526   14.527 1.181961 23.05033 
1 1 1   26    4    3 o   65.423   22.708   3.0228   2.7792  -2.0969   4.6900   5.7938   3.4503   57.072   25.662   85.130   24.901 -28.05854 35.75747 
1 1 1   26    4    4 o  195.893   10.712   29.590   3.1998   28.414   5.5882   30.164   3.9029  190.299   19.459  197.445   12.987 -7.146530 23.39467 
1 1 1   26    4    5 o  145.836   7.8288   16.364   1.7412   16.715   5.3976   16.323   1.8395  143.939   25.429  145.607   8.2880 -1.667557 26.74571 
1 1 1   26    4    6 o  180.133   6.1424   24.871   1.6936   26.783   3.6801   24.358   1.9076  185.982   13.010  178.223   6.9927 7.759094 14.76978 
1 1 1   26    4    7 o  245.127   6.3594   46.063   2.3860   47.188   4.1552   45.510   2.9144  247.691   10.960  243.546   7.8181 4.144714 13.46278 
1 1 1   26    4    8 o  319.904   7.6929   78.518   3.7669   85.271   4.9831   69.514   5.7540  333.121   9.7730  300.384   12.515 32.73730 15.87860 
1 1 1   26    4    9 o  246.104   8.7485   46.507   3.2955   50.281   4.4190   41.778   4.9466  255.613   11.295  232.250   13.980 23.36310 17.97247 
1 1 1   26    4   10 o   74.777   25.838   4.0329   3.5961   4.0329   3.5961   0.0000   0.0000   74.777   25.838  ?   ?  0.000000 25.83804 
1 1 1   26    4   11 o  151.490   21.701   18.277   4.8881   18.277   4.8881   0.0000   0.0000  151.490   21.701  ?   ?  0.000000 21.70097 
1 1 1   26    4   12 o  174.780   15.636   23.828   4.1387   23.828   4.1387   0.0000   0.0000  174.780   15.636  ?   ?  0.000000 15.63572 
1 1 1   26    4   13 o  251.802   9.1607   48.720   3.5307   55.251   4.6606   39.924   5.4089  267.858   11.367  226.538   15.696 41.31938 19.37969 
1 1 1   26    4   14 o  207.373   10.689   33.184   3.3812   31.871   4.4099   35.058   5.2668  202.549   14.317  212.020   16.356 -9.471237 21.73650 
1 1 1   26    4   15 o  278.288   7.5378   59.442   3.2108   54.005   5.0437   63.147   4.1633  264.589   12.454  286.584   9.4911 -21.99551 15.65837 
1 1 1   26    4   16 o  163.333   11.033   20.641   2.7421   22.733   4.6120   19.498   3.4104  169.984   18.000  158.140   14.242 11.84418 22.95307 
1 1 1   26    4   17 o  288.421   6.3784   63.808   2.8158   74.980   5.7363   60.261   3.2320  311.756   12.021  280.166   7.5368 31.59009 14.18844 
1 1 1   26    4   18 o  311.828   5.8236   74.562   2.7796   78.678   6.1120   73.489   3.1210  319.194   12.510  309.492   6.5883 9.701752 14.13881 
1 1 1   26    4   19 o  131.044   10.249   13.304   2.0394   8.5409   5.2105   14.166   2.2162  102.006   30.791  135.157   10.803 -33.15060 32.63130 
1 1 1   26    4   20 o   53.617   18.256   2.0843   1.7935   7.4398   5.2644   1.3811   1.9076   96.421   31.236   49.064   18.549 47.35672 36.32842 
1 1 1   26    4   21 o  158.019   8.9971   19.273   2.1671   27.602   5.6227   17.820   2.3485  186.482   20.011  151.743   10.171 34.73955 22.44765 
1 1 1   26    4   22 o  121.429   9.6737   11.428   1.7831   16.063   2.9360   8.7191   2.2443  143.361   13.540  105.072   14.329 38.28929 19.71442 
1 1 1   26    4   23 o  121.606   10.390   11.486   1.9153   11.700   3.3011   11.378   2.3515  120.909   18.420  120.540   12.948 0.3683472 22.51531 
1 1 1   26    4   24 o  115.360   11.015   10.367   1.9213   12.153   3.1637   9.3234   2.4183  123.570   17.193  108.513   14.957 15.05663 22.78825 
1 1 1   26    4   25 o  186.381   7.2635   26.692   2.0721   24.709   3.7517   27.563   2.4857  177.863   13.891  189.246   8.5812 -11.38348 16.32781 
1 1 1   26    4   26 o  139.162   9.5395   14.997   2.0197   11.594   3.6651   16.480   2.4204  119.498   20.793  145.657   10.936 -26.15907 23.49369 
1 1 1   26    4   27 o  323.355   6.7618   80.322   3.3467   86.370   5.6977   77.137   4.1352  334.231   11.137  316.525   8.5353 17.70599 14.03182 
1 1 1   26    4   28 o  139.981   11.525   15.265   2.4475   14.066   4.3198   15.832   2.9702  131.212   22.307  142.032   13.838 -10.82042 26.25109 
1 1 1   26    4   29 o  133.208   12.261   13.873   2.4718   6.8033   4.0312   18.133   3.1290   90.503   27.031  152.106   13.583 -61.60342 30.25137 
1 1 1   26    4   30 o  111.047   13.430   9.7275   2.2364   11.737   4.0050   8.8172   2.6958  119.252   22.772  104.576   17.457 14.67522 28.69348 
1 1 1   26    4   31 o  189.525   8.9643   27.704   2.6005   22.548   4.8639   29.768   3.0772  167.661   19.306  195.954   10.296 -28.29350 21.87957 
1 1 1   26    4   32 o   61.155   21.757   2.6597   2.5622   2.3611   4.7645   2.7811   3.0390   70.706   28.534   64.135   23.575 6.570305 37.01284 
1 1 1   26    4   33 o  162.053   11.633   20.486   2.8662   22.110   7.5051   20.209   3.1013  159.478   31.860  160.652   12.716 -1.174210 34.30428 
1 1 1   26    4   34 o  104.278   16.483   8.7610   2.5435   6.1444   4.9860   9.6815   2.9572   87.631   30.416  109.129   18.356 -21.49751 35.52552 
1 1 1   26    4   35 f  101.123   18.534   8.3627   2.7630   5.0787   6.3058   9.1429   3.0737   86.425   33.459  105.426   19.774 -19.00163 38.86580 
1 1 1   26    4   36 f   91.788   19.905   6.9964   2.7160   11.461   5.4451   5.5179   3.1336  113.902   30.586   81.134   23.730 32.76728 38.71227 
1 1 1   26    4   37 o   41.115   18.857  -1.6787   2.6926   1.9170   5.5443  -2.7886   3.0802   71.915   30.080   41.344   19.371 30.57083 35.77742 
1 1 1   26    4   38 o   72.206   22.657   4.2950   2.7876   1.0028   5.3557   5.5183   3.2647   67.793   29.008   80.812   24.369 -13.01920 37.88527 
1 1 1   26    4   39 o   45.250   20.419  -1.1962   2.9998  -1.8401   3.8124  -0.1495   4.8608   49.638   22.642   61.367   26.933 -11.72951 35.18603 
1 1 1   26    4   40 o  152.235   13.286   18.374   3.0647   18.743   4.3112   17.996   4.3576  151.096   19.066  147.644   19.780 3.452011 27.47229 
1 1 1   26    4   41 o   65.643   22.485   3.4222   2.7207   3.5872   4.2015   3.3032   3.5704   71.465   27.406   67.811   25.432 3.654091 37.38843 
1 1 1   26    4   42 o   73.135   22.307   4.5503   2.7244   7.3214   4.1441   2.4411   3.6155   90.442   27.496   63.531   25.116 26.91152 37.24028 
1 1 1   26    4   43 o  109.489   17.470   9.9398   2.8293   12.971   4.1895   7.3980   3.8362  122.119   23.263   90.624   26.184 31.49555 35.02542 
1 1 1   26    4   44 o   71.470   23.127   4.3958   2.8865   9.1236   3.9334  -1.1216   4.2492  100.182   25.566   53.471   24.199 46.71074 35.20255 
1 1 1   26    4   45 o   66.476   23.646   3.6266   3.0263   1.1766   5.0092   5.0349   3.7977   63.814   27.684   75.794   26.532 -11.97958 38.34503 
1 1 1   26    4   46 o  135.705   14.975   15.082   3.0587   14.661   4.6649   15.400   4.0510  126.936   24.899  133.556   20.469 -6.619820 32.23295 
1 1 1   26    5    1 o  331.331   8.8920   84.283   4.5095   83.358   6.5629   85.109   6.2068  328.913   13.036  332.489   12.196 -3.576019 17.85172 
1 1 1   26    5    2 o  285.430   9.5177   62.578   4.1582   65.994   6.4367   60.131   5.4474  292.438   14.380  279.392   12.738 13.04495 19.21063 
1 1 1   26    5    3 f  293.303   9.1861   66.062   4.1240   68.930   6.7067   64.319   5.2295  298.816   14.664  289.084   11.818 9.731476 18.83335 
1 1 1   26    5    4 o  486.827   12.758  182.585   9.5066  182.585   9.5066   0.0000   0.0000  486.827   12.758  ?   ?  0.000000 12.75801 
1 1 1   26    5    5 o  269.704   6.9035   55.779   2.8499   67.839   6.8841   53.284   3.1308  295.929   15.250  263.537   7.7614 32.39209 17.11135 
1 1 1   26    5    6 o  455.846   8.6711  159.529   6.0501  174.679   9.5736  149.456   7.8065  476.033   13.139  440.680   11.573 35.35367 17.50950 
1 1 1   26    5    7 o  125.796   14.174   12.365   2.6816   10.638   3.7167   14.240   3.8728  114.914   21.931  134.008   19.449 -19.09366 29.31269 
1 1 1   26    5    8 o  375.278   9.7236  108.224   5.5854  108.224   5.5854   0.0000   0.0000  375.278   9.7236  ?   ?  0.000000 9.723646 
1 1 1   26    5    9 o  198.263   13.954   30.488   4.2075   30.488   4.2075   0.0000   0.0000  198.263   13.954  ?   ?  0.000000 13.95388 
1 1 1   26    5   10 o  205.557   13.933   32.767   4.3580   32.767   4.3580   0.0000   0.0000  205.557   13.933  ?   ?  0.000000 13.93340 
1 1 1   26    5   11 o  363.018   7.8815  101.145   4.3793  113.597   5.8675   85.485   6.5801  384.383   9.9729  332.930   12.913 51.45313 16.31539 
1 1 1   26    5   12 o  139.838   16.012   15.338   3.3655   19.924   5.2245   12.084   4.4000  158.077   22.205  121.916   24.430 36.16153 33.01361 
1 1 1   26    5   13 o  144.145   11.123   16.091   2.4350   18.016   4.3351   15.204   2.9432  150.929   19.200  139.607   13.961 11.32268 23.73902 
1 1 1   26    5   14 o   46.817   19.315   0.5341   2.2419   3.8641   4.1999  -0.7930   2.6513   76.148   27.756   44.566   19.712 31.58192 34.04302 
1 1 1   26    5   15 f  343.529   8.6353   90.669   4.5406   91.178   5.9270   89.947   7.0644  344.024   11.256  341.193   13.527 2.831390 17.59765 
1 1 1   26    5   16 o  335.324   8.9258   86.427   4.5812   85.292   6.0583   87.942   7.0011  332.558   11.902  337.300   13.561 -4.741608 18.04292 
1 1 1   26    5   17 o  252.809   10.361   49.210   4.0091   58.203   5.7029   40.423   5.6371  274.348   13.581  227.566   16.291 46.78191 21.20954 
1 1 1   26    5   18 o  180.972   12.280   25.400   3.3814   20.021   5.1981   29.345   4.4522  158.104   22.083  193.956   15.116 -35.85187 26.76089 
1 1 1   26    5   19 o  176.219   20.913   24.712   5.5306   24.712   5.5306   0.0000   0.0000  176.219   20.913  ?   ?  0.000000 20.91276 
1 1 1   26    5   20 o  270.250   6.1311   56.029   2.5362   57.877   6.3456   55.678   2.7667  272.564   15.272  269.338   6.7112 3.225281 16.68121 
1 1 1   26    5   21 o  281.568   6.1402   60.827   2.6463   72.314   6.7007   58.705   2.8804  305.299   14.339  276.532   6.8052 28.76706 15.87206 
1 1 1   26    5   22 o   75.707   15.667   4.6202   1.7557   6.6534   5.7532   4.4114   1.8436   93.457   32.659   73.788   16.712 19.66972 36.68652 
1 1 1   26    5   23 o   53.467   17.536   2.1549   1.6571   5.2342   2.9334   0.7117   2.0082   80.128   22.818   45.538   18.473 34.58991 29.35871 
1 1 1   26    5   24 o  191.086   7.4119   28.059   2.1678   38.102   4.0732   24.090   2.5606  221.614   12.053  176.572   9.5095 45.04187 15.35283 
1 1 1   26    5   25 o  161.249   7.6952   19.990   1.8993   25.028   3.5820   18.019   2.2401  179.189   13.152  152.601   9.6398 26.58839 16.30652 
1 1 1   26    5   26 o  176.001   7.6346   23.817   2.0567   25.015   3.9270   23.364   2.4143  178.743   14.478  173.916   9.1011 4.826767 17.10099 
1 1 1   26    5   27 o  176.157   7.8627   23.871   2.1200   24.898   3.9601   23.458   2.5100  178.214   14.647  174.178   9.4502 4.035812 17.43114 
1 1 1   26    5   28 o  197.626   8.9013   30.095   2.6926   26.728   4.1550   32.532   3.5354  184.573   14.833  204.742   11.325 -20.16896 18.66188 
1 1 1   26    5   29 o   54.763   20.513   1.8491   2.3213   3.4513   4.3979   1.2304   2.7330   73.909   28.111   54.004   21.675 19.90574 35.49733 
1 1 1   26    5   30 o  129.980   12.110   13.216   2.3816   7.2008   5.3890   14.676   2.6549   94.101   31.648  136.856   12.824 -42.75474 34.14722 
1 1 1   26    5   31 o  184.027   9.2584   26.200   2.5995   32.472   5.4708   24.371   2.9544  202.131   17.867  177.083   10.954 25.04727 20.95715 
1 1 1   26    5   32 o  219.309   8.9599   37.112   3.0077   39.603   5.2231   35.876   3.6788  224.317   15.304  214.846   11.226 9.470901 18.97970 
1 1 1   26    5   33 o  287.939   7.7867   63.863   3.4318   63.416   8.4584   63.951   3.7548  281.436   19.761  287.955   8.5190 -6.519012 21.51862 
1 1 1   26    5   34 f  130.333   13.439   13.394   2.6425   10.590   5.4275   14.265   3.0253  110.037   30.935  134.080   14.998 -24.04286 34.37929 
1 1 1   26    5   35 o  151.716   12.475   18.051   2.8713   14.866   6.4228   18.847   3.2100  129.238   32.501  154.667   13.701 -25.42952 35.27070 
1 1 1   26    5   36 o  229.410   8.9417   40.679   3.1398   35.663   6.1674   42.434   3.6479  210.230   19.385  233.962   10.187 -23.73178 21.89826 
1 1 1   26    5   37 o  154.697   12.632   18.818   2.9650   15.892   5.8435   19.833   3.4408  134.621   29.199  158.232   14.363 -23.61035 32.54082 
1 1 1   26    5   38 o  131.982   15.980   13.993   3.1625   16.685   5.5187   12.676   3.8589  138.866   26.936  123.385   21.197 15.48079 34.27603 
1 1 1   26    5   39 o  126.022   17.726   12.950   3.3248   10.095   5.3568   14.738   4.2404  105.555   31.070  132.739   21.614 -27.18368 37.84841 
1 1 1   26    5   40 o   48.388   21.275  -0.3729   3.0450  -6.9831   5.3074   2.8706   3.7178   48.822   23.571   66.443   25.700 -17.62092 34.87278 
1 1 1   26    5   41 o  144.827   14.133   16.754   3.0930   18.653   5.7893   15.996   3.6590  145.530   26.984  139.973   17.458 5.556442 32.13863 
1 1 1   26    5   42 o  136.891   15.189   15.123   3.1288   11.201   5.6323   16.873   3.7629  108.953   31.799  143.522   17.491 -34.56837 36.29152 
1 1 1   26    5   43 o   89.664   20.761   6.9342   2.7931   7.7080   4.1084   6.2692   3.8085   91.964   27.248   83.804   26.508 8.160469 38.01433 
1 1 1   26    5   44 o  121.185   17.776   12.251   3.1993   17.493   4.7337   7.8433   4.3409  141.950   22.540   91.713   28.191 50.23646 36.09400 
1 1 1   26    5   45 o   78.090   23.992   5.4674   3.1446   15.388   5.2093  -0.2201   3.9443  128.716   27.288   53.902   23.932 74.81335 36.29537 
1 1 1   26    5   46 o   65.290   22.903   3.5667   2.8307   5.1138   4.1378   2.2058   3.8809   76.007   27.573   62.002   25.477 14.00469 37.54161 
1 1 1   26    6    0 o  444.304   11.659  151.809   7.9167  151.809   7.9167  151.809   7.9167  444.304   11.659  444.304   11.659 0.000000 0.000000 
1 1 1   26    6    1 o   92.550   28.125   6.8262   4.3365   0.0000   0.0000   6.8262   4.3365  ?   ?    92.550   28.125 0.000000 28.12490 
1 1 1   26    6    2 o   82.223   23.171   5.4337   3.0411   4.0103   5.1607   6.1909   3.7641   81.197   30.552   87.995   26.083 -6.797890 40.17150 
1 1 1   26    6    3 o  557.665   8.0937  238.651   6.9086  247.995   11.103  232.749   8.8250  567.330   12.786  550.222   10.479 17.10815 16.53152 
1 1 1   26    6    4 o   77.349   31.782   1.8663   6.0394   1.8663   6.0394   0.0000   0.0000   77.349   31.782  ?   ?  0.000000 31.78237 
1 1 1   26    6    5 o  317.367   16.054   78.116   7.7734   78.116   7.7734   0.0000   0.0000  317.367   16.054  ?   ?  0.000000 16.05446 
1 1 1   26    6    6 o   58.235   27.307  -5.9189   6.1421  -5.9189   6.1421   0.0000   0.0000   58.235   27.307  ?   ?  0.000000 27.30737 
1 1 1   26    6    7 o  278.720   11.369   59.788   4.8502   59.788   4.8502   0.0000   0.0000  278.720   11.369  ?   ?  0.000000 11.36898 
1 1 1   26    6    8 o  151.243   17.807   17.986   4.0432   17.986   4.0432   0.0000   0.0000  151.243   17.807  ?   ?  0.000000 17.80671 
1 1 1   26    6    9 o   68.850   22.104   3.6295   2.6407   7.2923   3.8326   0.3192   3.6435   94.640   25.765   57.215   24.182 37.42545 35.33574 
1 1 1   26    6   10 o  159.974   9.5319   19.737   2.3234   19.323   4.2974   19.908   2.7618  156.682   18.262  160.419   11.321 -3.736954 21.48607 
1 1 1   26    6   11 o   79.838   17.434   5.1359   2.0708   8.9135   4.1390   3.8746   2.3917  104.265   26.019   69.942   20.805 34.32275 33.31380 
1 1 1   26    6   12 o   74.736   19.520   4.5130   2.2573   0.4681   5.1272   5.4855   2.5141   67.463   28.609   82.251   20.133 -14.78810 34.98315 
1 1 1   26    6   13 o   45.705   18.916   0.4645   2.1600  -1.2750   4.1703   1.1022   2.5251   55.490   24.624   52.253   20.883 3.237206 32.28664 
1 1 1   26    6   14 o  327.554   7.0370   82.322   3.5281   81.899   5.8333   82.566   4.4302  325.978   11.691  327.798   8.8298 -1.820404 14.65093 
1 1 1   26    6   15 o  241.115   8.4085   44.661   3.1032   41.166   5.2860   46.499   3.8333  230.049   15.096  245.809   10.188 -15.75975 18.21225 
1 1 1   26    6   16 o  185.405   10.067   26.533   2.8461   20.104   5.0250   29.569   3.4533  158.809   21.202  195.495   11.592 -36.68611 24.16427 
1 1 1   26    6   17 o  225.558   15.958   39.696   5.4740   39.696   5.4740   0.0000   0.0000  225.558   15.958  ?   ?  0.000000 15.95833 
1 1 1   26    6   18 o   49.874   23.635  -5.4588   4.8253  -5.4588   4.8253   0.0000   0.0000   49.874   23.635  ?   ?  0.000000 23.63499 
1 1 1   26    6   19 o  184.837   13.026   26.551   3.6618   30.069   5.4479   23.651   4.9455  195.338   18.439  172.885   19.002 22.45302 26.47821 
1 1 1   26    6   20 o  290.413   8.2363   64.833   3.6612   60.326   6.3486   67.078   4.4814  278.345   14.956  295.106   9.9213 -16.76080 17.94768 
1 1 1   26    6   21 o  233.663   9.2903   42.031   3.3227   44.762   6.1982   40.929   3.9360  238.914   17.062  230.282   11.167 8.631592 20.39107 
1 1 1   26    6   22 f   72.598   12.620   4.1930   1.3514   4.3580   2.6304   4.1338   1.5751   73.595   21.802   71.658   14.849 1.936974 26.37840 
1 1 1   26    6   23 o   38.419   16.191   0.1516   1.6259   10.910   5.9500  -0.7165   1.6902  113.435   32.562   34.604   15.494 78.83106 36.06019 
1 1 1   26    6   24 o   94.982   11.813   7.0808   1.6803   12.119   3.3693   5.4130   1.9385  123.013   18.464   81.965   16.026 41.04811 24.44910 
1 1 1   26    6   25 o  177.899   7.0291   24.314   1.9140   30.576   3.7590   22.122   2.2239  198.312   12.447  169.313   8.6095 28.99844 15.13436 
1 1 1   26    6   26 o  185.035   7.0994   26.310   2.0107   33.119   3.9985   24.006   2.3262  206.296   12.725  176.576   8.6068 29.71945 15.36240 
1 1 1   26    6   27 o  192.556   7.2491   28.502   2.1365   30.708   4.0870   27.672   2.5063  198.344   13.543  189.557   8.6381 8.787140 16.06325 
1 1 1   26    6   28 o   76.319   20.565   4.7797   2.4566   9.0429   4.1522   2.4838   3.0470  103.693   26.162   62.740   23.502 40.95272 35.16795 
1 1 1   26    6   29 o  159.023   10.083   19.609   2.4416   22.660   4.6975   18.480   2.8579  168.539   18.515  153.880   12.235 14.65894 22.19189 
1 1 1   26    6   30 o  215.269   7.6699   35.663   2.5272   36.938   4.9657   35.217   2.9359  216.888   15.051  213.701   8.9755 3.187088 17.52432 
1 1 1   26    6   31 o  117.705   14.992   11.001   2.6397   5.4891   5.2881   12.830   3.0464   85.812   31.165  126.942   16.036 -41.13025 35.04894 
1 1 1   26    6   32 o  134.935   12.455   14.273   2.5435   16.353   5.8317   13.784   2.8264  138.391   28.481  132.118   14.200 6.273209 31.82411 
1 1 1   26    6   33 o   55.950   21.052   1.9464   2.4502   6.9256   5.9689   0.9374   2.6870   93.249   33.204   51.959   21.257 41.28939 39.42532 
1 1 1   26    6   34 o  116.408   16.395   10.873   2.8403 -19.8302   12.917   12.434   2.9116   71.131   34.875  124.878   15.571 -53.74719 38.19356 
1 1 1   26    6   35 o  200.588   9.6989   31.138   2.9778   35.947   7.0790   30.104   3.2823  209.564   22.417  196.640   10.949 12.92389 24.94785 
1 1 1   26    6   36 o  194.845   11.025   29.591   3.2745   40.009   6.2575   25.663   3.8426  223.203   18.482  180.381   14.028 42.82166 23.20294 
1 1 1   26    6   37 o   97.376   20.987   7.9447   3.0359   23.322   5.7822   2.0926   3.5671  167.363   23.195   62.671   24.893 104.6917 34.02473 
1 1 1   26    6   38 o  162.288   11.778   20.663   2.9058   22.563   5.5491   19.945   3.4109  164.512   22.637  158.552   14.205 5.960281 26.72491 
1 1 1   26    6   39 o   62.150   22.763   2.7580   2.8296   2.6307   5.2936   2.8089   3.3481   72.403   29.753   64.701   24.547 7.702484 38.57232 
1 1 1   26    6   40 o  145.574   17.914   17.299   3.9073   19.229   5.4958   15.327   5.5562  149.545   24.885  130.954   28.527 18.59096 37.85521 
1 1 1   26    6   41 o  103.842   19.242   9.0217   2.9457   8.4727   5.5464   9.2375   3.4766   96.356   32.106  103.601   22.563 -7.244873 39.24087 
1 1 1   26    6   42 o   59.315   23.017   2.2202   2.9895  -0.0117   5.1592   3.3485   3.6681   62.400   27.553   67.987   25.718 -5.587471 37.69054 
1 1 1   26    6   43 o  100.094   23.800   8.8794   3.5929   2.7076   6.4109   11.706   4.3382   74.786   31.862  114.277   25.454 -39.49046 40.78123 
1 1 1   26    6   44 o   51.906   22.357   0.4406   3.2200  -0.7814   5.5234   1.0698   3.9632   61.150   27.639   58.673   25.026 2.477272 37.28555 
1 1 1   26    6   45 o   40.069   19.019  -3.1271   3.1497 -10.0016   5.3723   0.4733   3.8879   43.826   21.679   55.785   24.295 -11.95937 32.56107 
1 1 1   26    6   46 o   92.837   23.230   7.8220   3.2930   4.2878   5.7153   9.5783   4.0290   75.528   30.963  101.166   25.906 -25.63763 40.37106 
1 1 1   26    7    0 o  282.586   12.845   61.702   5.5296   61.702   5.5296   61.702   5.5296  282.586   12.845  282.586   12.845 0.000000 0.000000 
1 1 1   26    7    1 o  188.055   15.013   27.491   4.2853   0.0000   0.0000   27.491   4.2853  ?   ?   188.055   15.013 0.000000 15.01279 
1 1 1   26    7    2 f  283.058   8.4181   61.502   3.6472   66.747   6.3087   58.869   4.4699  294.101   14.014  276.696   10.554 17.40503 17.54402 
1 1 1   26    7    3 o  165.952   8.8897   21.208   2.2499   27.312   6.0942   20.244   2.4209  185.836   21.841  162.016   9.8084 23.81976 23.94268 
1 1 1   26    7    4 o  305.312   15.792   72.290   7.3548   72.290   7.3548   0.0000   0.0000  305.312   15.792  ?   ?  0.000000 15.79230 
1 1 1   26    7    5 o  294.159   16.657   67.227   7.4689   67.227   7.4689   0.0000   0.0000  294.159   16.657  ?   ?  0.000000 16.65676 
1 1 1   26    7    6 o  300.067   16.874   69.985   7.7187   69.985   7.7187   0.0000   0.0000  300.067   16.874  ?   ?  0.000000 16.87415 
1 1 1   26    7    7 o  321.511   10.760   79.520   5.2951   79.520   5.2951   0.0000   0.0000  321.511   10.760  ?   ?  0.000000 10.75989 
1 1 1   26    7    8 o   65.188   20.109   3.3112   2.2065   1.4060   3.7926   4.2860   2.7129   62.701   25.404   73.654   22.215 -10.95327 33.74673 
1 1 1   26    7    9 o  142.707   10.036   15.735   2.1783   19.712   4.1954   14.267   2.5487  158.423   17.599  135.494   12.428 22.92885 21.54484 
1 1 1   26    7   10 o   86.813   16.081   6.0189   2.0581   6.6441   4.0213   5.7970   2.3956   90.854   26.966   84.692   18.953 6.162239 32.96054 
1 1 1   26    7   11 o  121.762   11.802   11.528   2.1720   13.101   4.2654   10.978   2.5237  127.476   22.692  118.363   14.214 9.113297 26.77675 
1 1 1   26    7   12 o  258.162   8.0688   51.173   3.1884   58.267   6.6529   49.057   3.6328  273.743   15.947  252.624   9.3949 21.11899 18.50884 
1 1 1   26    7   13 o   37.723   17.212  -1.4045   2.2048  -0.9474   4.2915  -1.5685   2.5698   57.361   25.238   40.910   18.633 16.45094 31.37102 
1 1 1   26    7   14 o  260.506   7.7828   52.104   3.1033   55.029   5.4737   50.718   3.7672  266.538   13.460  256.806   9.5840 9.732147 16.52377 
1 1 1   26    7   15 o  253.435   8.0921   49.333   3.1390   60.695   5.5148   43.888   3.8179  280.343   12.852  238.753   10.447 41.59036 16.56261 
1 1 1   26    7   16 o  209.277   11.040   33.843   3.5237   34.555   5.2778   33.270   4.7332  210.238   16.534  206.639   15.069 3.598801 22.37081 
1 1 1   26    7   17 o   78.626   29.668   3.8429   4.8737   3.8429   4.8737   0.0000   0.0000   78.626   29.668  ?   ?  0.000000 29.66758 
1 1 1   26    7   18 o  194.263   9.9360   29.132   2.9445   32.875   5.6568   27.740   3.4485  204.406   18.273  189.185   11.971 15.22104 21.84514 
1 1 1   26    7   19 o  400.454   8.6912  123.324   5.3272  126.811   7.2952  119.339   7.7975  405.265   11.761  392.770   12.970 12.49487 17.50824 
1 1 1   26    7   20 o   97.474   24.040   7.8389   3.5643   9.6574   5.5517   6.5636   4.6490  107.537   31.623   90.738   29.349 16.79913 43.14400 
1 1 1   26    7   21 o  162.972   15.204   20.823   3.7489   21.073   5.9429   20.658   4.8315  160.848   24.947  160.927   20.050 -0.7876587E-01 32.00499 
1 1 1   26    7   22 f  241.408   7.0510   44.760   2.6054   53.195   3.4981   34.251   3.9045  262.929   8.6920  210.091   12.194 52.83844 14.97518 
1 1 1   26    7   23 o   47.688   20.738  -0.3435   2.8245  -6.7558   5.8946   1.5676   3.2180   54.466   25.901   59.208   23.604 -4.741772 35.04298 
1 1 1   26    7   24 o  183.255   9.8660   25.965   2.7572   27.244   3.9657   24.769   3.8360  186.789   13.972  177.998   14.198 8.791183 19.91960 
1 1 1   26    7   25 o  108.537   10.183   9.1677   1.6719   13.965   3.4557   7.7016   1.9103  132.429   17.475   98.856   12.936 33.57295 21.74187 
1 1 1   26    7   26 o  199.203   6.8346   30.486   2.0839   29.275   4.2763   30.863   2.3864  193.381   14.554  200.317   7.7833 -6.936066 16.50437 
1 1 1   26    7   27 f  223.093   6.7326   38.237   2.2990   40.645   4.9628   37.580   2.5941  228.051   14.290  221.040   7.6674 7.010925 16.21692 
1 1 1   26    7   28 o  161.149   8.3556   20.051   2.0539   22.440   4.1567   19.279   2.3625  168.518   16.320  157.741   9.8337 10.77664 19.05353 
1 1 1   26    7   29 o  211.640   10.201   34.609   3.3044   30.743   4.8196   38.039   4.5392  197.468   16.086  220.699   13.502 -23.23048 21.00132 
1 1 1   26    7   30 o   86.665   16.403   6.0776   2.0962   6.1418   4.5573   6.0604   2.3607   87.308   29.103   86.042   18.477 1.265526 34.47294 
1 1 1   26    7   31 f  149.636   11.420   17.458   2.5959   14.906   4.9728   18.414   3.0435  133.492   25.263  153.265   13.100 -19.77242 28.45717 
1 1 1   26    7   32 o  156.556   10.725   19.070   2.5546   26.582   5.2586   16.749   2.9227  182.009   19.164  146.038   13.218 35.97012 23.28046 
1 1 1   26    7   33 o  196.301   9.1987   29.764   2.7639   26.906   5.5512   30.707   3.1870  182.494   20.213  198.838   10.509 -16.34427 22.78141 
1 1 1   26    7   34 o  119.864   15.783   11.485   2.8253   3.9773   13.788   11.814   2.8865  104.439   45.611  121.560   15.894 -17.12117 48.30089 
1 1 1   26    7   35 o  139.505   14.105   15.397   2.9704   22.863   7.0760   13.800   3.2727  162.641   29.511  131.141   16.682 31.49969 33.89977 
1 1 1   26    7   36 o  137.751   13.876   15.020   2.8858   18.544   7.3635   14.380   3.1367  142.913   34.132  134.189   15.560 8.724228 37.51125 
1 1 1   26    7   37 o   64.429   22.518   3.1404   2.7351   1.3318   5.8015   3.6572   3.1014   71.026   30.286   68.881   23.984 2.145111 38.63262 
1 1 1   26    7   38 o  200.669   9.9090   31.266   3.0435   27.968   5.6193   32.635   3.6206  184.771   20.198  204.152   11.635 -19.38075 23.30954 
1 1 1   26    7   39 o  138.402   13.799   15.241   2.8842   22.288   5.4694   12.527   3.3945  163.001   22.524  123.450   18.537 39.55088 29.17099 
1 1 1   26    7   40 o  155.609   16.861   19.617   3.9517   17.659   5.5751   21.594   5.6021  141.973   26.634  159.316   23.695 -17.34341 35.64804 
1 1 1   26    7   41 o   93.018   20.656   7.3697   2.8644   4.7466   5.4188   8.3869   3.3744   79.871   30.990   98.422   22.840 -18.55128 38.49753 
1 1 1   26    7   42 o   63.632   23.819   2.9220   3.1288   6.7387   6.2272   1.6332   3.6187   88.507   33.502   59.725   24.578 28.78246 41.55061 
1 1 1   26    7   43 o   89.174   24.802   7.1428   3.5083   11.475   5.9511   4.8354   4.3433  108.010   32.975   76.416   28.169 31.59406 43.36862 
1 1 1   26    7   44 o   76.362   23.209   5.1587   2.9528  -1.8459   4.5146   10.396   3.9036   52.965   24.338  107.519   24.293 -54.55376 34.38717 
1 1 1   26    7   45 o  167.196   13.054   22.455   3.3143   17.210   4.6140   28.046   4.7640  140.160   22.251  183.960   17.115 -43.79984 28.07189 
1 1 1   26    7   46 o   44.387   20.647  -2.1137   3.3977   3.6762   7.5113  -3.6031   3.8098   77.810   33.828   43.783   20.822 34.02662 39.72277 
1 1 1   26    8    0 o  212.651   13.761   35.181   4.4359   35.181   4.4359   35.181   4.4359  212.651   13.761  212.651   13.761 0.000000 0.000000 
1 1 1   26    8    1 o  224.823   8.8390   38.815   3.0417   45.863   4.9573   34.559   3.8520  243.498   13.352  211.514   11.947 31.98352 17.91644 
1 1 1   26    8    2 o  111.252   13.503   9.6845   2.2522   0.0000   0.0000   9.6845   2.2522  ?   ?   111.252   13.503 0.000000 13.50291 
1 1 1   26    8    3 o  293.153   14.517   66.380   6.5141   66.380   6.5141   0.0000   0.0000  293.153   14.517  ?   ?  0.000000 14.51740 
1 1 1   26    8    4 o  448.661   12.931  155.197   8.8799  155.197   8.8799   0.0000   0.0000  448.661   12.931  ?   ?  0.000000 12.93062 
1 1 1   26    8    5 o  204.732   21.337   33.063   6.5881   33.063   6.5881   0.0000   0.0000  204.732   21.337  ?   ?  0.000000 21.33679 
1 1 1   26    8    6 o  219.256   21.052   37.853   6.9781   37.853   6.9781   0.0000   0.0000  219.256   21.052  ?   ?  0.000000 21.05184 
1 1 1   26    8    7 o  193.694   9.2726   28.827   2.7491   31.136   4.4193   27.369   3.5111  200.220   14.519  188.064   12.265 12.15648 19.00595 
1 1 1   26    8    8 o   91.343   17.485   6.6858   2.3556   12.861   4.2050   3.8616   2.8437  126.358   22.570   71.045   22.951 55.31370 32.18951 
1 1 1   26    8    9 o  153.105   11.510   18.153   2.6776   21.747   4.4622   16.131   3.3472  166.410   17.794  143.559   15.477 22.85002 23.58379 
1 1 1   26    8   10 o  242.437   7.5259   45.107   2.7927   47.427   5.0377   44.077   3.3555  247.512   13.347  239.496   9.1536 8.016907 16.18404 
1 1 1   26    8   11 o  207.524   8.2880   33.073   2.6326   28.684   4.7643   35.002   3.1586  191.636   16.401  213.357   9.6721 -21.72145 19.04011 
1 1 1   26    8   12 o  249.782   8.1241   47.911   3.1060   50.757   6.4343   47.047   3.5466  255.218   16.561  247.380   9.3666 7.837234 19.02594 
1 1 1   26    8   13 o  152.779   11.000   18.070   2.5551   14.447   4.7171   19.574   3.0396  133.515   23.962  158.769   12.612 -25.25333 27.07862 
1 1 1   26    8   14 o  391.528   6.7896  117.616   4.0689  129.769   6.7446  110.661   5.1019  410.484   10.735  379.454   8.7843 31.03049 13.87069 
1 1 1   26    8   15 f   65.574   23.483   2.9337   2.9896  -1.8241   4.6398   6.3114   3.9093   57.141   25.622   88.475   26.663 -31.33487 36.97826 
1 1 1   26    8   16 o   59.504   21.442   2.3675   2.4962  -1.4863   4.8694   3.7413   2.9073   59.619   26.524   70.249   23.237 -10.62963 35.26295 
1 1 1   26    8   17 o  191.327   12.305   28.387   3.5844   28.919   5.5243   27.999   4.7107  191.386   19.114  189.045   16.444 2.341187 25.21349 
1 1 1   26    8   18 o  108.840   15.573   9.3823   2.5205   20.889   5.4125   6.1961   2.8481  161.231   22.549   87.034   21.504 74.19617 31.15938 
1 1 1   26    8   19 o  243.668   8.8084   45.673   3.2852   48.019   6.2015   44.757   3.8734  247.772   16.446  240.955   10.502 6.816574 19.51297 
1 1 1   26    8   20 o  152.618   12.533   18.135   2.9019   18.859   5.6949   17.881   3.3726  151.877   25.394  151.037   14.778 0.8400421 29.38102 
1 1 1   26    8   21 o  224.223   10.074   38.754   3.4574   38.372   6.3784   38.912   4.1143  220.324   19.103  224.026   12.043 -3.701569 22.58198 
1 1 1   26    8   22 o  148.411   10.262   17.065   2.3168   17.567   2.6528   15.454   4.7560  150.329   11.619  137.684   23.406 12.64462 26.13096 
1 1 1   26    8   23 o  144.101   12.415   16.190   2.7116   22.145   3.3345   4.5627   4.6594  168.551   13.026   80.518   29.252 88.03336 32.02130 
1 1 1   26    8   24 f  185.454   14.022   26.868   3.9508   0.0000   0.0000   26.868   3.9508  ?   ?   185.454   14.022 0.000000 14.02170 
1 1 1   26    8   25 o  213.441   8.9614   35.092   2.9277   37.832   4.1027   32.250   4.1791  220.685   12.193  203.354   13.503 17.33141 18.19364 
1 1 1   26    8   26 o   72.940   20.475   4.3363   2.3794   5.4609   3.7872   3.6028   3.0584   82.518   26.469   69.428   23.838 13.08970 35.62046 
1 1 1   26    8   27 o  147.798   11.642   17.015   2.6125   14.158   4.2320   18.775   3.3207  131.815   21.733  154.666   14.185 -22.85149 25.95260 
1 1 1   26    8   28 o  132.009   9.6813   13.520   1.9425   9.7538   4.3612   14.452   2.1696  107.480   26.643  136.353   10.476 -28.87361 28.62882 
1 1 1   26    8   29 o   97.421   21.149   7.8347   3.0631   5.1412   4.4932   10.174   4.1869   82.165   28.854  110.014   25.381 -27.84814 38.42813 
1 1 1   26    8   30 o   78.750   18.423   5.0908   2.1811  -2.5950   4.7554   7.1384   2.4545   55.109   25.196   93.714   17.762 -38.60501 30.82725 
1 1 1   26    8   31 o  145.944   10.544   16.569   2.3395   20.415   5.0614   15.524   2.6383  158.422   21.423  140.810   12.366 17.61259 24.73571 
1 1 1   26    8   32 o   40.474   18.072  -0.8136   2.2826   8.5276   5.0374  -3.2271   2.5605   99.784   30.310   35.494   16.932 64.29080 34.71904 
1 1 1   26    8   33 o  124.503   14.736   12.305   2.7537   14.442   5.4211   11.562   3.1968  129.687   28.120  119.586   18.025 10.10104 33.40097 
1 1 1   26    8   34 o  151.523   12.400   17.999   2.8507   8.1955   5.8724   21.022   3.2606   98.238   33.037  163.599   13.132 -65.36055 35.55096 
1 1 1   26    8   35 o   60.755   22.005   2.5942   2.6338   4.1966   13.459   2.5304   2.6857  103.034   45.028   60.608   22.180 42.42578 50.19449 
1 1 1   26    8   36 o   32.008   15.586  -4.1919   2.4527   0.4540   6.1763  -5.0617   2.6725   70.476   30.658   32.371   15.870 38.10546 34.52153 
1 1 1   26    8   37 o   55.977   21.805   1.7734   2.6907   11.542   6.8396  -0.0154   2.9267  111.888   35.537   49.131   21.238 62.75729 41.39923 
1 1 1   26    8   38 o   68.849   22.957   3.8109   2.8358   6.7923   6.7028   3.1609   3.1297   91.860   34.761   65.803   23.964 26.05709 42.22026 
1 1 1   26    8   39 o  170.492   11.853   22.857   3.0738   15.800   6.8675   24.625   3.4374  129.459   34.161  176.605   12.803 -47.14610 36.48108 
1 1 1   26    8   40 o   69.552   26.183   3.4873   3.7910   0.4633   5.4799   6.2629   5.2500   65.869   28.760   86.189   31.091 -20.32096 42.35334 
1 1 1   26    8   41 o   69.449   23.050   3.9835   2.8600  -6.2639   6.3349   6.6068   3.2052   55.582   26.548   86.989   23.512 -31.40716 35.46292 
1 1 1   26    8   42 o   72.655   23.891   4.4827   3.0751   2.4046   5.1631   5.6251   3.8280   69.605   29.063   80.220   26.670 -10.61476 39.44517 
1 1 1   26    8   43 o   75.840   23.543   5.0422   3.0191  -1.3695   4.8111   9.2072   3.8776   56.145   25.543  100.890   25.188 -44.74430 35.87273 
1 1 1   26    8   44 o   59.955   22.922   2.5378   2.9335  -2.9980   4.6458   6.2086   3.7831   50.971   23.852   82.465   26.454 -31.49426 35.61994 
1 1 1   26    8   45 o   38.335   18.148  -2.7256   2.8308  -1.4602   4.5031  -3.5525   3.6400   53.462   24.471   42.790   20.350 10.67164 31.82709 
1 1 1   26    9    0 o  476.862   10.223  174.679   7.4542  174.679   7.4542  174.679   7.4542  476.862   10.223  476.862   10.223 0.000000 0.000000 
1 1 1   26    9    1 o   65.626   18.539   3.4362   1.9444   5.4314   3.5068   2.5505   2.3365   82.814   25.319   60.077   20.823 22.73691 32.78162 
1 1 1   26    9    2 o  231.413   8.5267   41.119   3.0202   0.0000   0.0000   41.119   3.0202  ?   ?   231.413   8.5267 0.000000 8.526746 
1 1 1   26    9    3 o  428.678   11.930  141.550   7.8281  141.550   7.8281   0.0000   0.0000  428.678   11.930  ?   ?  0.000000 11.93043 
1 1 1   26    9    4 o  119.630   13.439   11.179   2.4182   5.7495   5.3342   12.583   2.7130   89.313   31.433  126.868   14.215 -37.55528 34.49812 
1 1 1   26    9    5 o  199.835   9.7464   30.697   2.9812   35.171   6.1090   29.298   3.4155  211.786   19.049  194.727   11.510 17.05899 22.25657 
1 1 1   26    9    6 o  215.229   21.213   36.526   6.8976   36.526   6.8976   0.0000   0.0000  215.229   21.213  ?   ?  0.000000 21.21338 
1 1 1   26    9    7 o  218.130   8.7601   36.547   2.9248   45.007   4.7306   31.312   3.7213  241.221   12.859  201.208   12.140 40.01344 17.68413 
1 1 1   26    9    8 o  300.272   7.8365   69.209   3.6017   72.048   5.3821   66.907   4.8469  305.845   11.497  294.852   10.740 10.99307 15.73279 
1 1 1   26    9    9 o  257.509   8.5394   50.932   3.3658   54.881   5.1464   47.980   4.4493  266.740   12.605  249.549   11.648 17.19037 17.16316 
1 1 1   26    9   10 f  247.453   8.8677   47.049   3.3587   50.996   5.0827   43.990   4.4750  256.723   12.977  238.526   12.299 18.19679 17.87922 
1 1 1   26    9   11 o   91.751   19.172   6.8007   2.6057   8.5489   4.3141   5.7966   3.2694  101.954   27.158   84.643   24.085 17.31036 36.29917 
1 1 1   26    9   12 o  129.108   12.594   12.984   2.4571   12.367   5.6218   13.130   2.7319  121.858   30.275  129.574   13.997 -7.716187 33.35426 
1 1 1   26    9   13 o  381.836   11.292  112.365   6.5999  112.365   6.5999   0.0000   0.0000  381.836   11.292  ?   ?  0.000000 11.29244 
1 1 1   26    9   14 o  179.231   12.483   24.919   3.4032   19.929   5.1108   28.894   4.5615  157.920   21.719  192.369   15.627 -34.44920 26.75639 
1 1 1   26    9   15 o  334.438   7.2803   85.865   3.7268   93.688   6.4444   81.933   4.5682  348.399   12.085  326.401   9.1436 21.99783 15.15402 
1 1 1   26    9   16 o  355.817   7.2376   97.201   3.9417   97.222   6.6352   97.189   4.9001  354.819   12.217  355.488   9.0056 -0.6695557 15.17774 
1 1 1   26    9   17 o   65.683   23.720   2.9167   3.0571   1.9157   4.8567   3.5736   3.9343   70.588   28.694   73.237   26.838 -2.648933 39.28899 
1 1 1   26    9   18 o  132.695   13.521   13.773   2.7079   11.860   5.2307   14.473   3.1651  119.008   28.985  135.611   15.528 -16.60285 32.88197 
1 1 1   26    9   19 o  151.325   12.590   17.832   2.8897   17.234   5.5678   18.052   3.3807  144.830   26.075  151.786   14.737 -6.956131 29.95173 
1 1 1   26    9   20 o  172.645   12.676   23.188   3.3264   16.640   9.5151   24.100   3.5504  137.621   41.625  175.886   13.286 -38.26451 43.69392 
1 1 1   26    9   21 o   66.532   23.559   3.1303   3.0009  -6.8959   9.4005   4.2680   3.1665   73.428   34.218   74.146   24.237 -0.7180099 41.93243 
1 1 1   26    9   22 o   93.556   13.966   6.9378   1.9387   6.1410   2.4177   8.3730   3.2448   86.868   18.734  101.062   21.630 -14.19360 28.61487 
1 1 1   26    9   23 o  196.864   8.3672   29.819   2.5213   34.802   3.3662   23.450   3.8053  212.379   10.355  173.084   14.497 39.29422 17.81545 
1 1 1   26    9   24 o   86.142   27.556   5.9725   4.1070   5.7430   8.2985   6.0469   4.7265   96.788   38.118   87.783   29.638 9.004959 48.28462 
1 1 1   26    9   25 o  279.321   8.9045   60.100   3.8070   62.778   4.6884   54.917   6.5227  285.054   10.746  264.572   16.185 20.48236 19.42720 
1 1 1   26    9   26 o   82.732   23.429   5.6373   3.1014   7.9036   4.0199   2.3049   4.8746   97.122   26.365   71.515   28.861 25.60746 39.09062 
1 1 1   26    9   27 o  198.959   9.2369   30.524   2.8129   29.283   4.6318   31.249   3.5407  192.875   15.829  200.556   11.583 -7.680786 19.61450 
1 1 1   26    9   28 o  107.885   16.693   9.3318   2.6675   10.642   4.7945   8.7446   3.2103  111.852   28.054  103.107   21.053 8.744316 35.07531 
1 1 1   26    9   29 o   40.886   19.511  -4.2564   3.4061  -3.9427   4.4825  -4.6851   5.2395   50.044   23.422   53.695   25.192 -3.651348 34.39835 
1 1 1   26    9   30 o  204.460   9.8911   32.306   3.0954   35.545   5.1681   30.494   3.8655  212.245   16.027  197.591   12.851 14.65369 20.54258 
1 1 1   26    9   31 f   79.661   18.035   5.2080   2.1479   2.8288   4.9968   5.7473   2.3789   73.528   29.380   83.535   19.030 -10.00709 35.00467 
1 1 1   26    9   32 o  236.894   8.2515   43.266   2.9920   42.212   5.7046   43.666   3.5141  231.053   16.233  237.663   9.6601 -6.610474 18.89013 
1 1 1   26    9   33 o   79.606   19.757   5.2544   2.3959   11.259   5.6440   3.9345   2.6462  113.156   31.453   69.914   22.093 43.24257 38.43673 
1 1 1   26    9   34 o  138.320   11.893   14.994   2.4934   18.378   5.9178   14.264   2.7493  146.706   27.360  134.415   13.548 12.29105 30.53079 
1 1 1   26    9   35 o   78.328   21.030   5.1297   2.5744   3.9905   12.343   5.1815   2.6323   99.734   43.362   78.690   21.324 21.04363 48.32126 
1 1 1   26    9   36 o  224.986   8.7391   39.140   3.0095   42.706   6.7259   38.247   3.3652  229.812   19.300  222.084   9.8996 7.728043 21.69044 
1 1 1   26    9   37 o   58.994   21.760   2.3908   2.5923   9.5837   5.5433   0.3774   2.9327  103.284   31.875   50.770   21.588 52.51425 38.49745 
1 1 1   26    9   38 f   42.128   18.972  -1.0117   2.5745   2.9950   5.2558  -2.2766   2.9531   73.549   29.868   41.433   19.265 32.11559 35.54193 
1 1 1   26    9   39 o   33.087   16.063  -4.0800   2.5530   4.9527   5.2594  -6.8645   2.9201   80.835   30.743   31.382   15.602 49.45303 34.47516 
1 1 1   26    9   40 o   78.624   24.176   5.3066   3.1922   9.8351   8.6977   4.6016   3.4317  103.216   39.467   74.525   25.254 28.69121 46.85543 
1 1 1   26    9   41 o   85.638   25.411   6.4790   3.5712   9.0574   6.2198   5.2109   4.3619   98.283   33.980   79.115   28.362 19.16777 44.26055 
1 1 1   26    9   42 o   82.122   23.883   5.9576   3.1822   2.7691   6.1311   7.1333   3.7229   74.094   31.346   88.971   25.820 -14.87733 40.61088 
1 1 1   26    9   43 o   64.078   22.912   3.2665   2.8451   1.0112   4.8251   4.4685   3.5225   62.835   27.215   72.645   25.546 -9.810585 37.32602 
1 1 1   26    9   44 f  118.168   16.356   11.572   2.8790   10.976   4.4942   11.987   3.7493  108.226   27.170  117.093   21.719 -8.867676 34.78436 
1 1 1   26    9   45 f   76.586   22.567   5.2546   2.8247   4.3774   4.5828   5.7921   3.5872   73.403   28.494   79.477   25.788 -6.073792 38.43128 
1 1 1   26   10    0 o   78.866   25.229   6.0742   2.6848   6.0742   2.6848   6.0742   2.6848   78.866   25.229   78.866   25.229 0.000000 0.000000 
1 1 1   26   10    1 o  171.201   8.4395   22.506   2.2115   21.769   3.5276   22.983   2.8387  167.338   13.898  172.490   10.806 -5.151505 17.60502 
1 1 1   26   10    2 o  126.376   7.8395   12.305   1.5090   0.0000   0.0000   12.305   1.5090  ?   ?   126.376   7.8395 0.000000 7.839547 
1 1 1   26   10    3 o   74.233   17.875   4.4497   2.0067   2.2833   4.1065   5.1293   2.3000   68.373   26.850   79.621   19.115 -11.24754 32.95919 
1 1 1   26   10    4 o  212.054   9.0597   34.549   2.9406   42.089   5.6623   31.764   3.4409  232.564   16.004  202.829   11.126 29.73460 19.49148 
1 1 1   26   10    5 o   59.724   20.171   2.6050   2.1892   3.8672   5.1143   2.3218   2.4223   80.140   30.354   58.935   21.134 21.20461 36.98721 
1 1 1   26   10    6 o  351.593   14.830   95.622   7.9808   95.622   7.9808   0.0000   0.0000  351.593   14.830  ?   ?  0.000000 14.82990 
1 1 1   26   10    7 o  204.216   9.3640   32.056   2.9270   35.008   4.6767   30.155   3.7529  212.297   14.479  197.351   12.488 14.94588 19.12040 
1 1 1   26   10    8 o  305.541   7.9280   71.673   3.7077   78.247   5.4884   66.154   5.0287  318.736   11.250  293.079   11.210 25.65686 15.88136 
1 1 1   26   10    9 o  333.566   7.7657   85.418   3.9649   92.122   5.7519   79.349   5.4729  345.895   10.864  320.971   11.140 24.92374 15.56048 
1 1 1   26   10   10 o  122.055   14.850   11.697   2.7171   9.6745   4.3345   13.007   3.4873  108.379   26.378  128.013   18.320 -19.63426 32.11599 
1 1 1   26   10   11 o  454.419   7.6153  158.531   5.2968  163.505   7.2808  152.938   7.7202  460.891   10.321  445.489   11.322 15.40121 15.32002 
1 1 1   26   10   12 o  275.490   10.025   58.407   4.2274   61.298   7.2404   56.912   5.2071  280.296   16.956  271.518   12.529 8.777191 21.08293 
1 1 1   26   10   13 o   48.081   21.054  -0.5788   2.9555   1.2040   4.4509  -1.9849   3.9527   65.739   27.177   51.610   23.350 14.12878 35.82983 
1 1 1   26   10   14 o  225.980   9.9295   39.308   3.4345   44.103   9.0601   38.504   3.7116  234.331   25.681  223.531   10.848 10.80000 27.87785 
1 1 1   26   10   15 o  124.617   15.508   12.235   2.8940   6.3942   8.7795   12.947   3.0653  101.631   39.443  128.134   15.976 -26.50307 42.55574 
1 1 1   26   10   16 o   43.865   19.523  -0.9191   2.6408   3.9538   9.0334  -1.3745   2.7614   95.221   38.968   43.343   19.571 51.87837 43.60677 
1 1 1   26   10   17 o  209.321   13.674   34.080   4.3569   40.903   9.4996   32.263   4.9030  223.897   28.355  203.061   15.902 20.83612 32.50954 
1 1 1   26   10   18 o  263.355   9.4742   53.401   3.8190   75.312   10.514   50.071   4.0990  307.757   22.476  254.835   10.509 52.92218 24.81117 
1 1 1   26   10   19 o  103.256   18.109   8.5736   2.7577   13.117   5.5037   7.0505   3.1865  124.928   29.291   92.559   22.672 32.36884 37.03993 
1 1 1   26   10   20 o   62.343   22.471   2.6423   2.7416   8.0743   5.5032   0.8490   3.1619   99.473   31.906   55.505   22.923 43.96776 39.28698 
1 1 1   26   10   21 o  125.405   15.262   12.412   2.8691   17.231   5.9021   10.921   3.2831  143.919   27.799  116.515   19.069 27.40374 33.71084 
1 1 1   26   10   22 f  127.506   10.496   12.629   2.0303   15.007   2.5653   8.6413   3.3217  138.734   12.205  102.623   21.819 36.11122 25.00039 
1 1 1   26   10   23 o  131.135   11.380   13.391   2.2616   16.559   2.9788   9.0801   3.4748  145.454   13.535  105.061   22.298 40.39293 26.08479 
1 1 1   26   10   24 f   69.402   21.621   3.8242   2.5437   6.7920   3.6243   0.9432   3.5709   90.481   25.224   58.611   24.295 31.87046 35.02123 
1 1 1   26   10   25 o  136.566   16.081   14.769   3.2970   23.260   7.0520   12.394   3.7297  166.795   28.655  123.653   20.419 43.14191 35.18579 
1 1 1   26   10   26 o  198.281   12.000   30.573   3.6246   32.764   4.6475   27.171   5.7912  204.410   14.958  183.893   20.948 20.51678 25.74066 
1 1 1   26   10   27 o  249.916   9.0569   48.155   3.4645   46.206   5.1603   49.754   4.6748  243.215   13.919  253.313   12.057 -10.09818 18.41519 
1 1 1   26   10   28 o  248.807   11.215   47.936   4.2710   48.571   5.3436   46.813   7.1068  249.244   14.064  242.428   19.312 6.816147 23.89085 
1 1 1   26   10   29 o   51.348   21.823   0.2689   2.9939  -4.7204   4.7349   3.5924   3.8645   50.146   23.658   72.156   26.575 -22.01068 35.57979 
1 1 1   26   10   30 o   76.213   24.238   4.6867   3.1810   9.7563   4.8469   0.8510   4.2160  106.569   28.959   61.972   26.093 44.59667 38.98000 
1 1 1   26   10   31 o  112.152   20.180   10.308   3.3369   5.1769   5.1385   14.050   4.3880   83.743   30.674  130.332   22.828 -46.58878 38.23609 
1 1 1   26   10   32 o  217.700   10.515   36.714   3.5039   38.903   5.8245   35.473   4.3865  221.202   17.342  212.741   13.541 8.460602 22.00227 
1 1 1   26   10   33 o  119.397   18.445   11.571   3.2623   16.584   5.8674   9.3274   3.9249  138.747   28.580  104.785   24.848 33.96162 37.87136 
1 1 1   26   10   34 o   99.865   21.736   8.3493   3.2282   7.8456   6.2492   8.5327   3.7702   96.851   34.027  100.029   24.758 -3.178108 42.08067 
1 1 1   26   10   35 o  127.076   14.318   12.835   2.7364   22.230   13.117   12.407   2.7980  145.416   49.372  124.708   14.957 20.70747 51.58771 
1 1 1   26   10   36 o   93.833   17.868   7.2429   2.4725   12.965   5.8046   5.9746   2.7328  120.003   31.282   84.172   21.218 35.83103 37.79886 
1 1 1   26   10   37 o  230.335   8.5695   41.050   3.0212   31.582   5.7016   44.746   3.5625  197.025   19.148  240.116   9.6931 -43.09119 21.46190 
1 1 1   26   10   38 f   48.879   20.500   0.5835   2.5858   4.7876   5.9044  -0.4142   2.8763   82.163   32.218   46.936   20.656 35.22704 38.27113 
1 1 1   26   10   39 o   98.369   18.411   8.0443   2.6702   8.8707   5.9622   7.8370   2.9864   98.580   33.288   96.078   20.902 2.502243 39.30597 
1 1 1   26   10   40 f  111.221   16.894   10.144   2.7856   13.174   4.9541   8.7440   3.3685  121.318   27.335  100.703   22.429 20.61513 35.35868 
1 1 1   26   10   41 o   84.467   25.784   6.3291   3.6388   2.9481   4.8493   10.686   5.5048   70.483   28.664  106.089   31.565 -35.60657 42.63748 
1 1 1   26   10   42 o   90.013   20.304   6.9850   2.7308   0.2803   4.8421   10.112   3.3069   60.970   26.817  108.589   20.651 -47.61824 33.84710 
1 1 1   26   10   43 o   51.781   22.080   0.6439   3.0837  -2.6234   5.6634   2.0208   3.6764   57.567   26.737   60.909   24.885 -3.342472 36.52635 
1 1 1   26   10   44 o   77.797   23.075   5.4200   2.9453  -2.7390   5.4594   8.7694   3.4980   55.884   26.054   98.583   23.512 -42.69847 35.09453 
1 1 1   26   10   45 f   66.209   23.680   3.6548   3.0389  -5.8341   5.5920   7.6315   3.6201   50.647   24.387   90.591   25.193 -39.94400 35.06293 
1 1 1   26   11    0 o  151.866   13.428   18.136   3.0652   18.136   3.0652   18.136   3.0652  151.866   13.428  151.866   13.428 0.000000 0.000000 
1 1 1   26   11    1 o  191.502   6.2812   28.120   1.8411   28.244   3.5772   28.076   2.1474  191.014   12.300  191.283   7.3345 -0.2682343 14.32120 
1 1 1   26   11    2 o   48.833   19.427   0.9910   2.1758   0.0000   0.0000   0.9910   2.1758  ?   ?    48.833   19.427 0.000000 19.42724 
1 1 1   26   11    3 o  192.431   8.7341   28.446   2.5725   31.341   4.3844   26.927   3.1769  200.848   14.356  186.671   11.170 14.17699 18.19007 
1 1 1   26   11    4 o  309.944   7.8656   73.747   3.7315   78.013   6.1092   71.208   4.7128  318.028   12.550  304.257   10.120 13.77173 16.12189 
1 1 1   26   11    5 f   80.579   19.279   5.2605   2.3459   3.2828   4.7193   5.9095   2.7036   75.797   29.051   85.282   20.880 -9.485611 35.77584 
1 1 1   26   11    6 o  111.542   31.168   10.296   5.5271   10.296   5.5271   0.0000   0.0000  111.542   31.168  ?   ?  0.000000 31.16804 
1 1 1   26   11    7 o  233.603   8.7437   41.929   3.1264   44.505   4.6953   39.877   4.1904  239.793   12.839  227.091   12.099 12.70238 17.64179 
1 1 1   26   11    8 o  127.691   14.311   12.765   2.7490   16.585   4.4559   10.419   3.4929  144.198   20.789  113.707   20.837 30.49020 29.43402 
1 1 1   26   11    9 o  117.102   16.171   10.834   2.8212   10.683   4.4448   10.936   3.6509  113.938   26.054  116.431   21.270 -2.492744 33.63322 
1 1 1   26   11   10 o  299.008   8.6368   68.704   3.9528   66.519   5.5848   70.897   5.5954  293.573   12.429  303.156   12.059 -9.582825 17.31709 
1 1 1   26   11   11 o  112.515   17.201   10.064   2.8682   11.352   4.3819   9.0982   3.7938  117.643   25.100  105.338   24.058 12.30419 34.76730 
1 1 1   26   11   12 o   63.154   23.665   2.4246   3.0902   4.1703   5.5974   1.6593   3.7062   83.032   31.682   63.022   25.260 20.01015 40.51948 
1 1 1   26   11   13 o  100.041   21.576   8.1561   3.2066   8.2011   4.7540   8.1184   4.3435   99.889   29.232   99.231   27.595 0.6581573 40.19961 
1 1 1   26   11   14 o  422.049   8.5209  136.928   5.5045  144.794   7.5306  127.904   8.0660  433.259   11.356  406.724   12.957 26.53510 17.22861 
1 1 1   26   11   15 o  196.542   10.015   29.827   3.0029   37.005   5.4075   26.626   3.6108  217.470   16.365  185.133   12.821 32.33766 20.78963 
1 1 1   26   11   16 f  194.473   10.204   29.220   3.0269   26.738   5.4422   30.331   3.6422  183.639   19.668  197.777   12.090 -14.13762 23.08612 
1 1 1   26   11   17 o  209.277   11.680   33.930   3.7265   37.332   5.8006   31.538   4.8627  217.950   17.536  200.680   15.963 17.27013 23.71369 
1 1 1   26   11   18 o  108.024   16.954   9.3142   2.7110   18.354   5.4503   6.3423   3.1250  150.036   24.585   87.833   22.980 62.20229 33.65271 
1 1 1   26   11   19 o  200.884   19.132   31.951   5.8115   31.951   5.8115   0.0000   0.0000  200.884   19.132  ?   ?  0.000000 19.13158 
1 1 1   26   11   20 f  149.610   13.518   17.494   3.0622   19.137   5.9359   16.899   3.5745  152.432   26.397  146.348   16.231 6.083542 30.98798 
1 1 1   26   11   21 o  239.745   9.8520   44.309   3.6153   49.278   6.8516   42.392   4.2560  250.120   18.017  233.812   11.932 16.30766 21.61021 
1 1 1   26   11   22 o  147.732   9.5139   16.888   2.1399   15.351   2.5921   20.179   3.7918  140.306   12.191  160.137   15.671 -19.83115 19.85405 
1 1 1   26   11   23 o  195.340   8.7782   29.384   2.6246   33.672   3.5176   23.998   3.9421  208.447   11.065  174.933   14.863 33.51385 18.52978 
1 1 1   26   11   24 o  151.454   12.374   17.891   2.8434   19.429   4.2291   16.623   3.8412  156.297   18.007  144.511   17.738 11.78561 25.27649 
1 1 1   26   11   25 o  138.871   16.102   15.275   3.3591   26.773   7.2192   12.098   3.7949  179.850   27.063  121.860   21.110 57.98979 34.32297 
1 1 1   26   11   26 f   49.084   20.869   0.1931   2.7401   5.9371   4.4202  -3.3917   3.4920   86.225   28.658   43.706   20.525 42.51909 35.24972 
1 1 1   26   11   27 o   63.960   23.765   2.6655   3.1035   4.0402   4.6967   1.6000   4.1349   77.691   29.163   64.594   26.391 13.09746 39.33160 
1 1 1   26   11   28 o  184.790   12.490   26.641   3.5119   32.870   5.9906   23.379   4.3349  202.712   19.549  171.747   16.701 30.96603 25.71203 
1 1 1   26   11   29 o   97.390   24.727   7.9864   3.6927   12.295   5.5487   4.5609   4.9474  119.167   30.341   80.638   29.997 38.52914 42.66605 
1 1 1   26   11   30 o   50.191   21.729  -0.1496   3.0733  -2.7659   4.9572   1.4839   3.9169   55.930   25.628   62.602   25.644 -6.671200 36.25491 
1 1 1   26   11   31 o   67.059   24.726   3.0772   3.3469   3.0442   5.2827   3.0993   4.3258   75.462   30.189   71.516   27.706 3.946136 40.97516 
1 1 1   26   11   32 o  296.446   8.6728   67.828   3.9353   73.063   6.4961   64.793   4.9461  305.667   13.885  288.932   11.184 16.73495 17.82886 
1 1 1   26   11   33 o  202.018   11.459   31.821   3.5286   29.492   6.2682   32.901   4.2693  189.855   21.976  204.624   13.710 -14.76970 25.90246 
1 1 1   26   11   34 o  257.452   9.7535   51.336   3.8435   52.685   6.6439   50.658   4.7120  257.237   16.969  254.940   12.075 2.297195 20.82718 
1 1 1   26   11   35 o   99.576   25.298   8.5403   3.8636   1.5322   13.172   9.1999   4.0413   96.597   43.252  103.237   25.681 -6.640610 50.30173 
1 1 1   26   11   36 o   55.534   22.884   1.1211   3.1419   4.0545   5.2775  -0.4894   3.9104   78.078   30.503   54.546   24.042 23.53156 38.83841 
1 1 1   26   11   37 o   95.398   23.077   7.8100   3.3329   2.2351   5.7217   10.673   4.1004   72.889   30.528  111.085   24.749 -38.19519 39.29984 
1 1 1   26   11   38 o  157.520   14.050   19.746   3.3520   22.088   5.2735   18.158   4.3419  162.585   21.735  148.376   19.598 14.20865 29.26583 
1 1 1   26   11   39 o   68.544   21.549   3.9065   2.5203  -6.2303   4.9827   7.3917   2.9216   47.878   23.045   93.143   20.995 -45.26583 31.17480 
1 1 1   26   11   40 o  189.036   11.247   28.093   3.2396   23.923   5.0032   31.103   4.2512  169.870   19.602  197.442   14.161 -27.57167 24.18238 
1 1 1   26   11   41 o   90.968   25.089   7.4109   3.6067   3.6575   4.7348   12.599   5.5669   72.597   28.729  115.127   30.931 -42.52919 42.21451 
1 1 1   26   11   42 o   79.492   21.304   5.5235   2.6447   2.2093   4.7701   6.9944   3.1778   66.678   27.896   88.685   23.159 -22.00702 36.25624 
1 1 1   26   11   43 o   42.580   19.249  -0.9405   2.6801   0.7394   4.8790  -1.6665   3.2074   61.906   27.081   44.494   20.471 17.41246 33.94777 
1 1 1   26   11   44 o   61.114   22.571   2.8861   2.7911   0.0545   4.9576   4.2002   3.3772   59.909   26.701   70.199   24.978 -10.28990 36.56252 
1 1 1   26   12    0 o  299.137   6.7439   68.667   3.0843   68.667   3.0843   68.667   3.0843  299.137   6.7439  299.137   6.7439 0.000000 0.000000 
1 1 1   26   12    1 o  265.063   4.7998   53.833   1.9474   53.292   2.7421   54.384   2.7660  263.570   6.7970  266.259   6.7870 -2.688354 9.605383 
1 1 1   26   12    2 o   80.466   16.249   5.1977   1.9324  -0.0551   3.0882   8.5777   2.4772   51.342   22.000  104.010   16.079 -52.66792 27.24928 
1 1 1   26   12    3 o  175.384   9.4916   23.719   2.5385   28.912   4.0813   20.442   3.2419  192.915   13.915  162.185   13.173 30.72992 19.16156 
1 1 1   26   12    4 o  185.549   9.8480   26.556   2.7869   28.263   4.5676   25.543   3.5175  190.299   15.825  181.487   12.743 8.812073 20.31796 
1 1 1   26   12    5 o  261.832   13.805   53.138   5.5130   53.138   5.5130   0.0000   0.0000  261.832   13.805  ?   ?  0.000000 13.80480 
1 1 1   26   12    6 o  135.910   14.327   14.445   2.9355   13.223   5.1850   15.021   3.5613  126.636   27.535  137.984   17.238 -11.34798 32.48547 
1 1 1   26   12    7 o  160.360   11.536   19.923   2.8127   23.323   4.1960   17.148   3.7903  172.653   16.062  147.582   17.096 25.07144 23.45753 
1 1 1   26   12    8 o  193.607   10.745   28.957   3.1716   29.784   4.6779   28.254   4.3147  195.325   15.782  190.410   14.924 4.914810 21.72054 
1 1 1   26   12    9 o  164.764   12.385   21.070   3.1006   27.788   4.6183   15.557   4.1838  188.508   16.162  139.655   20.156 48.85266 25.83547 
1 1 1   26   12   10 o  282.339   12.791   61.580   5.5279   0.0000   0.0000   61.580   5.5279  ?   ?   282.339   12.791 0.000000 12.79136 
1 1 1   26   12   11 o  177.669   12.259   24.484   3.3135   32.051   4.9319   18.258   4.4736  202.513   16.042  151.544   19.756 50.96893 25.44888 
1 1 1   26   12   12 o  279.709   10.936   60.308   4.6819   70.963   8.1245   55.011   5.7288  301.179   17.702  266.148   14.113 35.03162 22.63911 
1 1 1   26   12   13 o  233.471   11.113   42.036   3.9713   47.304   5.5336   36.442   5.7029  246.536   14.732  215.520   17.437 31.01553 22.82701 
1 1 1   26   12   14 o  178.512   13.472   24.806   3.6539   25.897   5.0467   23.604   5.2972  181.110   18.464  172.206   20.500 8.903763 27.58867 
1 1 1   26   12   15 o  322.626   9.5815   80.141   4.7315   84.906   6.4646   74.643   6.9439  331.313   12.748  310.125   14.628 21.18768 19.40339 
1 1 1   26   12   16 o  225.433   12.310   39.406   4.2316   39.308   5.9040   39.510   6.0681  223.719   17.378  224.143   17.835 -0.4243011 24.90099 
1 1 1   26   12   17 o   97.357   22.320   7.7868   3.2551   3.5588   5.3211   10.315   4.1148   78.993   30.693  111.723   24.717 -32.72948 39.40809 
1 1 1   26   12   18 o  255.304   8.8125   50.159   3.4437   59.259   6.5434   46.673   4.0499  275.473   15.583  245.941   10.758 29.53181 18.93568 
1 1 1   26   12   19 o   47.914   20.371   0.1389   2.6105   9.6492   5.6245  -2.4724   2.9472  107.217   31.907   41.501   19.280 65.71605 37.27982 
1 1 1   26   12   20 o  222.264   9.8261   38.081   3.3429   63.007   6.8140   30.180   3.8362  283.897   15.743  196.980   12.793 86.91669 20.28526 
1 1 1   26   12   21 o   47.571   20.604  -0.2396   2.7655  -2.4499   5.8097   0.4080   3.1446   62.670   28.335   53.373   22.507 9.297153 36.18610 
1 1 1   26   12   22 o  138.081   10.740   14.813   2.2520   17.599   2.9454   10.893   3.4940  150.104   12.946  115.825   20.456 34.27885 24.20873 
1 1 1   26   12   23 f  175.622   10.198   23.885   2.7296   24.323   3.7907   23.413   3.9337  176.282   14.169  172.693   15.032 3.588165 20.65681 
1 1 1   26   12   24 o  204.396   10.285   32.340   3.2073   38.349   5.0101   28.168   4.1748  221.302   14.877  189.635   14.493 31.66727 20.76953 
1 1 1   26   12   25 o  123.328   18.275   12.217   3.3454   12.767   7.5785   12.084   3.7283  120.755   37.270  121.857   20.732 -1.102394 42.64825 
1 1 1   26   12   26 o  308.561   10.595   73.612   5.0041   84.214   6.6944   60.187   7.5334  329.077   13.291  275.880   17.938 53.19745 22.32494 
1 1 1   26   12   27 o   98.357   21.827   8.0149   3.2001   8.4151   5.7471   7.8350   3.8527  100.228   32.647   96.481   25.648 3.747345 41.51662 
1 1 1   26   12   28 o  143.565   15.694   16.334   3.3925   20.348   5.8741   14.325   4.1556  156.530   25.387  132.469   21.211 24.06096 33.08185 
1 1 1   26   12   29 o   78.314   23.248   5.0489   2.9886   0.6008   5.7716   6.6785   3.4934   69.856   30.008   89.214   24.726 -19.35791 38.88278 
1 1 1   26   12   30 o   67.043   23.837   3.2676   3.0752   4.1366   5.8925   2.9423   3.6050   81.994   32.175   67.553   25.509 14.44047 41.06049 
1 1 1   26   12   31 o  152.297   16.567   18.484   3.7996   20.880   5.8092   16.693   5.0230  158.374   24.776  141.629   24.030 16.74507 34.51513 
1 1 1   26   12   32 o  215.667   11.886   36.288   3.9085   34.220   6.2486   37.617   5.0095  205.821   20.091  218.342   15.082 -12.52153 25.12180 
1 1 1   26   12   33 o   89.479   24.772   6.8048   3.5085   4.2320   6.1817   8.0273   4.2613   82.637   32.787   96.501   27.510 -13.86358 42.79895 
1 1 1   26   12   34 o   35.495   17.536  -7.3517   3.4761  -6.7017   5.6723  -7.7426   4.3988   52.107   24.951   41.939   20.518 10.16794 32.30442 
1 1 1   26   12   35 o  147.296   18.909   17.671   4.1646   0.0000   0.0000   17.671   4.1646  ?   ?   147.296   18.909 0.000000 18.90858 
1 1 1   26   12   36 o   90.251   23.535   6.9933   3.2848   1.5937   5.5756   9.8637   4.0652   70.395   29.843  106.625   25.291 -36.22961 39.11792 
1 1 1   26   12   37 o   31.865   15.870  -7.4601   3.0763  -9.5113   4.7609  -5.9898   4.0307   41.645   20.564   41.855   20.288 -0.2100601 28.88722 
1 1 1   26   12   38 o   91.967   23.567   7.3347   3.3326   1.4008   4.9504   12.253   4.5068   66.277   28.110  118.305   25.629 -52.02802 38.03946 
1 1 1   26   12   39 o  138.118   15.829   15.430   3.2860   11.564   4.8505   18.710   4.4674  113.068   28.139  150.020   19.950 -36.95204 34.49338 
1 1 1   26   12   40 o   90.511   26.784   7.3755   3.9716   5.2009   4.6360   13.374   7.6996   79.362   29.125  114.512   37.812 -35.15043 47.72883 
1 1 1   26   12   41 o   62.252   23.759   2.7167   3.1483   2.6421   4.5533   2.7851   4.3579   67.668   27.676   67.460   27.266 0.2076492 38.85130 
1 1 1   26   12   42 o  103.934   21.546   9.4257   3.3150   8.5037   4.9093   10.198   4.4945   94.306   30.124  104.396   27.678 -10.09028 40.90846 
1 1 1   26   12   43 o   64.673   25.484   2.9024   3.7111   2.7271   5.0999   3.0997   5.4104   69.003   28.854   71.299   29.759 -2.295219 41.45043 
1 1 1   26   12   44 o   48.118   21.032   0.0706   2.9373   4.2762   5.1553  -1.9510   3.5742   74.283   29.785   46.167   21.372 28.11588 36.65920 
1 1 1   26   13    0 o  244.882   7.2256   46.078   2.7030   46.078   2.7030   46.078   2.7030  244.882   7.2256  244.882   7.2256 0.000000 0.000000 
1 1 1   26   13    1 o  201.973   7.3766   31.311   2.2805   30.089   2.9716   33.063   3.5569  197.768   9.8167  206.839   11.277 -9.071716 14.95140 
1 1 1   26   13    2 o  187.162   6.4379   26.869   1.8443   26.967   2.1733   26.616   3.4865  187.423   7.5756  185.320   12.362 2.103043 14.49891 
1 1 1   26   13    3 o  336.374   5.6618   86.744   2.9151   86.640   3.4578   87.001   5.4200  336.051   6.7224  336.150   10.534 -0.9906006E-01 12.49622 
1 1 1   26   13    4 o   57.093   20.833   2.1027   2.3670   0.9797   3.7751   2.8301   3.0384   60.608   25.040   65.232   23.634 -4.623707 34.43192 
1 1 1   26   13    5 o  292.636   12.923   66.145   5.7884   66.145   5.7884   0.0000   0.0000  292.636   12.923  ?   ?  0.000000 12.92303 
1 1 1   26   13    6 o  184.613   11.684   26.386   3.2846   29.421   5.2335   24.414   4.2190  193.564   17.866  176.706   15.764 16.85724 23.82664 
1 1 1   26   13    7 o  221.978   9.4003   37.900   3.1939   37.761   4.4245   38.051   4.6153  220.660   13.160  221.392   13.687 -0.7321014 18.98702 
1 1 1   26   13    8 o  171.312   11.694   22.740   3.0480   27.176   4.4593   18.851   4.1756  186.466   15.772  154.524   17.991 31.94189 23.92574 
1 1 1   26   13    9 o  118.448   16.532   11.110   2.9156   9.9689   4.2019   12.169   4.0488  109.968   25.465  122.531   22.414 -12.56335 33.92427 
1 1 1   26   13   10 o  164.494   12.487   21.020   3.1205   28.304   4.5804   14.710   4.2628  190.239   15.875  135.303   21.286 54.93631 26.55435 
1 1 1   26   13   11 o  167.390   12.895   21.788   3.2784   25.484   4.7334   18.381   4.5450  180.014   17.396  151.890   20.039 28.12360 26.53606 
1 1 1   26   13   12 o  154.437   16.551   18.770   3.8514   16.282   6.4765   20.131   4.7904  139.169   31.177  158.994   20.136 -19.82425 37.11433 
1 1 1   26   13   13 o  159.815   15.347   20.019   3.7079   27.741   5.1846   11.934   5.3051  187.529   18.296  119.343   29.266 68.18599 34.51397 
1 1 1   26   13   14 o  223.243   11.795   38.600   4.0160   39.532   5.4545   37.496   5.9348  224.839   15.953  218.334   17.917 6.505066 23.98969 
1 1 1   26   13   15 o   51.451   22.890  -1.1508   3.6263  -7.5484   5.1569   5.1067   5.1002   48.325   23.307   84.753   30.633 -36.42815 38.49129 
1 1 1   26   13   16 o  532.305   8.5118  217.947   6.9351  248.781   9.5365  183.338   10.104  567.768   10.974  486.329   13.573 81.43860 17.45397 
1 1 1   26   13   17 o  122.009   29.177   12.527   5.3752   12.527   5.3752   0.0000   0.0000  122.009   29.177  ?   ?  0.000000 29.17664 
1 1 1   26   13   18 o   48.959   20.641   0.3040   2.6437  -5.4454   5.4128   2.1051   3.0296   53.756   25.341   60.807   23.283 -7.050930 34.41319 
1 1 1   26   13   19 o  164.564   12.464   21.082   3.1161   25.320   6.0626   19.561   3.6327  177.160   22.893  157.814   15.228 19.34599 27.49511 
1 1 1   26   13   20 o   78.580   22.492   5.0374   2.8427   4.0616   5.4975   5.3935   3.3211   81.405   31.318   81.504   24.578 -0.9918213E-01 39.81097 
1 1 1   26   13   21 o   84.199   22.211   5.8404   2.9037   17.206   5.9005   2.2084   3.3356  143.476   27.873   62.996   24.350 80.48005 37.01106 
1 1 1   26   13   22 o  297.164   7.6087   67.903   3.4608   74.671   4.9288   61.320   4.8605  310.997   10.354  281.599   11.277 29.39795 15.30917 
1 1 1   26   13   23 o  298.690   8.7220   68.718   3.9876   84.036   6.5008   59.477   5.0490  329.057   12.907  277.119   11.903 51.93814 17.55787 
1 1 1   26   13   24 o  344.572   8.1273   91.392   4.2864  112.221   6.8595   78.048   5.4904  380.622   11.774  317.574   11.295 63.04840 16.31595 
1 1 1   26   13   25 o  209.501   14.421   34.374   4.5962   43.413   6.0041   21.581   7.1432  234.625   16.831  159.292   30.407 75.33325 34.75385 
1 1 1   26   13   26 o  224.618   10.751   39.032   3.6963   45.881   6.2990   35.436   4.5649  240.959   17.192  212.759   14.098 28.20038 22.23271 
1 1 1   26   13   27 o  119.390   19.202   11.552   3.3901   10.672   5.9535   11.973   4.1239  110.913   32.785  120.170   23.261 -9.256805 40.19890 
1 1 1   26   13   28 o   87.721   24.416   6.4394   3.3987   4.2059   5.9420   7.5253   4.1433   82.662   32.346   94.367   27.197 -11.70557 42.26036 
1 1 1   26   13   29 o   62.814   23.439   2.5701   3.0250   0.3752   5.8339   3.3772   3.5377   69.438   30.000   69.557   25.456 -0.1187057 39.34450 
1 1 1   26   13   30 o   48.563   21.533  -0.8057   3.1832   5.3243   6.1786  -3.0208   3.7141   87.276   33.290   46.243   21.536 41.03392 39.64876 
1 1 1   26   13   31 o   57.801   23.224   1.5108   3.1412  -0.9133   6.7455   2.1820   3.5495   70.344   31.261   63.389   24.941 6.954525 39.99100 
1 1 1   26   13   32 o  146.770   14.906   17.087   3.3022   18.537   6.1520   16.500   3.9139  146.726   28.419  142.948   18.309 3.778137 33.80632 
1 1 1   26   13   33 o  114.288   20.371   10.791   3.4329   5.0022   6.9882   12.632   3.9412   87.590   34.826  123.320   21.671 -35.72997 41.01764 
1 1 1   26   13   34 o  227.484   10.802   40.234   3.7612   38.353   6.2741   41.289   4.6992  217.857   19.006  229.095   13.460 -11.23747 23.28922 
1 1 1   26   13   35 o  228.713   15.012   41.506   5.2262   15.576   12.802   46.692   5.7249  124.472   47.815  242.342   15.515 -117.8704 50.26897 
1 1 1   26   13   36 o  111.673   21.748   10.530   3.5836   10.556   5.0160   10.503   5.1216  108.334   29.469  107.870   29.954 0.4642868 42.01942 
1 1 1   26   13   37 o   56.620   23.826   0.8948   3.5121  -0.9406   4.9026   2.8297   5.0338   59.044   26.416   71.793   29.201 -12.74940 39.37661 
1 1 1   26   13   38 o   38.565   18.519  -4.1293   3.1738  -3.1768   4.7857  -4.8771   4.2404   52.581   24.474   45.311   21.664 7.270519 32.68480 
1 1 1   26   13   39 o   50.937   23.122  -1.4492   3.9148  -5.3523   4.5150   10.372   7.8574   46.139   22.138  103.633   37.935 -57.49368 43.92213 
1 1 1   26   13   40 o  151.616   14.869   18.555   3.4062   15.802   4.6853   21.641   4.9607  134.737   23.577  160.159   20.722 -25.42184 31.38915 
1 1 1   26   13   41 o   72.381   24.562   4.4781   3.2463   3.7713   4.6366   5.1578   4.5467   72.192   28.473   78.057   28.812 -5.865532 40.50780 
1 1 1   26   13   42 o   68.707   25.656   3.7469   3.6256  -0.8948   4.8424   9.6680   5.4692   57.155   25.852   98.910   31.816 -41.75542 40.99552 
1 1 1   26   13   43 o  103.674   22.468   9.5714   3.4625   7.3741   5.0316   11.548   4.7720   87.642   30.547  109.932   28.217 -22.29010 41.58546 
1 1 1   26   14    0 o  202.102   8.2303   31.474   2.5364   31.474   2.5364   31.474   2.5364  202.102   8.2303  202.102   8.2303 0.000000 0.000000 
1 1 1   26   14    1 o  168.960   7.4129   21.916   1.9171   22.169   2.3221   21.374   3.3975  169.576   8.9783  165.727   13.511 3.848663 16.22216 
1 1 1   26   14    2 o  228.145   6.3615   39.927   2.2215   41.725   2.6640   35.820   4.0249  233.127   7.4657  215.082   12.277 18.04510 14.36866 
1 1 1   26   14    3 o  110.988   9.7394   9.5501   1.6378   9.5398   1.8909   9.5810   3.2772  110.677   11.321  108.940   20.404 1.737206 23.33402 
1 1 1   26   14    4 o  166.938   7.1667   21.391   1.8312   23.965   2.0897   12.875   3.8013  176.653   7.7284  126.742   20.278 49.91095 21.70116 
1 1 1   26   14    5 o  230.670   14.355   41.364   5.0431   41.364   5.0431   0.0000   0.0000  230.670   14.355  ?   ?  0.000000 14.35463 
1 1 1   26   14    6 o  103.280   19.309   8.5970   2.9402   21.308   4.7447   0.6736   3.7461  164.019   19.266   59.092   24.721 104.9274 31.34210 
1 1 1   26   14    7 o  272.682   9.8651   57.238   4.1174   59.557   6.2911   55.500   5.4458  276.736   14.907  267.879   13.282 8.856262 19.96563 
1 1 1   26   14    8 o   77.406   22.679   4.8232   2.8600   7.5115   4.0042   2.0235   4.0864   95.541   26.470   66.799   26.608 28.74217 37.53175 
1 1 1   26   14    9 o  110.823   18.250   9.8299   2.9880   9.3435   4.1885   10.334   4.2639  106.252   25.973  111.878   25.471 -5.625862 36.37785 
1 1 1   26   14   10 f  156.191   13.539   19.024   3.2048   21.482   4.5188   16.536   4.5458  164.876   18.210  143.509   21.345 21.36682 28.05730 
1 1 1   26   14   11 o  174.369   14.855   23.765   3.9269   29.223   6.8246   21.063   4.8013  190.587   23.922  162.781   19.669 27.80643 30.96956 
1 1 1   26   14   12 o  116.902   19.265   10.976   3.3270   9.3167   4.7016   12.640   4.7086  105.695   28.438  123.756   25.698 -18.06129 38.32894 
1 1 1   26   14   13 o   52.836   22.931  -0.3352   3.4395  -1.9887   4.5846   1.7938   5.2021   56.090   25.282   71.850   29.507 -15.76007 38.85689 
1 1 1   26   14   14 o  141.025   17.637   15.771   3.7238   15.669   4.9466   15.906   5.6571  138.529   24.210  138.403   27.671 0.1265259 36.76756 
1 1 1   26   14   15 f   60.796   24.501   1.4949   3.5076   2.1158   4.7166   0.7265   5.2467   70.400   28.397   68.383   28.967 2.016388 40.56472 
1 1 1   26   14   16 o  243.765   16.217   46.526   6.0164   46.526   6.0164   0.0000   0.0000  243.765   16.217  ?   ?  0.000000 16.21734 
1 1 1   26   14   17 o  128.681   20.176   13.333   3.8432   20.675   5.4299   5.9632   5.4405  159.916   22.832   89.424   31.715 70.49187 39.07861 
1 1 1   26   14   18 o  161.598   17.293   20.651   4.2109   29.176   5.9898   12.320   5.9212  191.141   20.809  120.213   31.719 70.92851 37.93625 
1 1 1   26   14   19 o  131.119   14.834   13.544   2.9248   20.048   5.8394   11.366   3.3792  156.327   25.266  118.782   19.245 37.54556 31.76048 
1 1 1   26   14   20 o  204.579   10.951   32.426   3.4167   27.287   6.1870   34.681   4.0983  183.978   22.435  211.143   12.741 -27.16531 25.80071 
1 1 1   26   14   21 o  188.857   9.5871   27.571   2.7623   32.539   3.9523   22.828   3.8621  204.473   12.691  170.538   14.946 33.93518 19.60746 
1 1 1   26   14   22 o   47.539   20.305   0.0712   2.6155   2.2810   4.2450  -1.2810   3.3207   68.199   27.134   48.357   21.680 19.84195 34.73172 
1 1 1   26   14   23 o  153.176   14.136   18.416   3.2769   23.501   6.1818   16.429   3.8645  169.360   24.564  143.479   17.992 25.88098 30.44853 
1 1 1   26   14   24 o   96.271   32.462   7.5310   5.6700   4.3726   10.642   8.7829   6.7001   99.355   41.624  103.304   35.286 -3.949242 54.56805 
1 1 1   26   14   25 o   80.259   23.910   5.2870   3.1571   9.2672   5.6357   3.4667   3.8112  104.302   32.131   71.412   26.375 32.88966 41.57020 
1 1 1   26   14   26 o  190.306   12.437   28.246   3.6027   29.961   6.2774   27.404   4.3994  192.479   21.685  186.452   15.557 6.026276 26.68834 
1 1 1   26   14   27 f  260.303   10.300   52.408   4.1039   58.799   6.8987   48.907   5.1056  272.979   16.590  250.219   13.379 22.76018 21.31238 
1 1 1   26   14   28 o  314.608   10.840   76.675   5.2201   79.084   7.3685   74.248   7.3964  317.686   15.153  307.145   15.786 10.54150 21.88217 
1 1 1   26   14   29 o   56.630   22.771   1.4064   3.0225   4.4010   6.0421   0.4069   3.4906   83.442   32.627   55.438   23.562 28.00390 40.24535 
1 1 1   26   14   30 o  152.940   14.480   18.476   3.3493   18.098   6.5034   18.612   3.9073  144.282   30.407  152.622   17.016 -8.339569 34.84426 
1 1 1   26   14   31 o   87.543   23.849   6.4723   3.2824   6.0553   6.6883   6.6047   3.7672   90.902   34.645   88.319   26.072 2.583580 43.35941 
1 1 1   26   14   32 o  100.192   22.685   8.4642   3.3981   4.6044   6.4698   9.9345   3.9932   84.786   33.573  107.969   24.699 -23.18348 41.67913 
1 1 1   26   14   33 o  188.285   11.821   27.740   3.3895   25.435   5.4297   29.212   4.3387  176.443   20.486  192.025   14.878 -15.58153 25.31865 
1 1 1   26   14   34 o  193.113   11.471   29.171   3.3754   22.086   4.9998   35.105   4.5755  164.093   20.343  210.699   14.272 -46.60590 24.84969 
1 1 1   26   14   35 o  198.137   14.341   31.135   4.3200   25.120   12.426   31.961   4.6074  151.972   47.860  200.370   15.134 -48.39772 50.19600 
1 1 1   26   14   36 o  146.834   14.657   17.222   3.2502   15.677   4.7447   18.587   4.4612  135.626   23.720  150.068   19.914 -14.44229 30.97064 
1 1 1   26   14   37 o  127.780   17.757   13.371   3.3792   7.9036   4.9948   17.986   4.5888   93.910   30.426  146.737   21.032 -52.82750 36.98773 
1 1 1   26   14   38 o   49.064   22.698  -2.4587   4.0222   1.9252   4.7788 -13.1103   7.4489   66.908   27.950   52.415   25.852 14.49262 38.07315 
1 1 1   26   14   39 o   81.255   25.722   5.8055   3.5856   5.5613   4.7129   6.1412   5.5250   81.087   29.426   84.940   31.680 -3.853523 43.23743 
1 1 1   26   14   40 o   96.840   24.114   8.3729   3.5606   8.2930   4.4762   8.5105   5.8756   94.393   28.549   94.460   33.005 -0.6757355E-01 43.63936 
1 1 1   26   14   41 o   77.257   25.176   5.2948   3.4176   3.6924   4.2841   8.0991   5.6674   70.533   27.503   91.856   32.392 -21.32298 42.49314 
1 1 1   26   14   42 o   74.341   24.283   4.8942   3.1788  -0.2917   4.3494   10.840   4.6573   55.968   24.972  106.772   28.111 -50.80372 37.60101 
1 1 1   26   15    0 f  159.454   14.623   20.066   3.4999   20.066   3.4999   20.066   3.4999  159.454   14.623  159.454   14.623 0.000000 0.000000 
1 1 1   26   15    1 o   57.856   17.606   2.6244   1.6985   1.7371   2.0142   4.8084   3.1599   52.336   19.199   77.841   24.073 -25.50487 30.79149 
1 1 1   26   15    2 o  248.161   6.6091   47.256   2.5104   48.809   3.0103   43.707   4.5493  252.077   7.8019  237.527   12.558 14.55013 14.78394 
1 1 1   26   15    3 o  154.266   8.6418   18.352   2.0323   20.679   2.3935   12.339   3.8474  163.646   9.5976  123.728   21.071 39.91795 23.15354 
1 1 1   26   15    4 o  276.299   7.4969   58.626   3.1705   58.626   3.1705   0.0000   0.0000  276.299   7.4969  ?   ?  0.000000 7.496889 
1 1 1   26   15    5 o  167.305   7.9214   21.505   2.0285   21.895   2.2806   20.028   4.4392  168.502   8.8737  159.071   18.583 9.430847 20.59258 
1 1 1   26   15    6 o  134.994   15.889   14.352   3.2202   14.052   4.5825   14.644   4.5260  131.409   23.653  134.478   22.803 -3.068146 32.85473 
1 1 1   26   15    7 o  128.401   15.363   12.980   2.9595   11.884   3.8957   14.475   4.5509  121.103   21.819  133.567   23.096 -12.46456 31.77281 
1 1 1   26   15    8 o  342.617   9.5146   90.360   4.9897   97.410   7.4513   84.629   6.7184  354.624   13.728  330.670   13.274 23.95380 19.09565 
1 1 1   26   15    9 o  242.770   11.541   45.498   4.2884   48.338   6.5931   43.416   5.6460  248.280   17.460  235.778   15.735 12.50130 23.50429 
1 1 1   26   15   10 o  122.429   18.007   11.950   3.2735   14.184   4.4036   9.1914   4.8940  132.253   22.563  104.987   29.326 27.26582 37.00171 
1 1 1   26   15   11 o  225.784   13.408   39.622   4.6130   44.611   7.6420   36.762   5.7861  236.966   21.297  216.236   17.636 20.73018 27.65092 
1 1 1   26   15   12 o  252.031   10.987   49.015   4.2386   52.830   5.5525   43.689   6.5615  260.637   13.969  235.558   18.343 25.07899 23.05653 
1 1 1   26   15   13 o   58.286   24.412   0.6705   3.6588   1.9149   4.8191  -1.0230   5.6220   70.186   28.562   65.388   28.823 4.797668 40.57823 
1 1 1   26   15   14 o   52.500   23.201  -0.9146   3.6651   0.7543   4.7885  -3.2752   5.6951   65.800   27.762   60.194   27.540 5.606728 39.10485 
1 1 1   26   15   15 o  120.452   22.168   11.824   3.9364   11.778   5.1617   11.887   6.0856  118.337   28.775  118.177   32.589 0.1601410 43.47469 
1 1 1   26   15   16 o  245.637   16.003   47.240   5.9841   47.240   5.9841   0.0000   0.0000  245.637   16.003  ?   ?  0.000000 16.00347 
1 1 1   26   15   17 o  256.063   12.077   50.737   4.7336   57.450   6.3313   42.230   7.1280  271.163   15.317  230.458   20.419 40.70459 25.52503 
1 1 1   26   15   18 o   55.476   24.405  -0.7598   4.0119   0.4194   5.3494  -2.2757   6.0652   67.766   28.994   64.585   29.099 3.180817 41.07742 
1 1 1   26   15   19 o  262.336   12.220   53.298   4.9068   63.099   6.5918   41.119   7.3482  284.137   15.212  226.771   21.424 57.36612 26.27533 
1 1 1   26   15   20 o  128.738   11.086   12.904   2.1633   13.589   2.2938   7.3881   6.5060  132.061   11.461   97.659   34.677 34.40234 36.52218 
1 1 1   26   15   21 o   73.385   21.670   4.3660   2.6022   4.2054   3.7743   4.5116   3.5926   75.373   26.446   76.526   25.840 -1.153496 36.97404 
1 1 1   26   15   22 o  152.751   18.745   18.651   4.2908   14.084   5.1698   28.762   7.6921  129.529   26.953  186.028   27.873 -56.49881 38.77325 
1 1 1   26   15   23 o  173.721   18.867   24.086   4.9362   26.776   6.5190   20.470   7.5570  181.035   24.127  153.749   33.092 27.28587 40.95350 
1 1 1   26   15   24 o  177.105   15.666   24.732   4.2029   0.0000   0.0000   24.732   4.2029  ?   ?   177.105   15.666 0.000000 15.66587 
1 1 1   26   15   25 o  108.070   20.136   9.5531   3.2082   8.8052   5.3140   9.9821   4.0244  101.736   31.177  109.081   24.680 -7.344513 39.76373 
1 1 1   26   15   26 o   43.200   20.021  -2.4349   3.1495   2.6302   5.2673  -5.2536   3.9293   74.155   29.975   43.048   20.654 31.10725 36.40187 
1 1 1   26   15   27 o   83.617   24.376   5.8160   3.3114   12.944   5.7566   2.2911   4.0483  121.951   30.825   66.764   26.519 55.18688 40.66198 
1 1 1   26   15   28 o   80.297   26.473   5.1896   3.7746   5.6740   5.7570   4.8244   4.9991   87.558   32.401   81.722   30.203 5.836243 44.29463 
1 1 1   26   15   29 f  163.767   15.520   21.250   3.8439   14.699   6.1400   25.473   4.9294  129.352   31.341  178.290   18.324 -48.93791 36.30473 
1 1 1   26   15   30 o   94.747   22.700   7.5535   3.2489   14.422   6.3405   5.1081   3.7833  127.285   32.447   79.561   26.516 47.72321 41.90388 
1 1 1   26   15   31 o  139.244   15.486   15.448   3.2447   11.201   5.6215   17.570   3.9734  112.338   31.448  147.651   17.951 -35.31333 36.21090 
1 1 1   26   15   32 o  172.473   12.856   23.380   3.3696   17.456   5.3489   27.278   4.3388  143.493   25.277  185.330   15.435 -41.83653 29.61736 
1 1 1   26   15   33 o   96.031   21.014   7.7463   3.0031   19.705   4.7006  -0.5006   3.9036  154.977   20.304   54.535   24.030 100.4417 31.45917 
1 1 1   26   15   34 o   59.995   23.511   2.0671   3.1427  -1.2791   4.9872   4.2710   4.0473   58.950   26.489   74.887   27.255 -15.93719 38.00632 
1 1 1   26   15   35 o  178.310   14.629   25.307   3.9575   22.548   7.8576   26.245   4.5809  156.007   33.877  180.536   16.769 -24.52895 37.79976 
1 1 1   26   15   36 o   56.287   22.914   1.4102   3.1026   3.8027   4.8302  -0.2703   4.0482   74.780   29.191   55.785   24.529 18.99505 38.12840 
1 1 1   26   15   37 o   84.176   25.941   6.1891   3.6731   6.1475   4.9138   6.2417   5.5295   84.961   30.140   86.330   31.790 -1.368530 43.80658 
1 1 1   26   15   38 o   72.323   24.856   4.3313   3.3259   2.3195   4.8718   6.0873   4.5515   68.398   28.367   83.628   29.058 -15.23037 40.60888 
1 1 1   26   15   39 o   66.959   26.179   3.0604   3.8898   1.9050   4.5923   5.9942   7.3177   65.220   27.334   86.981   35.271 -21.76080 44.62283 
1 1 1   26   15   40 o   87.968   23.287   6.8960   3.1847   5.4485   4.3189   8.6211   4.7150   79.045   28.234   95.439   29.388 -16.39373 40.75262 
1 1 1   26   15   41 o   80.096   25.235   5.7973   3.4542   5.7051   4.3305   5.9586   5.7272   79.825   28.297   82.610   31.914 -2.785683 42.65247 
1 1 1   26   15   42 o   85.260   25.122   6.6909   3.5005   7.3996   4.4233   5.5032   5.7261   88.145   28.638   80.302   31.652 7.842484 42.68443 
1 1 1   26   16    0 o  643.263   11.796  318.394   11.605  318.394   11.605  318.394   11.605  643.263   11.796  643.263   11.796 0.000000 0.000000 
1 1 1   26   16    1 f  126.210   21.979   12.894   4.0916   0.0000   0.0000   12.894   4.0916  ?   ?   126.210   21.979 0.000000 21.97885 
1 1 1   26   16    2 o  230.090   7.5441   40.664   2.6569   39.272   3.1254   44.291   5.0451  225.939   9.0375  238.720   13.867 -12.78064 16.55208 
1 1 1   26   16    3 o  203.137   9.3936   31.759   2.9207   31.759   2.9207   0.0000   0.0000  203.137   9.3936  ?   ?  0.000000 9.393616 
1 1 1   26   16    4 o  291.143   6.8553   65.068   3.0550   68.057   3.5830   57.110   5.8464  297.613   7.8655  271.072   14.140 26.54092 16.18017 
1 1 1   26   16    5 f  225.410   7.6258   39.033   2.6311   38.771   2.9965   39.915   5.4974  224.522   8.7195  225.960   15.998 -1.438416 18.22016 
1 1 1   26   16    6 o  231.544   7.4987   41.182   2.6576   42.576   3.0130   36.300   5.6402  235.322   8.3651  215.035   17.282 20.28777 19.20039 
1 1 1   26   16    7 o  226.366   6.9097   39.340   2.3941   39.456   2.6406   38.804   5.6749  226.623   7.6125  222.505   16.786 4.118073 18.43175 
1 1 1   26   16    8 o  208.113   11.042   33.509   3.5046   32.995   4.5069   34.296   5.5739  205.726   14.404  208.835   17.602 -3.108643 22.74398 
1 1 1   26   16    9 o  246.454   11.540   46.906   4.3532   54.135   6.3991   40.677   5.9394  263.237   15.957  227.667   17.170 35.56979 23.44050 
1 1 1   26   16   10 o   71.515   28.952   2.1148   4.9217   0.0000   0.0000   2.1148   4.9217  ?   ?    71.515   28.952 0.000000 28.95156 
1 1 1   26   16   11 o  189.557   16.069   28.183   4.6185   43.858   8.0294   20.433   5.6460  234.248   22.678  158.680   23.995 75.56795 33.01619 
1 1 1   26   16   12 o  193.244   13.930   29.115   4.0926   39.698   5.3540   14.240   6.3476  225.304   15.622  129.332   32.192 95.97116 35.78210 
1 1 1   26   16   13 f  196.765   14.368   30.223   4.2973   31.068   5.5854   28.997   6.7273  198.214   18.628  189.570   23.703 8.644104 30.14705 
1 1 1   26   16   14 o  189.273   14.896   28.027   4.2805   31.101   5.6449   23.868   6.5661  198.199   18.834  170.790   25.933 27.40916 32.05016 
1 1 1   26   16   15 o   56.997   26.262  -3.5341   5.3049  -3.5341   5.3049   0.0000   0.0000   56.997   26.262  ?   ?  0.000000 26.26199 
1 1 1   26   16   16 o  129.593   22.045   13.661   4.2162   19.714   5.4685   4.7896   6.6204  155.624   23.706   88.316   34.258 67.30843 41.66043 
1 1 1   26   16   17 o  113.975   25.329   10.813   4.3041   8.5925   5.7476   13.647   6.4943  101.893   32.599  125.878   33.221 -23.98516 46.54449 
1 1 1   26   16   18 o  295.450   11.627   67.532   5.2579   69.353   6.9644   65.119   8.0180  297.854   15.328  287.300   18.329 10.55457 23.89323 
1 1 1   26   16   19 o   51.505   18.310   1.8238   1.8143   2.3988   1.8879  -5.1265   6.5631   56.430   18.728   61.310   28.578 -4.880585 34.16764 
1 1 1   26   16   20 o  194.473   7.9687   29.101   2.3720   29.851   2.5242   23.435   6.9369  196.909   8.3750  167.652   28.022 29.25668 29.24645 
1 1 1   26   16   21 o   99.394   23.162   8.2084   3.4585   6.1074   4.0072   14.343   6.8473   86.501   27.168  128.149   34.251 -41.64783 43.71796 
1 1 1   26   16   22 o  150.794   13.516   17.823   3.0866   26.849   5.0044   12.282   3.9213  183.826   18.017  122.496   21.709 61.33004 28.21173 
1 1 1   26   16   23 f  122.489   20.492   12.214   3.7063   18.578   10.447   11.298   3.9641  141.534   43.772  116.862   22.981 24.67204 49.43753 
1 1 1   26   16   24 o  196.872   11.685   30.154   3.5054   31.237   5.4735   29.401   4.5641  198.113   18.256  193.175   15.568 4.937210 23.99259 
1 1 1   26   16   25 f  145.472   15.206   16.734   3.3358   18.165   5.4250   15.864   4.2300  147.941   24.838  139.850   20.358 8.091568 32.11521 
1 1 1   26   16   26 o  116.055   20.062   11.001   3.4348   12.349   5.6579   10.215   4.3224  119.141   30.800  109.722   26.114 9.419670 40.38075 
1 1 1   26   16   27 o   50.928   22.714  -1.0748   3.5947  -3.7471   5.6050   0.7922   4.6851   57.777   26.752   64.427   27.337 -6.650173 38.24876 
1 1 1   26   16   28 o  117.033   19.408   11.172   3.3547   6.7939   5.0877   14.540   4.4622   90.922   30.750  132.480   22.830 -41.55755 38.29795 
1 1 1   26   16   29 o  210.163   12.182   34.497   3.9018   31.310   5.6036   37.497   5.4363  197.464   18.765  217.373   16.461 -19.90837 24.96215 
1 1 1   26   16   30 o  115.273   18.740   10.841   3.1929   6.6335   5.3110   13.223   3.9957   90.059   31.384  126.480   21.403 -36.42043 37.98744 
1 1 1   26   16   31 o  135.842   15.972   14.769   3.2575   12.582   5.0649   16.312   4.2540  120.128   28.054  141.062   20.286 -20.93405 34.62019 
1 1 1   26   16   32 o   49.669   21.515  -0.0658   3.0164   0.5629   4.5994  -0.5402   3.9958   62.424   26.801   55.063   24.284 7.361450 36.16653 
1 1 1   26   16   33 o   97.136   21.464   7.9715   3.1062   8.5712   4.6410   7.4849   4.1807   98.446   28.903   92.611   27.497 5.834694 39.89340 
1 1 1   26   16   34 o   80.514   26.675   5.4424   3.8306  -7.5312   12.481   6.7915   4.0249   80.007   37.943   88.378   27.142 -8.371384 46.65135 
1 1 1   26   16   35 o  108.460   20.166   9.8522   3.2246   11.019   4.8427   8.9229   4.3222  110.835   28.413  100.166   27.400 10.66931 39.47200 
1 1 1   26   16   36 o   70.810   26.259   3.7495   3.7853   1.4135   5.0236   6.8179   5.7576   66.523   28.270   89.274   32.504 -22.75044 43.07790 
1 1 1   26   16   37 o  107.423   23.200   10.026   3.7031   8.7727   4.9134   11.674   5.6344   97.599   29.991  111.250   31.605 -13.65078 43.56956 
1 1 1   26   16   38 o   38.176   18.583  -5.4623   3.4791  -3.5795   4.5976  -7.9851   5.3220   49.976   23.495   46.788   22.821 3.187572 32.75399 
1 1 1   26   16   39 o   70.658   25.256   4.1043   3.4566   9.3036   4.4030  -4.2469   5.5802  100.032   27.772   54.204   25.606 45.82740 37.77476 
1 1 1   26   16   40 o   76.838   23.975   5.2425   3.1263   8.4376   4.2840   1.6026   4.5725   94.806   27.751   63.404   26.958 31.40223 38.68900 
1 1 1   26   16   41 o   35.923   17.542  -5.1648   3.1711  -9.1152   4.3329  -0.6086   4.6534   38.469   19.105   56.703   25.523 -18.23390 31.88175 
1 1 1   26   17    0 o   87.920   35.372   8.4431   4.6357   8.4431   4.6357   8.4431   4.6357   87.920   35.372   87.920   35.372 0.000000 0.000000 
1 1 1   26   17    1 o  113.959   14.284   10.224   2.4369   8.9343   2.8500   13.732   4.6992  105.453   18.322  129.437   24.618 -23.98442 30.68816 
1 1 1   26   17    2 o   58.284   22.121   1.9716   2.7196   1.9716   2.7196   0.0000   0.0000   58.284   22.121  ?   ?  0.000000 22.12083 
1 1 1   26   17    3 o  264.300   9.0921   53.757   3.6782   53.757   3.6782   0.0000   0.0000  264.300   9.0921  ?   ?  0.000000 9.092144 
1 1 1   26   17    4 o  128.411   12.960   12.887   2.5125   13.479   2.8925   11.068   5.0705  130.983   14.680  114.914   28.866 16.06837 32.38419 
1 1 1   26   17    5 o  137.372   12.119   14.696   2.5222   15.062   2.8741   13.468   5.2602  138.758   13.712  127.136   27.806 11.62286 31.00249 
1 1 1   26   17    6 o  110.630   15.245   9.6845   2.5129   9.2916   2.8519   11.049   5.3147  107.662   17.937  114.597   29.962 -6.934845 34.92055 
1 1 1   26   17    7 o  348.467   8.5124   93.395   4.5403  104.336   5.8691   77.090   7.1649  367.857   10.424  314.996   14.860 52.86044 18.15177 
1 1 1   26   17    8 o  143.774   11.559   16.067   2.5223   15.528   2.8410   18.070   5.4806  140.972   13.324  148.714   24.962 -7.741913 28.29540 
1 1 1   26   17    9 o  115.902   13.999   10.566   2.4332   11.448   2.7252   7.1001   5.4029  120.448   15.115   94.708   31.690 25.73993 35.10956 
1 1 1   26   17   10 o   73.574   22.043   4.3448   2.6777   5.3053   3.1040   1.5510   5.2937   80.801   23.613   71.377   29.584 9.423454 37.85204 
1 1 1   26   17   11 o  279.842   11.963   60.552   5.1241   68.065   7.5861   54.248   6.9488  294.752   16.885  262.857   17.369 31.89471 24.22377 
1 1 1   26   17   12 o  114.121   23.868   10.734   4.0351   5.9956   5.1367   18.371   6.5208   88.753   30.868  147.910   29.832 -59.15726 42.92812 
1 1 1   26   17   13 o  248.872   12.370   47.947   4.7122   52.193   6.0734   41.524   7.4691  258.412   15.425  228.031   21.660 30.38062 26.59100 
1 1 1   26   17   14 o  306.765   10.980   72.685   5.1556   74.562   6.6882   69.938   8.0934  309.778   14.105  298.199   17.813 11.57904 22.72174 
1 1 1   26   17   15 o  195.592   19.998   30.473   5.9029   30.473   5.9029   0.0000   0.0000  195.592   19.998  ?   ?  0.000000 19.99846 
1 1 1   26   17   16 f  248.062   8.2956   47.351   3.1498   50.466   3.4558   32.065   7.6554  256.000   8.8194  198.086   25.867 57.91406 27.32875 
1 1 1   26   17   17 o  383.416   5.7961  112.816   3.4015  115.011   3.6586   98.822   9.2373  387.057   6.1755  355.181   16.991 31.87625 18.07869 
1 1 1   26   17   18 o  171.361   8.3486   22.604   2.1898   22.375   2.2918   25.007   7.4222  170.209   8.8270  172.868   29.084 -2.659210 30.39369 
1 1 1   26   17   19 o  186.624   8.1220   26.806   2.3201   27.657   2.4437   19.030   7.3867  189.523   8.4241  148.279   33.354 41.24426 34.40159 
1 1 1   26   17   20 o   75.730   17.880   4.6866   2.0394   4.4664   2.1243   7.2770   7.2856   73.858   18.756   98.625   36.459 -24.76722 41.00055 
1 1 1   26   17   21 o  222.203   15.902   38.839   5.3726   37.287   7.1108   40.903   8.2015  215.120   21.901  224.146   24.294 -9.026489 32.70879 
1 1 1   26   17   22 o  255.616   22.515   52.724   8.7191   0.0000   0.0000   52.724   8.7191  ?   ?   255.616   22.515 0.000000 22.51506 
1 1 1   26   17   23 o   42.344   19.481  -1.9918   2.9040  -4.4152   4.4862  -0.2440   3.8099   49.027   23.099   55.461   24.102 -6.434330 33.38342 
1 1 1   26   17   24 o  267.775   9.3560   55.354   3.8347   62.454   5.6296   49.208   5.2378  283.298   12.983  250.885   13.691 32.41266 18.86801 
1 1 1   26   17   25 o  150.277   13.871   17.765   3.1545   19.480   4.5043   16.115   4.4192  155.522   19.340  140.550   21.201 14.97198 28.69676 
1 1 1   26   17   26 o  134.170   15.650   14.310   3.1536   12.837   4.5776   15.640   4.3507  123.557   25.062  138.319   21.228 -14.76189 32.84368 
1 1 1   26   17   27 o  103.631   22.794   8.9924   3.5173   7.3245   4.7141   11.087   5.2825   93.152   29.494  112.777   30.057 -19.62554 42.11094 
1 1 1   26   17   28 o  211.902   11.293   34.969   3.6496   33.835   5.1809   36.086   5.1418  206.402   16.538  213.508   15.847 -7.106735 22.90479 
1 1 1   26   17   29 o   66.201   24.574   2.9928   3.3165  -2.0080   4.8319   7.4474   4.5604   56.647   25.704   93.298   28.931 -36.65133 38.69976 
1 1 1   26   17   30 o  234.248   10.961   42.648   3.9299   45.354   5.4882   39.799   5.6300  239.522   15.046  223.554   16.572 15.96799 22.38311 
1 1 1   26   17   31 o  208.500   10.939   33.903   3.4787   43.453   5.3290   26.811   4.5921  234.298   14.938  183.102   16.564 51.19646 22.30493 
1 1 1   26   17   32 o  123.836   17.218   12.444   3.1753   10.656   4.8609   13.775   4.1936  109.585   28.656  128.172   22.179 -18.58725 36.23603 
1 1 1   26   17   33 o   50.439   21.850  -0.0040   3.1111  -3.6842   4.7002   2.8659   4.1506   51.237   23.982   68.538   26.969 -17.30037 36.08943 
1 1 1   26   17   34 o   78.140   27.095   5.0053   3.9562  -6.3321   12.351   6.3014   4.1762   80.697   38.113   85.479   27.829 -4.781731 47.19196 
1 1 1   26   17   35 o  144.600   20.716   17.444   4.4541   18.177   5.0948   15.068   9.1748  145.940   23.614  121.309   41.292 24.63126 47.56712 
1 1 1   26   17   36 o  131.637   19.349   14.417   3.7822   15.373   5.2378   13.377   5.4674  131.400   26.947  120.505   29.807 10.89524 40.18188 
1 1 1   26   17   37 o   76.640   25.256   5.0601   3.4357  -0.4184   4.8931   10.388   4.8252   59.599   26.547  105.825   28.951 -46.22678 39.27953 
1 1 1   26   17   38 o   83.028   24.990   6.1605   3.4358   3.2294   4.4862   10.319   5.3433   69.687   27.841  103.568   31.163 -33.88152 41.78799 
1 1 1   26   17   39 o   86.375   23.536   6.6809   3.1964   4.8370   4.3700   8.8025   4.6876   75.988   28.207   96.229   29.241 -20.24037 40.62860 
1 1 1   26   17   40 o   46.756   21.093  -0.9034   3.1991  -1.8403   4.3168   0.2381   4.7648   51.600   23.744   59.780   26.434 -8.179291 35.53163 
1 1 1   26   18    0 o   43.729   29.283  -1.7458   5.4529  -1.7458   5.4529  -1.7458   5.4529   43.729   29.283   43.729   29.283 0.000000 0.000000 
1 1 1   26   18    1 f  348.632   14.145   94.304   7.5481   94.304   7.5481   0.0000   0.0000  348.632   14.145  ?   ?  0.000000 14.14494 
1 1 1   26   18    2 o  172.179   13.186   23.090   3.4488   23.090   3.4488   0.0000   0.0000  172.179   13.186  ?   ?  0.000000 13.18644 
1 1 1   26   18    3 o  136.714   13.889   14.638   2.8660   19.218   3.3203   1.2574   5.6758  156.807   13.981   72.471   30.382 84.33592 33.44419 
1 1 1   26   18    4 o  107.473   17.380   9.2396   2.7614   7.6960   3.1515   14.343   5.7306   96.880   21.782  130.703   29.362 -33.82224 36.55878 
1 1 1   26   18    5 o  321.380   7.9242   79.394   3.8980   77.201   4.5259   85.692   7.6713  316.642   9.3382  331.978   15.097 -15.33575 17.75165 
1 1 1   26   18    6 f   58.414   22.443   1.8940   2.8207   4.3330   3.2169  -6.2182   5.8667   74.725   24.429   55.312   26.168 19.41334 35.79868 
1 1 1   26   18    7 o  367.456   7.0078  103.697   3.9415  104.626   4.4655  100.422   8.3856  368.922   7.9079  359.273   15.249 9.648285 17.17743 
1 1 1   26   18    8 o  226.669   9.1436   39.558   3.1723   42.009   3.5795   30.588   6.8488  233.443   10.018  194.866   23.432 38.57771 25.48328 
1 1 1   26   18    9 o   65.790   24.058   2.8816   3.1590   6.1737   3.6812  -6.3161   6.1531   86.907   25.802   56.885   26.877 30.02226 37.25772 
1 1 1   26   18   10 o  296.849   7.9600   67.757   3.6167   66.541   4.0572   72.460   7.9813  293.979   9.0166  303.908   17.229 -9.928925 19.44552 
1 1 1   26   18   11 o  193.537   10.717   29.001   3.1624   28.950   3.4937   29.232   7.4405  193.113   11.877  188.977   26.448 4.135986 28.99214 
1 1 1   26   18   12 o  208.812   7.0682   33.498   2.2591   34.264   2.3822   26.654   7.1195  211.152   7.3708  180.177   26.617 30.97476 27.61863 
1 1 1   26   18   13 o  287.680   6.2568   63.530   2.7551   63.512   2.9204   63.679   8.3051  287.584   6.6346  283.798   19.232 3.785797 20.34464 
1 1 1   26   18   14 o   77.693   15.320   4.8621   1.7571   4.8621   1.7571   0.0000   0.0000   77.693   15.320  ?   ?  0.000000 15.32003 
1 1 1   26   18   15 o  331.320   5.9436   84.251   3.0142   87.133   3.2168   63.509   8.6297  336.890   6.2382  282.849   20.063 54.04147 21.01058 
1 1 1   26   18   16 o  181.359   7.8014   25.299   2.1656   26.537   2.2650   12.113   7.3918  185.723   7.9676  118.385   36.853 67.33783 37.70440 
1 1 1   26   18   17 o  390.854   6.1569  117.291   3.6834  122.330   4.0016   89.335   9.4250  399.078   6.5510  336.412   18.373 62.66623 19.50618 
1 1 1   26   18   18 f  355.819   6.4290   97.242   3.5014  103.908   3.8173   61.900   8.7896  367.739   6.7819  278.545   20.765 89.19412 21.84471 
1 1 1   26   18   19 o  183.598   8.6600   25.970   2.4336   25.375   2.5708   31.105   7.5515  181.157   9.3027  194.406   26.031 -13.24939 27.64347 
1 1 1   26   18   20 o  163.204   12.144   20.770   3.0118   22.067   3.2923   14.117   7.4571  168.052   12.898  126.272   36.513 41.78009 38.72430 
1 1 1   26   18   21 o  145.195   16.326   16.731   3.5654   18.763   4.0077   9.0182   7.8083  153.513   17.361  105.621   37.938 47.89198 41.72143 
1 1 1   26   18   22 o  217.248   11.079   36.642   3.6718   39.643   4.0565   23.030   8.6387  225.786   11.779  161.145   35.939 64.64018 37.81960 
1 1 1   26   18   23 f  203.103   12.014   32.132   3.7181   31.330   4.1203   35.651   8.6286  200.072   13.534  206.441   28.032 -6.369614 31.12813 
1 1 1   26   18   24 o   95.502   24.601   7.6861   3.6183   8.2440   3.9968   5.1519   8.5179   98.597   26.081   94.045   38.082 4.552780 46.15707 
1 1 1   26   18   25 o  156.988   13.346   19.350   3.1764   23.959   4.4058   14.361   4.5838  173.606   16.790  131.434   23.655 42.17174 29.00772 
1 1 1   26   18   26 o  238.422   10.729   44.063   3.9154   46.898   4.9913   39.529   6.3130  244.772   13.373  222.260   18.731 22.51184 23.01534 
1 1 1   26   18   27 o  152.594   14.204   18.385   3.2794   15.141   4.5283   21.962   4.7555  135.137   22.697  164.929   19.197 -29.79170 29.72691 
1 1 1   26   18   28 o  115.185   18.852   10.832   3.2088   16.666   4.5632   5.1251   4.5130  142.214   21.646   81.210   28.877 61.00466 36.08906 
1 1 1   26   18   29 o  110.901   20.661   10.201   3.3781   13.218   4.7221   7.0377   4.8345  124.363   25.659   91.082   29.956 33.28127 39.44296 
1 1 1   26   18   30 o   85.422   24.517   6.2154   3.3734   3.5731   4.6420   9.1727   4.9109   74.068   28.699  101.934   29.676 -27.86596 41.28282 
1 1 1   26   18   31 o   54.629   22.642   0.9849   3.1008  -1.2012   4.6802   2.6953   4.1398   57.384   25.732   67.960   26.873 -10.57533 37.20573 
1 1 1   26   18   32 o  159.842   13.646   20.243   3.3066   24.751   5.0320   16.818   4.3867  174.113   19.201  142.443   20.728 31.67014 28.25449 
1 1 1   26   18   33 o  126.560   26.145   13.974   4.8971   11.087   12.117   14.538   5.3538  111.031   45.249  127.997   28.097 -16.96562 53.26330 
1 1 1   26   18   34 o  179.042   16.814   25.904   4.5539   27.742   5.2587   20.395   9.1056  184.061   18.936  141.814   40.139 42.24620 44.38161 
1 1 1   26   18   35 o   76.904   24.313   5.0642   3.2044   5.9390   4.8255   4.3742   4.2857   83.640   29.847   75.111   27.924 8.528572 40.87281 
1 1 1   26   18   36 o  172.539   13.593   23.756   3.5609   17.757   5.0818   29.542   4.9910  142.928   24.085  190.179   17.336 -47.25035 29.67583 
1 1 1   26   18   37 o   59.216   23.588   2.0580   3.2115  -0.4332   4.4535   4.7569   4.6355   56.836   25.321   76.755   28.940 -19.91942 38.45356 
1 1 1   26   18   38 o   51.770   22.479   0.2435   3.3082   1.9973   4.2631  -2.4113   5.2450   63.652   26.479   55.963   25.901 7.689022 37.03984 
1 1 1   26   18   39 o   57.797   23.329   1.8887   3.1855  -3.0145   4.2899   7.9149   4.7559   48.683   22.826   91.062   29.700 -42.37927 37.45849 
1 1 1   26   19    1 o  167.163   18.375   22.147   4.6240   24.790   6.3921   19.247   6.6971  174.740   24.579  151.527   29.937 23.21231 38.73404 
1 1 1   26   19    2 o  293.082   8.7290   66.100   3.9158   68.358   4.5382   59.519   7.7473  297.801   9.9561  274.914   18.519 22.88651 21.02574 
1 1 1   26   19    3 o  146.648   14.191   16.847   3.1455   14.531   3.4935   26.767   7.2292  135.318   17.260  180.654   26.970 -45.33568 32.02037 
1 1 1   26   19    4 o  405.962   7.8512  126.694   4.8786  130.001   5.6927  117.551   9.4668  410.922   9.0508  388.341   15.927 22.58105 18.31861 
1 1 1   26   19    5 o  106.198   19.953   9.1494   3.1242   7.8225   3.4943   14.437   6.9755   97.253   23.693  129.451   34.558 -32.19738 41.89946 
1 1 1   26   19    6 o  243.166   10.078   45.594   3.7510   45.389   4.2919   46.258   7.7190  242.330   11.571  241.059   21.134 1.271057 24.09411 
1 1 1   26   19    7 o  226.856   10.632   39.719   3.6917   39.490   4.2363   40.442   7.5264  225.554   12.317  224.815   22.161 0.7389526 25.35353 
1 1 1   26   19    8 f   96.065   26.836   7.6746   4.0980   12.941   5.0795  -2.1430   6.9354  124.363   27.422   69.840   31.320 54.52290 41.62844 
1 1 1   26   19    9 o  207.200   11.606   33.295   3.6660   36.627   4.2294   23.228   7.3517  217.052   12.787  166.544   29.940 50.50818 32.55664 
1 1 1   26   19   10 o  123.729   18.253   12.253   3.3530   12.584   3.8166   11.134   7.0198  124.678   20.727  114.471   35.959 10.20662 41.50521 
1 1 1   26   19   11 o   51.293   22.119  -0.1243   3.1594  -0.8687   3.4989   3.1632   7.3529   51.256   22.659   85.687   35.122 -34.43084 41.79694 
1 1 1   26   19   12 o  119.604   18.439   11.483   3.2672   11.464   3.6576   11.557   7.2676  118.770   20.882  116.225   36.601 2.544945 42.13914 
1 1 1   26   19   13 o  222.245   7.7350   37.985   2.6313   37.985   2.6313   0.0000   0.0000  222.245   7.7350  ?   ?  0.000000 7.735014 
1 1 1   26   19   14 o  100.971   13.271   8.0457   2.0013   8.0457   2.0013   0.0000   0.0000  100.971   13.271  ?   ?  0.000000 13.27105 
1 1 1   26   19   15 o  214.986   7.1385   35.524   2.3490   35.739   2.4434   32.912   8.5324  215.598   7.4044  198.874   28.874 16.72414 29.80803 
1 1 1   26   19   16 o  116.924   15.771   10.866   2.7506   11.098   2.9117   8.9419   8.3850  117.963   16.584  107.000   39.185 10.96232 42.54992 
1 1 1   26   19   17 o  164.662   11.846   21.112   2.9657   20.600   3.1776   24.574   8.2587  162.385   12.891  168.930   33.124 -6.544693 35.54372 
1 1 1   26   19   18 o  172.036   11.517   23.022   3.0152   25.194   3.2675   10.569   7.8243  179.897   11.934  111.789   38.131 68.10870 39.95524 
1 1 1   26   19   19 o  173.811   9.2385   23.368   2.4490   24.095   2.5729   16.367   7.9862  176.435   9.5632  135.283   37.343 41.15196 38.54839 
1 1 1   26   19   20 o   61.306   19.798   2.9235   2.1162   2.3889   2.1980   9.7033   7.8274   57.656   20.185  108.132   38.075 -50.47584 43.09396 
1 1 1   26   19   21 o  176.544   13.286   24.395   3.5638   25.264   3.9246   20.310   8.5101  179.328   14.420  150.359   37.185 28.96938 39.88292 
1 1 1   26   19   22 o  337.834   8.5520   87.991   4.4222   93.276   4.9624   67.603   9.7466  347.590   9.3273  289.396   22.172 58.19434 24.05409 
1 1 1   26   19   23 o  147.899   15.460   17.327   3.4480   19.291   3.7596   6.9269   8.6510  155.964   15.974   99.632   39.017 56.33276 42.16081 
1 1 1   26   19   24 o   58.885   23.836   1.4585   3.3357   1.3358   3.6751   2.0320   7.9471   60.454   24.811   83.284   35.478 -22.82972 43.29308 
1 1 1   26   19   25 o   54.101   23.044   0.3343   3.3518   0.5629   3.7005  -0.7102   7.9097   57.405   24.323   76.305   33.883 -18.90061 41.70934 
1 1 1   26   19   26 o  123.813   17.566   12.368   3.2356   14.241   4.0350   8.9947   5.4154  131.799   20.682  101.736   31.523 30.06349 37.70206 
1 1 1   26   19   27 o  128.201   16.268   13.172   3.1204   13.685   4.0774   12.447   4.8476  128.686   21.456  120.214   27.005 8.472916 34.49089 
1 1 1   26   19   28 o  194.470   11.858   29.575   3.5129   25.907   4.5897   34.762   5.4586  179.997   16.855  208.497   17.260 -28.49928 24.12465 
1 1 1   26   19   29 o  153.308   15.008   18.702   3.4767   19.381   4.6775   17.864   5.1969  153.711   20.384  145.571   24.172 8.140106 31.61901 
1 1 1   26   19   30 o  124.315   18.526   12.645   3.4175   17.470   4.7196   7.3265   4.9550  144.778   21.989   91.985   30.331 52.79284 37.46341 
1 1 1   26   19   31 o  135.009   17.264   14.784   3.4858   13.026   4.7472   16.841   5.1350  122.372   26.139  140.351   24.810 -17.97878 36.03885 
1 1 1   26   19   32 o   63.156   24.562   2.4598   3.4101  -1.1625   4.7249   6.3984   4.9268   57.477   25.808   86.860   30.230 -29.38301 39.74804 
1 1 1   26   19   33 o   77.698   30.275   4.2592   5.1883   13.176   11.440   1.9505   5.8213  114.891   44.903   71.932   30.494 42.95889 54.27873 
1 1 1   26   19   34 o   47.451   21.349  -1.0411   3.2517  -3.6369   4.7882   1.1807   4.4298   51.456   24.123   62.576   26.568 -11.12014 35.88532 
1 1 1   26   19   35 o  115.521   19.853   11.248   3.3838   10.768   5.0152   11.649   4.5847  107.599   29.549  113.640   26.794 -6.041245 39.88776 
1 1 1   26   19   36 f  146.232   15.453   17.361   3.4065   9.5991   4.9207   24.504   4.7205  100.925   29.798  172.187   18.186 -71.26259 34.90956 
1 1 1   26   19   37 o  136.998   17.585   15.572   3.6023   17.651   4.7226   12.679   5.5706  142.795   22.339  114.463   31.021 28.33215 38.22778 
1 1 1   26   19   38 o   67.782   24.257   3.7705   3.1895   5.3697   4.4789   2.1253   4.5431   78.473   28.654   65.064   27.223 13.40834 39.52353 
1 1 1   26   20    0 o   58.104   36.240   2.0395   6.5636   2.0395   6.5636   2.0395   6.5636   58.104   36.240   58.104   36.240 0.000000 0.000000 
1 1 1   26   20    1 o  111.168   35.218   10.390   6.7207   0.0000   0.0000   10.390   6.7207  ?   ?   111.168   35.218 0.000000 35.21779 
1 1 1   26   20    2 o  175.217   19.830   24.471   5.2247   16.517   7.4547   32.150   7.3248  138.046   35.179  199.191   24.544 -61.14474 42.89443 
1 1 1   26   20    3 o  231.077   10.642   41.216   3.7640   40.754   4.2977   42.738   7.7989  229.133   12.299  231.035   22.332 -1.902573 25.49515 
1 1 1   26   20    4 f  164.881   14.127   21.269   3.5309   18.874   3.9825   30.070   7.6343  154.441   17.136  191.529   26.773 -37.08823 31.78769 
1 1 1   26   20    5 f  232.338   10.854   41.685   3.8598   42.270   4.4358   39.858   7.8327  233.313   12.466  222.559   23.340 10.75328 26.46106 
1 1 1   26   20    6 o  162.475   14.801   20.704   3.6405   18.928   4.1397   26.767   7.6476  154.433   17.841  179.549   28.801 -25.11630 33.87926 
1 1 1   26   20    7 o  143.615   18.477   16.446   3.9675   21.773   4.6255   1.6188   7.7178  165.508   18.580   82.849   35.116 82.66000 39.72799 
1 1 1   26   20    8 o  153.620   17.124   18.688   3.9580   19.249   4.5496   16.941   8.0260  155.156   19.594  138.929   37.059 16.22675 41.92056 
1 1 1   26   20    9 o  272.066   9.1340   57.025   3.8037   56.637   4.1789   58.898   9.1850  270.945   10.076  271.273   22.319 -0.3277588 24.48814 
1 1 1   26   20   10 o  269.313   9.0660   55.877   3.7372   54.828   4.0648   61.608   9.5013  266.591   9.9616  277.260   22.585 -10.66965 24.68407 
1 1 1   26   20   11 o  301.617   8.4262   70.028   3.8901   73.099   4.2834   55.575   9.2931  308.013   9.0856  262.768   23.349 45.24512 25.05425 
1 1 1   26   20   12 o  170.270   12.732   22.607   3.2942   21.805   3.5599   27.388   8.6899  166.861   14.070  179.113   32.910 -12.25215 35.79123 
1 1 1   26   20   13 o  172.127   13.248   23.141   3.4636   23.141   3.4636   0.0000   0.0000  172.127   13.248  ?   ?  0.000000 13.24832 
1 1 1   26   20   14 o  237.484   10.083   43.542   3.6653   45.372   4.0261   34.682   8.8586  242.256   10.858  203.898   29.220 38.35767 31.17214 
1 1 1   26   20   15 o  114.711   11.890   10.301   2.0574   11.114   2.1266  -1.5811   8.1312  119.213   11.810   76.509   34.140 42.70430 36.12463 
1 1 1   26   20   16 o  196.577   7.7631   29.735   2.3358   30.201   2.4296   24.037   8.4875  198.079   8.0137  166.128   34.506 31.95123 35.42480 
1 1 1   26   20   17 o   76.878   17.617   4.8295   2.0286   5.4483   2.0999  -3.8155   7.8488   81.791   17.313   70.429   32.263 11.36163 36.61460 
1 1 1   26   20   18 o  200.096   8.1793   30.835   2.5051   31.377   2.6225   25.185   8.4671  201.798   8.4904  170.285   33.679 31.51286 34.73232 
1 1 1   26   20   19 o  258.913   7.4721   51.581   2.9612   54.058   3.1264   29.985   9.2307  265.012   7.7075  185.975   33.667 79.03682 34.53771 
1 1 1   26   20   20 o  142.612   11.492   15.867   2.4873   16.479   2.5991   9.2055   8.5744  145.281   11.790  107.175   39.566 38.10564 41.28493 
1 1 1   26   20   21 o  144.936   14.624   16.582   3.2000   16.308   3.3891   18.833   9.7145  143.395   15.698  142.135   41.841 1.260132 44.68914 
1 1 1   26   20   22 o  105.289   20.755   9.1406   3.2259   8.9963   3.4626   10.089   8.8780  103.906   22.429  110.120   40.322 -6.214325 46.13986 
1 1 1   26   20   23 o   47.990   21.278  -0.7933   3.1081  -0.2410   3.3322  -4.4893   8.6209   51.777   22.521   72.170   33.332 -20.39292 40.22711 
1 1 1   26   20   24 o  185.608   12.680   26.965   3.5808   27.758   3.8962   22.654   9.0858  188.007   13.632  156.844   38.201 31.16240 40.56025 
1 1 1   26   20   25 o  127.201   20.380   13.265   3.8340   13.265   3.8340   0.0000   0.0000  127.201   20.380  ?   ?  0.000000 20.38031 
1 1 1   26   20   26 o   99.878   23.108   8.4314   3.4625   6.2398   3.7654   20.433   8.8114   85.959   26.227  147.525   38.583 -61.56600 46.65261 
1 1 1   26   20   27 f  229.052   10.194   40.699   3.5741   42.084   4.5929   38.573   5.6907  231.602   13.009  219.769   17.051 11.83316 21.44674 
1 1 1   26   20   28 o   97.568   21.913   8.0378   3.1925   8.6718   4.1406   7.1084   5.0134   99.845   26.611   91.245   30.526 8.599846 40.49658 
1 1 1   26   20   29 o  172.387   13.286   23.456   3.4787   27.986   4.6007   17.410   5.3155  187.038   16.231  142.744   25.252 44.29419 30.01909 
1 1 1   26   20   30 o   60.960   23.767   2.2076   3.1989   4.8308   4.2416  -1.2526   4.8714   78.131   27.972   58.263   26.180 19.86859 38.31237 
1 1 1   26   20   31 o  213.706   11.517   35.789   3.7534   41.589   5.0146   28.400   5.6601  228.955   14.382  185.778   20.232 43.17703 24.82309 
1 1 1   26   20   32 o   99.202   36.238   8.8722   7.1649   17.694   12.030   4.0225   8.9194  127.241   46.884   87.822   37.503 39.41920 60.03799 
1 1 1   26   20   33 o   77.049   24.001   5.0899   3.1345   8.2552   4.6327   2.4172   4.2570   95.370   29.089   66.405   26.911 28.96587 39.62755 
1 1 1   26   20   34 o  109.921   19.896   10.208   3.2242   4.4708   4.6088   15.707   4.5120   75.988   28.807  135.289   22.585 -59.30027 36.60540 
1 1 1   26   20   35 o   40.123   19.079  -3.4046   3.1974  -4.3177   4.6225  -2.5670   4.4273   48.534   23.039   51.086   23.697 -2.551109 33.05027 
1 1 1   26   20   36 o   70.477   24.795   4.1349   3.3188   6.6234   4.6619   1.5779   4.7256   85.256   29.421   64.336   27.381 20.92021 40.19124 
1 1 1   26   20   37 o  125.158   18.851   13.221   3.4993   14.014   4.5621   12.087   5.4541  124.979   24.724  111.255   30.917 13.72428 39.58686 
1 1 1   26   21    0 o  170.851   34.588   25.722   8.0100   25.722   8.0100   25.722   8.0100  170.851   34.588  170.851   34.588 0.000000 0.000000 
1 1 1   26   21    1 o   94.994   30.962   7.3226   5.1688   9.5904   7.2235   4.9430   7.3993  108.082   36.639   91.417   35.997 16.66436 51.36345 
1 1 1   26   21    2 o  190.309   19.000   28.764   5.4605   31.764   7.5465   25.468   7.9112  197.304   25.591  173.948   30.843 23.35640 40.07717 
1 1 1   26   21    3 o  157.919   17.935   19.802   4.2583   23.115   5.1900   12.979   7.4488  169.930   20.359  122.359   36.789 47.57064 42.04653 
1 1 1   26   21    4 o  101.177   23.346   8.4771   3.5420   8.7769   4.0716   7.5443   7.1816  102.450   25.939   99.922   36.314 2.528481 44.62680 
1 1 1   26   21    5 o  102.613   22.937   8.7023   3.5119   6.2073   3.9619   17.854   7.5877   87.237   26.951  143.289   34.916 -56.05203 44.10777 
1 1 1   26   21    6 o  224.039   15.525   39.338   5.2910   38.192   6.8032   41.091   8.4169  218.822   20.553  225.005   24.854 -6.182922 32.25136 
1 1 1   26   21    7 o   57.789   23.566   1.1905   3.2889   2.5214   3.6298  -4.9138   7.7738   66.114   25.444   68.390   31.609 -2.276314 40.57799 
1 1 1   26   21    8 o  161.623   14.096   20.465   3.4522   22.506   3.7913   10.560   8.3514  169.362   14.773  113.043   39.357 56.31902 42.03864 
1 1 1   26   21    9 o  215.807   11.066   36.098   3.6429   39.979   3.9756   15.774   9.0968  227.036   11.478  133.011   40.797 94.02467 42.38072 
1 1 1   26   21   10 o   86.825   23.280   6.2413   3.1572   7.2792   3.4256   0.3853   8.1370   93.552   23.851   81.199   35.255 12.35252 42.56511 
1 1 1   26   21   11 o  211.835   11.078   34.796   3.5793   35.401   3.8866   31.416   9.1851  213.449   11.944  192.208   32.371 21.24100 34.50428 
1 1 1   26   21   12 o  122.197   18.902   12.031   3.4212   12.031   3.4212   0.0000   0.0000  122.197   18.902  ?   ?  0.000000 18.90162 
1 1 1   26   21   13 o   57.893   22.887   1.6286   3.0024   2.2525   3.1971  -3.0296   8.7358   62.280   23.902   76.301   34.599 -14.02113 42.05194 
1 1 1   26   21   14 o  168.766   12.726   22.237   3.2632   22.214   3.4992   22.390   9.0385  168.417   13.693  158.381   37.808 10.03612 40.21105 
1 1 1   26   21   15 o   81.731   23.117   5.5173   3.0213   5.8881   3.2181   2.7595   8.7755   84.301   23.863   89.154   37.597 -4.853516 44.53069 
1 1 1   26   21   16 o  148.526   10.592   17.144   2.3922   18.362   2.4950   3.2668   8.4233  153.717   10.670   89.103   37.156 64.61400 38.65731 
1 1 1   26   21   17 f   93.415   15.967   7.0193   2.2010   7.2039   2.2813   4.5364   8.3661   94.561   16.354   92.285   37.603 2.275681 41.00566 
1 1 1   26   21   18 o  200.862   8.4070   31.092   2.5847   32.385   2.7011   17.054   8.9012  204.960   8.6099  136.564   40.009 68.39604 40.92485 
1 1 1   26   21   19 o   64.328   20.671   3.2520   2.3090   4.2602   2.3920 -10.5222   8.8416   72.120   20.629   64.384   30.915 7.735680 37.16566 
1 1 1   26   21   20 o  296.703   7.5281   67.769   3.4188   70.114   3.6167   48.084   10.480  301.719   7.8314  238.967   29.262 62.75235 30.29191 
1 1 1   26   21   21 o  174.680   12.624   23.869   3.3525   24.074   3.5648   22.296   9.8626  175.196   13.395  154.365   41.036 20.83083 43.16684 
1 1 1   26   21   22 o   71.926   23.531   4.1154   2.9844   1.0372   3.1417   32.574   9.5524   55.630   22.898  192.699   33.609 -137.0687 40.66780 
1 1 1   26   21   23 o  241.649   10.406   45.250   3.8488   49.390   4.1985   23.463   9.6315  252.319   10.871  158.407   39.779 93.91226 41.23811 
1 1 1   26   21   24 o   67.471   24.300   3.3004   3.2055   3.8065   3.4265  -0.2470   9.0724   71.152   25.177   81.618   36.263 -10.46513 44.14608 
1 1 1   26   21   25 o  151.412   17.166   18.404   3.9081   18.404   3.9081   0.0000   0.0000  151.412   17.166  ?   ?  0.000000 17.16618 
1 1 1   26   21   26 o  133.327   18.035   14.412   3.5860   12.818   3.8754   23.905   9.4573  124.352   21.116  158.595   39.186 -34.24329 44.51338 
1 1 1   26   21   27 o   59.108   24.272   1.3808   3.5194   2.4956   3.8270  -4.7293   8.9598   65.723   25.885   71.914   33.477 -6.190720 42.31740 
1 1 1   26   21   28 o  117.658   18.122   11.322   3.1588   11.298   4.0822   11.358   4.9870  114.979   23.972  113.072   28.750 1.906517 37.43318 
1 1 1   26   21   29 o  121.180   17.841   11.997   3.2101   16.329   4.1477   5.5269   5.0695  140.774   19.796   83.326   30.475 57.44890 36.34056 
1 1 1   26   21   30 o   66.120   25.397   2.8791   3.6119   2.4090   3.9730   5.1180   8.6698   65.586   26.201   90.534   37.719 -24.94766 45.92606 
1 1 1   26   21   31 o  101.362   33.460   9.4957   6.0295   12.449   8.1479   5.9208   8.9643  112.676   38.895   92.652   38.457 20.02380 54.69696 
1 1 1   26   21   33 o  125.568   17.017   12.949   3.1863   12.741   4.5714   13.145   4.4436  119.656   25.725  122.303   24.590 -2.646561 35.58660 
1 1 1   26   21   34 o   90.712   22.870   7.2452   3.1746   6.5690   4.6706   7.8259   4.3281   85.496   29.452   92.237   28.113 -6.741005 40.71521 
1 1 1   26   21   35 o   51.794   22.159   0.5424   3.1243   1.7090   4.5629  -0.4872   4.2868   64.073   27.070   55.526   24.782 8.546452 36.70061 
1 1 1   26   21   36 o   85.893   26.173   6.7567   3.7519   0.6940   5.1558   13.581   5.4700   63.240   27.747  118.903   30.044 -55.66293 40.89680 
1 1 1   26   22    0 o   75.097   42.849   6.3255   7.7285   6.3255   7.7285   6.3255   7.7285   75.097   42.849   75.097   42.849 0.000000 0.000000 
1 1 1   26   22    1 o  122.355   29.840   12.744   5.5384   13.007   7.6250   12.452   8.0578  122.214   37.329  120.032   38.620 2.182655 53.71125 
1 1 1   26   22    2 o  199.070   19.445   31.543   5.8492   36.188   7.9753   26.136   8.6046  210.719   25.229  174.670   33.402 36.04947 41.85874 
1 1 1   26   22    3 o  369.224   11.991  105.577   6.7767  106.069   9.0179  104.939   10.271  368.396   15.993  364.750   18.458 3.646454 24.42253 
1 1 1   26   22    4 o   66.223   25.296   2.6121   3.5707   3.5805   3.9927  -1.2564   7.9801   72.991   26.989   76.746   34.059 -3.755180 43.45538 
1 1 1   26   22    5 o  263.021   23.070   55.670   9.1937   0.0000   0.0000   55.670   9.1937  ?   ?   263.021   23.070 0.000000 23.06955 
1 1 1   26   22    6 o  192.447   17.695   29.319   5.1540   23.717   6.4235   39.444   8.6357  169.868   25.492  219.443   26.230 -49.57439 36.57675 
1 1 1   26   22    7 o   53.234   22.840   0.0448   3.3365   0.6152   3.6890  -2.5185   7.8205   58.004   24.414   73.167   32.996 -15.16327 41.04648 
1 1 1   26   22    8 o  102.348   22.214   8.6524   3.3801   9.2417   3.7465   6.0742   7.8369  105.417   23.785   96.013   37.265 9.404175 44.20822 
1 1 1   26   22    9 o   91.443   23.824   6.9608   3.3679   7.7577   3.6705   2.7171   8.4703   96.333   24.758   88.214   37.055 8.119736 44.56510 
1 1 1   26   22   10 o  229.901   10.847   40.873   3.8169   46.221   4.1967   15.275   9.1814  244.392   11.219  130.519   41.144 113.8723 42.64577 
1 1 1   26   22   11 o   63.263   24.865   2.0844   3.5244   2.0844   3.5244   0.0000   0.0000   63.263   24.865  ?   ?  0.000000 24.86478 
1 1 1   26   22   12 o  204.070   11.846   32.384   3.6841   31.744   3.9597   36.508   10.051  201.745   12.890  206.644   32.880 -4.899658 35.31649 
1 1 1   26   22   13 o   51.377   22.176  -0.1010   3.1817   0.5969   3.4020  -4.9721   8.9881   55.822   23.468   73.746   34.051 -17.92465 41.35495 
1 1 1   26   22   14 o  114.318   19.185   10.599   3.2380   12.056   3.4709   0.8214   8.9917  122.080   19.210   85.165   37.019 36.91548 41.70627 
1 1 1   26   22   15 f  134.737   16.288   14.438   3.2910   15.707   3.5347   6.1740   9.0182  140.457   16.773   98.892   39.485 41.56548 42.90027 
1 1 1   26   22   16 o   77.939   24.414   4.9289   3.2383   3.6795   3.4753   13.167   8.9235   71.110   25.334  121.673   40.726 -50.56279 47.96245 
1 1 1   26   22   17 o  148.083   10.999   17.076   2.4752   17.462   2.5627   11.708   9.5535  149.694   11.267  116.787   41.962 32.90707 43.44864 
1 1 1   26   22   18 o  113.202   13.959   10.145   2.3674   10.747   2.4473   1.3779   9.3411  116.546   13.999   87.193   37.816 29.35218 40.32381 
1 1 1   26   22   19 o  128.386   12.869   12.958   2.4949   12.691   2.5719   17.223   10.269  126.886   13.448  135.185   43.609 -8.298653 45.63517 
1 1 1   26   22   20 o  172.999   9.8196   23.220   2.5895   22.851   2.6857   28.094   9.7597  171.503   10.278  176.184   37.350 -4.680359 38.73885 
1 1 1   26   22   21 o  115.950   17.674   10.869   3.0374   11.784   3.2272   3.7656   8.9901  120.705   18.020   91.013   38.200 29.69126 42.23688 
1 1 1   26   22   22 o  117.240   17.338   11.101   3.0174   10.563   3.2088   15.209   8.8704  113.692   19.118  127.383   40.471 -13.69151 44.75949 
1 1 1   26   22   23 o  112.057   19.348   10.300   3.1985   8.6609   3.4296   21.251   8.8649  101.416   22.664  150.770   38.330 -49.35406 44.52891 
1 1 1   26   22   24 o  108.044   22.829   9.8398   3.6571   9.8398   3.6571   0.0000   0.0000  108.044   22.829  ?   ?  0.000000 22.82911 
1 1 1   26   22   25 o   46.371   21.136  -1.7063   3.3144  -0.8811   3.5735  -6.7858   8.8657   50.990   22.701   68.464   32.322 -17.47459 39.49739 
1 1 1   26   22   26 o   70.153   25.351   3.6716   3.4927   6.6393   3.7795 -13.6845   9.1401   87.863   26.157   60.696   29.670 27.16741 39.55387 
1 1 1   26   22   27 o  116.377   21.441   11.352   3.6785   11.508   3.9790   10.437   9.6491  116.412   23.146  108.250   41.528 8.161438 47.54252 
1 1 1   26   22   28 f   84.101   25.176   6.0784   3.4941   7.4721   3.7536  -2.9703   9.5643   92.615   25.616   76.574   35.275 16.04093 43.59490 
1 1 1   26   22   29 o   47.029   21.433  -1.6335   3.4067  -1.0719   3.6962  -4.8027   8.7807   50.910   22.846   70.121   32.807 -19.21040 39.97775 
1 1 1   26   22   30 o  117.971   24.874   12.132   4.3500   3.1887   8.0203   15.859   5.1777   82.976   35.501  134.568   26.080 -51.59140 44.05106 
1 1 1   26   22   31 o   72.985   24.910   4.4107   3.3393   5.6320   4.6257   3.0814   4.8255   81.757   29.217   71.266   28.732 10.49125 40.97754 
1 1 1   26   22   32 o  122.716   17.905   12.469   3.2641   17.947   4.3434   5.3596   4.9477  146.410   19.897   80.603   29.996 65.80702 35.99478 
1 1 1   26   22   33 o   80.614   24.940   5.7493   3.3913   2.6786   4.8099   8.7848   4.7823   68.925   28.347   96.852   29.558 -27.92650 40.95422 
1 1 1   26   22   34 o   79.473   24.606   5.6118   3.3003   6.8071   5.1413   4.7740   4.3043   86.395   30.810   75.830   28.025 10.56468 41.64963 
1 1 1   26   22   35 f   63.644   23.906   3.0353   3.1572   3.3868   4.5304   2.7034   4.4023   69.980   27.970   66.802   27.255 3.177948 39.05376 
1 1 1   26   23    0 o  183.260   32.490   28.969   8.2591   28.969   8.2591   28.969   8.2591  183.260   32.490  183.260   32.490 0.000000 0.000000 
1 1 1   26   23    1 o  120.897   29.568   12.471   5.4261   14.616   7.7065   10.362   7.6412  128.644   37.096  111.083   37.684 17.56126 52.87863 
1 1 1   26   23    2 f   82.572   30.990   4.6151   5.3033   11.134   7.3452  -2.4837   7.6650  113.943   36.894   72.409   32.660 41.53402 49.27325 
1 1 1   26   23    3 o  210.169   18.306   35.033   5.8302   25.421   7.8469   46.879   8.7110  173.253   30.714  240.512   23.982 -67.25819 38.96839 
1 1 1   26   23    4 o  102.584   32.209   8.8555   5.6327   16.630   7.3108  -2.5007   8.8357  137.778   34.689   77.840   35.091 59.93797 49.34325 
1 1 1   26   23    5 o  183.503   14.922   26.440   4.1550   24.008   4.6740   35.604   9.0724  173.862   17.815  206.262   29.584 -32.39990 34.53350 
1 1 1   26   23    6 o  145.305   18.894   16.921   4.1027   17.359   4.6365   15.341   8.8077  146.332   21.327  130.842   40.145 15.49017 45.45892 
1 1 1   26   23    7 o  104.365   22.600   9.0212   3.5056   8.3928   3.8567   12.009   8.4099  100.024   25.202  117.873   39.536 -17.84872 46.88485 
1 1 1   26   23    8 o  304.140   11.470   71.637   5.3394   71.407   6.2834   72.234   10.129  302.946   13.551  299.868   22.226 3.078583 26.03134 
1 1 1   26   23    9 f  173.887   17.374   23.995   4.5623   24.653   5.3699   22.287   8.6502  175.122   20.417  158.685   36.390 16.43739 41.72576 
1 1 1   26   23   10 o  110.796   29.309   10.502   5.0471   10.502   5.0471   0.0000   0.0000  110.796   29.309  ?   ?  0.000000 29.30875 
1 1 1   26   23   11 o  251.516   13.315   49.352   5.1079   47.750   5.8886   54.220   10.265  246.481   15.690  256.729   26.504 -10.24773 30.80015 
1 1 1   26   23   12 o  254.811   13.578   50.702   5.2768   54.806   6.1259   38.898   10.388  264.291   15.207  212.961   32.932 51.33008 36.27360 
1 1 1   26   23   13 o   57.921   25.768  -1.1591   4.5953  -0.6876   5.1567  -2.9778   10.128   62.816   27.651   81.890   37.179 -19.07383 46.33437 
1 1 1   26   23   14 o  248.875   14.663   48.565   5.5611   50.181   6.5958   44.592   10.342  251.871   17.212  229.892   30.116 21.97958 34.68767 
1 1 1   26   23   15 o  201.781   17.541   32.346   5.3635   30.009   6.3093   38.437   10.185  192.398   21.810  211.429   32.513 -19.03123 39.15059 
1 1 1   26   23   16 o  331.983   12.371   85.688   6.2865   89.639   7.6439   77.429   11.050  338.434   14.756  308.550   23.577 29.88406 27.81360 
1 1 1   26   23   17 o  119.626   29.107   12.365   5.2789   16.035   6.2537   3.2668   9.8462  135.754   30.803   92.989   39.549 42.76478 50.12892 
1 1 1   26   23   18 o  130.839   17.536   13.757   3.4236   15.821   3.6524  -1.1840   9.8275  140.520   17.350   83.267   37.316 57.25294 41.15219 
1 1 1   26   23   19 o   70.504   22.839   3.9671   2.8146   4.6353   2.9597  -2.3520   9.1015   75.273   23.301   77.965   35.338 -2.692589 42.32852 
1 1 1   26   23   20 o   99.521   16.450   8.0068   2.4183   8.1319   2.5103   6.3942   9.0146  100.146   16.984   97.898   39.340 2.247681 42.84922 
1 1 1   26   23   21 o  219.133   10.287   37.226   3.4504   40.686   3.7914   20.545   8.3248  228.935   10.820  149.433   36.671 79.50177 38.23340 
1 1 1   26   23   22 o  200.816   11.528   31.483   3.5284   33.579   3.8834   21.562   8.4482  207.134   12.304  152.809   36.602 54.32480 38.61464 
1 1 1   26   23   23 o   51.294   22.260  -0.1014   3.2405  -0.1014   3.2405   0.0000   0.0000   51.294   22.260  ?   ?  0.000000 22.25981 
1 1 1   26   23   24 o  143.893   15.627   16.557   3.3865   17.609   3.6794   10.729   8.6615  148.080   16.515  109.127   39.847 38.95238 43.13343 
1 1 1   26   23   25 o  116.521   20.334   11.273   3.4947   12.451   3.8039   4.9025   8.8488  122.248   21.091   91.459   38.106 30.78893 43.55302 
1 1 1   26   23   26 o  255.515   11.066   50.887   4.3280   56.304   4.8714   30.588   9.4303  268.411   11.857  181.982   35.128 86.42896 37.07472 
1 1 1   26   23   27 o   73.463   25.857   4.2693   3.6097   3.7114   3.9437   7.1509   8.9632   71.582   26.752   96.983   39.137 -25.40133 47.40670 
1 1 1   26   23   28 o   67.034   29.253   0.4918   5.6618   0.0312   7.8431   0.9929   8.1816   75.275   33.564   78.664   34.718 -3.389000 48.28938 
1 1 1   26   23   29 o  123.646   30.427   14.072   5.7194   13.452   7.7503   14.814   8.4751  116.350   37.913  120.695   39.662 -4.344963 54.86755 
1 1 1   26   23   30 o   52.741   23.267  -0.3267   3.6705   0.8650   4.1599  -4.5166   7.8003   59.856   25.587   65.419   30.707 -5.562576 39.97048 
1 1 1   26   23   31 o  142.748   15.881   16.562   3.4110   22.618   4.6814   9.7083   4.9802  165.206   18.851  101.849   29.952 63.35782 35.38996 
1 1 1   26   23   32 o  116.723   29.609   12.810   5.2981   0.0000   0.0000   12.810   5.2981  ?   ?   116.723   29.609 0.000000 29.60905 
1 1 1   26   23   33 o   37.839   18.243  -4.2145   3.1532  -0.5773   4.1810  -9.0120   4.8018   54.612   24.417   41.903   20.684 12.70863 32.00019 
1 1 1   26   23   34 o   71.767   24.581   4.4118   3.2517   9.0273   4.4080  -1.0980   4.8162   97.965   27.998   56.624   25.681 41.34138 37.99204 
1 1 1   26   24    0 o  128.434   43.867   17.261   7.7406   17.261   7.7406   17.261   7.7406  128.434   43.867  128.434   43.867 0.000000 0.000000 
1 1 1   26   24    1 o  231.426   16.920   42.263   5.9521   39.576   8.2861   45.129   8.5555  220.024   25.051  235.667   24.055 -15.64233 34.73041 
1 1 1   26   24    2 o  259.189   15.689   52.747   6.1948   48.752   8.3948   57.524   9.1792  245.853   22.560  267.139   22.663 -21.28633 31.97756 
1 1 1   26   24    3 o  218.628   18.213   37.927   6.0392   34.061   8.0792   42.823   9.0915  203.080   26.634  228.066   26.540 -24.98572 37.59972 
1 1 1   26   24    4 o   80.936   31.162   4.1369   5.4460   7.8267   7.2228  -0.7248   8.2908  100.286   36.422   78.920   34.884 21.36662 50.43301 
1 1 1   26   24    5 o  346.142   9.8513   92.520   5.2194   91.816   6.0806   94.492   10.174  344.251   11.540  344.964   19.346 -0.7124634 22.52630 
1 1 1   26   24    6 o  329.572   10.277   83.946   5.1844   87.106   5.9389   73.824   10.628  335.280   11.573  302.368   23.140 32.91217 25.87228 
1 1 1   26   24    7 o   85.346   25.590   6.0211   3.6078   7.9277   3.9367  -3.9773   9.0152   97.020   25.988   75.552   34.597 21.46830 43.27068 
1 1 1   26   24    8 o  363.291   9.7218  101.914   5.4059  101.914   5.4059   0.0000   0.0000  363.291   9.7218  ?   ?  0.000000 9.721784 
1 1 1   26   24    9 o  202.532   13.975   32.125   4.3058   32.125   4.3058   0.0000   0.0000  202.532   13.975  ?   ?  0.000000 13.97516 
1 1 1   26   24   10 o  208.831   12.435   33.992   3.9569   32.955   4.2510   40.715   10.825  205.244   13.609  217.301   33.633 -12.05734 36.28164 
1 1 1   26   24   11 o  210.978   12.269   34.683   3.9449   36.878   4.2931   22.776   9.9993  217.350   12.963  156.987   41.123 60.36302 43.11768 
1 1 1   26   24   12 o  117.062   20.655   11.219   3.5656   10.967   3.8278   12.866   9.8031  115.059   22.541  120.817   42.602 -5.758209 48.19827 
1 1 1   26   24   13 o  229.953   11.188   40.990   3.9378   40.927   4.2498   41.373   10.470  229.206   12.157  219.591   32.098 9.615112 34.32359 
1 1 1   26   24   14 o  113.664   21.357   10.654   3.5792   13.441   3.8179  -9.5716   10.284  128.495   20.068   71.996   34.230 56.49866 39.67921 
1 1 1   26   24   15 f   52.566   22.770  -0.1309   3.3787  -1.1639   3.5887   7.9283   10.023   50.578   22.617  105.290   41.757 -54.71190 47.48867 
1 1 1   26   24   16 o  134.213   18.047   14.507   3.6135   15.162   3.8664   9.9857   10.158  136.918   18.958  111.140   42.616 25.77847 46.64254 
1 1 1   26   24   17 o  118.571   21.897   11.650   3.8276   16.983   4.2159 -13.3645   9.1307  144.720   19.531   61.865   30.112 82.85522 35.89165 
1 1 1   26   24   18 o   82.674   24.680   5.7190   3.3611   4.8447   3.6532   10.541   8.5794   77.771   26.057  110.223   39.747 -32.45107 47.52709 
1 1 1   26   24   19 o  126.858   19.669   13.154   3.6955   11.864   4.1744   17.826   7.9467  118.687   23.807  138.957   36.785 -20.26991 43.81680 
1 1 1   26   24   20 o  118.022   15.063   11.127   2.6591   11.295   2.8186   9.7692   8.0198  118.638   15.923  106.235   38.411 12.40262 41.58043 
1 1 1   26   24   21 o  169.818   13.002   22.687   3.3540   25.590   3.7108   9.7316   7.8388  180.207   13.552  105.498   37.999 74.70925 40.34381 
1 1 1   26   24   22 o  149.514   16.268   17.916   3.6629   17.916   3.6629   0.0000   0.0000  149.514   16.268  ?   ?  0.000000 16.26794 
1 1 1   26   24   23 o   79.454   24.040   5.3237   3.1734   6.5645   3.4268  -2.1458   8.4079   87.500   24.574   74.099   33.732 13.40078 41.73433 
1 1 1   26   24   24 o  142.904   15.447   16.346   3.3251   17.993   3.6301   7.7655   8.2865  149.730   16.092   98.286   38.271 51.44421 41.51625 
1 1 1   26   24   25 o   85.029   23.994   6.2084   3.2588   9.9196   3.5519 -13.5339   8.1924  108.183   22.195   56.202   27.600 51.98055 35.41709 
1 1 1   26   24   26 o   60.248   27.580  -2.3618   5.7223 -10.9207   7.8064   7.5782   8.4127   57.146   27.821   96.968   38.319 -39.82231 47.35371 
1 1 1   26   24   27 o  167.474   24.018   23.911   5.9806   20.982   8.3911   26.936   8.5262  146.391   37.332  169.805   33.991 -23.41467 50.48834 
1 1 1   26   24   28 o   65.062   25.706   2.5946   3.7852   6.3195   4.3376  -9.2996   7.7510   85.012   28.394   58.372   28.255 26.64006 40.05699 
1 1 1   26   24   29 o  235.770   12.727   44.004   4.5757   54.174   5.5198   21.665   8.1809  260.862   13.874  147.811   36.400 113.0509 38.95494 
1 1 1   26   24   30 o  171.672   16.433   23.991   4.2652   29.007   5.1049   12.395   7.7624  187.820   17.977  109.948   37.963 77.87211 42.00431 
1 1 1   26   24   31 o  145.648   17.449   17.506   3.8126   23.184   4.4021   0.4637   7.6263  167.878   17.384   73.183   32.829 94.69550 37.14786 
1 1 1   26   24   32 f   92.490   23.292   7.6166   3.2955   7.3414   4.4288   7.9580   4.9331   88.936   28.633   91.814   30.264 -2.878365 41.66209 
1 1 1   26   25    0 o  269.449   21.929   57.900   8.9064   57.900   8.9064   57.900   8.9064  269.449   21.929  269.449   21.929 0.000000 0.000000 
1 1 1   26   25    1 o   58.003   26.689  -3.3203   5.4533  -4.7378   7.5048  -1.7346   7.9377   66.822   30.946   74.947   33.566 -8.125740 45.65416 
1 1 1   26   25    2 o   70.587   29.424   1.5675   5.2798   1.7882   7.2586   1.3195   7.6940   80.455   34.076   81.044   34.726 -0.5884857 48.65187 
1 1 1   26   25    3 o  286.916   14.781   64.484   6.4691   61.834   8.8284   67.556   9.5068  277.772   20.918  289.993   21.572 -12.22147 30.04875 
1 1 1   26   25    4 o  130.260   28.956   14.499   5.6237   18.249   7.3860   9.3269   8.6749  144.061   34.037  107.969   39.809 36.09148 52.37576 
1 1 1   26   25    5 o  188.730   19.826   28.574   5.6417   21.505   7.2868   39.152   8.9141  158.149   31.210  217.027   27.448 -58.87776 41.56295 
1 1 1   26   25    6 o   49.434   22.775  -2.6614   3.9885  -0.6084   4.5024 -10.1457   8.5965   58.938   25.893   63.771   30.584 -4.833847 40.07283 
1 1 1   26   25    7 o  200.751   14.718   31.664   4.4910   31.664   4.4910   0.0000   0.0000  200.751   14.718  ?   ?  0.000000 14.71816 
1 1 1   26   25    8 o  186.596   14.121   27.327   4.0033   29.668   4.3159   12.903   10.713  194.294   14.620  121.654   44.332 72.63981 46.68040 
1 1 1   26   25    9 o  115.461   22.417   11.042   3.8188   9.4631   4.0934   21.637   10.605  105.748   25.570  151.226   43.491 -45.47862 50.45076 
1 1 1   26   25   10 o   94.477   24.558   7.5213   3.5840   5.8688   3.8080   20.338   10.605   84.377   26.482  146.316   43.876 -61.93904 51.24791 
1 1 1   26   25   11 o  186.556   13.655   27.296   3.8720   27.373   4.1166   26.710   11.402  186.521   14.534  167.372   43.946 19.14920 46.28745 
1 1 1   26   25   12 o   69.478   25.301   3.4101   3.4887   4.0824   3.7281  -1.3280   9.8968   73.984   26.252   83.383   37.402 -9.399101 45.69590 
1 1 1   26   25   13 o  113.894   21.941   10.754   3.6862   12.306   3.9807   1.4193   9.7646  121.945   22.142   88.329   38.484 33.61566 44.39971 
1 1 1   26   25   14 o   60.911   24.507   1.6974   3.5029   3.1174   3.8038  -6.2286   8.9865   69.180   26.184   70.792   33.143 -1.611954 42.23795 
1 1 1   26   25   15 o  177.081   14.158   24.702   3.8054   26.724   4.1911   15.209   9.0820  183.906   15.020  127.491   40.999 56.41551 43.66327 
1 1 1   26   25   16 o   47.872   21.974  -2.2203   3.6664  -4.5049   4.0970   6.9655   8.2153   45.661   21.679   97.599   38.077 -51.93851 43.81620 
1 1 1   26   25   17 o   94.348   24.198   7.5689   3.5113   7.7963   3.8851   6.5552   8.2046   95.383   25.930   96.036   37.877 -0.6531372 45.90208 
1 1 1   26   25   18 o   81.350   25.514   5.5214   3.5355   7.0229   4.0155   0.3428   7.4573   90.586   26.960   76.113   33.384 14.47337 42.91056 
1 1 1   26   25   19 o  192.306   13.275   29.092   3.8834   36.467   4.5047   7.7514   7.6630  215.197   13.748   98.187   37.164 117.0101 39.62545 
1 1 1   26   25   20 o  176.442   15.253   24.750   4.0788   26.380   4.7518   20.188   7.9504  181.230   17.342  147.630   35.598 33.60008 39.59742 
1 1 1   26   25   21 o   59.490   22.502   2.2810   2.8080   2.2810   2.8080   0.0000   0.0000   59.490   22.502  ?   ?  0.000000 22.50173 
1 1 1   26   25   22 o   88.715   23.918   6.7522   3.3219   6.7522   3.3219   0.0000   0.0000   88.715   23.918  ?   ?  0.000000 23.91833 
1 1 1   26   25   23 o   65.028   24.232   2.9458   3.2312   1.8308   3.5104   9.1302   8.2673   60.859   24.516  102.438   38.643 -41.57898 45.76366 
1 1 1   26   25   24 o  149.493   29.938   19.980   6.6115   66.163   11.896  -0.6615   7.9530  275.788   28.596   74.536   33.475 201.2514 44.02617 
1 1 1   26   25   25 o   82.478   33.307   4.4802   6.4966   25.731   11.579  -5.2837   7.8484  154.073   45.765   65.127   30.644 88.94597 55.07655 
1 1 1   26   25   26 o  128.634   19.984   13.810   3.8070   15.464   4.3943   8.8337   7.6225  135.130   22.002   98.859   37.144 36.27124 43.17130 
1 1 1   26   25   27 o  158.381   15.672   20.257   3.7494   21.731   4.2973   15.557   7.6737  163.075   17.489  124.272   37.335 38.80312 41.22783 
1 1 1   26   25   28 o   96.421   24.032   8.2146   3.5342   11.568   4.0624  -2.2221   7.1670  114.928   23.874   66.495   30.596 48.43285 38.80826 
1 1 1   26   25   29 o  103.850   24.701   9.6204   3.8692   12.596   4.5858   2.2691   7.2083  118.366   26.021   76.322   33.160 42.04459 42.15053 
1 1 1   26   25   30 o   59.028   24.599   1.4771   3.6886   0.5249   4.2226   4.5439   7.5778   58.428   25.383   82.867   34.941 -24.43888 43.18760 
1 1 1   26   25   31 f   63.983   25.601   2.5647   3.7998   4.5197   4.3756  -3.4315   7.6629   74.664   28.125   65.351   30.599 9.313034 41.56039 
1 1 1   26   26    0 o  204.790   31.378   35.679   9.1496   35.679   9.1496   35.679   9.1496  204.790   31.378  204.790   31.378 0.000000 0.000000 
1 1 1   26   26    1 o  477.087   11.826  176.694   8.6355  172.891   11.987  180.797   12.451  468.634   16.711  479.011   16.982 -10.37650 23.82564 
1 1 1   26   26    2 o   79.206   31.683   3.4051   5.8181   3.9256   7.9874   2.8169   8.4918   88.874   36.538   87.624   36.970 1.249718 51.97892 
1 1 1   26   26    3 o  122.176   30.805   12.989   5.7594   16.160   7.8127   9.2158   8.5237  133.746   36.942  106.807   39.445 26.93864 54.04277 
1 1 1   26   26    4 o  130.300   28.966   14.583   5.6273   11.284   7.2597   19.548   8.9068  113.322   36.678  145.930   39.090 -32.60782 53.60305 
1 1 1   26   26    5 o   82.291   33.984   3.0032   6.9496   3.0032   6.9496   0.0000   0.0000   82.291   33.984  ?   ?  0.000000 33.98418 
1 1 1   26   26    6 f  204.933   16.072   33.202   5.0010   33.202   5.0010   0.0000   0.0000  204.933   16.072  ?   ?  0.000000 16.07208 
1 1 1   26   26    7 o  137.818   18.451   15.298   3.7944   17.285   4.1421   4.9288   9.4619  146.445   18.921   95.936   39.639 50.50920 43.92367 
1 1 1   26   26    8 o  244.138   11.190   46.232   4.1816   50.251   4.6458   29.082   9.5979  254.293   11.936  180.527   35.998 73.76576 37.92475 
1 1 1   26   26    9 o  310.333   9.5572   74.444   4.5397   75.332   5.0275   70.521   10.565  311.847   10.533  293.858   23.691 17.98926 25.92654 
1 1 1   26   26   10 o  275.708   10.247   58.858   4.3244   60.106   4.7860   53.307   10.093  278.290   11.236  253.172   26.435 25.11794 28.72365 
1 1 1   26   26   11 o  331.871   9.2176   85.108   4.6823   90.791   5.2765   64.055   10.156  342.455   10.066  279.455   23.976 62.99939 26.00300 
1 1 1   26   26   12 o   85.246   25.619   6.1002   3.6129   6.4647   4.0122   4.5373   8.3076   87.683   27.127   90.787   37.287 -3.103844 46.11060 
1 1 1   26   26   13 o  305.883   9.6651   72.405   4.5251   83.479   5.2956   42.437   8.7116  328.098   10.545  225.656   25.679 102.4421 27.76009 
1 1 1   26   26   14 o   89.483   24.896   6.8032   3.5345   6.7354   4.0586   7.0163   7.1912   89.095   27.237   95.349   36.023 -6.253792 45.16121 
1 1 1   26   26   15 o  267.815   11.600   55.824   4.7551   69.923   5.9709   31.378   7.8623  299.074   13.043  192.137   27.520 106.9364 30.45467 
1 1 1   26   26   16 o  166.307   15.103   21.957   3.8025   23.360   4.3607   17.506   7.7680  170.820   16.900  137.293   36.381 33.52725 40.11456 
1 1 1   26   26   17 o   93.454   24.479   7.4794   3.5434   10.067   4.0394  -1.1576   7.3805  108.373   24.878   72.038   32.307 36.33483 40.77581 
1 1 1   26   26   18 o  161.214   17.078   20.890   4.1500   25.624   4.8955   8.7980   7.8238  178.156   18.209  101.744   37.748 76.41244 41.90992 
1 1 1   26   26   19 o   51.841   23.240  -1.1439   3.8148  -4.8175   4.4952   8.3114   7.2118   47.644   22.646   98.913   36.323 -51.26957 42.80387 
1 1 1   26   26   20 o   75.439   28.344   4.1091   4.4386   4.1091   4.4386   0.0000   0.0000   75.439   28.344  ?   ?  0.000000 28.34398 
1 1 1   26   26   21 o  179.089   19.199   26.152   5.1808   26.152   5.1808   0.0000   0.0000  179.089   19.199  ?   ?  0.000000 19.19921 
1 1 1   26   26   22 o  123.425   32.584   14.085   6.2461   21.967   10.457   9.7128   7.7883  145.466   43.555  103.569   37.790 41.89680 57.66353 
1 1 1   26   26   23 o  107.751   20.128   9.7309   3.1975   8.6271   3.5100   15.115   7.7522   99.967   23.360  124.147   37.576 -24.18007 44.24554 
1 1 1   26   26   24 o  180.811   13.399   25.938   3.6818   29.098   4.1891   15.209   7.7182  191.033   14.433  123.809   37.499 67.22398 40.18031 
1 1 1   26   26   25 o   79.004   24.972   5.3885   3.3806   4.0399   3.7716   10.899   7.6239   71.986   26.293  105.855   37.544 -33.86863 45.83500 
1 1 1   26   26   26 o   86.499   24.305   6.5991   3.3512   7.8992   3.8396   2.4414   6.8662   93.912   25.881   76.278   32.747 17.63393 41.73959 
1 1 1   26   26   27 o  231.548   12.226   42.401   4.3177   52.304   5.3005   22.870   7.4438  256.298   13.560  155.261   32.371 101.0372 35.09667 
1 1 1   26   26   28 o  239.016   12.288   45.252   4.4804   58.969   5.7245   23.567   7.1980  271.738   13.809  158.601   30.761 113.1369 33.71777 
1 1 1   26   26   29 o   80.312   25.360   5.7463   3.4871   5.7027   4.0009   5.8841   7.1125   80.214   27.268   85.648   34.758 -5.433983 44.17743 
1 1 1   26   27    0 o  467.498   16.886  170.538   12.047  170.538   12.047  170.538   12.047  467.498   16.886  467.498   16.886 0.000000 0.000000 
1 1 1   26   27    1 o  195.708   21.976   31.196   6.4693   26.362   9.1775   35.971   9.1208  171.316   36.136  205.385   29.890 -34.06981 46.89577 
1 1 1   26   27    2 o  436.008   12.251  147.913   8.1758  154.915   11.593  140.986   11.532  442.775   17.106  421.801   17.861 20.97379 24.73141 
1 1 1   26   27    3 o   69.008   29.939   0.2526   5.8589  -0.4283   7.6045   1.2470   9.1904   75.641   33.423   85.824   37.366 -10.18343 50.13285 
1 1 1   26   27    4 o  190.280   28.493   30.701   8.0432   30.701   8.0432   0.0000   0.0000  190.280   28.493  ?   ?  0.000000 28.49308 
1 1 1   26   27    5 o  166.831   22.872   22.898   5.6868   21.468   7.3871   24.978   8.9098  156.560   31.909  166.484   36.012 -9.923553 48.11483 
1 1 1   26   27    6 o  123.323   29.174   13.211   5.4209   28.790   7.0414  -9.4586   8.4938  185.873   25.416   63.676   30.502 122.1963 39.70326 
1 1 1   26   27    7 o  108.914   25.208   10.087   4.1192   17.074   4.8225  -8.7669   7.9219  143.713   22.675   61.772   29.555 81.94055 37.25135 
1 1 1   26   27    8 o  162.064   17.475   21.034   4.2663   21.700   4.9389   19.077   8.4679  163.473   20.166  143.508   37.964 19.96532 42.98778 
1 1 1   26   27    9 f  106.791   24.656   9.6880   3.9487   11.563   4.6860   5.0973   7.3333  115.956   26.920   89.374   35.631 26.58159 44.65680 
1 1 1   26   27   10 o  126.747   21.665   13.294   4.0520   17.798   4.8789   3.2799   7.2748  146.705   22.441   83.500   34.650 63.20443 41.28205 
1 1 1   26   27   11 o  256.737   11.385   51.258   4.4741   50.520   5.4097   52.855   7.9594  253.500   13.996  255.497   20.526 -1.996277 24.84376 
1 1 1   26   27   12 o   51.910   23.240  -1.1590   3.8013  -4.0213   4.5142   5.8182   7.0480   49.637   23.319   90.532   35.283 -40.89495 42.29246 
1 1 1   26   27   13 o  119.066   25.590   12.144   4.5248   17.496   5.8386   4.0950   7.1596  142.321   27.799   85.085   34.741 57.23603 44.49439 
1 1 1   26   27   14 o  135.207   23.357   15.339   4.6591   18.070   5.9582   11.040   7.4744  144.480   27.953  110.233   37.271 34.24751 46.58833 
1 1 1   26   27   15 o   65.315   25.806   2.3978   3.8147   5.0138   4.4794  -4.5082   7.2780   80.130   28.739   64.761   30.156 15.36871 41.65707 
1 1 1   26   27   16 o   91.047   24.889   7.1248   3.5678   7.8822   4.0396   4.4394   7.6068   95.270   26.655   87.039   35.705 8.231499 44.55735 
1 1 1   26   27   17 f   61.960   24.743   2.0025   3.5418   2.7718   4.0609  -0.4426   7.2401   67.997   26.701   72.681   32.339 -4.683823 41.93764 
1 1 1   26   27   18 o  134.073   18.725   14.695   3.7378   22.572   4.3577  -7.2337   7.2711  167.343   17.261   59.875   28.555 107.4684 33.36649 
1 1 1   26   27   19 o  145.908   19.978   17.537   4.3446   17.537   4.3446   0.0000   0.0000  145.908   19.978  ?   ?  0.000000 19.97843 
1 1 1   26   27   20 o  111.372   25.441   10.808   4.2419   10.808   4.2419   0.0000   0.0000  111.372   25.441  ?   ?  0.000000 25.44113 
1 1 1   26   27   21 o  107.040   23.281   9.8619   3.7058   8.8172   4.2870   12.950   7.3709   99.510   27.316  115.608   36.910 -16.09742 45.91794 
1 1 1   26   27   22 o   67.994   29.664   0.6805   5.8186   10.946   10.285  -4.1515   7.0563  107.644   42.422   63.112   29.490 44.53187 51.66527 
1 1 1   26   27   23 o   38.990   18.780  -4.4823   3.3229  -3.9793   3.7917  -6.1476   6.8991   43.765   20.801   58.702   27.946 -14.93749 34.83758 
1 1 1   26   27   24 o  154.711   14.769   19.242   3.4550   22.362   3.9499   9.0822   7.1287  166.372   15.696   98.438   36.118 67.93390 39.38137 
1 1 1   26   27   25 o   43.288   19.976  -1.8909   3.0864  -1.9464   3.4487  -1.6677   6.9170   45.991   21.185   66.442   30.381 -20.45064 37.03820 
1 1 1   26   27   26 o   66.427   24.649   3.3448   3.3363   2.9477   3.7781   4.7510   7.1096   66.040   25.806   82.841   34.305 -16.80061 42.92795 
1 1 1   26   27   27 o   87.777   25.021   6.9312   3.5254   5.7299   4.0753   10.503   7.0273   80.541   27.519  102.260   36.069 -21.71918 45.36803 
1 1 1   26   28    0 o   54.984   36.737  -1.6066   8.4979  -1.6066   8.4979  -1.6066   8.4979   54.984   36.737   54.984   36.737 0.000000 0.000000 
1 1 1   26   28    1 o  252.246   24.286   52.535   9.2610   52.535   9.2610   0.0000   0.0000  252.246   24.286  ?   ?  0.000000 24.28646 
1 1 1   26   28    2 o  342.094   19.862   94.116   10.355   94.116   10.355   0.0000   0.0000  342.094   19.862  ?   ?  0.000000 19.86181 
1 1 1   26   28    3 o   87.748   32.603   5.8300   5.8407   7.4615   8.2053   4.1543   8.3158   98.996   38.212   89.419   37.071 9.577019 53.23927 
1 1 1   26   28    4 o  172.804   24.138   24.846   6.2103   28.894   8.7282   20.696   8.8382  180.950   32.718  148.718   38.519 32.23203 50.53856 
1 1 1   26   28    5 o   92.215   32.557   6.9679   5.7270   7.0907   7.7422   6.8196   8.5105   96.665   37.171   97.501   38.537 -0.8360901 53.54293 
1 1 1   26   28    6 o   97.944   32.430   8.2655   5.6623   11.256   7.6367   4.6136   8.4387  111.716   37.674   90.824   37.473 20.89236 53.13685 
1 1 1   26   28    7 o   59.658   26.266  -0.4914   4.6553   3.5901   5.7904  -7.9519   7.8285   78.807   31.578   62.161   29.641 16.64598 43.31023 
1 1 1   26   28    8 o   50.934   22.841  -1.1959   3.6880   0.3983   4.3036  -5.6037   7.1561   60.321   25.912   62.418   29.335 -2.097542 39.14035 
1 1 1   26   28    9 f  133.157   19.416   14.486   3.8408   11.966   4.4025   22.513   7.8582  118.404   25.073  158.166   33.502 -39.76237 41.84487 
1 1 1   26   28   10 o   82.041   25.776   5.6431   3.6067   7.2104   4.2017   1.2546   7.0309   91.533   27.655   76.411   32.974 15.12154 43.03542 
1 1 1   26   28   11 o  132.648   19.820   14.434   3.9007   21.684   4.6209  -3.5416   7.2758  163.562   18.799   66.608   30.714 96.95344 36.01055 
1 1 1   26   28   12 o  130.911   22.738   14.359   4.3909   18.052   5.3392   6.6436   7.7179  146.032   24.772   94.309   36.875 51.72314 44.42336 
1 1 1   26   28   13 o  105.726   23.628   9.5286   3.7274   14.593   4.2896  -6.0837   7.5314  132.299   21.953   63.211   29.826 69.08743 37.03420 
1 1 1   26   28   14 f  166.538   15.406   22.108   3.8826   25.598   4.4749   11.482   7.8091  178.766   16.542  111.332   38.094 67.43398 41.53006 
1 1 1   26   28   15 o   78.277   25.367   5.1016   3.4717   6.0096   3.9988   2.3228   6.9954   84.196   27.218   78.576   33.375 5.620049 43.06648 
1 1 1   26   28   16 o  185.263   13.412   27.107   3.7776   32.651   4.4472   12.743   7.1583  202.940   14.411  116.187   36.282 86.75287 39.03927 
1 1 1   26   28   17 o  141.609   17.109   16.243   3.6332   17.532   4.2273   12.602   7.1069  146.092   19.383  115.250   36.178 30.84267 41.04329 
1 1 1   26   28   18 o   83.929   27.931   6.0174   4.1983   6.0174   4.1983   0.0000   0.0000   83.929   27.931  ?   ?  0.000000 27.93111 
1 1 1   26   28   19 o   85.559   26.029   6.3834   3.7128   6.7067   4.2850   5.4098   7.4371   87.496   28.164   87.780   35.570 -0.2833328 45.37029 
1 1 1   26   28   20 o   82.535   26.192   5.9124   3.7161   4.8264   4.2611   9.3617   7.5941   77.409   27.997  100.736   37.226 -23.32632 46.57891 
1 1 1   26   28   21 o  138.499   18.517   15.833   3.8272   19.066   4.5676   8.2154   7.0119  151.144   20.253   95.614   35.684 55.52991 41.03050 
1 1 1   26   28   22 o   90.933   30.064   7.5014   4.8669   16.742   7.3185   0.1745   6.5167  130.065   35.685   69.169   30.733 60.89624 47.09481 
1 1 1   26   28   23 o   86.900   31.637   6.6313   5.4543   7.7815   10.052   6.1514   6.4933   96.879   40.510   86.582   33.832 10.29713 52.77916 
1 1 1   26   28   24 o  292.651   10.176   66.971   4.5580   80.098   5.6122   41.533   7.8124  319.117   11.490  219.631   23.610 99.48613 26.25733 
1 1 1   26   28   25 o   60.675   23.707   2.3776   3.1883   4.0750   3.5945  -3.8851   6.9044   70.974   25.707   61.697   28.937 9.276920 38.70672 
1 1 1   26   29    1 o  286.043   23.779   67.632   10.317   0.0000   0.0000   67.632   10.317  ?   ?   286.043   23.779 0.000000 23.77893 
1 1 1   26   29    2 o  130.429   32.892   15.388   6.5654   22.202   9.4533   9.0379   9.1252  152.111   40.051  104.795   40.340 47.31653 56.84550 
1 1 1   26   29    3 o  131.833   32.252   15.638   6.4545   14.607   8.9015   16.781   9.3729  123.732   40.646  131.424   41.586 -7.691673 58.15061 
1 1 1   26   29    4 o  133.132   30.715   15.747   6.1315   14.974   8.6280   16.536   8.7151  125.276   39.927  131.280   39.866 -6.003632 56.42174 
1 1 1   26   29    5 o   92.915   33.590   7.0846   6.1330   9.3843   8.5086   4.5976   8.8482  104.901   39.277   91.390   38.093 13.51074 54.71493 
1 1 1   26   29    6 o  156.871   21.791   20.341   5.0909   14.739   6.2878   31.002   8.6742  127.814   32.165  187.648   31.303 -59.83359 44.88344 
1 1 1   26   29    7 o   91.946   30.076   7.2564   4.8757   12.792   6.1097  -2.4517   8.0908  118.758   32.614   72.424   33.016 46.33327 46.40836 
1 1 1   26   29    8 o   35.034   17.501  -9.8540   3.8635 -10.3344   4.4513  -8.3867   7.7794   38.676   19.234   60.968   29.201 -22.29247 34.96666 
1 1 1   26   29    9 o   76.766   27.021   4.6404   3.9420   11.422   4.6276 -13.2986   7.5263  114.527   26.863   53.463   26.295 61.06337 37.59010 
1 1 1   26   29   10 o  171.206   16.221   23.452   4.2000   23.790   4.9111   22.531   8.1037  171.054   19.083  156.504   34.736 14.54979 39.63235 
1 1 1   26   29   11 o   60.707   26.358   0.1743   4.5481  -1.3527   5.5307   3.3637   7.9930   62.000   27.874   84.932   35.853 -22.93223 45.41365 
1 1 1   26   29   12 o   46.429   21.688  -3.0683   3.8116  -3.9233   4.3150  -0.0316   8.1318   48.153   22.677   77.060   34.280 -28.90620 41.10223 
1 1 1   26   29   13 o   64.414   25.775   2.2308   3.8517   3.9660   4.3871  -3.6046   8.0451   74.434   28.133   69.453   32.120 4.980843 42.69856 
1 1 1   26   29   14 o   93.772   25.795   7.6848   3.8182   6.5847   4.2970   11.812   8.3227   87.266   28.215  111.375   39.256 -24.10828 48.34396 
1 1 1   26   29   15 o   66.212   25.509   2.8729   3.6514   2.0698   4.2241   5.2470   7.2624   65.334   26.682   87.253   35.223 -21.91944 44.18779 
1 1 1   26   29   16 o   61.864   24.719   2.0934   3.5371   3.1427   4.1063  -0.9239   6.9633   69.218   26.944   69.398   31.231 -0.1794815 41.24737 
1 1 1   26   29   17 o   56.045   24.774  -0.4067   4.1818  -0.4067   4.1818   0.0000   0.0000   56.045   24.774  ?   ?  0.000000 24.77389 
1 1 1   26   29   18 o   91.346   25.806   7.3954   3.7673   8.5134   4.3757   4.1929   7.4061   97.113   27.938   83.457   34.824 13.65582 44.64540 
1 1 1   26   29   19 o  193.736   14.403   29.994   4.2406   38.816   5.0023   7.4634   7.9944  220.174   14.932   94.088   37.299 126.0860 40.17693 
1 1 1   26   29   20 o   39.781   19.299  -5.4472   3.6688  -4.4952   4.2856  -8.0591   7.0987   46.145   21.984   56.592   27.307 -10.44710 35.05631 
1 1 1   26   29   21 o  106.152   24.201   9.9505   3.8449   10.987   4.5716   7.4446   7.1077  109.854   27.306   91.986   35.548 17.86823 44.82504 
1 1 1   26   29   22 o  149.588   22.931   19.294   5.0829   21.976   7.3728   16.866   7.0171  151.500   32.749  130.472   34.580 21.02840 47.62652 
1 1 1   26   29   23 o  170.516   20.423   24.500   5.2243   37.573   7.5047   12.207   7.2772  208.133   23.997  109.120   36.776 99.01314 43.91269 
1 1 1   26   30    0 o   81.759   45.874   8.5598   8.6622   8.5598   8.6622   8.5598   8.6622   81.759   45.874   81.759   45.874 0.000000 0.000000 
1 1 1   26   30    1 o  105.357   33.723   10.028   6.1501   24.225   8.8692  -3.1209   8.5357  160.777   36.831   72.850   33.472 87.92725 49.76854 
1 1 1   26   30    2 f  184.256   23.833   28.421   6.5640   35.661   9.0353   20.329   9.5519  201.827   30.174  143.460   41.279 58.36681 51.13158 
1 1 1   26   30    3 o   73.945   34.180  -3.7788   9.0926   0.0000   0.0000  -3.7788   9.0926  ?   ?    73.945   34.180 0.000000 34.18002 
1 1 1   26   30    4 o  109.732   40.472   10.955   8.9678   0.0000   0.0000   10.955   8.9678  ?   ?   109.732   40.472 0.000000 40.47248 
1 1 1   26   30    5 o  105.537   40.138   9.6939   8.9656   0.0000   0.0000   9.6939   8.9656  ?   ?   105.537   40.138 0.000000 40.13823 
1 1 1   26   30    6 o  170.413   20.578   23.877   5.2589   25.858   6.7186   20.743   8.4501  174.025   26.022  147.577   37.370 26.44838 45.53760 
1 1 1   26   30    7 o   85.535   30.033   6.0539   4.8679   7.9225   6.1918   3.0296   7.8771   95.727   33.847   83.448   35.429 12.27951 48.99805 
1 1 1   26   30    8 o  200.178   17.152   32.234   5.2045   40.276   6.5894   18.898   8.4858  222.337   19.562  139.458   38.493 82.87836 43.17818 
1 1 1   26   30    9 o   86.150   29.870   6.2467   4.8078   7.8400   6.0200   3.4409   7.9889   94.877   33.393   84.563   35.778 10.31379 48.94021 
1 1 1   26   30   10 o   55.802   24.641  -0.4679   4.1265   3.5134   4.8154 -11.4727   8.0059   73.800   29.046   57.515   28.039 16.28463 40.37129 
1 1 1   26   30   11 f   91.087   28.939   7.3114   4.5353   8.3308   5.4124   4.9081   8.3102   96.370   31.696   88.945   36.982 7.425613 48.70647 
1 1 1   26   30   12 o  136.595   20.382   15.527   4.1309   16.275   4.7064   13.016   8.6212  138.455   23.016  114.830   39.988 23.62520 46.13832 
1 1 1   26   30   13 o   71.904   26.893   3.8241   3.9868   2.3635   4.5230   8.9118   8.4415   67.665   27.619  100.383   38.755 -32.71805 47.58945 
1 1 1   26   30   14 o  184.055   15.081   27.127   4.2113   29.860   4.8942   19.331   8.2652  192.150   16.810  139.468   37.781 52.68285 41.35217 
1 1 1   26   30   15 o  173.641   15.862   24.304   4.1693   26.381   4.7638   17.506   8.6187  179.989   17.514  130.529   39.646 49.46014 43.34209 
1 1 1   26   30   16 o  228.930   14.347   41.802   5.0020   41.802   5.0020   0.0000   0.0000  228.930   14.347  ?   ?  0.000000 14.34726 
1 1 1   26   30   17 o  113.704   23.494   11.250   3.9535   13.184   4.5059   4.7839   8.2409  122.481   24.884   86.604   36.473 35.87712 44.15311 
1 1 1   26   30   18 o   44.334   21.017  -3.7557   3.8216  -4.3325   4.3518  -1.8117   7.9889   46.885   22.284   70.689   32.443 -23.80390 39.35948 
1 1 1   26   30   19 f  154.739   17.601   19.687   4.0946   18.700   4.7305   22.635   8.1767  148.376   21.452  150.975   35.907 -2.599152 41.82740 
1 1 1   26   30   20 o   40.134   19.421  -5.1360   3.6549  -4.2414   4.1697  -8.1024   7.5933   45.672   21.738   58.521   28.239 -12.84843 35.63668 
1 1 1   26   30   21 o   94.285   26.045   8.0716   3.8832   10.420   4.4865   1.0607   7.7528  106.434   27.382   75.023   33.416 31.41156 43.20234 
1 1 1   26   31    0 o   56.828   37.223   0.4465   8.0528   0.4465   8.0528   0.4465   8.0528   56.828   37.223   56.828   37.223 0.000000 0.000000 
1 1 1   26   31    1 o   75.970   30.792   3.3646   5.5744   1.8588   7.7776   4.9552   7.9935   79.562   34.506   88.417   36.475 -8.855721 50.21023 
1 1 1   26   31    2 o   73.739   30.695   2.5333   5.7343   5.3844   7.8952  -0.6498   8.3422   89.382   36.488   75.987   34.191 13.39523 50.00380 
1 1 1   26   31    3 o   55.840   26.221  -4.3921   5.6969 -10.6069   7.8774   2.4225   8.2487   57.872   28.123   82.456   35.648 -24.58394 45.40577 
1 1 1   26   31    4 o  140.176   28.138   17.385   5.8274   15.369   8.1980   19.444   8.2849  124.689   38.810  141.215   37.644 -16.52597 54.06766 
1 1 1   26   31    5 o  106.000   32.053   10.354   5.6426   19.548   8.0308   1.3892   7.9298  142.283   36.651   78.752   34.486 63.53164 50.32438 
1 1 1   26   31    6 f  207.366   16.966   34.681   5.3380   36.973   6.8779   31.209   8.4651  210.899   21.612  186.439   30.735 24.45973 37.57254 
1 1 1   26   31    7 o   70.095   30.379   1.0274   6.0198   1.8296   10.002   0.5718   7.5378   86.026   38.156   75.186   33.246 10.83991 50.60826 
1 1 1   26   31    8 o  103.543   33.902   10.007   6.1944   6.5166   10.244   12.019   7.7774   96.580   40.669  111.134   38.016 -14.55367 55.67085 
1 1 1   26   31    9 o  113.634   33.048   12.189   6.0932   3.2658   9.8545   17.713   7.7529   88.177   38.533  134.433   36.665 -46.25584 53.18898 
1 1 1   26   31   10 o   69.596   28.719   2.4243   4.9574   10.428   6.3753  -9.8163   7.8843  104.949   34.395   58.461   28.346 46.48707 44.57016 
1 1 1   26   31   11 o   60.837   26.973  -0.3444   4.9940  -0.6196   6.4465   0.0685   7.8975   67.345   30.199   74.855   33.506 -7.510689 45.10677 
1 1 1   26   31   12 o   70.490   28.890   2.7094   4.9745   2.9590   6.4355   2.3388   7.8406   76.711   32.265   79.686   34.603 -2.975288 47.31163 
1 1 1   26   31   13 o   55.684   25.465  -1.9408   4.8617  -3.6661   6.3924   0.4263   7.4878   60.359   28.158   73.764   32.849 -13.40554 43.26579 
1 1 1   26   31   14 o   66.494   30.066  -1.0030   6.5429  -1.0030   6.5429   0.0000   0.0000   66.494   30.066  ?   ?  0.000000 30.06598 
1 1 1   26   31   15 o  260.053   19.638   55.973   7.7590   55.973   7.7590   0.0000   0.0000  260.053   19.638  ?   ?  0.000000 19.63752 
1 1 1   26   31   16 o   86.623   30.520   6.6821   5.0301   8.5619   6.3808   3.5962   8.1754   95.553   34.298   82.814   35.647 12.73932 49.46764 
1 1 1   26   31   17 o   78.601   30.066   4.9042   5.0486   1.6295   6.2625   10.983   8.5327   71.418   30.969  104.362   39.282 -32.94415 50.02116 
1 1 1   26   32    0 o  299.835   21.325   72.582   9.6730   72.582   9.6730   72.582   9.6730  299.835   21.325  299.835   21.325 0.000000 0.000000 
1 1 1   26   32    1 o   74.473   30.285   3.2993   5.4131   2.7538   7.9308   3.7750   7.4065   81.313   35.055   82.425   34.638 -1.112038 49.28127 
1 1 1   26   32    2 o  204.669   19.552   34.505   6.0506   32.046   9.0428   36.498   8.1417  185.878   32.992  204.667   26.620 -18.78905 42.39201 
1 1 1   26   32    3 f   82.419   31.152   5.3998   5.3794   5.3599   8.0836   5.4314   7.2069   88.548   36.617   86.743   35.063 1.805046 50.69716 
1 1 1   26   32    4 o   68.505   29.208   1.5604   5.3951   1.8833   8.0175   1.2932   7.2934   79.368   34.718   75.438   33.053 3.929497 47.93567 
1 1 1   26   32    5 o  183.980   21.223   28.313   5.8668   29.816   8.6620   27.039   7.9745  179.074   32.811  171.507   31.540 7.566864 45.51196 
1 1 1   26   32    6 o  122.658   26.615   13.389   4.8531   15.357   6.3777   10.682   7.4801  127.387   32.580  105.125   37.198 22.26208 49.44845 
1 1 1   26   32    7 o  119.453   27.200   12.807   4.8618   16.896   6.3047   6.8093   7.6362  134.767   31.183   91.564   36.405 43.20276 47.93418 
1 1 1   26   32    8 o   92.720   29.662   7.8178   4.7585   4.6805   5.9309   13.487   7.9725   80.629   32.075  115.241   38.495 -34.61178 50.10638 
1 1 1   26   32    9 o  170.337   19.868   24.134   5.0826   24.961   6.3976   22.720   8.3690  169.130   25.506  151.647   36.496 17.48293 44.52572 
1 1 1   26   32   10 o   61.163   25.670   1.3968   4.0594   0.3087   4.7188   4.4950   7.9623   60.965   26.652   85.042   35.835 -24.07677 44.65981 
1 1 1   26   32   11 o   76.366   27.569   4.7932   4.1291   6.1557   4.8281   1.0833   7.9669   84.141   29.873   76.564   34.002 7.576996 45.26056 
1 1 1   26   32   12 o  109.149   28.691   11.005   4.8565   11.005   4.8565   0.0000   0.0000  109.149   28.691  ?   ?  0.000000 28.69131 
1 1 1   26   32   13 o   85.230   29.680   6.4468   4.7495   6.4468   4.7495   0.0000   0.0000   85.230   29.680  ?   ?  0.000000 29.68006 
1 1 1   26   32   14 o   89.026   27.031   7.1786   4.0071   3.5032   4.6198   18.343   8.0518   71.595   28.363  133.253   37.755 -61.65753 47.22209 
1 1 1   26   33    0 o  236.334   27.324   47.350   9.5403   47.350   9.5403   47.350   9.5403  236.334   27.324  236.334   27.324 0.000000 0.000000 
1 1 1   26   33    1 o  210.253   19.366   36.554   6.1624   48.507   8.9874   25.948   8.4659  236.599   25.205  163.924   34.816 72.67427 42.98226 
1 1 1   26   33    2 o   67.292   29.253   0.9770   5.6156  -1.6894   8.5381   3.0098   7.4549   73.091   33.544   79.662   34.159 -6.571495 47.87488 
1 1 1   26   33    3 o   85.708   31.977   6.2459   5.6298   2.8028   8.5104   8.9250   7.5071   82.200   35.868   97.857   36.843 -15.65672 51.41911 
1 1 1   26   33    4 o  163.892   24.991   23.417   6.0709   24.611   9.0186   22.428   8.2094  155.881   38.116  150.613   36.084 5.267990 52.48730 
1 1 1   26   33    5 f   68.608   29.821   1.1343   5.8342   4.7585   8.6446  -1.8974   7.9063   87.111   37.053   70.205   32.241 16.90560 49.11624 
1 1 1   26   33    6 o   67.206   28.211   1.9868   4.9042   6.9235   6.4499  -4.7783   7.5504   89.387   34.033   63.573   29.956 25.81379 45.33894 
1 1 1   26   33    7 o  118.580   28.296   12.892   5.0643   16.875   6.4575   6.5298   8.1623  133.157   32.066   90.709   37.073 42.44785 49.01661 
1 1 1   26   33    8 o  163.926   20.907   22.652   5.1264   32.770   6.5176   6.2371   8.3017  196.551   22.044   90.010   37.155 106.5400 43.20257 
1 1 1   27    0    1 o   96.137   18.079   7.8236   2.3853   7.8236   2.3853   7.8236   2.3853   96.137   18.079   96.137   18.079 0.000000 0.000000 
1 1 1   27    0    2 o  136.077   12.163   14.556   2.4868   14.556   2.4868   14.556   2.4868  136.077   12.163  136.077   12.163 0.000000 0.000000 
1 1 1   27    0    3 o  368.252   7.7375  104.070   4.3570  104.070   4.3570  104.070   4.3570  368.252   7.7375  368.252   7.7375 0.000000 0.000000 
1 1 1   27    0    4 o  607.138   8.1570  282.711   7.5773  282.711   7.5773  282.711   7.5773  607.138   8.1570  607.138   8.1570 0.000000 0.000000 
1 1 1   27    0    5 o  240.424   8.3479   44.472   3.0636   44.472   3.0636   44.472   3.0636  240.424   8.3479  240.424   8.3479 0.000000 0.000000 
1 1 1   27    0    6 o  154.842   8.8523   18.563   2.0823   18.563   2.0823   18.563   2.0823  154.842   8.8523  154.842   8.8523 0.000000 0.000000 
1 1 1   27    0    7 o  259.095   9.1090   51.672   3.6023   51.672   3.6023   51.672   3.6023  259.095   9.1090  259.095   9.1090 0.000000 0.000000 
1 1 1   27    0    8 o   40.738   25.596   0.6939   3.3376   0.6939   3.3376   0.6939   3.3376   40.738   25.596   40.738   25.596 0.000000 0.000000 
1 1 1   27    0    9 o  348.256   8.5987   93.166   4.5772   93.166   4.5772   93.166   4.5772  348.256   8.5987  348.256   8.5987 0.000000 0.000000 
1 1 1   27    0   10 o   94.019   23.939   8.0249   2.9784   8.0249   2.9784   8.0249   2.9784   94.019   23.939   94.019   23.939 0.000000 0.000000 
1 1 1   27    0   11 o  120.054   17.947   11.830   3.0808   11.830   3.0808   11.830   3.0808  120.054   17.947  120.054   17.947 0.000000 0.000000 
1 1 1   27    0   12 o  171.795   13.513   23.116   3.5028   23.116   3.5028   23.116   3.5028  171.795   13.513  171.795   13.513 0.000000 0.000000 
1 1 1   27    0   13 o  294.304   10.235   66.727   4.5980   66.727   4.5980   66.727   4.5980  294.304   10.235  294.304   10.235 0.000000 0.000000 
1 1 1   27    0   14 f  148.813   18.329   17.861   4.0050   17.861   4.0050   17.861   4.0050  148.813   18.329  148.813   18.329 0.000000 0.000000 
1 1 1   27    0   15 o  318.608   10.724   78.224   5.2165   78.224   5.2165   78.224   5.2165  318.608   10.724  318.608   10.724 0.000000 0.000000 
1 1 1   27    0   16 o  172.022   16.664   23.469   4.2931   23.469   4.2931   23.469   4.2931  172.022   16.664  172.022   16.664 0.000000 0.000000 
1 1 1   27    0   17 o  278.575   12.205   60.022   5.1814   60.022   5.1814   60.022   5.1814  278.575   12.205  278.575   12.205 0.000000 0.000000 
1 1 1   27    0   18 o   91.896   33.171   8.7743   4.2770   8.7743   4.2770   8.7743   4.2770   91.896   33.171   91.896   33.171 0.000000 0.000000 
1 1 1   27    0   19 o   94.121   33.820   9.2036   4.4580   9.2036   4.4580   9.2036   4.4580   94.121   33.820   94.121   33.820 0.000000 0.000000 
1 1 1   27    0   20 o  178.249   17.873   25.313   4.7640   25.313   4.7640   25.313   4.7640  178.249   17.873  178.249   17.873 0.000000 0.000000 
1 1 1   27    0   22 o  302.058   17.659   71.368   8.1007   71.368   8.1007   71.368   8.1007  302.058   17.659  302.058   17.659 0.000000 0.000000 
1 1 1   27    0   23 o   35.264   24.682  -4.8369   4.9747  -4.8369   4.9747  -4.8369   4.9747   35.264   24.682   35.264   24.682 0.000000 0.000000 
1 1 1   27    0   24 o  232.096   17.063   42.377   5.9865   42.377   5.9865   42.377   5.9865  232.096   17.063  232.096   17.063 0.000000 0.000000 
1 1 1   27    0   25 o   56.485   28.588   3.7136   3.0748   3.7136   3.0748   3.7136   3.0748   56.485   28.588   56.485   28.588 0.000000 0.000000 
1 1 1   27    0   26 o  273.613   10.365   57.813   4.3269   57.813   4.3269   57.813   4.3269  273.613   10.365  273.613   10.365 0.000000 0.000000 
1 1 1   27    0   27 o  179.225   13.864   25.234   3.7509   25.234   3.7509   25.234   3.7509  179.225   13.864  179.225   13.864 0.000000 0.000000 
1 1 1   27    0   28 o   39.613   24.403   1.0280   2.8857   1.0280   2.8857   1.0280   2.8857   39.613   24.403   39.613   24.403 0.000000 0.000000 
1 1 1   27    0   29 o  157.149   19.148   20.046   4.4233   20.046   4.4233   20.046   4.4233  157.149   19.148  157.149   19.148 0.000000 0.000000 
1 1 1   27    0   30 o  172.018   17.909   23.734   4.5984   23.734   4.5984   23.734   4.5984  172.018   17.909  172.018   17.909 0.000000 0.000000 
1 1 1   27    0   31 o  241.608   9.9745   45.142   3.6744   45.142   3.6744   45.142   3.6744  241.608   9.9745  241.608   9.9745 0.000000 0.000000 
1 1 1   27    0   32 o  120.439   18.653   12.059   3.1930   12.059   3.1930   12.059   3.1930  120.439   18.653  120.439   18.653 0.000000 0.000000 
1 1 1   27    0   33 o  342.239   14.308   91.182   7.4653   91.182   7.4653   91.182   7.4653  342.239   14.308  342.239   14.308 0.000000 0.000000 
1 1 1   27    0   34 o  228.237   11.893   40.539   4.1291   40.539   4.1291   40.539   4.1291  228.237   11.893  228.237   11.893 0.000000 0.000000 
1 1 1   27    0   35 o  205.843   12.106   33.072   3.7840   33.072   3.7840   33.072   3.7840  205.843   12.106  205.843   12.106 0.000000 0.000000 
1 1 1   27    0   36 o   55.937   30.480   3.6690   3.6986   3.6690   3.6986   3.6690   3.6986   55.937   30.480   55.937   30.480 0.000000 0.000000 
1 1 1   27    0   37 o  148.896   17.227   17.994   3.7893   17.994   3.7893   17.994   3.7893  148.896   17.227  148.896   17.227 0.000000 0.000000 
1 1 1   27    0   38 o   69.066   31.997   5.7009   3.7389   5.7009   3.7389   5.7009   3.7389   69.066   31.997   69.066   31.997 0.000000 0.000000 
1 1 1   27    0   39 o   41.835   28.022  -1.2119   4.9985  -1.2119   4.9985  -1.2119   4.9985   41.835   28.022   41.835   28.022 0.000000 0.000000 
1 1 1   27    0   40 o   30.699   21.485  -3.4697   3.7660  -3.4697   3.7660  -3.4697   3.7660   30.699   21.485   30.699   21.485 0.000000 0.000000 
1 1 1   27    0   41 o   57.361   31.325   4.0190   3.9149   4.0190   3.9149   4.0190   3.9149   57.361   31.325   57.361   31.325 0.000000 0.000000 
1 1 1   27    0   42 o   44.486   28.488   0.8604   4.3697   0.8604   4.3697   0.8604   4.3697   44.486   28.488   44.486   28.488 0.000000 0.000000 
1 1 1   27    0   43 o   54.279   31.475   3.4543   4.2729   3.4543   4.2729   3.4543   4.2729   54.279   31.475   54.279   31.475 0.000000 0.000000 
1 1 1   27    0   44 o   24.320   17.699  -7.8443   3.7852  -7.8443   3.7852  -7.8443   3.7852   24.320   17.699   24.320   17.699 0.000000 0.000000 
1 1 1   27    0   45 o  108.109   32.611   12.087   4.7057   12.087   4.7057   12.087   4.7057  108.109   32.611  108.109   32.611 0.000000 0.000000 
1 1 1   27    1    0 o  114.585   14.646   10.577   2.4540   10.577   2.4540   10.577   2.4540  114.585   14.646  114.585   14.646 0.000000 0.000000 
1 1 1   27    1    1 o  242.262   6.1013   44.996   2.2625   45.249   3.1913   44.741   3.2079  242.732   8.5896  241.355   8.6836 1.377274 12.21415 
1 1 1   27    1    2 o  346.005   5.5189   91.756   2.9228   94.888   4.1950   88.800   4.0746  351.609   7.7948  340.138   7.8264 11.47076 11.04584 
1 1 1   27    1    3 o  196.331   6.7347   29.564   2.0238   27.009   2.9216   31.921   2.8062  187.115   10.240  203.835   8.9943 -16.72041 13.62898 
1 1 1   27    1    4 o  364.976   5.4064  102.089   3.0203  107.023   4.4059   97.714   4.1483  373.421   7.7084  356.826   7.5953 16.59503 10.82170 
1 1 1   27    1    5 o  167.390   7.2995   21.499   1.8702   24.065   4.5438   20.976   2.0521  175.275   17.157  165.290   8.1111 9.984955 18.97755 
1 1 1   27    1    6 o  273.320   6.3798   57.287   2.6690   62.694   3.9715   52.833   3.6043  285.635   9.0839  262.223   8.9800 23.41235 12.77335 
1 1 1   27    1    7 o   55.141   19.617   2.0562   2.0829   3.2719   2.7958   0.5398   3.1226   66.929   22.794   54.150   22.605 12.77870 32.10185 
1 1 1   27    1    8 o  164.423   8.6668   20.827   2.1735   21.414   3.3259   20.389   2.8715  166.029   13.196  162.252   11.640 3.777039 17.59602 
1 1 1   27    1    9 o  245.962   7.6047   46.439   2.8630   45.411   5.0187   46.935   3.4859  242.056   13.601  247.098   9.2166 -5.041901 16.42951 
1 1 1   27    1   10 o  262.135   6.8251   52.719   2.7384   55.472   4.1076   50.516   3.6740  268.513   9.9942  256.320   9.3647 12.19220 13.69604 
1 1 1   27    1   11 o  250.785   7.2339   48.271   2.7768   52.802   4.1018   44.437   3.7728  261.919   10.231  240.275   10.259 21.64375 14.48863 
1 1 1   27    1   12 o  298.911   6.8807   68.561   3.1481   71.917   4.5865   65.571   4.3287  305.723   9.8014  291.941   9.6872 13.78152 13.78070 
1 1 1   27    1   13 o   75.108   20.535   4.5648   2.4285   7.7651   3.5129   1.6351   3.3611   97.277   23.790   60.734   24.151 36.54248 33.90042 
1 1 1   27    1   14 o  175.516   10.647   23.821   2.8468   28.207   4.1943   20.074   3.8763  190.260   14.512  159.972   16.047 30.28835 21.63599 
1 1 1   27    1   15 o  133.129   13.883   13.867   2.7873   13.795   4.1212   13.928   3.7840  130.905   21.301  132.120   19.279 -1.215775 28.73006 
1 1 1   27    1   16 o   99.289   19.124   7.9648   2.8009   10.554   4.1733   5.8422   3.7783  113.201   24.774   85.300   26.314 27.90154 36.14076 
1 1 1   27    1   17 o  155.652   12.985   18.874   3.0654   20.952   4.5927   17.204   4.1164  162.567   18.805  147.148   18.699 15.41890 26.51902 
1 1 1   27    1   18 o  105.118   19.400   8.9292   3.0064   10.348   4.5866   7.8601   3.9808  111.391   27.149   97.389   26.152 14.00270 37.69633 
1 1 1   27    1   19 o   58.765   23.808   1.3053   3.3309 -10.8139   5.8482   7.1247   4.0525   48.072   23.548   92.965   26.927 -44.89277 35.77143 
1 1 1   27    1   20 o  126.446   18.852   12.805   3.5372   6.0319   6.2168   16.048   4.3013   91.916   33.728  141.328   20.481 -49.41183 39.45955 
1 1 1   27    1   21 o  137.123   19.477   15.067   3.9729   19.251   5.1155   8.7076   6.3068  154.331   22.302  103.307   34.227 51.02375 40.85180 
1 1 1   27    1   22 o   93.511   26.952   7.2503   4.0690   0.0736   8.6183   9.3090   4.6159   82.919   36.140  105.248   28.119 -22.32976 45.79055 
1 1 1   27    1   23 o  174.922   14.203   23.943   3.7698   20.294   5.6332   26.902   5.0732  157.668   24.108  184.230   18.230 -26.56253 30.22505 
1 1 1   27    1   24 o   35.526   16.577  -2.0283   2.2181  -3.7217   2.8234   0.7015   3.5848   36.958   17.672   57.671   24.160 -20.71362 29.93313 
1 1 1   27    1   25 o  206.253   7.4156   32.710   2.3411   31.985   3.7124   33.189   3.0165  202.840   12.011  207.445   9.5001 -4.604431 15.31368 
1 1 1   27    1   26 o   91.125   16.266   6.6865   2.1855   9.8277   3.4518   4.5846   2.8236  109.421   21.377   75.184   22.660 34.23689 31.15224 
1 1 1   27    1   27 o  174.682   10.614   23.680   2.8245   24.210   3.7875   23.016   4.2396  175.685   14.206  170.571   16.442 5.113876 21.72943 
1 1 1   27    1   28 o  185.972   10.482   26.830   2.9716   26.896   4.0092   26.749   4.4268  185.156   14.256  184.113   15.864 1.043304 21.32817 
1 1 1   27    1   29 o  251.833   7.0956   48.781   2.7351   51.220   4.4860   47.337   3.4507  257.037   11.402  247.679   9.1022 9.357605 14.58980 
1 1 1   27    1   30 o  103.142   17.435   8.6074   2.6544   1.3811   6.4031   10.107   2.9168   75.159   31.927  111.901   17.612 -36.74203 36.46263 
1 1 1   27    1   31 o  134.705   12.536   14.239   2.5551   13.134   4.5642   14.743   3.0835  125.083   24.716  136.373   15.021 -11.29069 28.92270 
1 1 1   27    1   32 o   73.468   19.725   4.4609   2.2649   6.3071   3.3847   2.9640   3.0477   86.578   24.461   65.031   23.653 21.54703 34.02653 
1 1 1   27    1   33 o   91.078   18.324   6.8123   2.4660   5.7113   3.5426   7.8474   3.4349   82.765   25.471   96.363   23.499 -13.59836 34.65560 
1 1 1   27    1   34 o  281.547   6.9953   61.037   3.0146   61.454   4.5698   60.716   4.0112  281.394   10.610  280.133   9.3548 1.260620 14.14503 
1 1 1   27    1   35 o  116.243   14.699   10.789   2.5568   10.637   3.7548   10.921   3.4914  112.452   22.599  114.791   20.629 -2.339066 30.59878 
1 1 1   27    1   36 o   37.789   17.479  -1.7604   2.3833  -4.1741   3.3766   0.6360   3.3643   40.432   19.331   54.970   23.236 -14.53729 30.22578 
1 1 1   27    1   37 f  144.930   12.857   16.597   2.8225   17.692   3.8085   15.263   4.2040  147.929   17.137  135.518   20.942 12.41074 27.06066 
1 1 1   27    1   38 o   96.155   20.223   7.7898   2.8820   7.4829   5.0977   7.9340   3.4940   92.100   30.782   95.660   23.925 -3.559944 38.98573 
1 1 1   27    1   39 o   87.184   22.347   6.5489   2.9960   9.4080   3.9237   2.5516   4.6395  103.531   25.035   68.851   28.023 34.68077 37.57710 
1 1 1   27    1   40 o  135.016   13.783   14.573   2.8085   11.503   3.9111   17.841   4.0355  115.546   22.924  147.286   18.295 -31.73988 29.32919 
1 1 1   27    1   41 o   93.767   19.783   7.4823   2.7500   7.4895   3.8258   7.4746   3.9556   91.296   26.080   91.034   26.671 0.2620468 37.30306 
1 1 1   27    1   42 f   61.003   22.861   2.6985   2.8838   2.6475   3.8900   2.7606   4.2969   64.898   25.926   67.016   27.079 -2.117599 37.48895 
1 1 1   27    1   43 o   60.694   22.739   2.7216   2.8528   6.8521   4.2125  -0.7778   3.8773   85.946   27.948   51.883   23.331 34.06248 36.40665 
1 1 1   27    1   44 o  188.363   10.539   28.025   3.0263   26.724   4.2141   29.411   4.3486  180.804   15.373  189.949   15.081 -9.145096 21.53557 
1 1 1   27    1   45 o   78.446   23.748   5.6078   3.0962   7.7290   4.3473   3.4243   4.4108   89.397   28.325   68.660   27.543 20.73708 39.50898 
1 1 1   27    2    0 o  276.089   8.1676   58.582   3.4447   58.582   3.4447   58.582   3.4447  276.089   8.1676  276.089   8.1676 0.000000 0.000000 
1 1 1   27    2    1 o  163.160   7.5830   20.429   1.8937   21.950   2.7294   19.018   2.6297  168.571   10.633  156.804   11.027 11.76756 15.31819 
1 1 1   27    2    2 o   65.449   16.200   3.4494   1.6142   3.3055   2.3291   3.5824   2.2392   65.482   20.731   67.358   20.152 -1.875946 28.91201 
1 1 1   27    2    3 o  111.206   11.917   9.6359   1.9969   12.527   4.2429   8.8133   2.2633  124.492   23.118  105.856   14.337 18.63596 27.20269 
1 1 1   27    2    4 o  189.265   11.227   27.677   3.2380   31.312   5.0065   25.063   4.2454  200.310   16.475  179.252   15.630 21.05827 22.70955 
1 1 1   27    2    5 o   68.691   15.096   3.7915   1.5439  -0.0546   4.2747   4.3685   1.6556   60.235   25.849   73.820   15.160 -13.58526 29.96631 
1 1 1   27    2    6 o  356.431   6.0756   97.406   3.3146   96.281   6.9544   97.736   3.7704  353.244   12.862  356.941   6.9012 -3.696960 14.59665 
1 1 1   27    2    7 o  238.647   5.9893   43.665   2.1878   42.625   5.7761   43.839   2.3639  233.913   16.233  239.087   6.4596 -5.175018 17.47142 
1 1 1   27    2    8 o  342.580   5.4579   89.955   2.8619   87.142   7.0128   90.518   3.1348  335.838   13.642  343.599   5.9606 -7.760498 14.88769 
1 1 1   27    2    9 o   79.091   12.940   4.9518   1.5123   6.1316   5.1547   4.8406   1.5820   90.304   30.949   78.026   13.748 12.27750 33.86548 
1 1 1   27    2   10 o  130.433   9.0902   13.140   1.8035   0.0000   0.0000   13.140   1.8035  ?   ?   130.433   9.0902 0.000000 9.090169 
1 1 1   27    2   11 o  154.040   7.8629   18.268   1.8477   16.197   5.9080   18.493   1.9453  140.097   28.521  154.942   8.2321 -14.84523 29.68505 
1 1 1   27    2   12 o   97.272   19.040   7.6316   2.7333   6.4319   5.4853   8.0279   3.1525   92.403   31.912   99.337   21.368 -6.933929 38.40541 
1 1 1   27    2   13 o   99.903   19.274   8.0521   2.8405   3.6508   6.0102   9.3180   3.2232   82.737   32.486  107.396   20.353 -24.65898 38.33500 
1 1 1   27    2   14 f  206.208   10.506   32.841   3.3051   26.277   6.4100   35.217   3.8575  180.900   23.722  213.299   11.862 -32.39903 26.52226 
1 1 1   27    2   15 o  129.171   15.424   13.132   2.9892   17.223   6.0629   11.818   3.4358  144.234   28.473  121.538   19.099 22.69547 34.28582 
1 1 1   27    2   16 o  206.804   10.952   33.072   3.4543   33.684   6.9838   32.874   3.9744  205.351   22.593  205.822   12.678 -0.4704742 25.90642 
1 1 1   27    2   17 o  155.450   12.353   18.795   2.9149   15.368   4.7044   20.931   3.7137  137.593   23.160  163.500   15.007 -25.90659 27.59744 
1 1 1   27    2   18 o   92.449   20.177   6.9706   2.7750   5.5547   4.5142   7.8308   3.5183   85.148   28.964   97.405   23.801 -12.25665 37.48827 
1 1 1   27    2   19 o   88.975   20.321   6.4732   2.7067   7.4418   4.5663   5.9485   3.3608   95.151   28.848   85.256   24.472 9.894775 37.82976 
1 1 1   27    2   20 o   93.104   23.593   7.1635   3.3663   13.407   4.8255   1.2452   4.6983  127.287   25.654   66.941   27.818 60.34544 37.84140 
1 1 1   27    2   21 o   49.003   21.192  -0.2104   2.9167  -1.6389   4.9534   0.5478   3.6087   59.392   26.563   57.356   24.145 2.035397 35.89672 
1 1 1   27    2   22 o  145.223   12.730   16.463   2.8011   11.115   8.6344   17.092   2.9613  115.844   40.036  147.879   13.223 -32.03514 42.16334 
1 1 1   27    2   23 o  237.589   8.5474   43.454   3.1084   44.907   6.3224   42.991   3.5696  238.755   17.421  236.089   9.8780 2.665649 20.02655 
1 1 1   27    2   24 f   40.233   17.746  -0.5516   2.1346  -0.6794   2.8958  -0.3994   3.1590   46.892   20.677   50.160   21.871 -3.267708 30.09798 
1 1 1   27    2   25 o  410.409   8.7381  129.754   5.4891  129.754   5.4891   0.0000   0.0000  410.409   8.7381  ?   ?  0.000000 8.738055 
1 1 1   27    2   26 o  406.401   6.6067  126.892   4.1097  134.848   5.7018  118.291   5.9288  418.284   8.9057  391.443   9.8953 26.84134 13.31274 
1 1 1   27    2   27 o  118.522   16.034   11.191   2.8341   13.631   3.6074   7.2562   4.5806  130.192   18.634   93.367   29.002 36.82445 34.47218 
1 1 1   27    2   28 o  147.267   10.215   16.842   2.2884   17.172   3.8117   16.656   2.8615  146.773   17.299  145.806   12.957 0.9667969 21.61349 
1 1 1   27    2   29 o   76.979   18.887   4.8766   2.2087   3.5355   3.7242   5.6043   2.7432   71.250   26.111   82.182   21.544 -10.93282 33.85199 
1 1 1   27    2   30 o  154.315   10.481   18.516   2.4609   17.240   4.1381   19.214   3.0609  146.301   18.923  156.592   12.885 -10.29004 22.89313 
1 1 1   27    2   31 o   97.560   18.700   7.7877   2.6908  -2.3027   6.6178   9.7863   2.9452   66.669   30.183  109.832   18.154 -43.16324 35.22180 
1 1 1   27    2   32 o  137.210   13.969   14.868   2.8929   16.495   6.6960   14.495   3.2077  136.487   32.515  134.872   15.840 1.614716 36.16840 
1 1 1   27    2   33 o   42.561   19.292  -1.3328   2.7131  -3.3984   4.9280  -0.4343   3.2500   53.983   25.027   50.316   22.055 3.666584 33.35773 
1 1 1   27    2   34 o   58.514   21.108   2.4086   2.4200   3.7649   3.8282   1.5059   3.1232   72.220   26.473   57.493   23.137 14.72641 35.15861 
1 1 1   27    2   35 o  119.506   14.288   11.372   2.5617   5.4289   3.9067   15.854   3.3930   81.181   26.940  140.729   16.038 -59.54807 31.35293 
1 1 1   27    2   36 o   69.609   21.197   3.9980   2.4614   3.4341   3.5637   4.5123   3.4036   69.136   25.511   74.706   25.151 -5.569710 35.82404 
1 1 1   27    2   37 o  122.969   14.266   12.075   2.6353   8.0979   3.8623   15.540   3.6049   96.366   25.709  138.402   17.402 -42.03563 31.04494 
1 1 1   27    2   38 o  109.131   19.920   9.9542   3.2048   14.164   5.1678   7.3231   4.0852  126.511   27.474   91.168   27.207 35.34373 38.66585 
1 1 1   27    2   39 o  138.065   14.143   15.236   2.9466   18.591   4.0587   11.498   4.2847  150.806   17.935  114.632   25.114 36.17420 30.86041 
1 1 1   27    2   40 o  201.881   9.5791   31.722   2.9600   31.263   4.3448   32.120   4.0435  197.851   14.447  201.246   13.200 -3.394928 19.56924 
1 1 1   27    2   41 o  102.518   18.969   8.8459   2.8669   9.8831   3.8406   7.5406   4.3085  105.768   24.242   91.019   28.103 14.74895 37.11438 
1 1 1   27    2   42 o   48.264   20.486   0.5164   2.6324  -1.7564   3.7776   2.6619   3.6703   48.671   22.328   64.037   25.309 -15.36547 33.74988 
1 1 1   27    2   43 o   42.199   19.084  -0.9515   2.6374  -0.5747   3.6616  -1.3578   3.8020   51.106   22.849   49.683   22.643 1.422768 32.16816 
1 1 1   27    2   44 o   68.471   23.477   4.0204   2.9661   3.6175   4.1701   4.4330   4.2197   69.185   27.091   73.012   27.592 -3.827095 38.66796 
1 1 1   27    2   45 o   56.444   22.196   2.0871   2.8096   1.8416   4.3201   2.2669   3.6987   62.240   26.321   61.270   24.988 0.9706306 36.29314 
1 1 1   27    3    0 o   99.031   18.481   8.2939   2.5152   8.2939   2.5152   8.2939   2.5152   99.031   18.481   99.031   18.481 0.000000 0.000000 
1 1 1   27    3    1 f   83.765   16.667   5.6276   2.0617   8.4685   4.1604   4.7028   2.3737  101.626   26.480   76.280   20.062 25.34635 33.22147 
1 1 1   27    3    2 o  319.194   8.4492   78.242   4.1280   79.189   6.1725   77.476   5.5524  320.449   12.584  317.174   11.437 3.275360 17.00506 
1 1 1   27    3    3 o  124.144   15.435   12.108   2.8696   17.223   4.6706   9.0059   3.6370  146.962   21.391  105.150   23.218 41.81218 31.56974 
1 1 1   27    3    4 o   54.949   20.577   1.7910   2.3354   6.9006   4.5549  -0.0314   2.7202   93.026   28.924   48.361   20.683 44.66513 35.55835 
1 1 1   27    3    5 o  301.085   6.2631   69.512   2.8863   77.184   6.6197   67.711   3.2073  316.113   13.681  297.081   7.0533 19.03220 15.39231 
1 1 1   27    3    6 o  199.197   5.9682   30.421   1.8197   36.660   3.6998   28.431   2.0899  217.911   11.130  192.498   7.0931 25.41281 13.19770 
1 1 1   27    3    7 f   87.061   11.218   5.9327   1.4601   3.5184   3.1509   6.5929   1.6477   69.899   24.184   91.711   12.028 -21.81210 27.00986 
1 1 1   27    3    8 o  161.370   6.6501   19.975   1.6426   17.826   3.5227   20.572   1.8568  150.923   15.468  163.719   7.4095 -12.79544 17.15096 
1 1 1   27    3    9 o  138.166   7.3420   14.692   1.5471   14.334   3.5331   14.777   1.7209  134.685   17.556  138.475   8.1550 -3.790405 19.35754 
1 1 1   27    3   10 o  140.595   7.3905   15.214   1.5848   10.814   4.5436   15.824   1.6910  114.559   26.447  143.353   7.7355 -28.79359 27.55540 
1 1 1   27    3   11 o  238.075   5.4182   43.449   1.9744   42.945   4.2822   43.584   2.2250  235.665   11.910  238.395   6.0978 -2.730499 13.38015 
1 1 1   27    3   12 o   97.823   8.6252   7.4111   1.2782   4.5469   3.6543   7.8104   1.3644   77.596   26.061  100.397   8.9735 -22.80119 27.56278 
1 1 1   27    3   13 o   93.816   8.4017   6.8172   1.1937   6.1753   3.7642   6.8890   1.2587   87.417   26.123   94.254   8.8272 -6.837112 27.57376 
1 1 1   27    3   14 o  246.023   7.1710   46.466   2.7004   53.924   4.8200   43.054   3.2601  264.315   11.914  236.607   9.0018 27.70795 14.93226 
1 1 1   27    3   15 o   71.481   18.472   4.1420   2.0356   0.0456   4.0732   5.5056   2.3501   58.935   25.260   82.301   19.035 -23.36629 31.62882 
1 1 1   27    3   16 o  312.519   6.7276   74.966   3.2182   83.808   5.7597   70.952   3.8804  329.534   11.419  303.800   8.3448 25.73492 14.14327 
1 1 1   27    3   17 o  236.875   7.8269   43.118   2.8378   44.617   5.1980   42.482   3.3871  239.419   14.249  234.905   9.4203 4.513947 17.08117 
1 1 1   27    3   18 o  176.176   9.8467   23.987   2.6446   18.400   5.0799   26.064   3.0975  150.892   22.698  183.436   11.084 -32.54401 25.25945 
1 1 1   27    3   19 o  183.193   9.0803   25.836   2.5461   28.707   5.2017   24.931   2.9198  190.672   18.038  179.445   10.679 11.22748 20.96169 
1 1 1   27    3   20 o  138.858   11.937   15.018   2.5125   10.272   5.4196   16.317   2.8356  110.285   30.880  144.566   12.952 -34.28119 33.48629 
1 1 1   27    3   21 o  187.302   10.409   27.151   2.9724   26.462   5.6965   27.409   3.4843  181.911   20.834  187.809   12.187 -5.897903 24.13690 
1 1 1   27    3   22 o  227.057   10.692   39.807   3.7159   43.417   6.1316   37.712   4.6714  234.912   17.172  219.899   13.951 15.01314 22.12482 
1 1 1   27    3   23 o  331.064   8.4332   84.363   4.2734  100.798   11.463   81.710   4.6054  355.991   21.131  325.630   9.2400 30.36069 23.06319 
1 1 1   27    3   24 o  120.609   12.338   11.387   2.2456   8.6971   3.1267   14.253   3.2271  103.130   20.530  134.141   16.035 -31.01167 26.04979 
1 1 1   27    3   25 o   64.800   19.693   3.3506   2.1260   10.278   3.2518  -1.8214   2.8098  112.562   19.585   42.098   19.291 70.46460 27.49066 
1 1 1   27    3   26 o  125.012   11.686   12.208   2.2101   10.247   3.4025   13.640   2.9069  112.012   20.605  131.463   14.698 -19.45151 25.30967 
1 1 1   27    3   27 o  125.859   12.366   12.408   2.3515   10.003   3.6277   14.151   3.0882  110.028   22.304  133.698   15.370 -23.67041 27.08749 
1 1 1   27    3   28 o  342.594   7.3285   90.292   3.8430  104.499   5.3499   75.145   5.5238  367.918   9.5000  311.334   11.592 56.58325 14.98713 
1 1 1   27    3   29 f  182.315   8.7790   25.636   2.4499   22.642   4.2241   27.154   3.0073  168.942   16.548  187.028   10.548 -18.08574 19.62366 
1 1 1   27    3   30 o  287.835   6.7178   63.707   2.9597   62.439   4.8942   64.437   3.7161  283.745   11.269  289.097   8.3980 -5.351654 14.05409 
1 1 1   27    3   31 o  135.361   12.152   14.358   2.4910   17.617   4.3218   12.736   3.0483  147.522   19.627  126.281   16.140 21.24067 25.41078 
1 1 1   27    3   32 o  103.308   18.921   8.7355   2.8816   7.5020   6.8190   9.0036   3.1794   96.913   35.360  104.347   20.638 -7.434158 40.94225 
1 1 1   27    3   33 o   76.019   22.985   4.7734   2.9018   18.748   10.207   3.5445   3.0266  139.112   43.305   68.298   23.698 70.81467 49.36492 
1 1 1   27    3   34 o   63.508   22.024   3.0406   2.6139   7.8577   5.4668   1.6128   2.9762   95.810   31.872   57.086   22.718 38.72415 39.13972 
1 1 1   27    3   35 o  151.917   12.132   18.119   2.7975   19.420   5.2757   17.610   3.2996  152.450   23.353  148.898   14.668 3.551590 27.57750 
1 1 1   27    3   36 o  161.163   12.383   20.427   3.0312   27.483   6.1074   18.120   3.4916  181.996   22.397  150.642   15.358 31.35428 27.15648 
1 1 1   27    3   37 o   95.081   20.543   7.6117   2.9024   10.127   6.0575   6.8621   3.3067  105.159   33.448   89.269   23.776 15.89019 41.03696 
1 1 1   27    3   38 o   53.672   21.289   1.5055   2.6059   3.4120   4.2712   0.3751   3.2889   71.148   27.539   53.061   22.719 18.08609 35.70112 
1 1 1   27    3   39 o  169.819   13.609   22.918   3.5076   24.965   4.3186   18.951   6.0125  175.954   16.218  146.066   27.910 29.88788 32.28009 
1 1 1   27    3   40 o   60.425   22.198   2.6441   2.6938   3.8712   3.9175   1.5435   3.7101   71.537   26.677   60.043   24.816 11.49396 36.43509 
1 1 1   27    3   41 o   56.298   21.666   2.0378   2.6317   0.1427   3.7900   3.8023   3.6572   54.897   23.946   69.985   25.839 -15.08742 35.22851 
1 1 1   27    3   42 o   46.787   20.261   0.1120   2.6737   2.7090   3.8098  -2.4084   3.7532   64.775   25.727   46.741   21.728 18.03441 33.67450 
1 1 1   27    3   43 o  139.177   13.384   15.599   2.8160   18.481   4.0020   12.774   3.9630  148.805   17.932  120.728   22.267 28.07703 28.58964 
1 1 1   27    3   44 o  106.529   19.319   9.7545   3.0341   10.232   4.3510   9.3030   4.2331  104.024   27.067   99.076   27.122 4.947975 38.31740 
1 1 1   27    3   45 o  232.010   10.028   42.364   3.5612   34.260   6.1904   46.373   4.3538  199.318   20.587  241.478   11.779 -42.15988 23.71913 
1 1 1   27    4    0 o  174.871   17.078   24.225   4.4711   24.225   4.4711   24.225   4.4711  174.871   17.078  174.871   17.078 0.000000 0.000000 
1 1 1   27    4    1 o   60.616   26.014  -0.0551   4.3302  -0.0551   4.3302   0.0000   0.0000   60.616   26.014  ?   ?  0.000000 26.01411 
1 1 1   27    4    2 o  128.676   15.399   12.995   2.9727   9.2695   4.7881   15.331   3.7921  106.128   28.759  139.285   18.224 -33.15752 34.04721 
1 1 1   27    4    3 o   98.070   20.102   7.7689   2.9161   15.557   4.9419   3.6084   3.6120  138.758   24.145   72.371   25.823 66.38654 35.35295 
1 1 1   27    4    4 o  327.785   6.8636   82.420   3.4436   79.443   6.7539   83.466   4.0030  320.684   13.760  329.729   7.9316 -9.045929 15.88200 
1 1 1   27    4    5 o   35.935   15.359  -0.0383   1.4983  -6.8940   5.1631   0.5921   1.5656   49.751   23.818   40.692   16.380 9.059364 28.90677 
1 1 1   27    4    6 o  202.828   5.8809   31.540   1.8258   35.444   3.9924   30.507   2.0530  214.050   12.236  199.426   6.7257 14.62405 13.96308 
1 1 1   27    4    7 o   45.890   17.499   1.1462   1.7068   1.0440   3.3026   1.1835   1.9937   57.700   23.582   48.508   18.804 9.192436 30.16122 
1 1 1   27    4    8 o  266.369   8.3333   54.499   3.3976   56.022   4.5090   52.498   5.1679  269.714   10.922  260.762   12.948 8.951630 16.93946 
1 1 1   27    4    9 o   73.921   21.470   4.3766   2.5732   2.5318   3.5333   6.4601   3.7549   66.236   25.196   89.270   25.938 -23.03371 36.16073 
1 1 1   27    4   10 o  167.926   11.442   21.835   2.9235   24.123   3.9394   19.030   4.3618  175.889   14.769  155.139   18.749 20.75089 23.86736 
1 1 1   27    4   11 o   71.974   23.671   3.9455   3.0187   9.5716   4.6814  -0.0589   3.9495  107.499   28.127   57.806   24.827 49.69336 37.51663 
1 1 1   27    4   12 o   79.476   22.605   5.1075   2.8806   4.2133   3.8987   6.1825   4.2747   76.552   26.877   88.309   28.099 -11.75715 38.88393 
1 1 1   27    4   13 o  213.378   10.652   35.080   3.4789   30.127   4.5081   42.371   5.4699  196.526   15.102  233.169   15.413 -36.64330 21.57881 
1 1 1   27    4   14 o  158.171   13.829   19.513   3.3143   20.754   4.4264   17.929   5.0002  162.102   18.151  149.230   22.598 12.87227 28.98540 
1 1 1   27    4   15 o   63.310   23.650   2.4785   3.0815  -1.9509   4.1056   8.1928   4.6632   52.785   23.847   99.634   28.893 -46.84951 37.46251 
1 1 1   27    4   16 o  314.161   9.3334   75.966   4.4881   76.522   5.8376   75.161   7.0186  314.697   12.119  311.176   14.736 3.521332 19.07923 
1 1 1   27    4   17 o  274.594   7.9322   57.953   3.3339   67.545   5.7682   53.140   4.0854  295.456   12.755  262.588   10.165 32.86777 16.30972 
1 1 1   27    4   18 o  108.169   9.5301   9.0801   1.5617   14.946   5.0083   8.4483   1.6437  134.847   25.192  104.158   10.451 30.68880 27.27341 
1 1 1   27    4   19 o  191.337   7.6409   28.137   2.2378   28.726   5.4707   28.018   2.4523  190.387   19.028  190.851   8.3948 -0.4645996 20.79759 
1 1 1   27    4   20 o  121.918   11.227   11.577   2.0715   13.863   5.3595   11.175   2.2461  128.666   28.009  119.524   12.461 9.141815 30.65547 
1 1 1   27    4   21 o  137.270   10.537   14.626   2.1969   28.633   5.7361   12.218   2.3783  189.570   20.074  124.987   12.604 64.58356 23.70292 
1 1 1   27    4   22 o  130.265   10.785   13.192   2.1310   4.6970   5.8742   14.480   2.2868   85.273   32.476  136.464   11.043 -51.19085 34.30172 
1 1 1   27    4   23 o  341.286   7.8365   89.587   4.0936  111.998   11.727   86.478   4.3684  375.679   20.472  335.160   8.5153 40.51910 22.17215 
1 1 1   27    4   24 o  311.203   6.4582   74.379   3.0763   84.275   4.5582   66.102   4.1689  330.710   9.0049  292.825   9.3012 37.88492 12.94608 
1 1 1   27    4   25 f  207.919   8.2022   33.279   2.6103   34.852   3.9111   32.015   3.5052  211.716   12.119  203.094   11.321 8.622009 16.58443 
1 1 1   27    4   26 o   50.081   18.285   1.6366   1.8237   2.7552   3.3062   1.1474   2.1864   65.487   24.491   49.467   19.539 16.02001 31.32989 
1 1 1   27    4   27 o  138.286   11.158   14.899   2.3416   10.406   3.5931   18.215   3.0871  112.468   21.658  152.446   13.365 -39.97744 25.45006 
1 1 1   27    4   28 o  132.224   13.873   13.771   2.7659   13.682   3.8039   13.872   4.0288  129.959   19.744  130.469   20.878 -0.5103760 28.73577 
1 1 1   27    4   29 f   65.081   19.542   3.4136   2.1028   3.5321   3.8411   3.3628   2.5128   71.665   26.477   65.724   21.596 5.941048 34.16721 
1 1 1   27    4   30 o   87.932   17.224   6.2967   2.2353   3.9866   3.8994   7.4272   2.7280   74.110   26.785   95.062   19.405 -20.95210 33.07596 
1 1 1   27    4   31 o   66.506   21.010   3.5332   2.3931   1.0067   4.4004   4.5942   2.8517   63.456   26.684   74.901   22.817 -11.44523 35.10960 
1 1 1   27    4   32 o  194.585   10.190   29.400   3.0245   27.627   5.3713   30.223   3.6599  185.242   19.224  196.686   12.218 -11.44395 22.77767 
1 1 1   27    4   33 o   81.925   21.261   5.6133   2.6891   9.3440   7.6011   5.0796   2.8751  104.663   37.448   78.090   22.698 26.57253 43.79034 
1 1 1   27    4   34 o  121.751   14.370   11.790   2.6264   10.104   5.1745   12.376   3.0482  107.008   30.248  124.069   16.457 -17.06154 34.43550 
1 1 1   27    4   35 o  116.859   15.992   10.990   2.7854   20.350   6.0622   8.4853   3.1361  154.203   26.648  100.678   21.029 53.52501 33.94627 
1 1 1   27    4   36 o   74.464   21.963   4.6431   2.6743   6.1227   5.0031   4.0512   3.1644   86.234   30.432   71.313   24.250 14.92103 38.91212 
1 1 1   27    4   37 o  121.685   15.371   11.912   2.7991   11.979   5.1241   11.884   3.3418  115.658   28.999  120.154   18.786 -4.495781 34.55184 
1 1 1   27    4   38 o  101.632   18.410   8.5660   2.7585   4.7637   5.2201   10.039   3.2492   79.929   30.573  109.470   20.133 -29.54150 36.60645 
1 1 1   27    4   39 o  103.756   29.709   9.8462   4.9586   3.0723   6.2919   20.950   8.0557   76.923   32.098  147.002   36.072 -70.07891 48.28509 
1 1 1   27    4   40 o  111.537   17.828   10.295   2.9411   10.860   6.3177   10.139   3.3231  106.282   34.196  109.360   20.609 -3.078056 39.92604 
1 1 1   27    4   41 o   49.642   21.416   0.2302   2.9643   1.8098   6.2698  -0.2246   3.3640   71.960   31.095   50.756   22.338 21.20402 38.28696 
1 1 1   27    4   42 o   88.830   20.006   6.8079   2.6547   3.1078   3.7843   10.393   3.7251   66.439   25.865  108.493   23.138 -42.05430 34.70378 
1 1 1   27    4   43 o  116.578   15.738   11.199   2.7365   6.5990   3.8520   15.887   3.8883   84.594   26.648  137.077   19.047 -52.48347 32.75473 
1 1 1   27    4   44 f   61.977   22.524   3.0537   2.7629   4.5840   3.7265   1.1859   4.1172   72.769   26.201   59.244   25.394 13.52499 36.48792 
1 1 1   27    5    1 o  183.313   12.636   26.041   3.5237   24.508   5.2032   27.341   4.7891  176.247   19.621  186.953   16.919 -10.70538 25.90825 
1 1 1   27    5    2 o  123.041   18.559   12.034   3.3865   12.612   5.1873   11.604   4.4708  123.662   28.050  119.138   25.298 4.523247 37.77315 
1 1 1   27    5    3 o  254.340   10.069   49.759   3.9197   45.910   6.0915   52.479   5.1206  242.737   16.493  260.788   12.828 -18.05182 20.89467 
1 1 1   27    5    4 o  123.975   8.9141   11.870   1.6802   8.0111   5.4111   12.282   1.7676  100.027   31.592  126.078   9.2236 -26.05119 32.91049 
1 1 1   27    5    5 o  163.077   9.2042   20.505   2.2881   19.811   5.8647   20.630   2.4850  156.546   25.342  163.467   9.9796 -6.920639 27.23582 
1 1 1   27    5    6 o  208.216   9.4980   33.335   3.0270   35.149   4.2221   31.416   4.3422  212.986   13.014  201.074   14.200 11.91226 19.26112 
1 1 1   27    5    7 o  146.771   12.519   16.740   2.7856   13.970   3.8416   19.811   4.0452  132.451   19.535  158.849   16.897 -26.39798 25.82911 
1 1 1   27    5    8 o  177.371   10.952   24.323   2.9587   29.398   4.1288   18.964   4.2421  194.495   13.962  155.036   18.224 39.45897 22.95756 
1 1 1   27    5    9 o  131.113   14.426   13.461   2.8472   12.134   3.9004   14.974   4.1658  122.697   21.555  136.907   20.511 -14.20946 29.75444 
1 1 1   27    5   10 o  285.693   8.6410   62.726   3.7786   67.669   5.1301   56.865   5.5866  296.296   11.312  271.213   13.458 25.08252 17.58012 
1 1 1   27    5   11 o   63.274   23.387   2.5355   2.9976  -2.8141   4.8090   5.9349   3.8335   55.700   25.416   86.119   26.496 -30.41831 36.71512 
1 1 1   27    5   12 o  181.724   11.723   25.581   3.2434   27.000   4.4940   24.037   4.6856  185.792   15.958  174.762   17.763 11.03047 23.87864 
1 1 1   27    5   13 o   79.210   23.146   5.0589   2.9825   10.540   4.3159   0.0491   4.1263  113.050   25.544   59.353   25.431 53.69754 36.04459 
1 1 1   27    5   14 o  204.128   8.9491   32.048   2.7961   33.310   4.8112   31.405   3.4359  206.576   15.325  201.484   11.185 5.091614 18.97291 
1 1 1   27    5   15 o  260.266   7.9455   52.052   3.1653   58.510   5.5739   48.978   3.8454  274.951   13.245  252.173   9.9627 22.77773 16.57329 
1 1 1   27    5   16 f  172.053   13.342   23.056   3.4861   20.210   4.9150   25.938   4.9453  159.036   20.680  181.300   18.061 -22.26405 27.45692 
1 1 1   27    5   17 o  188.639   10.065   27.500   2.8957   28.094   5.3823   27.258   3.4352  188.413   18.919  187.416   12.039 0.9968262 22.42433 
1 1 1   27    5   18 o  163.372   13.027   20.799   3.2305   30.853   5.4735   15.426   4.0018  197.658   18.300  138.910   19.347 58.74754 26.63010 
1 1 1   27    5   19 o  103.294   19.987   8.6672   3.0458   12.401   5.2930   6.8187   3.7241  121.382   28.904   90.901   25.650 30.48148 38.64351 
1 1 1   27    5   20 o  163.668   7.2050   20.581   1.8050   22.497   5.7353   20.370   1.9016  166.766   23.088  162.790   7.6316 3.976547 24.31677 
1 1 1   27    5   21 o  124.005   9.4050   11.915   1.7718   16.812   5.9498   11.439   1.8560  141.708   28.420  121.373   10.082 20.33537 30.15523 
1 1 1   27    5   22 o  144.293   8.9297   16.095   1.9625   17.930   6.3581   15.902   2.0633  145.885   29.488  143.334   9.4576 2.551117 30.96743 
1 1 1   27    5   23 o  280.196   5.9593   60.261   2.5558   75.670   4.9836   54.762   2.9771  313.048   10.401  266.913   7.2872 46.13541 12.69947 
1 1 1   27    5   24 o  197.822   7.0215   30.075   2.1260   37.210   3.7659   26.738   2.5758  219.039   11.271  186.268   9.0344 32.77126 14.44485 
1 1 1   27    5   25 o   36.157   16.434  -1.1346   1.9856  -0.9090   3.1031  -1.2911   2.5838   47.775   21.218   41.743   18.882 6.032356 28.40367 
1 1 1   27    5   26 o  195.168   7.8040   29.314   2.3313   26.914   4.0107   30.538   2.8650  185.299   14.250  198.954   9.4082 -13.65530 17.07577 
1 1 1   27    5   27 o  216.415   7.5923   36.040   2.5150   44.068   4.5621   32.534   3.0144  237.870   12.575  205.290   9.5931 32.58025 15.81626 
1 1 1   27    5   28 o   69.184   22.032   3.8035   2.6276   4.7563   3.6194   2.7418   3.8206   77.667   25.937   67.768   26.098 9.898651 36.79469 
1 1 1   27    5   29 o   45.319   18.437   0.7160   2.0072  -0.5507   3.7409   1.2281   2.3786   53.814   23.623   51.274   20.339 2.539722 31.17251 
1 1 1   27    5   30 o  169.771   9.2634   22.324   2.3981   22.339   4.4369   22.318   2.8502  167.280   17.592  169.322   11.058 -2.041794 20.77927 
1 1 1   27    5   31 o   56.663   21.003   2.0928   2.4212  -0.0171   4.1627   3.1715   2.9764   58.382   25.282   65.993   23.453 -7.610954 34.48495 
1 1 1   27    5   32 o   53.243   20.728   1.5304   2.4306   1.4355   4.5825   1.5675   2.8672   65.905   27.437   56.322   22.334 9.583153 35.37820 
1 1 1   27    5   33 f   73.582   20.922   4.4873   2.4680   2.3955   4.8081   5.2356   2.8757   70.446   28.582   79.148   22.612 -8.701576 36.44446 
1 1 1   27    5   34 o   75.817   22.265   4.7879   2.7537   6.8999   7.9478   4.4998   2.9356   96.143   37.468   74.025   23.254 22.11843 44.09776 
1 1 1   27    5   35 o   65.759   22.040   3.4014   2.6136   0.0199   6.0448   4.1789   2.8985   68.476   30.045   71.669   23.173 -3.192589 37.94321 
1 1 1   27    5   36 o   46.874   20.063   0.1592   2.5632   0.4079   5.0816   0.0743   2.9684   64.368   27.904   49.749   21.447 14.61859 35.19381 
1 1 1   27    5   37 o   45.812   19.885  -0.1046   2.5870  -3.5537   4.9125   1.2189   3.0432   52.837   24.661   55.141   22.598 -2.303627 33.44861 
1 1 1   27    5   38 o   82.267   22.551   5.8125   2.9242  -2.4507   5.2327   9.5649   3.5262   57.093   26.223  105.706   22.485 -48.61367 34.54314 
1 1 1   27    5   39 o   73.103   23.595   4.4877   3.0060   5.5003   5.2386   3.9906   3.6704   82.624   30.842   71.618   25.971 11.00549 40.32010 
1 1 1   27    5   40 o  146.668   15.488   17.384   3.4244   22.413   5.4028   14.007   4.4273  162.462   22.316  127.163   23.616 35.29884 32.49178 
1 1 1   27    5   41 o   46.931   20.694  -0.3260   2.9004 -10.2451   5.8779   2.8665   3.3346   46.958   23.123   63.896   24.436 -16.93702 33.64231 
1 1 1   27    5   42 o  170.395   12.874   23.193   3.3329   15.477   6.0846   26.501   3.9838  126.149   31.584  181.213   14.484 -55.06371 34.74655 
1 1 1   27    5   43 o   70.995   25.062   4.2923   3.3933  -9.5647   5.6115   12.280   4.2606   45.765   22.546  116.504   24.661 -70.73854 33.41421 
1 1 1   27    5   44 o   83.912   23.728   6.4222   3.1835   1.3875   5.7828   8.6115   3.8133   66.928   29.375   96.149   25.496 -29.22079 38.89659 
1 1 1   27    6    0 o   90.530   34.981   8.7340   4.6015   8.7340   4.6015   8.7340   4.6015   90.530   34.981   90.530   34.981 0.000000 0.000000 
1 1 1   27    6    1 o  254.896   14.258   50.390   5.5404   0.0000   0.0000   50.390   5.5404  ?   ?   254.896   14.258 0.000000 14.25785 
1 1 1   27    6    2 o   89.733   23.356   6.5657   3.2390   4.7453   5.1865   7.7297   4.1473   84.112   30.816   97.200   26.941 -13.08829 40.93225 
1 1 1   27    6    3 o  241.762   9.7200   44.949   3.5969   42.032   6.4149   46.286   4.3440  231.702   18.235  245.084   11.580 -13.38197 21.60127 
1 1 1   27    6    4 o   83.154   31.891   4.0460   5.6893   4.0460   5.6893   0.0000   0.0000   83.154   31.891  ?   ?  0.000000 31.89095 
1 1 1   27    6    5 o   82.948   32.529   3.6310   6.0192   3.6310   6.0192   0.0000   0.0000   82.948   32.529  ?   ?  0.000000 32.52882 
1 1 1   27    6    6 o   91.195   22.860   6.7908   3.1848   0.5562   6.3097   8.9222   3.6893   74.270   31.625  104.464   23.626 -30.19433 39.47575 
1 1 1   27    6    7 o  415.331   7.5721  132.424   4.8137  130.762   6.1925  134.962   7.6521  412.286   9.8129  418.333   11.951 -6.047485 15.46318 
1 1 1   27    6    8 o  257.429   8.9462   50.940   3.5250   54.985   4.8641   46.465   5.1158  267.006   11.902  244.770   13.710 22.23596 18.15519 
1 1 1   27    6    9 o  205.291   10.399   32.531   3.2570   32.394   4.5281   32.677   4.6881  204.021   14.597  204.805   15.061 -0.7835693 20.97355 
1 1 1   27    6   10 o  185.298   11.495   26.575   3.2442   27.499   4.5601   25.628   4.6164  187.528   16.041  180.780   16.879 6.747910 23.28546 
1 1 1   27    6   11 o   62.612   22.581   2.6305   2.7692   1.2668   4.0459   3.8324   3.7984   63.462   26.037   74.125   26.478 -10.66340 37.13521 
1 1 1   27    6   12 o  339.363   7.3913   88.427   3.8393   96.469   7.6980   85.765   4.4295  352.896   14.252  334.011   8.6642 18.88553 16.67855 
1 1 1   27    6   13 o  204.476   8.7696   32.150   2.7447   33.720   5.0026   31.474   3.2829  207.724   15.854  201.811   10.666 5.913132 19.10749 
1 1 1   27    6   14 o  371.085   6.8243  105.699   3.8761  112.794   6.5053  101.794   4.8265  382.404   11.114  363.835   8.6667 18.56854 14.09378 
1 1 1   27    6   15 o  222.911   8.6340   38.214   2.9459   39.884   5.2876   37.463   3.5474  226.038   15.374  220.448   10.513 5.589661 18.62523 
1 1 1   27    6   16 o  104.086   19.348   8.7551   2.9690   6.8477   5.1870   9.6845   3.6208   93.169   31.048  108.784   22.489 -15.61493 38.33688 
1 1 1   27    6   17 o  389.886   11.955  117.503   7.1346  117.503   7.1346   0.0000   0.0000  389.886   11.955  ?   ?  0.000000 11.95532 
1 1 1   27    6   18 o  188.115   12.344   27.493   3.5345   30.214   5.6376   25.731   4.5368  195.283   19.106  180.868   16.572 14.41417 25.29151 
1 1 1   27    6   19 o  126.187   14.620   12.536   2.7714   14.848   5.7280   11.829   3.1668  132.940   28.969  121.799   17.488 11.14052 33.83827 
1 1 1   27    6   20 o  152.841   13.139   18.240   3.0438   14.959   6.0668   19.344   3.5187  132.828   30.486  157.019   14.816 -24.19046 33.89502 
1 1 1   27    6   21 f  196.515   11.009   29.925   3.2981   19.140   6.3295   33.944   3.8642  151.417   28.352  209.069   12.127 -57.65213 30.83693 
1 1 1   27    6   22 o   75.636   22.582   4.6303   2.8139   16.991   6.4520   1.7269   3.1269  141.376   30.696   59.309   23.386 82.06720 38.58928 
1 1 1   27    6   23 o   66.441   15.485   3.5803   1.5457   13.101   9.7507   3.3349   1.5655  123.401   42.552   64.094   16.006 59.30765 45.46233 
1 1 1   27    6   24 o   42.123   16.328   0.9057   1.5031   2.0530   3.1085   0.5556   1.7172   60.781   23.503   41.766   17.029 19.01521 29.02395 
1 1 1   27    6   25 o  245.594   6.2571   46.322   2.3521   56.138   4.3306   42.215   2.8013  269.516   10.498  234.225   7.8138 35.29053 13.08650 
1 1 1   27    6   26 o   58.179   18.060   2.6668   1.7767   2.9310   3.4502   2.5715   2.0725   67.074   25.031   58.467   19.627 8.606712 31.80823 
1 1 1   27    6   27 o  264.229   6.1105   53.623   2.4713   64.913   4.7762   49.495   2.8879  289.631   10.774  253.638   7.4389 35.99275 13.09241 
1 1 1   27    6   28 o   47.115   18.684   1.0106   2.0067   4.4802   3.8741  -0.2616   2.3459   76.789   26.802   43.479   18.904 33.30925 32.79795 
1 1 1   27    6   29 o  120.962   16.080   11.682   2.9033   11.654   4.0539   11.712   4.1601  118.357   23.207  118.452   23.771 -0.9466553E-01 33.22101 
1 1 1   27    6   30 o   91.277   17.183   6.7753   2.3126   6.8940   4.0183   6.7165   2.8278   90.446   26.982   89.893   20.941 0.5520706 34.15456 
1 1 1   27    6   31 o  148.042   11.507   17.120   2.5869   13.698   4.5792   18.724   3.1351  127.851   24.288  154.320   13.406 -26.46825 27.74237 
1 1 1   27    6   32 o  172.940   9.8606   23.223   2.5994   24.661   4.9348   22.671   3.0580  175.079   18.704  170.338   11.802 4.741135 22.11600 
1 1 1   27    6   33 o  150.470   11.568   17.714   2.6438   14.948   5.4571   18.562   3.0221  131.489   27.974  153.627   12.973 -22.13794 30.83627 
1 1 1   27    6   34 o  152.560   12.251   18.272   2.8367   22.374   8.4266   17.748   3.0125  155.822   36.047  150.020   13.256 5.802017 38.40716 
1 1 1   27    6   35 o   56.348   21.509   1.9504   2.5805  -1.1551   6.5221   2.5268   2.8098   67.797   30.390   60.946   22.619 6.850845 37.88416 
1 1 1   27    6   36 o  100.941   19.261   8.4621   2.8673   8.6326   5.2140   8.3881   3.4329   98.436   31.002   99.048   23.073 -0.6111832 38.64559 
1 1 1   27    6   37 o   95.678   20.422   7.7191   2.8998   4.0175   5.0162   9.5770   3.5537   76.454   29.774  105.884   22.614 -29.43034 37.38877 
1 1 1   27    6   38 o  118.118   15.805   11.302   2.7858   13.277   5.1934   10.504   3.3009  121.584   28.417  112.023   19.984 9.560509 34.74020 
1 1 1   27    6   39 o   58.792   22.140   2.3432   2.7112   3.9465   5.1319   1.7225   3.1932   75.891   29.948   58.083   23.388 17.80867 37.99834 
1 1 1   27    6   40 o   54.073   23.542   0.1272   3.6479  -2.4806   4.9696   3.1741   5.3717   54.922   25.346   73.322   30.033 -18.40007 39.29860 
1 1 1   27    6   41 o   82.038   21.691   5.8762   2.7652   7.1503   4.9016   5.2814   3.3490   88.306   30.180   77.627   24.889 10.67937 39.11948 
1 1 1   27    6   42 o   49.400   20.999   0.5742   2.7735   0.1603   4.5789   0.8141   3.4856   58.882   25.981   54.994   23.463 3.887825 35.00754 
1 1 1   27    6   43 o   67.721   24.006   3.8305   3.1165   1.2393   4.5100   6.1987   4.3116   61.536   26.482   82.037   28.295 -20.50042 38.75448 
1 1 1   27    6   44 o   49.074   21.932  -0.4850   3.3701   4.5806   7.6798  -1.6932   3.7506   80.547   34.608   48.025   22.111 32.52285 41.06832 
1 1 1   27    7    0 o  157.400   20.506   20.094   4.7085   20.094   4.7085   20.094   4.7085  157.400   20.506  157.400   20.506 0.000000 0.000000 
1 1 1   27    7    1 o  151.378   18.792   18.117   4.2604   0.0000   0.0000   18.117   4.2604  ?   ?   151.378   18.792 0.000000 18.79155 
1 1 1   27    7    2 o  109.435   17.200   9.5215   2.7861   7.0643   5.0957   10.569   3.3275   94.710   30.736  114.847   19.635 -20.13756 36.47226 
1 1 1   27    7    3 o  266.060   7.6477   54.342   3.1145   50.757   6.6509   55.350   3.5248  255.012   17.139  268.408   8.5797 -13.39627 19.16634 
1 1 1   27    7    4 o  229.759   19.176   41.458   6.6821   41.458   6.6821   0.0000   0.0000  229.759   19.176  ?   ?  0.000000 19.17583 
1 1 1   27    7    5 o  601.884   13.343  279.901   12.293  279.901   12.293   0.0000   0.0000  601.884   13.343  ?   ?  0.000000 13.34346 
1 1 1   27    7    6 o  261.580   18.760   53.627   7.4613   53.627   7.4613   0.0000   0.0000  261.580   18.760  ?   ?  0.000000 18.76007 
1 1 1   27    7    7 o  244.867   12.862   46.432   4.8040   46.432   4.8040   0.0000   0.0000  244.867   12.862  ?   ?  0.000000 12.86248 
1 1 1   27    7    8 o  249.566   9.3632   47.902   3.5767   49.595   4.9089   45.985   5.2219  253.426   12.655  243.378   14.078 10.04831 18.92981 
1 1 1   27    7    9 o  308.278   8.4594   73.030   3.9916   78.294   5.4205   66.794   5.9000  318.722   11.111  293.981   13.112 24.74112 17.18656 
1 1 1   27    7   10 o  181.466   8.8067   25.316   2.4461   30.110   4.5761   23.398   2.8943  196.428   15.342  173.910   10.929 22.51837 18.83649 
1 1 1   27    7   11 o   45.816   18.518   0.7392   2.0100  -0.1147   4.2034   0.9924   2.2886   59.317   25.546   49.665   19.870 9.652115 32.36373 
1 1 1   27    7   12 o  145.544   11.083   16.427   2.4506   16.753   5.6977   16.353   2.7145  142.682   27.080  144.986   12.349 -2.304123 29.76252 
1 1 1   27    7   13 o  257.429   7.7584   50.910   3.0570   52.761   5.5147   50.089   3.6730  260.625   13.874  255.117   9.4062 5.507462 16.76211 
1 1 1   27    7   14 o  137.346   15.105   14.820   3.1230   19.355   4.8913   11.699   4.0577  155.496   21.096  119.756   22.972 35.74001 31.18907 
1 1 1   27    7   15 o  385.781   8.3105  114.429   4.9073  119.143   6.8493  109.457   7.0342  392.850   11.391  376.299   12.213 16.55103 16.70028 
1 1 1   27    7   16 o  181.199   12.413   25.511   3.4220   20.125   5.3298   29.289   4.4634  157.929   22.701  193.518   15.191 -35.58858 27.31470 
1 1 1   27    7   17 o  364.427   9.1162  102.242   5.0850  106.090   6.9767   97.881   7.4271  370.326   12.308  355.269   13.658 15.05655 18.38576 
1 1 1   27    7   18 o  201.650   9.8636   31.341   3.0444   34.402   5.8662   30.213   3.5616  208.643   18.563  197.336   11.846 11.30632 22.02070 
1 1 1   27    7   19 o  206.304   9.8377   32.809   3.1065   46.688   6.2033   28.163   3.5890  243.915   16.716  190.353   12.385 53.56200 20.80473 
1 1 1   27    7   20 o  156.460   12.830   19.094   3.0456   23.147   6.1336   17.767   3.5087  168.568   24.489  150.238   15.480 18.32983 28.97085 
1 1 1   27    7   21 o  115.481   16.928   10.642   2.9034   6.0808   6.1099   11.973   3.2997   91.505   33.458  122.258   18.187 -30.75362 38.08189 
1 1 1   27    7   22 o  161.607   12.741   20.375   3.1261   19.282   6.7328   20.675   3.5297  150.956   30.194  162.392   14.348 -11.43681 33.42946 
1 1 1   27    7   23 f   84.853   16.924   5.8312   2.1210   5.8564   2.7867   5.7964   3.2701   84.258   21.529   83.896   24.156 0.3621979 32.35746 
1 1 1   27    7   24 o   57.154   22.884   1.4305   3.0383  -6.1960   7.0536   3.1679   3.3666   62.034   29.145   68.071   24.844 -6.036842 38.29686 
1 1 1   27    7   25 o  176.310   10.137   24.088   2.7242   30.226   3.8717   18.070   3.8339  196.845   12.922  150.858   16.894 45.98692 21.26891 
1 1 1   27    7   26 f   71.060   15.971   4.1068   1.6948   1.1321   3.7399   4.8756   1.9012   60.270   24.913   77.430   16.544 -17.16030 29.90613 
1 1 1   27    7   27 o   54.639   17.578   2.3062   1.6693  -0.8341   3.8267   3.0443   1.8552   53.581   23.691   61.582   18.324 -8.001331 29.95073 
1 1 1   27    7   28 o   27.271   13.330  -3.4307   1.8440  -2.5573   3.6496  -3.7302   2.1368   47.031   21.710   29.868   14.544 17.16331 26.13129 
1 1 1   27    7   29 o  126.207   10.680   12.421   2.0437   14.398   4.1702   11.796   2.3445  132.622   21.261  122.496   12.688 10.12653 24.75971 
1 1 1   27    7   30 o   47.467   21.617  -1.8270   3.4573  -3.6391   4.2315   1.8117   5.9963   48.706   22.784   74.396   31.210 -25.68930 38.64154 
1 1 1   27    7   31 o  103.966   15.954   8.6894   2.4577   7.8637   4.6490   9.0096   2.8954   95.892   29.116  105.035   18.695 -9.142357 34.60131 
1 1 1   27    7   32 f  195.337   9.6862   29.529   2.8961   30.395   5.2824   29.157   3.4629  194.859   17.911  193.256   11.763 1.602753 21.42841 
1 1 1   27    7   33 o  126.613   13.332   12.672   2.5449   6.0691   5.3006   14.650   2.9012   87.320   31.269  135.972   14.147 -48.65193 34.32025 
1 1 1   27    7   34 o   88.482   18.851   6.4896   2.4749   2.6446   5.3335   7.5447   2.7939   73.368   29.974   95.248   19.809 -21.88014 35.92876 
1 1 1   27    7   35 o  161.835   13.136   20.663   3.2257   13.026   10.754   21.418   3.3815  117.250   44.106  164.633   13.539 -47.38284 46.13677 
1 1 1   27    7   36 o   87.900   19.326   6.4666   2.5294   7.5303   5.1073   6.1209   2.9116   92.792   30.803   84.738   22.187 8.054306 37.96186 
1 1 1   27    7   37 o  154.962   11.567   18.878   2.7238   16.150   5.1062   19.963   3.2203  136.650   25.346  158.678   13.384 -22.02802 28.66268 
1 1 1   27    7   38 o   82.851   20.703   5.8496   2.6180   7.2928   5.0790   5.3274   3.0551   90.776   30.723   78.791   23.531 11.98459 38.69931 
1 1 1   27    7   39 o   53.025   21.151   1.4539   2.5853   6.2307   5.0793  -0.2164   3.0035   85.324   30.603   48.439   21.218 36.88476 37.23914 
1 1 1   27    7   40 o   63.294   23.000   3.0367   2.8808  -6.2739   4.9244   7.8811   3.5521   47.052   22.714   94.220   24.427 -47.16801 33.35555 
1 1 1   27    7   41 o  136.857   16.014   15.318   3.2912   13.526   4.8479   16.850   4.4826  121.889   26.722  140.174   21.585 -18.28498 34.35050 
1 1 1   27    7   42 o  129.340   16.525   13.820   3.1967   16.170   5.4915   12.616   3.9315  131.700   28.098  120.103   22.204 11.59683 35.81244 
1 1 1   27    7   43 o   40.848   18.983  -1.9178   2.8610   0.4751   5.3026  -2.9006   3.3981   62.743   27.808   42.526   20.056 20.21771 34.28578 
1 1 1   27    7   44 f   72.894   22.892   4.7442   2.8451   2.5490   4.3975   6.3245   3.7312   65.242   26.996   82.317   26.258 -17.07489 37.65989 
1 1 1   27    8    0 o   78.359   33.032   6.7858   3.9958   6.7858   3.9958   6.7858   3.9958   78.359   33.032   78.359   33.032 0.000000 0.000000 
1 1 1   27    8    1 o   96.419   18.000   7.4620   2.5588   12.932   4.2450   4.3406   3.2068  126.451   22.770   75.093   24.383 51.35765 33.36179 
1 1 1   27    8    2 o  246.588   7.7160   46.685   2.9123   44.103   5.4694   47.707   3.4406  238.135   15.083  249.126   9.0228 -10.99095 17.57599 
1 1 1   27    8    3 o  247.389   16.256   47.707   6.1213   47.707   6.1213   0.0000   0.0000  247.389   16.256  ?   ?  0.000000 16.25607 
1 1 1   27    8    4 o  298.973   15.555   69.495   7.0935   69.495   7.0935   0.0000   0.0000  298.973   15.555  ?   ?  0.000000 15.55470 
1 1 1   27    8    5 o  235.880   18.762   43.670   6.7178   43.670   6.7178   0.0000   0.0000  235.880   18.762  ?   ?  0.000000 18.76159 
1 1 1   27    8    6 o  279.589   18.043   61.157   7.6803   61.157   7.6803   0.0000   0.0000  279.589   18.043  ?   ?  0.000000 18.04318 
1 1 1   27    8    7 o  194.594   15.483   29.553   4.5734   29.553   4.5734   0.0000   0.0000  194.594   15.483  ?   ?  0.000000 15.48255 
1 1 1   27    8    8 o   36.956   16.943  -1.5019   2.1704  -0.2718   3.9190  -2.0461   2.6066   56.810   24.566   39.642   18.316 17.16770 30.64272 
1 1 1   27    8    9 o   92.638   17.839   6.9059   2.4377   5.4124   4.3441   7.5923   2.9451   84.286   28.414   96.666   20.538 -12.38068 35.05942 
1 1 1   27    8   10 o   50.675   18.944   1.5352   1.9779   7.1652   4.0945  -0.1785   2.2590   93.574   27.056   43.339   18.696 50.23454 32.88704 
1 1 1   27    8   11 o  328.652   6.7816   82.898   3.4114   96.311   6.0620   76.681   4.1270  353.379   11.207  315.827   8.5371 37.55188 14.08864 
1 1 1   27    8   12 o  108.213   17.656   9.3605   2.8237   4.1467   5.4583   11.266   3.2995   82.150   31.300  118.651   18.794 -36.50111 36.50927 
1 1 1   27    8   13 o  203.379   10.909   31.991   3.3836   28.238   5.2046   34.738   4.4531  189.240   18.193  211.298   13.846 -22.05811 22.86193 
1 1 1   27    8   14 o  262.170   9.5120   52.921   3.8170   56.359   5.6093   49.957   5.2090  269.360   13.650  253.610   13.467 15.75021 19.17518 
1 1 1   27    8   15 o   66.568   23.251   3.1868   2.9158   0.2551   4.7655   4.9411   3.6863   64.029   27.379   79.661   26.156 -15.63172 37.86539 
1 1 1   27    8   16 o  140.017   12.452   15.284   2.6407   14.420   5.1508   15.592   3.0757  131.968   26.421  140.991   14.457 -9.022873 30.11778 
1 1 1   27    8   17 o   77.272   24.695   4.7141   3.2990   9.7286   5.1390   1.1990   4.3027  107.570   30.053   64.458   26.690 43.11187 40.19329 
1 1 1   27    8   18 f  135.980   13.256   14.466   2.7239   15.673   5.5038   14.074   3.1348  137.310   27.149  133.544   15.632 3.765915 31.32775 
1 1 1   27    8   19 o  140.270   13.393   15.396   2.8405   14.255   5.5557   15.800   3.3051  130.219   28.651  141.599   15.503 -11.38004 32.57668 
1 1 1   27    8   20 o  129.254   14.743   13.162   2.8646   10.808   5.8562   13.902   3.2843  112.668   32.293  132.404   16.569 -19.73532 36.29571 
1 1 1   27    8   21 o  250.462   9.3110   48.346   3.5695   54.313   7.0021   46.251   4.1491  262.616   17.520  244.621   11.081 17.99579 20.73037 
1 1 1   27    8   22 o  113.352   17.930   10.322   3.0074   18.035   6.8924   8.5083   3.3423  145.065   31.909  101.566   22.126 43.49858 38.82911 
1 1 1   27    8   23 o  209.356   8.1748   33.736   2.6196   43.366   3.6518   23.527   3.7599  237.016   10.066  173.259   14.306 63.75630 17.49228 
1 1 1   27    8   24 o  113.972   14.715   10.289   2.5071   17.374   3.6874   4.1987   3.4190  148.024   16.558   74.098   25.207 73.92632 30.15880 
1 1 1   27    8   25 o  198.244   11.866   30.571   3.5841   29.856   7.5694   30.778   4.0691  189.857   26.792  198.454   13.476 -8.596924 29.99020 
1 1 1   27    8   26 o  140.229   12.404   15.383   2.6350   15.066   3.6404   15.732   3.8189  137.232   17.747  140.112   18.239 -2.880035 25.44848 
1 1 1   27    8   27 o  180.576   9.6735   25.257   2.6640   31.183   4.1530   21.113   3.4726  199.569   13.678  163.957   13.971 35.61201 19.55177 
1 1 1   27    8   28 o  137.106   14.302   14.837   2.9572   20.787   4.3132   9.5594   4.0623  161.331   17.761  106.338   25.322 54.99359 30.92965 
1 1 1   27    8   29 o   45.836   18.176   0.9583   1.8989   2.0626   4.1155   0.6597   2.1403   66.061   26.568   46.130   18.934 19.93042 32.62464 
1 1 1   27    8   30 o   84.494   21.127   5.9488   2.7252   8.5895   4.6178   4.5376   3.3757   99.958   28.684   75.500   25.042 24.45716 38.07677 
1 1 1   27    8   31 o   90.269   16.129   6.5996   2.1468   8.8267   4.8995   6.0705   2.3882  100.977   29.712   85.802   18.712 15.17428 35.11288 
1 1 1   27    8   32 o  185.424   9.1440   26.582   2.5952   28.250   5.4503   26.093   2.9512  187.058   19.314  183.106   10.575 3.951996 22.01977 
1 1 1   27    8   33 o  221.551   9.9017   38.040   3.3578   34.994   5.7982   39.577   4.1187  208.659   18.341  225.025   12.001 -16.36601 21.91840 
1 1 1   27    8   34 o  160.747   13.046   20.360   3.1822   17.580   5.4198   21.822   3.9311  143.626   25.592  165.413   15.715 -21.78745 30.03193 
1 1 1   27    8   35 o   69.647   23.364   3.8798   2.9371   12.884   10.248   3.0739   3.0657  116.289   43.190   65.156   23.719 51.13368 49.27399 
1 1 1   27    8   36 f   72.269   20.915   4.3838   2.4458   10.428   5.2119   2.6769   2.7697  107.287   30.368   61.393   22.515 45.89320 37.80431 
1 1 1   27    8   37 o  145.267   12.184   16.657   2.6841   12.836   5.2298   18.024   3.1274  119.359   28.928  150.549   13.722 -31.18988 32.01769 
1 1 1   27    8   38 o   86.167   20.157   6.3059   2.6113   14.003   5.2418   3.7653   3.0116  124.902   28.098   68.562   23.648 56.33993 36.72501 
1 1 1   27    8   39 o   48.472   20.333   0.6266   2.5447  -4.4980   5.0323   2.3873   2.9497   51.123   24.201   60.061   22.980 -8.938160 33.37273 
1 1 1   27    8   40 o   62.634   22.590   3.0093   2.7715   4.5542   4.8215   2.2470   3.3869   76.566   29.359   61.118   24.262 15.44746 38.08723 
1 1 1   27    8   41 o   70.715   25.134   4.1455   3.4185   6.2900   5.5785   2.8560   4.3258   84.481   31.769   67.358   27.187 17.12243 41.81375 
1 1 1   27    8   42 o   67.081   23.688   3.7262   3.0317   7.1272   5.3305   2.1001   3.6859   87.081   31.339   61.134   24.941 25.94631 40.05180 
1 1 1   27    8   43 o   65.739   22.471   3.6601   2.7173   3.1543   4.4736   3.9558   3.4207   68.140   27.596   68.887   25.058 -0.7462997 37.27551 
1 1 1   27    9    0 o  417.051   10.224  133.739   6.5177  133.739   6.5177  133.739   6.5177  417.051   10.224  417.051   10.224 0.000000 0.000000 
1 1 1   27    9    1 o  194.813   8.5849   29.165   2.5599   33.769   4.2632   26.569   3.2013  208.592   13.424  185.319   11.340 23.27254 17.57297 
1 1 1   27    9    2 o  207.874   8.4994   33.204   2.7043   0.0000   0.0000   33.204   2.7043  ?   ?   207.874   8.4994 0.000000 8.499415 
1 1 1   27    9    3 o  356.375   12.625   98.069   6.8867   98.069   6.8867   0.0000   0.0000  356.375   12.625  ?   ?  0.000000 12.62515 
1 1 1   27    9    4 o   72.461   29.990   1.5219   5.4291   1.5219   5.4291   0.0000   0.0000   72.461   29.990  ?   ?  0.000000 29.99016 
1 1 1   27    9    5 o   96.284   32.555   7.1735   5.7026   7.1735   5.7026   0.0000   0.0000   96.284   32.555  ?   ?  0.000000 32.55465 
1 1 1   27    9    6 o  122.709   32.782   12.668   6.2742   12.668   6.2742   0.0000   0.0000  122.709   32.782  ?   ?  0.000000 32.78234 
1 1 1   27    9    7 o  175.783   10.054   23.865   2.6940   28.918   4.5821   21.195   3.3304  192.387   15.697  165.043   13.296 27.34380 20.57147 
1 1 1   27    9    8 o  133.067   12.666   13.801   2.5486   14.406   4.2384   13.459   3.1897  133.850   21.409  130.614   16.310 3.235916 26.91431 
1 1 1   27    9    9 o  157.693   11.338   19.277   2.7183   21.172   4.6702   18.306   3.3429  163.509   19.016  153.034   14.442 10.47501 23.87822 
1 1 1   27    9   10 o   61.101   20.859   2.7240   2.3413   10.628   4.2414  -0.7403   2.8079  113.574   25.069   46.099   20.343 67.47520 32.28454 
1 1 1   27    9   11 o  231.231   9.3066   41.146   3.2939   44.328   5.2621   39.096   4.2237  238.657   14.474  224.601   12.333 14.05536 19.01556 
1 1 1   27    9   12 o  158.347   12.772   19.516   3.0693   28.112   5.8521   16.254   3.6050  188.009   20.677  143.508   16.725 44.50108 26.59507 
1 1 1   27    9   13 o  312.561   8.6730   75.145   4.1493   79.369   5.9524   71.152   5.7871  320.457   12.135  303.333   12.464 17.12393 17.39628 
1 1 1   27    9   14 o  158.655   10.991   19.515   2.6527   13.304   4.8494   22.167   3.1689  126.894   25.845  168.868   12.346 -41.97482 28.64258 
1 1 1   27    9   15 o  278.395   7.9125   59.577   3.3717   67.017   6.0484   56.223   4.0612  294.048   13.438  270.123   9.8226 23.92587 16.64556 
1 1 1   27    9   16 o  154.303   11.544   18.497   2.7067   20.288   5.1323   17.806   3.1858  158.836   21.676  150.860   13.955 7.975357 25.77990 
1 1 1   27    9   17 o  200.794   12.108   31.299   3.7039   38.214   5.6414   26.061   4.9106  220.556   16.838  181.581   17.901 38.97446 24.57569 
1 1 1   27    9   18 o  143.320   13.102   16.051   2.8423   17.781   5.5923   15.448   3.3004  146.927   25.808  139.961   15.675 6.966080 30.19577 
1 1 1   27    9   19 o  207.376   10.982   33.310   3.4735   50.813   10.099   30.962   3.6991  249.603   26.856  199.638   12.164 49.96478 29.48260 
1 1 1   27    9   20 o  170.981   12.514   22.770   3.2522   29.665   9.9198   21.940   3.4425  184.944   36.338  167.569   13.537 17.37584 38.77792 
1 1 1   27    9   21 o  137.201   16.038   14.898   3.3045   20.969   10.379   14.213   3.4858  151.693   42.825  133.560   17.470 18.13371 46.25152 
1 1 1   27    9   22 o  206.590   10.837   33.076   3.4148   31.959   6.7820   33.455   3.9524  198.949   22.677  207.346   12.512 -8.397507 25.89949 
1 1 1   27    9   23 o   70.448   18.123   4.0528   1.9654   3.4724   2.4023   5.2277   3.4178   66.396   21.058   80.362   25.066 -13.96611 32.73747 
1 1 1   27    9   24 f  267.871   7.6313   55.205   3.1289   64.490   4.3494   45.245   4.5046  289.024   9.8316  241.214   12.241 47.80952 15.70022 
1 1 1   27    9   25 o  174.186   13.287   23.734   3.5157   28.519   7.4226   22.349   3.9919  185.314   26.959  168.286   15.678 17.02859 31.18613 
1 1 1   27    9   26 o   34.765   16.542  -2.9483   2.4113  -2.9472   3.3980  -2.9495   3.4223   43.966   20.517   44.165   20.603 -0.1995354 29.07609 
1 1 1   27    9   27 o   51.833   21.239   0.8941   2.6876  -2.8126   3.9440   4.1076   3.6723   48.672   22.503   74.098   26.081 -25.42579 34.44654 
1 1 1   27    9   28 f  181.798   13.464   25.906   3.7200   26.951   4.6122   23.962   6.2929  184.369   16.519  170.075   24.912 14.29385 29.89135 
1 1 1   27    9   29 f  135.421   14.025   14.477   2.8650   11.811   4.7378   16.014   3.5972  117.620   26.901  141.555   16.939 -23.93456 31.78931 
1 1 1   27    9   30 o  114.034   17.038   10.479   2.8827  -1.0171   4.7490   17.186   3.6275   59.003   26.225  146.806   16.425 -87.80273 30.94382 
1 1 1   27    9   31 o   96.309   20.594   7.7074   2.9439   5.2901   5.0517   8.9505   3.6227   83.537   30.442  102.980   23.501 -19.44279 38.45803 
1 1 1   27    9   32 o   40.986   18.339  -0.8528   2.3636   1.1993   5.4579  -1.3265   2.6223   69.379   29.474   41.692   18.925 27.68718 35.02700 
1 1 1   27    9   33 o  175.854   9.5283   24.019   2.5551   21.407   5.6286   24.697   2.8676  160.083   23.686  178.028   10.571 -17.94534 25.93832 
1 1 1   27    9   34 o  120.083   13.599   11.455   2.4556   6.0250   5.2163   13.001   2.7832   86.355   31.009  127.717   14.494 -41.36137 34.22927 
1 1 1   27    9   35 o   64.364   21.711   3.2588   2.5362   1.3833   6.3929   3.6091   2.7629   73.351   31.548   67.364   22.660 5.986954 38.84263 
1 1 1   27    9   36 o   79.746   22.154   5.4220   2.8008   2.8597   7.0662   5.8995   3.0507   79.638   33.669   82.912   23.152 -3.273766 40.86090 
1 1 1   27    9   37 o   48.174   20.585   0.2735   2.6903  -1.2243   5.3483   0.7808   3.1127   60.689   27.336   53.462   22.460 7.227337 35.37965 
1 1 1   27    9   38 o   38.431   18.039  -2.4401   2.6919  -7.3923   5.2181  -0.6443   3.1423   47.398   23.000   47.980   21.328 -0.5815315 31.36694 
1 1 1   27    9   39 o  124.766   14.244   12.527   2.6714   14.348   4.9776   11.789   3.1661  126.753   26.509  119.365   17.879 7.388489 31.97459 
1 1 1   27    9   40 o  103.595   19.136   9.0789   2.9225   13.848   5.6644   7.3491   3.4116  120.706   30.613   90.774   24.137 29.93228 38.98406 
1 1 1   27    9   41 o   86.200   24.970   6.7319   3.4847   3.9550   4.5244   10.781   5.4636   72.416   28.256  104.894   31.501 -32.47778 42.31661 
1 1 1   27    9   42 o   99.246   18.385   8.3809   2.6899   8.1646   4.4718   8.5036   3.3672   92.483   28.643   97.455   22.952 -4.972130 36.70498 
1 1 1   27    9   43 o   45.836   19.974   0.0662   2.6315   4.0703   4.5619  -1.9305   3.2215   71.997   28.292   43.615   20.225 28.38186 34.77754 
1 1 1   27   10    0 o  220.395   11.384   37.609   3.8170   37.609   3.8170   37.609   3.8170  220.395   11.384  220.395   11.384 0.000000 0.000000 
1 1 1   27   10    1 o   55.077   18.033   2.2793   1.7526   2.3124   3.0796   2.2635   2.1313   62.472   23.581   56.827   19.877 5.644230 30.84048 
1 1 1   27   10    3 f  204.225   15.746   32.564   4.8842   32.564   4.8842   0.0000   0.0000  204.225   15.746  ?   ?  0.000000 15.74640 
1 1 1   27   10    4 f   53.639   19.471   1.8743   2.0637   1.3590   4.8413   1.9887   2.2813   68.566   28.344   55.777   20.437 12.78933 34.94396 
1 1 1   27   10    5 o  314.168   8.1374   75.834   3.9131   84.949   7.0653   71.801   4.6997  331.263   13.934  305.385   10.054 25.87839 17.18299 
1 1 1   27   10    6 o   86.973   32.624   4.9185   5.8754   4.9185   5.8754   0.0000   0.0000   86.973   32.624  ?   ?  0.000000 32.62360 
1 1 1   27   10    7 o  118.884   14.559   11.113   2.5940   9.5151   6.4138   11.426   2.8363  107.881   34.429  120.294   15.785 -12.41225 37.87470 
1 1 1   27   10    8 o  204.625   10.729   32.360   3.3487   43.190   7.5015   29.665   3.7422  233.434   21.227  195.532   12.570 37.90184 24.66983 
1 1 1   27   10    9 f  108.259   18.277   9.3941   2.9207   6.2615   7.2796   9.9951   3.1886   96.486   36.290  111.461   19.395 -14.97481 41.14702 
1 1 1   27   10   10 o  207.933   11.553   33.475   3.6626   48.046   7.9154   29.505   4.1315  246.169   21.214  194.645   13.960 51.52379 25.39561 
1 1 1   27   10   11 o   51.963   21.650   0.5610   2.8566   7.1650   7.1554  -0.6911   3.1156   99.291   36.223   48.919   21.514 50.37122 42.13017 
1 1 1   27   10   12 o  306.919   11.798   72.770   5.5425   0.0000   0.0000   72.770   5.5425  ?   ?   306.919   11.798 0.000000 11.79800 
1 1 1   27   10   13 o  215.781   9.9040   35.876   3.2711   29.694   8.4645   36.962   3.5467  189.161   30.254  218.916   10.585 -29.75471 32.05226 
1 1 1   27   10   14 o   86.003   20.884   6.0595   2.7217  -8.7396   8.2127   7.8854   2.8847   64.720   30.718   98.500   19.820 -33.78009 36.55693 
1 1 1   27   10   15 o   77.882   22.147   4.9347   2.7653  -1.3327   8.9300   5.5995   2.9083   81.473   36.098   82.660   22.419 -1.187820 42.49393 
1 1 1   27   10   16 o  127.717   15.186   12.864   2.9105   12.169   9.3570   12.939   3.0624  120.822   41.682  127.888   15.994 -7.066238 44.64576 
1 1 1   27   10   17 o  284.148   11.929   62.452   5.1883   74.719   10.570   58.559   5.9551  305.826   22.743  274.181   14.239 31.64468 26.83254 
1 1 1   27   10   18 o  104.365   17.576   8.7499   2.7078   6.0823   5.3838   9.6533   3.1330   89.642   31.576  109.226   19.453 -19.58430 37.08670 
1 1 1   27   10   19 o  221.883   9.6544   37.957   3.2788   41.056   6.2327   36.771   3.8555  228.042   18.003  217.734   11.611 10.30849 21.42191 
1 1 1   27   10   20 o  299.805   8.3097   69.178   3.8132   86.371   7.2056   62.490   4.4941  333.231   14.127  284.511   10.320 48.72034 17.49510 
1 1 1   27   10   21 o   68.029   22.853   3.5195   2.8101   6.8408   6.1773   2.6528   3.1555   94.568   33.767   64.300   23.949 30.26793 41.39812 
1 1 1   27   10   22 o   70.739   30.889  -0.2964   6.3216  -0.2964   6.3216   0.0000   0.0000   70.739   30.889  ?   ?  0.000000 30.88874 
1 1 1   27   10   23 o   48.445   18.139   1.4210   1.8149   2.4131   2.1950  -0.7227   3.2266   57.882   20.176   49.444   21.813 8.437717 29.71355 
1 1 1   27   10   24 o   42.483   18.292  -0.0914   2.1540  -0.9207   2.7993   1.1124   3.3725   45.051   20.072   57.824   23.754 -12.77260 31.09869 
1 1 1   27   10   25 o  150.390   11.401   17.621   2.6048   17.460   3.5617   17.806   3.8194  148.468   15.922  149.602   16.980 -1.134079 23.27719 
1 1 1   27   10   26 o   91.982   19.437   6.9501   2.6508   7.6349   3.8806   6.3510   3.6296   95.123   25.938   87.258   25.544 7.864662 36.40427 
1 1 1   27   10   27 o   56.563   23.341   1.0158   3.2745  -0.6911   4.1534   3.8192   5.3230   56.256   24.787   78.807   30.677 -22.55064 39.43939 
1 1 1   27   10   28 o  292.819   8.5261   66.129   3.8214   76.459   5.5455   56.789   5.2732  313.855   11.544  270.068   12.757 43.78726 17.20423 
1 1 1   27   10   29 o  210.275   9.6362   34.187   3.1014   40.731   5.2070   30.588   3.8610  227.403   15.045  197.735   12.826 29.66884 19.76998 
1 1 1   27   10   30 o  247.346   12.048   47.607   4.5614   35.556   8.3652   52.706   5.4416  205.592   27.255  259.267   13.761 -53.67413 30.53184 
1 1 1   27   10   31 o  137.819   14.877   15.086   3.0885   13.202   5.2515   16.082   3.8187  123.301   28.410  141.167   18.089 -17.86549 33.68023 
1 1 1   27   10   32 o   56.346   22.930   1.2967   3.1058  -1.5623   5.6746   2.5195   3.7110   62.709   28.210   65.538   25.586 -2.829540 38.08411 
1 1 1   27   10   33 o   48.128   21.137  -0.4297   2.9981  -5.1472   5.2762   1.8197   3.6434   52.301   24.765   61.826   24.951 -9.524494 35.15491 
1 1 1   27   10   34 o  110.077   19.260   10.009   3.1269   12.232   5.3390   8.8489   3.8577  116.999   29.747  101.162   25.046 15.83697 38.88741 
1 1 1   27   10   35 o   51.189   22.282  -0.1029   3.2669   6.3571   6.1241  -2.6723   3.8623   88.907   33.315   47.713   22.133 41.19448 39.99698 
1 1 1   27   10   36 o   58.975   21.624   2.4595   2.5547   3.8457   6.6347   2.2182   2.7682   80.968   33.296   58.586   22.298 22.38195 40.07251 
1 1 1   27   10   37 o  148.648   11.949   17.434   2.6957   11.052   5.3537   19.601   3.1200  109.469   30.706  157.213   13.085 -47.74377 33.37766 
1 1 1   27   10   38 f   93.593   19.037   7.3723   2.6344   7.0567   6.0184   7.4471   2.9300   90.038   33.164   93.267   21.027 -3.228416 39.26767 
1 1 1   27   10   39 o   57.987   22.047   2.2657   2.7046  -2.6439   5.6196   3.7457   3.0854   58.063   26.850   68.112   23.911 -10.04863 35.95347 
1 1 1   27   10   40 o   85.250   22.095   6.3889   2.9067   0.5709   4.5777   10.320   3.7627   60.411   26.334  108.046   23.427 -47.63495 35.24667 
1 1 1   27   10   41 o   75.671   26.611   4.9836   3.8226   3.7823   4.3657   8.9307   7.9134   71.028   27.745   95.144   37.301 -24.11569 46.48830 
1 1 1   27   10   42 o   96.401   18.382   7.9317   2.6133   10.085   4.5758   6.8896   3.1836  102.611   28.243   87.263   23.368 15.34861 36.65718 
1 1 1   27   10   43 o  176.971   10.851   24.828   2.9250   13.891   4.8048   31.268   3.6869  121.888   26.509  197.762   12.240 -75.87370 29.19849 
1 1 1   27   11    0 o   26.099   18.107  -2.1402   2.5205  -2.1402   2.5205  -2.1402   2.5205   26.099   18.107   26.099   18.107 0.000000 0.000000 
1 1 1   27   11    1 o  100.256   12.089   7.8692   1.8177   10.673   3.0811   6.3726   2.2512  115.685   17.985   89.032   17.142 26.65307 24.84531 
1 1 1   27   11    2 o  343.407   9.4285   90.737   4.9559   0.0000   0.0000   90.737   4.9559  ?   ?   343.407   9.4285 0.000000 9.428509 
1 1 1   27   11    3 o  303.590   7.4518   70.775   3.4627   72.469   5.5179   69.674   4.4475  306.434   11.764  300.876   9.6574 5.558228 15.22050 
1 1 1   27   11    4 o  139.189   10.985   15.027   2.3213   24.169   4.6759   12.037   2.6741  175.202   17.678  123.833   14.376 51.36852 22.78549 
1 1 1   27   11    5 o  111.579   14.088   9.7919   2.3525   4.7209   4.8977   11.313   2.6822   82.548   29.991  119.867   14.943 -37.31882 33.50735 
1 1 1   27   11    6 o  260.712   16.670   53.128   6.6173   53.128   6.6173   0.0000   0.0000  260.712   16.670  ?   ?  0.000000 16.66979 
1 1 1   27   11    7 o  236.979   8.7795   43.190   3.1846   41.369   4.8103   44.611   4.2491  230.737   13.681  240.417   11.547 -9.680634 17.90263 
1 1 1   27   11    8 o  196.625   9.9198   29.851   2.9758   37.329   4.8440   25.317   3.7715  218.900   14.540  180.272   13.772 38.62865 20.02722 
1 1 1   27   11    9 o  106.743   16.297   9.0639   2.5782   13.284   4.5011   7.0032   3.1453  127.493   23.945   92.357   22.465 35.13578 32.83313 
1 1 1   27   11   10 o   90.297   19.628   6.6359   2.6354   10.861   4.4092   4.2879   3.2871  114.501   25.779   74.722   24.708 39.77921 35.70768 
1 1 1   27   11   11 o  262.615   9.0392   53.076   3.6334   61.348   5.3616   46.051   4.9411  281.640   12.437  243.480   13.309 38.16008 18.21571 
1 1 1   27   11   12 o  154.979   14.874   18.828   3.4850   27.943   6.3551   14.908   4.1674  186.528   22.729  136.166   20.643 50.36205 30.70403 
1 1 1   27   11   13 o  305.977   9.1984   72.081   4.3079   71.239   5.9817   72.987   6.2093  303.317   12.884  306.921   13.218 -3.603943 18.45829 
1 1 1   27   11   14 o  211.336   9.2278   34.392   2.9850   39.100   5.4531   32.377   3.5668  223.413   16.053  204.406   11.446 19.00656 19.71628 
1 1 1   27   11   15 o   41.017   18.516  -1.2162   2.4700  -0.1923   4.8901  -1.5669   2.8619   63.252   27.397   43.523   19.761 19.72935 33.78010 
1 1 1   27   11   16 o  162.906   11.307   20.601   2.8019   25.971   5.4239   18.646   3.2724  180.534   19.962  154.350   14.004 26.18413 24.38429 
1 1 1   27   11   17 o   83.577   23.737   5.7309   3.1787   8.4676   5.4019   4.2813   3.9314  101.026   31.513   76.517   26.979 24.50920 41.48460 
1 1 1   27   11   18 o  174.854   11.219   23.726   2.9866   17.411   5.8003   26.004   3.4840  144.647   27.197  182.786   12.528 -38.13892 29.94351 
1 1 1   27   11   19 o  181.761   10.921   25.619   3.0241   33.994   6.1199   22.913   3.4784  206.715   19.575  171.287   13.374 35.42868 23.70752 
1 1 1   27   11   20 o  144.005   13.759   16.261   2.9958   11.604   6.1012   17.740   3.4390  116.160   32.849  150.092   15.178 -33.93221 36.18615 
1 1 1   27   11   21 o   77.447   22.729   4.8942   2.8705 -10.6308   6.1128   9.2859   3.2512   49.738   24.303  106.557   20.680 -56.81934 31.91039 
1 1 1   27   11   22 o  130.042   15.950   13.417   3.1081   21.962   6.8152   11.173   3.4925  161.725   28.577  117.238   20.191 44.48733 34.99018 
1 1 1   27   11   23 o  109.564   20.052   9.7911   3.2389   10.597   8.6545   9.6597   3.4927  112.785   40.001  108.264   21.831 4.520950 45.57036 
1 1 1   27   11   24 o  393.312   6.5241  118.866   3.9276  131.746   5.3366  103.646   5.8014  413.517   8.4315  366.157   10.351 47.35999 13.35062 
1 1 1   27   11   25 o   72.147   21.727   4.2260   2.5965   7.4155   3.5747   0.6640   3.7777   93.969   24.574   58.564   24.681 35.40499 34.82860 
1 1 1   27   11   26 o   50.686   23.563  -3.4100   4.4140   0.1568   7.2813  -5.4823   5.5500   76.018   33.173   54.043   25.532 21.97504 41.86100 
1 1 1   27   11   27 o  187.463   13.586   27.551   3.8718   30.604   4.7971   21.844   6.5580  196.719   16.072  160.864   27.630 35.85439 31.96438 
1 1 1   27   11   28 o   38.358   18.637  -5.6471   3.4552  -0.4068   4.5713 -12.6304   5.2771   59.784   26.182   41.762   20.797 18.02224 33.43629 
1 1 1   27   11   29 o  113.573   17.420   10.419   2.9317   8.4417   4.9677   11.475   3.6315   99.051   30.103  118.075   20.856 -19.02394 36.62173 
1 1 1   27   11   30 o  120.990   16.303   11.743   2.9424   13.028   5.2210   11.145   3.5619  122.602   28.382  116.220   20.786 6.382538 35.17986 
1 1 1   27   11   31 o  142.332   14.996   16.100   3.2178   8.4771   5.5895   19.878   3.9353   98.902   32.196  157.710   16.549 -58.80804 36.19969 
1 1 1   27   11   32 o  104.039   20.304   8.9917   3.1172   10.166   5.7144   8.4940   3.7194  106.686   32.255   99.605   24.553 7.081421 40.53683 
1 1 1   27   11   33 f  245.340   9.5070   46.652   3.5701   35.521   5.6684   53.971   4.5963  210.153   17.789  263.156   11.411 -53.00249 21.13441 
1 1 1   27   11   34 o   70.380   24.134   3.9290   3.1344   1.8406   5.1068   5.1912   3.9702   69.029   28.870   79.492   27.162 -10.46257 39.63903 
1 1 1   27   11   35 o   36.413   17.756  -5.4175   3.2152 -10.2233   6.1476  -3.6080   3.7722   49.283   24.142   44.708   21.099 4.574425 32.06257 
1 1 1   27   11   36 o  210.254   12.007   34.762   3.8480   23.935   7.0902   39.283   4.5815  163.766   29.364  222.775   13.500 -59.00833 32.31872 
1 1 1   27   11   37 o   84.667   24.219   6.2490   3.2969   0.5865   5.6817   9.1236   4.0482   66.997   29.269  101.358   25.975 -34.36101 39.13216 
1 1 1   27   11   38 o   86.966   23.655   6.6391   3.2322   2.3650   4.9927   9.7227   4.2407   69.078   28.688  103.907   26.562 -34.82903 39.09709 
1 1 1   27   11   39 o   71.455   25.554   4.1708   3.5391  -1.2142   4.8064   10.548   5.2305   56.755   25.706  105.280   30.619 -48.52437 39.97957 
1 1 1   27   11   40 o   56.166   23.635   1.1324   3.4560   2.9787   4.5829  -1.3020   5.2624   68.704   27.894   58.629   26.688 10.07465 38.60487 
1 1 1   27   11   41 o   45.034   19.527   0.0937   2.4896   1.1350   4.5012  -0.3652   2.9883   61.290   26.416   47.055   20.864 14.23475 33.66154 
1 1 1   27   11   42 o  124.839   19.818   13.389   3.6603   13.612   4.7754   13.072   5.6990  120.900   26.534  114.024   31.574 6.876442 41.24279 
1 1 1   27   12    0 o  169.501   7.9239   22.175   2.0456   22.175   2.0456   22.175   2.0456  169.501   7.9239  169.501   7.9239 0.000000 0.000000 
1 1 1   27   12    1 o  148.306   14.909   17.233   3.3386   17.233   3.3386   0.0000   0.0000  148.306   14.909  ?   ?  0.000000 14.90932 
1 1 1   27   12    2 o   83.811   17.793   5.6827   2.2119   0.0000   0.0000   5.6827   2.2119  ?   ?    83.811   17.793 0.000000 17.79251 
1 1 1   27   12    3 o  256.655   7.8024   50.608   3.0651   54.437   4.9489   48.225   3.9041  265.452   12.180  250.199   10.194 15.25327 15.88332 
1 1 1   27   12    4 o  148.951   10.963   17.201   2.4818   25.148   4.5635   13.863   2.9573  178.899   16.865  132.876   14.792 46.02283 22.43236 
1 1 1   27   12    5 o  280.837   13.767   61.100   5.9180   61.100   5.9180   0.0000   0.0000  280.837   13.767  ?   ?  0.000000 13.76729 
1 1 1   27   12    6 o  316.033   8.4314   76.793   4.0785   97.975   7.1348   66.512   4.9707  355.806   13.101  293.629   11.060 62.17691 17.14504 
1 1 1   27   12    7 o   96.946   17.965   7.5669   2.5676   5.2073   4.0682   9.1292   3.3103   82.221   27.498  105.915   21.159 -23.69432 34.69678 
1 1 1   27   12    8 o  221.111   9.7595   37.656   3.3030   43.916   5.0196   32.875   4.3865  237.630   13.861  205.443   14.033 32.18672 19.72445 
1 1 1   27   12    9 o  111.746   16.754   9.9417   2.7774   8.6246   4.3063   10.880   3.6342  101.818   27.139  115.777   21.293 -13.95889 34.49461 
1 1 1   27   12   10 o  242.943   9.5087   45.453   3.5358   58.680   5.4079   35.576   4.6731  275.335   12.832  213.617   14.376 61.71829 19.26983 
1 1 1   27   12   11 o  140.950   14.197   15.569   3.0211   19.619   4.6508   12.612   3.9737  156.822   19.818  124.721   21.598 32.10125 29.31213 
1 1 1   27   12   12 o  171.285   14.080   22.918   3.6588   26.616   6.8157   21.421   4.3367  180.890   25.309  164.649   17.475 16.24026 30.75618 
1 1 1   27   12   13 o  216.243   11.579   36.236   3.8185   35.177   5.4569   37.251   5.3451  211.544   16.996  218.006   16.133 -6.462021 23.43389 
1 1 1   27   12   14 o  266.746   10.424   54.892   4.2558   68.896   6.1153   41.740   5.9264  298.065   13.404  230.534   16.913 67.53108 21.58076 
1 1 1   27   12   15 o   42.123   19.841  -3.4390   3.3062  -4.2817   5.0324  -2.7990   4.3855   53.511   24.970   52.386   24.041 1.125320 34.66226 
1 1 1   27   12   16 o  212.498   9.7397   34.811   3.1679   41.157   5.9696   32.324   3.7376  228.705   17.178  204.035   12.021 24.67030 20.96657 
1 1 1   27   12   17 o  146.297   15.749   16.883   3.4711   20.322   5.7472   14.908   4.3552  157.594   24.632  135.548   21.725 22.04619 32.84414 
1 1 1   27   12   18 o  218.051   9.7482   36.669   3.2535   49.470   6.4230   32.251   3.7734  250.844   16.826  203.711   12.157 47.13342 20.75856 
1 1 1   27   12   19 o  125.861   15.159   12.522   2.8615   13.592   5.9234   12.196   3.2682  126.006   30.939  123.452   17.811 2.553261 35.69940 
1 1 1   27   12   20 o  313.352   8.3554   75.595   4.0075   89.304   7.5349   70.188   4.7323  338.546   14.541  301.483   10.255 37.06287 17.79326 
1 1 1   27   12   21 o  195.433   11.296   29.655   3.3645   29.963   6.6713   29.550   3.8963  192.190   23.144  194.591   13.159 -2.401047 26.62317 
1 1 1   27   12   22 o   62.390   23.386   2.4588   3.0180   5.1929   6.4947   1.7058   3.4084   88.644   34.055   60.772   24.271 27.87254 41.81921 
1 1 1   27   12   23 o   66.520   24.090   3.0792   3.1563   10.456   8.7551   1.9772   3.3839  112.218   40.186   61.873   24.349 50.34525 46.98770 
1 1 1   27   12   24 o  136.668   12.300   14.616   2.5454   15.854   3.3544   12.936   3.9082  141.423   15.765  125.853   21.030 15.56969 26.28321 
1 1 1   27   12   25 o   83.956   24.390   5.8577   3.3204   5.4790   3.9490   6.7716   6.1344   82.459   27.072   93.324   33.615 -10.86501 43.16109 
1 1 1   27   12   26 o  173.063   14.431   23.568   3.7880   23.068   7.5620   23.735   4.3766  163.411   31.374  172.869   16.751 -9.458618 35.56554 
1 1 1   27   12   27 o  103.918   19.246   8.8362   2.9485   11.305   4.6849   7.2167   3.7941  115.012   27.064   92.366   25.829 22.64616 37.41090 
1 1 1   27   12   28 o  190.952   13.300   28.584   3.8629   30.021   5.1927   26.804   5.7804  193.988   17.683  181.616   21.192 12.37141 27.60047 
1 1 1   27   12   29 o  108.507   18.026   9.5710   2.8888   13.610   5.3847   7.9387   3.4232  125.321   28.690   97.001   23.339 28.32033 36.98461 
1 1 1   27   12   30 o   60.061   23.173   2.1291   3.0164   5.6876   5.6418   0.7047   3.5694   86.621   32.071   56.921   23.990 29.69981 40.05077 
1 1 1   27   12   31 o   83.780   23.281   5.9314   3.0927   4.7738   5.5450   6.4541   3.7261   82.352   31.507   87.111   25.981 -4.759682 40.83759 
1 1 1   27   12   32 o   98.331   21.261   8.1213   3.1068   14.108   5.3876   5.1390   3.8027  126.840   28.451   79.249   26.585 47.59026 38.93912 
1 1 1   27   12   33 o  268.166   9.0206   55.690   3.7026   53.220   5.6856   57.509   4.8791  259.457   14.373  271.404   11.745 -11.94678 18.56123 
1 1 1   27   12   34 o  103.363   20.745   8.9845   3.1680   11.588   5.0575   7.3033   4.0641  113.719   28.973   91.314   27.111 22.40489 39.67945 
1 1 1   27   12   35 o  174.870   13.899   24.285   3.6895   28.978   7.1401   22.575   4.3095  183.276   26.198  167.025   17.098 16.25139 31.28354 
1 1 1   27   12   36 o   89.048   25.676   6.9692   3.6922   4.4893   8.6849   7.5163   4.0791   88.109   37.293   92.003   27.122 -3.894241 46.11215 
1 1 1   27   12   37 o  145.239   14.897   16.963   3.2647   14.650   5.0027   18.680   4.3087  128.610   26.300  150.205   19.179 -21.59514 32.55062 
1 1 1   27   12   38 o   57.333   23.287   1.6406   3.1954   9.5815   4.9310  -4.1078   4.1954  101.224   29.814   46.207   21.938 55.01648 37.01535 
1 1 1   27   12   39 o   57.547   25.034   0.4443   4.1183  -2.5252   4.8709   7.8888   7.7123   53.746   24.904   92.911   36.698 -39.16473 44.35032 
1 1 1   27   12   40 o  104.116   21.531   9.4707   3.3180   1.2306   4.7519   17.310   4.6349   62.990   27.145  141.159   22.183 -78.16925 35.05653 
1 1 1   27   12   41 o   51.354   22.156   0.4534   3.1731   2.5188   4.6631  -1.3278   4.3303   66.608   27.699   52.901   24.131 13.70773 36.73601 
1 1 1   27   12   42 o   90.083   23.591   7.4004   3.2913   2.4488   4.7567   11.948   4.5587   66.331   27.811  112.632   26.827 -46.30061 38.64082 
1 1 1   27   13    1 o   59.042   15.260   2.8097   1.3891   3.3571   1.8070   2.0188   2.1721   64.550   17.740   55.240   19.987 9.309875 26.72474 
1 1 1   27   13    2 o  200.955   6.0921   30.981   1.8739   30.839   2.2725   31.284   3.3122  200.375   7.4096  201.126   10.799 -0.7509003 13.09631 
1 1 1   27   13    3 o  232.365   8.4625   41.519   3.0098   43.190   4.7002   40.357   3.9186  235.876   13.070  228.687   11.195 7.188843 17.20889 
1 1 1   27   13    4 o   43.544   18.740  -0.1228   2.2589   0.8916   3.7793  -0.6866   2.8175   60.055   24.952   46.344   20.418 13.71098 32.24123 
1 1 1   27   13    5 o  164.025   18.338   21.298   4.5251   21.298   4.5251   0.0000   0.0000  164.025   18.338  ?   ?  0.000000 18.33792 
1 1 1   27   13    6 o  165.519   12.028   21.281   3.0264   19.435   4.9951   22.353   3.8041  155.584   21.554  169.014   14.856 -13.42955 26.17790 
1 1 1   27   13    7 o  261.449   8.6787   52.584   3.4731   59.184   4.9440   46.154   4.8799  276.797   11.669  243.796   13.126 33.00067 17.56296 
1 1 1   27   13    8 o  173.937   11.653   23.474   3.0844   25.442   4.5614   21.816   4.1866  179.849   16.763  166.459   16.655 13.39046 23.63062 
1 1 1   27   13    9 o  251.620   9.4069   48.756   3.6230   54.256   5.1830   43.500   5.0663  264.740   12.790  236.370   14.067 28.36993 19.01249 
1 1 1   27   13   10 o  236.209   9.8581   42.996   3.5642   46.655   5.1025   39.510   4.9807  244.913   13.666  225.077   14.535 19.83641 19.95058 
1 1 1   27   13   11 o  233.519   10.375   42.058   3.7084   48.195   5.3741   36.479   5.1237  248.762   14.173  215.900   15.610 32.86133 21.08392 
1 1 1   27   13   12 o  114.379   21.682   10.666   3.6571   9.0859   6.6524   11.350   4.3779  105.555   35.161  117.051   25.182 -11.49673 43.24856 
1 1 1   27   13   13 o  166.862   14.361   21.788   3.6321   28.826   5.2393   15.275   5.0397  190.954   18.144  136.235   25.093 54.71892 30.96514 
1 1 1   27   13   14 o  184.501   13.961   26.582   3.9136   23.802   5.6068   29.223   5.4651  172.064   21.777  191.987   18.840 -19.92360 28.79544 
1 1 1   27   13   15 o   61.626   24.534   1.7538   3.4723   7.4546   5.3717  -2.3378   4.5509   96.000   31.577   54.727   24.876 41.27368 40.19875 
1 1 1   27   13   16 o   79.859   30.904   3.8146   5.3775   3.8146   5.3775   0.0000   0.0000   79.859   30.904  ?   ?  0.000000 30.90387 
1 1 1   27   13   17 o  181.835   10.756   25.630   2.9802   38.034   5.8881   21.357   3.4556  219.495   17.676  165.229   13.789 54.26645 22.41838 
1 1 1   27   13   18 o  100.212   18.922   8.1533   2.7961   12.228   5.7473   6.8897   3.2004  119.474   31.119   91.173   22.950 28.30154 38.66599 
1 1 1   27   13   19 o  290.623   8.5975   65.049   3.8245   73.662   6.9916   61.372   4.5685  307.347   14.862  281.829   10.591 25.51764 18.24945 
1 1 1   27   13   20 o  176.795   11.901   24.325   3.2017   20.559   6.3116   25.630   3.7152  156.999   27.253  181.072   13.502 -24.07359 30.41438 
1 1 1   27   13   21 o  133.946   16.156   14.242   3.2454   26.870   10.804   12.990   3.4025  171.494   41.587  127.296   17.962 44.19822 45.30079 
1 1 1   27   13   22 o   55.468   23.125   0.7507   3.2617  -3.5661   10.074   1.2561   3.4474   80.860   36.854   58.933   24.090 21.92650 44.02889 
1 1 1   27   13   23 o  181.561   9.9023   25.541   2.7415   28.254   3.6684   22.109   4.1259  190.267   12.669  167.087   16.342 23.17966 20.67745 
1 1 1   27   13   24 o  265.543   10.222   54.528   4.1548   59.403   5.0269   44.018   7.3809  276.662   11.871  234.007   20.825 42.65503 23.97034 
1 1 1   27   13   25 o  185.239   11.859   26.745   3.3447   34.404   5.1588   21.190   4.3932  208.613   16.285  162.843   17.922 45.76984 24.21593 
1 1 1   27   13   26 o   56.720   23.398   1.0410   3.2894  -1.0220   7.0418   1.6168   3.7203   71.831   31.930   61.948   25.139 9.882778 40.63840 
1 1 1   27   13   27 o  233.983   9.9556   42.357   3.5655   43.614   5.3122   41.327   4.8099  235.457   14.815  229.613   13.749 5.843613 20.21220 
1 1 1   27   13   28 o   93.775   24.546   7.4545   3.5643   3.5599   4.9681   11.586   5.1167   75.953   29.617  115.447   28.995 -39.49313 41.44743 
1 1 1   27   13   29 o   92.464   23.324   7.2292   3.3007   0.5219   5.2984   11.483   4.2196   66.574   28.677  116.497   24.443 -49.92266 37.68066 
1 1 1   27   13   30 o   87.433   22.060   6.4405   2.9522   4.8541   5.3559   7.1329   3.5382   82.196   31.080   91.451   24.697 -9.254753 39.69772 
1 1 1   27   13   31 o   82.384   23.230   5.7406   3.0558   0.0134   5.2144   8.7364   3.7713   64.228   28.049  100.937   24.628 -36.70921 37.32718 
1 1 1   27   13   32 o  213.418   10.425   35.399   3.4055   32.679   5.2892   37.325   4.4508  201.732   17.297  217.676   13.424 -15.94334 21.89476 
1 1 1   27   13   33 o   52.476   22.032   0.6925   2.9918  -6.4911   4.9564   4.8101   3.7525   47.561   22.916   76.908   26.404 -29.34721 34.96145 
1 1 1   27   13   34 o  132.237   17.515   14.248   3.4579   10.607   6.4740   15.701   4.0901  106.694   34.645  137.719   19.987 -31.02465 39.99729 
1 1 1   27   13   35 o   86.996   23.037   6.5373   3.1160   1.4416   4.6824   10.587   4.1745   65.088   27.457  109.918   25.332 -44.82986 37.35757 
1 1 1   27   13   36 o   37.755   18.391  -5.5604   3.4251   3.9272   7.0801  -8.4590   3.9135   81.839   34.090   36.946   18.316 44.89321 38.69906 
1 1 1   27   13   37 o   51.012   21.909   0.3389   3.0755   2.4829   4.6269  -1.3582   4.1165   67.927   27.854   52.448   23.769 15.47845 36.61734 
1 1 1   27   13   38 o   60.044   24.466   1.8701   3.5416   3.0112   4.7186   0.3981   5.3594   69.799   28.316   63.963   28.171 5.836166 39.94275 
1 1 1   27   13   39 o   51.586   22.840  -0.2917   3.5687   1.9851   4.7066  -3.3713   5.4738   65.525   27.578   55.172   25.841 10.35304 37.79318 
1 1 1   27   13   40 o   53.100   22.640   0.7546   3.2415   2.2830   4.7632  -0.5639   4.4240   66.359   27.826   55.680   24.989 10.67929 37.40018 
1 1 1   27   13   41 o   69.923   24.479   4.1961   3.2327   4.5483   4.7499   3.8923   4.4122   74.609   28.996   71.021   27.850 3.588287 40.20477 
1 1 1   27   14    0 o  115.815   11.862   10.632   2.0521   10.632   2.0521   10.632   2.0521  115.815   11.862  115.815   11.862 0.000000 0.000000 
1 1 1   27   14    1 o  236.180   7.0478   42.835   2.5478   43.067   3.4068   42.540   3.8379  236.506   9.4109  234.851   10.676 1.654724 14.23209 
1 1 1   27   14    2 o  193.008   12.353   28.922   3.6301   0.0000   0.0000   28.922   3.6301  ?   ?   193.008   12.353 0.000000 12.35260 
1 1 1   27   14    3 o  157.268   7.1869   18.996   1.7300   18.631   1.9754   20.197   3.5839  155.435   8.3335  160.610   14.743 -5.174835 16.93523 
1 1 1   27   14    4 o  246.521   9.1510   46.780   3.4530   45.712   5.1983   47.623   4.6192  242.348   14.074  248.185   12.160 -5.836472 18.59963 
1 1 1   27   14    5 o  332.049   12.487   85.297   6.3463   85.297   6.3463   0.0000   0.0000  332.049   12.487  ?   ?  0.000000 12.48681 
1 1 1   27   14    6 o   89.242   20.621   6.5156   2.7602   13.534   4.5128   2.3209   3.4888  128.619   23.799   64.601   24.922 64.01884 34.46035 
1 1 1   27   14    7 o   84.153   20.557   5.7968   2.6252   5.3406   3.7501   6.2352   3.6762   82.090   26.339   87.343   25.747 -5.253586 36.83311 
1 1 1   27   14    8 o  134.307   14.461   14.165   2.9260   12.670   4.1926   15.586   4.0855  124.608   22.823  139.535   19.675 -14.92654 30.13305 
1 1 1   27   14    9 o  244.400   9.4459   46.008   3.5336   61.422   5.1761   32.555   4.8357  281.835   11.999  203.893   15.613 77.94197 19.69141 
1 1 1   27   14   10 o  196.124   11.409   29.815   3.4100   39.621   4.9885   21.214   4.6720  225.350   14.540  163.323   19.047 62.02763 23.96235 
1 1 1   27   14   11 o  228.372   12.213   40.467   4.2535   59.575   7.7674   32.282   5.0835  274.935   18.566  202.705   16.528 72.23015 24.85741 
1 1 1   27   14   12 o  281.673   9.6781   61.150   4.1726   60.140   5.6809   62.333   6.1487  278.461   13.328  282.887   14.246 -4.425720 19.50898 
1 1 1   27   14   13 o  138.610   17.835   15.292   3.6961   15.146   5.0932   15.454   5.3722  135.390   25.513  136.362   26.695 -0.9712830 36.92578 
1 1 1   27   14   14 o  230.831   12.072   41.356   4.2506   49.455   5.9084   32.668   6.1195  251.408   15.429  202.542   20.001 48.86655 25.25994 
1 1 1   27   14   15 o  164.544   16.252   21.352   4.0397   20.159   5.6010   22.644   5.8319  157.140   24.052  166.950   23.470 -9.810364 33.60586 
1 1 1   27   14   16 o  383.688   18.035  115.668   10.592  115.668   10.592   0.0000   0.0000  383.688   18.035  ?   ?  0.000000 18.03540 
1 1 1   27   14   17 o  128.187   25.308   13.647   4.7894   38.757   9.0574   3.9011   5.6429  216.612   27.972   81.102   31.581 135.5104 42.18723 
1 1 1   27   14   18 o  259.751   14.541   52.731   5.7579   78.135   10.528   41.891   6.8775  312.294   22.170  229.360   19.784 82.93341 29.71374 
1 1 1   27   14   19 o  101.269   21.923   8.4685   3.2996   2.4489   9.2494   9.3463   3.5320   90.337   38.374  106.358   22.404 -16.02023 44.43507 
1 1 1   27   14   20 o  113.546   19.913   10.488   3.3347   10.042   9.6803   10.547   3.5521  112.515   41.940  113.457   21.235 -0.9423523 47.00901 
1 1 1   27   14   21 o   80.567   24.530   5.3101   3.2965   16.037   9.9714   3.9938   3.4929  132.656   42.991   73.047   25.452 59.60834 49.95980 
1 1 1   27   14   22 o   65.776   24.773   2.7507   3.3947   13.044   9.7096   1.3172   3.6234  121.811   42.436   60.266   24.674 61.54438 49.08735 
1 1 1   27   14   23 o  280.714   10.276   60.941   4.4154   64.573   5.3311   53.006   7.8794  288.388   12.077  257.326   20.166 31.06204 23.50639 
1 1 1   27   14   24 o   54.052   21.876   1.1648   2.8091   1.7492   4.3042   0.7313   3.7076   65.905   26.926   58.286   24.501 7.618408 36.40543 
1 1 1   27   14   25 o   58.814   24.562   0.9107   3.6886   8.1203   10.332  -0.1424   3.9488  106.630   42.362   56.622   24.572 50.00792 48.97221 
1 1 1   27   14   26 o   72.093   24.411   4.0418   3.2066   8.5651   5.5819   1.8139   3.9174  100.086   32.137   63.870   25.839 36.21619 41.23638 
1 1 1   27   14   27 o  142.301   15.419   16.087   3.3047   14.917   5.1627   16.899   4.3013  132.547   26.375  144.150   20.037 -11.60262 33.12268 
1 1 1   27   14   28 o  233.779   12.147   42.673   4.3315   42.045   5.7158   43.519   6.6384  230.223   16.326  232.939   18.778 -2.715683 24.88312 
1 1 1   27   14   29 o   61.837   24.267   2.1240   3.3522  -0.5518   5.2437   3.9732   4.3593   63.010   27.802   75.144   28.118 -12.13414 39.54208 
1 1 1   27   14   30 o  183.838   11.482   26.414   3.2147   28.375   5.3187   25.285   4.0352  187.403   18.795  178.590   14.898 8.813110 23.98359 
1 1 1   27   14   31 f  160.775   13.313   20.402   3.2466   10.601   5.1433   26.893   4.1859  109.071   29.911  184.023   14.991 -74.95271 33.45794 
1 1 1   27   14   32 o  192.145   11.387   28.898   3.3339   25.598   5.1906   31.216   4.3497  177.048   19.476  198.419   14.421 -21.37117 24.23359 
1 1 1   27   14   33 o   39.194   18.516  -2.9769   2.9183  -2.2155   4.3130  -3.6198   3.9634   52.051   23.871   46.145   21.732 5.906231 32.28112 
1 1 1   27   14   34 o   81.790   23.807   5.7571   3.1607   1.7395   5.2294   8.0696   3.9674   68.784   29.016   95.618   26.290 -26.83392 39.15496 
1 1 1   27   14   35 o  110.546   19.251   10.193   3.1389   9.0343   4.5449   11.249   4.3405  100.012   28.376  112.995   25.679 -12.98386 38.26977 
1 1 1   27   14   36 o  103.253   24.025   9.3527   3.7256   7.1709   7.6172   10.039   4.2714   92.509   36.492  105.795   26.449 -13.28498 45.06911 
1 1 1   27   14   37 o   51.482   22.638  -0.1838   3.4483  -4.1559   4.4016   6.1281   5.5485   47.473   22.519   84.643   31.712 -37.16956 38.89438 
1 1 1   27   14   38 o   51.992   22.452   0.3551   3.2642  -4.9756   4.6627   5.4788   4.5713   47.356   22.662   79.680   28.970 -32.32377 36.78081 
1 1 1   27   14   39 o  153.294   16.430   19.331   3.7950   16.488   4.9319   23.457   5.9421  135.845   24.626  162.473   24.670 -26.62758 34.85722 
1 1 1   27   14   40 o  134.385   18.612   15.255   3.7256   8.7102   4.8151   25.017   5.8806   94.661   29.789  168.319   23.464 -73.65790 37.92032 
1 1 1   27   15    0 o  240.501   10.806   44.714   3.9595   44.714   3.9595   44.714   3.9595  240.501   10.806  240.501   10.806 0.000000 0.000000 
1 1 1   27   15    1 o  111.373   10.450   9.6482   1.7606   11.094   2.1632   6.8112   3.0299  119.208   12.020   91.043   21.990 28.16555 25.06038 
1 1 1   27   15    2 o  275.046   6.2651   58.057   2.6375   60.453   3.1849   52.827   4.7055  280.508   7.4179  261.454   11.758 19.05444 13.90252 
1 1 1   27   15    3 o  149.112   8.3984   17.155   1.9090   18.203   2.2113   14.089   3.7826  153.449   9.4609  132.702   19.179 20.74695 21.38585 
1 1 1   27   15    4 o  140.094   8.9017   15.165   1.8989   15.165   1.8989   0.0000   0.0000  140.094   8.9017  ?   ?  0.000000 8.901654 
1 1 1   27   15    5 o   78.150   22.448   4.9633   2.8271   6.0328   4.2610   4.1223   3.7785   87.003   28.093   75.265   26.458 11.73793 38.59092 
1 1 1   27   15    6 o  187.887   11.750   27.389   3.3621   28.263   5.0086   26.672   4.5359  189.343   17.480  184.264   16.249 5.079697 23.86558 
1 1 1   27   15    7 o  276.493   8.7659   58.835   3.7098   67.031   5.0883   49.533   5.4204  294.587   11.285  252.210   14.097 42.37706 18.05760 
1 1 1   27   15    8 o   97.359   20.221   7.7299   2.9148   8.7674   4.0069   6.5636   4.2481  102.643   25.592   89.860   27.932 12.78222 37.88374 
1 1 1   27   15    9 o  160.609   13.335   20.135   3.2484   16.786   4.4741   23.868   4.7240  144.446   20.839  173.639   18.037 -29.19298 27.56120 
1 1 1   27   15   10 o  246.809   10.122   46.981   3.8237   54.354   5.3814   39.463   5.4339  264.400   13.340  224.400   15.924 39.99966 20.77345 
1 1 1   27   15   11 o   81.416   26.500   5.2404   3.7867  -2.0018   6.8246   8.4620   4.5517   69.519   31.130  100.556   28.350 -31.03687 42.10501 
1 1 1   27   15   12 o  234.927   11.171   42.652   4.0168   48.283   5.6334   36.828   5.7291  248.606   14.873  216.137   17.467 32.46826 22.94100 
1 1 1   27   15   13 o  197.571   13.396   30.434   4.0272   36.975   5.5403   23.105   5.8641  216.760   16.831  168.754   23.326 48.00551 28.76454 
1 1 1   27   15   14 o  114.771   21.630   10.769   3.6604   15.939   5.1817   5.6187   5.1716  138.898   25.305   86.801   30.907 52.09689 39.94491 
1 1 1   27   15   15 o  280.974   13.128   61.280   5.6458   74.370   9.7109   54.597   6.9391  305.627   20.884  263.320   17.313 42.30740 27.12705 
1 1 1   27   15   16 o  214.148   29.062   38.126   9.2800   38.126   9.2800   0.0000   0.0000  214.148   29.062  ?   ?  0.000000 29.06234 
1 1 1   27   15   17 o  116.047   27.959   11.405   4.9074   16.263   8.4770   8.9561   6.0185  134.941   38.904  103.441   33.387 31.49963 51.26601 
1 1 1   27   15   18 o  159.130   21.535   20.492   5.1105   16.357   8.8110   22.588   6.2736  134.863   39.890  165.456   25.599 -30.59276 47.39738 
1 1 1   27   15   19 o  184.383   18.389   27.058   5.1207   32.734   9.2436   24.545   6.1507  196.094   31.893  173.309   23.816 22.78488 39.80385 
1 1 1   27   15   20 o  108.118   21.338   9.6168   3.4057   20.611   9.5571   8.0175   3.6450  150.092   40.613   97.806   24.422 52.28615 47.39084 
1 1 1   27   15   21 o  108.421   30.720   10.118   5.3307   13.110   10.290   9.0210   6.2321  122.432   43.596  103.396   34.012 19.03587 55.29453 
1 1 1   27   15   22 o  187.707   12.080   27.464   3.4524   29.675   4.0521   21.609   6.5939  194.656   13.687  160.130   27.918 34.52625 31.09279 
1 1 1   27   15   23 o  177.101   12.343   24.490   3.3249   26.371   5.2532   23.233   4.2947  181.334   19.220  171.101   16.608 10.23323 25.40104 
1 1 1   27   15   24 o  176.051   12.304   24.211   3.2947   35.302   5.4564   17.847   4.1332  210.935   17.046  149.017   18.520 61.91806 25.17054 
1 1 1   27   15   25 o   46.379   21.380  -2.3874   3.5222  -0.5775   10.682  -2.6082   3.7308   87.590   39.103   47.451   21.920 40.13954 44.82804 
1 1 1   27   15   26 o  150.225   15.529   17.916   3.5192   24.693   5.9991   14.360   4.3454  173.152   23.221  131.774   22.343 41.37805 32.22408 
1 1 1   27   15   27 o   67.407   26.430   2.6043   3.9734   4.9050   6.1669   0.9713   5.1955   85.220   33.062   67.498   28.718 17.72182 43.79306 
1 1 1   27   15   28 f   62.163   24.385   2.1523   3.3835   11.286   6.2404  -1.6509   4.0268  112.164   33.661   52.118   23.574 60.04632 41.09534 
1 1 1   27   15   29 o   67.418   24.872   3.1970   3.3873   1.1863   5.5570   4.3858   4.2729   69.634   29.665   76.649   27.987 -7.015198 40.78379 
1 1 1   27   15   30 o   66.263   24.258   3.1408   3.2129   4.6718   4.4940   1.5401   4.5952   78.452   28.694   65.773   27.437 12.67884 39.69995 
1 1 1   27   15   31 o  112.922   18.003   10.439   3.0071   3.1469   4.3643   17.030   4.1493   70.825   27.719  144.208   19.281 -73.38335 33.76572 
1 1 1   27   15   32 o   37.034   17.737  -3.6775   2.8695   0.2001   4.2998  -6.7912   3.8531   59.081   25.640   39.181   19.176 19.89937 32.01778 
1 1 1   27   15   33 o   86.216   22.668   6.3877   3.0311   0.0202   4.4312   11.987   4.1552   59.122   25.837  118.099   23.809 -58.97701 35.13459 
1 1 1   27   15   34 f  138.369   15.785   15.453   3.2833   14.944   5.0667   15.821   4.3109  130.447   26.284  137.321   21.192 -6.873566 33.76337 
1 1 1   27   15   35 o   43.083   19.805  -1.7547   2.9935  -1.9117   4.2319  -1.5975   4.2351   51.875   23.736   52.742   23.983 -0.8670769 33.74305 
1 1 1   27   15   36 o  135.764   23.092   15.919   4.6269   12.955   7.4402   17.788   5.9082  112.908   37.164  139.657   28.601 -26.74921 46.89586 
1 1 1   27   15   37 o   52.431   22.647   0.3485   3.3229   3.8243   4.1936  -5.5154   5.4469   71.306   27.372   51.246   24.516 20.05991 36.74554 
1 1 1   27   15   38 o   98.593   21.883   8.5313   3.2162   4.8482   4.4098   12.716   4.7008   76.124   28.320  117.623   26.718 -41.49866 38.93469 
1 1 1   27   15   39 o   88.802   26.258   7.3153   3.8185   5.7668   4.3794   12.226   7.7986   80.031   28.447  105.916   37.928 -25.88549 47.41070 
1 1 1   27   15   40 o   67.369   24.123   3.7846   3.1546   2.2344   4.3472   5.5089   4.5847   64.149   26.716   78.564   28.944 -14.41479 39.38933 
1 1 1   27   16    0 o  254.234   11.590   50.013   4.4886   50.013   4.4886   50.013   4.4886  254.234   11.590  254.234   11.590 0.000000 0.000000 
1 1 1   27   16    1 o  224.049   7.1957   38.562   2.4676   39.318   2.9719   36.884   4.4280  226.053   8.5893  217.730   13.351 8.322952 15.87538 
1 1 1   27   16    2 o   47.892   18.220   1.2897   1.8478   2.5081   2.1492  -2.1647   3.6188   58.540   19.984   48.220   22.020 10.32024 29.73666 
1 1 1   27   16    3 o  255.494   7.0144   50.137   2.7431   54.668   3.2405   38.682   5.1527  266.654   7.9394  222.445   15.225 44.20905 17.17082 
1 1 1   27   16    4 o  159.264   9.9261   19.627   2.4077   19.627   2.4077   0.0000   0.0000  159.264   9.9261  ?   ?  0.000000 9.926139 
1 1 1   27   16    5 o  288.400   6.5138   63.855   2.8754   63.551   3.2738   64.883   6.0145  287.574   7.4375  289.195   13.587 -1.620911 15.48985 
1 1 1   27   16    6 o  220.614   11.207   37.693   3.7720   41.063   5.3731   34.418   5.2964  229.115   15.411  209.277   16.673 19.83824 22.70432 
1 1 1   27   16    7 o  195.440   11.250   29.607   3.3511   36.288   4.4178   20.555   5.1427  215.880   13.436  159.808   21.576 56.07199 25.41763 
1 1 1   27   16    8 o  157.596   13.963   19.436   3.3333   25.375   4.5385   12.480   4.9117  179.449   16.716  122.176   26.985 57.27242 31.74296 
1 1 1   27   16    9 o  284.181   9.5529   62.244   4.1553   64.149   5.5432   59.801   6.2780  287.751   12.586  276.786   14.873 10.96518 19.48350 
1 1 1   27   16   10 o   58.500   25.003   0.2061   3.9706   5.4813   7.1673  -2.1298   4.7694   92.477   35.708   56.776   25.671 35.70088 43.97830 
1 1 1   27   16   11 o  139.569   21.721   15.788   4.4893   18.258   7.8299   14.579   5.4794  144.688   35.599  131.764   28.030 12.92438 45.30950 
1 1 1   27   16   12 o  130.337   19.096   13.639   3.6966   14.602   5.0213   12.499   5.4621  132.691   25.651  121.292   29.667 11.39926 39.21852 
1 1 1   27   16   13 o   61.282   25.214   1.2208   3.8074  -4.4930   5.1242   8.2634   5.6889   53.562   25.060  100.081   32.476 -46.51945 41.02068 
1 1 1   27   16   14 o  281.807   11.068   61.403   4.7741   67.759   6.3187   52.950   7.2876  295.135   13.987  258.723   18.525 36.41205 23.21280 
1 1 1   27   16   15 o   67.507   28.756   0.6379   5.2206   0.6379   5.2206   0.0000   0.0000   67.507   28.756  ?   ?  0.000000 28.75631 
1 1 1   27   16   16 o  122.626   26.800   12.644   4.8897   12.414   7.7014   12.800   6.3290  119.344   37.688  121.471   33.126 -2.127441 50.17723 
1 1 1   27   16   17 o  123.813   28.099   12.995   5.2032   14.814   8.1366   11.736   6.7678  128.993   38.375  116.231   35.094 12.76170 52.00188 
1 1 1   27   16   18 o  244.161   15.766   46.846   5.8604   44.696   9.3764   48.225   7.5074  232.875   26.794  245.753   20.135 -12.87828 33.51604 
1 1 1   27   16   19 o  158.932   22.998   20.646   5.4320   15.680   8.8725   23.623   6.8700  131.587   40.279  167.969   27.686 -36.38225 48.87684 
1 1 1   27   16   20 o   45.346   22.073  -8.0968   4.9078 -15.2938   8.9558  -5.0079   5.8673   59.422   29.115   57.031   26.726 2.390640 39.52144 
1 1 1   27   16   21 o  129.571   10.529   13.073   2.0701   13.585   2.1681   7.7890   6.9645  132.038   10.823   99.155   35.803 32.88309 37.40293 
1 1 1   27   16   22 o  292.947   9.0466   66.229   4.0565   86.436   6.7065   54.571   5.0939  333.126   13.153  264.896   12.563 68.23004 18.18877 
1 1 1   27   16   23 o  111.553   19.383   10.151   3.1896   13.250   5.0816   8.1367   4.0971  124.650   27.383   97.816   26.644 26.83407 38.20584 
1 1 1   27   16   24 o   72.401   25.854   3.8618   3.6213  -5.8437   10.000   5.3266   3.8850   75.970   35.366   81.244   26.860 -5.274269 44.40978 
1 1 1   27   16   25 o  187.311   12.683   27.460   3.6149   27.941   5.9490   27.178   4.5516  185.301   21.366  185.051   16.234 0.2501678 26.83369 
1 1 1   27   16   26 o   51.728   22.380  -0.0700   3.2557   1.6797   5.6427  -0.9431   3.9862   72.012   30.246   54.036   24.021 17.97620 38.62486 
1 1 1   27   16   27 f  163.683   16.578   21.395   4.0961   19.047   5.9780   23.472   5.6237  149.327   27.155  168.816   22.311 -19.48877 35.14477 
1 1 1   27   16   28 o   63.001   24.002   2.5167   3.2096   7.7632   4.7133  -2.0198   4.3828   94.721   29.418   53.490   24.352 41.23045 38.18953 
1 1 1   27   16   29 o  155.072   14.398   19.076   3.3784   23.300   4.6126   14.189   4.9620  169.904   18.011  128.406   26.136 41.49849 31.74071 
1 1 1   27   16   30 o   70.779   24.232   3.9700   3.1599   3.5294   4.1635   4.5685   4.8527   71.785   27.340   78.774   29.629 -6.988770 40.31586 
1 1 1   27   16   31 o  111.163   19.716   10.269   3.2319   7.2939   4.2784   14.223   4.9321   91.268   27.976  127.976   26.064 -36.70789 38.23602 
1 1 1   27   16   32 o   97.577   20.510   8.0295   2.9660   5.4149   4.3625   10.277   4.0445   81.040   28.433  108.717   24.848 -27.67790 37.75999 
1 1 1   27   16   33 o  147.277   14.254   17.316   3.1730   14.157   4.6306   20.112   4.3565  128.006   24.527  156.702   18.521 -28.69589 30.73444 
1 1 1   27   16   34 o  121.608   17.708   12.165   3.1993   11.885   4.8323   12.384   4.2689  114.813   27.795  119.355   24.195 -4.541595 36.85086 
1 1 1   27   16   35 o   56.699   25.265  -0.5622   4.4365 -13.8109   7.4019   6.8658   5.5423   51.163   25.333   88.154   31.922 -36.99083 40.75252 
1 1 1   27   16   36 o   84.524   24.721   6.3733   3.4010   2.7768   4.2164   13.070   5.7537   66.941   26.903  116.550   31.502 -49.60953 41.42613 
1 1 1   27   16   37 o   59.379   23.457   2.1970   3.1517   7.7692   3.9745  -7.2424   5.1730   91.850   26.685   46.674   22.706 45.17642 35.03772 
1 1 1   27   16   38 o   82.883   26.019   6.2749   3.6760   7.4599   4.3030   3.0748   7.0715   89.108   28.175   76.475   33.035 12.63256 43.41801 
1 1 1   27   16   39 o   71.682   24.008   4.4969   3.1011   5.9607   4.2783   2.8763   4.5014   80.691   28.165   67.298   27.521 13.39219 39.37871 
1 1 1   27   17    0 o  168.575   17.020   22.635   4.2891   22.635   4.2891   22.635   4.2891  168.575   17.020  168.575   17.020 0.000000 0.000000 
1 1 1   27   17    1 o  179.728   9.1470   24.942   2.5080   25.694   2.9666   23.058   4.6956  182.133   10.688  170.525   18.275 11.60825 21.17079 
1 1 1   27   17    2 o  120.596   12.773   11.390   2.3218   10.277   2.6988   14.560   4.5547  113.744   15.939  133.544   23.120 -19.80023 28.08186 
1 1 1   27   17    3 o  112.054   15.806   9.9737   2.6357   9.9737   2.6357   0.0000   0.0000  112.054   15.806  ?   ?  0.000000 15.80629 
1 1 1   27   17    4 o  316.687   6.9480   77.039   3.3679   78.342   3.9385   73.495   6.4964  319.149   8.0625  307.646   13.796 11.50305 15.97921 
1 1 1   27   17    5 o  138.335   10.949   14.871   2.2993   14.437   2.5746   16.583   5.1106  135.969   12.511  142.242   24.349 -6.272552 27.37530 
1 1 1   27   17    6 o  224.252   7.8699   38.673   2.7013   37.893   3.0398   41.599   5.8904  221.824   8.9530  230.036   16.846 -8.212189 19.07770 
1 1 1   27   17    7 o  135.272   10.203   14.197   2.0970   13.260   2.2770   19.426   5.3808  130.460   11.521  154.483   23.497 -24.02266 26.16937 
1 1 1   27   17    8 o  104.746   21.101   8.9769   3.2662   14.839   4.3294   1.2329   4.9759  135.260   21.641   68.305   28.526 66.95581 35.80630 
1 1 1   27   17    9 o  403.665   8.6183  125.447   5.3249  140.456   7.1801  107.104   7.9378  426.336   11.003  371.202   13.971 55.13416 17.78340 
1 1 1   27   17   10 o  207.525   15.807   33.811   4.9831   40.423   8.9809   30.870   5.9896  222.011   26.983  196.680   20.182 25.33055 33.69609 
1 1 1   27   17   11 o  274.177   10.841   58.090   4.5495   63.886   6.0943   50.794   6.8375  286.647   13.890  253.786   17.713 32.86096 22.50962 
1 1 1   27   17   12 o  245.843   12.005   46.815   4.5175   54.148   5.9349   36.715   6.9655  263.190   14.792  213.930   21.566 49.26047 26.15189 
1 1 1   27   17   13 o   73.643   26.770   3.7918   3.9030  -0.5904   5.1131   9.9104   6.0418   63.130   27.667  107.972   33.270 -44.84173 43.27087 
1 1 1   27   17   14 o  136.213   20.298   14.991   4.1028   16.968   5.4579   12.423   6.2212  142.927   25.902  119.799   32.915 23.12782 41.88412 
1 1 1   27   17   15 o  259.828   16.354   53.086   6.4708   53.086   6.4708   0.0000   0.0000  259.828   16.354  ?   ?  0.000000 16.35392 
1 1 1   27   17   16 o  211.553   14.880   35.102   4.7877   37.944   6.3969   31.482   7.2191  218.212   19.353  196.237   24.573 21.97484 31.27923 
1 1 1   27   17   17 o  159.005   19.442   20.292   4.6332   13.325   6.1044   29.759   7.1159  123.896   31.974  190.381   25.026 -66.48479 40.60355 
1 1 1   27   17   18 o  113.030   29.938   10.988   5.2619   12.969   8.3698   9.6939   6.7662  121.039   39.397  106.891   35.453 14.14812 53.00060 
1 1 1   27   17   19 o  142.013   11.851   15.750   2.5525   18.668   2.7643  -1.1341   6.6495  154.710   11.761   69.923   31.057 84.78744 33.20975 
1 1 1   27   17   20 o  291.105   6.9101   65.165   3.0789   68.903   3.3451   44.442   7.8762  299.254   7.3030  234.348   22.223 64.90620 23.39254 
1 1 1   27   17   21 o  163.245   10.124   20.687   2.5173   23.760   2.7053   0.8502   6.8731  174.988   10.144   75.879   32.673 99.10877 34.21149 
1 1 1   27   17   22 o   90.240   28.194   6.8114   4.3220   8.8187   5.3448   3.0192   7.3464  101.380   31.301   83.801   34.801 17.57925 46.80676 
1 1 1   27   17   23 o   91.888   25.377   7.1422   3.6870   1.6442   9.8538   8.0373   3.9758   89.161   38.755   97.181   26.153 -8.020020 46.75332 
1 1 1   27   17   24 o  162.702   13.382   20.803   3.3030   19.205   4.7450   22.306   4.6007  153.519   20.723  166.669   18.338 -13.14963 27.67125 
1 1 1   27   17   25 o  202.246   11.049   31.848   3.4073   42.735   5.0191   22.543   4.6404  233.155   14.131  167.404   18.414 65.75175 23.21144 
1 1 1   27   17   26 o  135.926   15.986   14.767   3.2623   17.885   4.7956   12.081   4.4508  147.215   21.954  119.140   25.194 28.07556 33.41723 
1 1 1   27   17   27 o   80.306   25.445   5.3675   3.5082   5.8608   4.5541   4.6474   5.5019   84.672   29.087   81.653   31.350 3.019730 42.76538 
1 1 1   27   17   28 o   52.457   22.241   0.4657   3.0978  -1.5015   4.2053   2.7999   4.5807   53.589   24.179   70.569   28.152 -16.97987 37.11026 
1 1 1   27   17   29 o   39.903   19.011  -3.7542   3.2057 -10.3816   4.1940   5.5583   4.9715   36.750   18.339   83.534   30.236 -46.78430 35.36308 
1 1 1   27   17   30 o  113.247   20.103   10.676   3.3570   12.291   4.4350   8.5104   5.1371  119.284   25.086   97.656   30.775 21.62866 39.70386 
1 1 1   27   17   31 o  189.919   12.855   28.457   3.7149   25.125   4.9518   32.745   5.6183  175.482   18.725  200.685   18.499 -25.20335 26.32153 
1 1 1   27   17   32 o  150.015   14.584   17.989   3.3064   9.2996   4.7282   26.306   4.6255  101.495   28.993  180.395   16.951 -78.90031 33.58437 
1 1 1   27   17   33 o  206.037   11.495   33.357   3.6107   25.474   5.3944   39.755   4.8600  175.006   20.528  223.443   14.285 -48.43645 25.00920 
1 1 1   27   17   34 o   57.644   23.781   1.4236   3.3983   2.8027   4.3071  -0.8505   5.5309   67.890   27.224   61.982   27.869 5.908798 38.95950 
1 1 1   27   17   35 o   94.684   31.876   8.4513   5.4670   8.6945   7.2921   8.1391   8.2612   95.995   36.273   94.966   37.831 1.028320 52.41123 
1 1 1   27   17   36 o  180.021   12.635   25.812   3.4596   20.777   4.2983   35.074   5.8295  158.209   18.074  205.385   18.750 -47.17581 26.04343 
1 1 1   27   17   37 o   75.978   23.784   5.1133   3.0740   2.7886   3.9902   8.5070   4.8212   65.482   26.223   94.217   29.827 -28.73573 39.71452 
1 1 1   27   17   38 o  117.076   20.075   11.792   3.4680   5.6793   4.2411   24.128   6.0245   79.362   28.017  164.194   24.739 -84.83258 37.37669 
1 1 1   27   18    0 o  120.514   31.217   13.440   4.9765   13.440   4.9765   13.440   4.9765  120.514   31.217  120.514   31.217 0.000000 0.000000 
1 1 1   27   18    1 o  234.794   11.150   42.604   4.0072   49.016   5.5647   35.698   5.7752  250.583   14.571  212.606   17.914 37.97653 23.09170 
1 1 1   27   18    2 o  149.433   13.945   17.495   3.1526   17.495   3.1526   0.0000   0.0000  149.433   13.945  ?   ?  0.000000 13.94456 
1 1 1   27   18    3 o  102.866   16.938   8.4839   2.5740   8.4712   2.9686   8.5222   5.1671  102.051   19.718  101.013   30.701 1.038315 36.48785 
1 1 1   27   18    4 o  214.296   9.1859   35.382   3.0130   35.189   3.4915   35.943   5.9634  213.191   10.734  213.107   18.465 0.8406067E-01 21.35805 
1 1 1   27   18    5 f  287.632   7.9384   63.636   3.4950   68.154   4.1451   52.526   6.5000  297.432   9.1050  258.680   16.502 38.75165 18.84761 
1 1 1   27   18    6 o  135.358   13.269   14.351   2.7138   15.916   3.1288   9.5998   5.4528  142.289   14.571  106.526   31.344 35.76275 34.56575 
1 1 1   27   18    7 o   61.736   21.217   2.7993   2.4232   3.0747   2.7509   1.8456   5.1192   64.961   22.590   71.167   29.254 -6.205788 36.96047 
1 1 1   27   18    8 o  289.168   7.4655   64.289   3.3043   67.515   3.7893   54.051   6.7503  296.163   8.3592  262.170   16.912 33.99347 18.86505 
1 1 1   27   18    9 o  261.195   9.1016   52.574   3.6388   56.879   4.3200   42.060   6.7507  271.395   10.400  230.124   19.345 41.27055 21.96311 
1 1 1   27   18   10 o  192.739   9.7359   28.730   2.8629   30.223   3.2009   22.757   6.4007  197.503   10.628  166.093   26.033 31.40987 28.11845 
1 1 1   27   18   11 o  289.899   7.7463   64.650   3.4372   69.029   3.8970   49.307   7.2944  299.399   8.5038  249.208   19.273 50.19099 21.06554 
1 1 1   27   18   12 o  245.292   12.443   46.784   4.6564   44.724   5.8338   50.399   7.7293  238.567   16.070  251.437   20.255 -12.87039 25.85559 
1 1 1   27   18   13 o  379.712   10.035  111.330   5.8322  117.570   7.5377  102.022   9.2061  389.193   12.653  360.689   16.675 28.50327 20.93256 
1 1 1   27   18   14 o  141.300   33.819   17.440   7.2168   17.440   7.2168   0.0000   0.0000  141.300   33.819  ?   ?  0.000000 33.81903 
1 1 1   27   18   15 o   67.939   28.413   1.2825   4.9461   5.2733   7.1098  -2.4602   6.8852   90.790   35.422   68.270   30.858 22.51907 46.97844 
1 1 1   27   18   16 o   72.145   29.732   1.9737   5.3047  -5.0653   7.4239   9.3165   7.5824   65.832   30.588  106.387   37.473 -40.55450 48.37186 
1 1 1   27   18   17 o  140.318   10.166   15.296   2.1687   15.682   2.2656   11.068   7.4953  142.018   10.497  113.066   37.306 28.95213 38.75415 
1 1 1   27   18   18 f   44.624   18.308   0.6011   2.0003   0.1115   2.0875   6.0940   6.9924   42.795   18.206   92.960   35.425 -50.16536 39.82940 
1 1 1   27   18   19 o   48.312   19.158   1.0718   2.1097   0.4498   2.2142   7.1999   6.9503   45.694   19.052   96.770   35.640 -51.07656 40.41228 
1 1 1   27   18   20 o  163.045   9.6301   20.610   2.3926   21.369   2.5346   14.400   7.2517  165.941   10.026  126.766   35.800 39.17484 37.17721 
1 1 1   27   18   21 o  190.320   9.3582   27.980   2.7261   28.134   2.8925   26.757   8.1566  190.475   9.9557  176.050   31.422 14.42490 32.96142 
1 1 1   27   18   22 o  126.429   26.697   13.605   5.0042   10.876   6.4891   17.609   7.8604  111.011   34.525  139.212   36.457 -28.20037 50.21046 
1 1 1   27   18   23 o  136.256   18.695   15.017   3.7963   11.894   4.2882   26.334   8.1632  118.815   24.396  173.718   31.875 -54.90358 40.13983 
1 1 1   27   18   24 o   51.681   21.747   0.5263   2.9259   5.4727   4.2895  -3.7774   4.0011   82.533   28.233   46.528   21.889 36.00504 35.72414 
1 1 1   27   18   25 o   73.311   23.820   4.3448   3.0601   0.9601   4.3657   7.6142   4.2907   62.752   26.494   94.075   27.839 -31.32334 38.43095 
1 1 1   27   18   26 o   90.590   24.348   7.0038   3.4487   3.5589   4.3874   12.574   5.5789   73.180   28.019  118.933   30.500 -45.75289 41.41675 
1 1 1   27   18   27 o   53.357   22.380   0.7032   3.0825   2.4293   4.2848  -1.1485   4.4380   67.689   27.150   56.141   25.124 11.54856 36.99077 
1 1 1   27   18   28 o   47.494   21.231  -0.9371   3.1598   0.5301   4.2535  -2.7438   4.7200   60.124   25.792   53.649   24.738 6.475143 35.73800 
1 1 1   27   18   29 o  173.306   13.444   23.752   3.5384   25.812   4.8492   21.406   5.1748  178.505   17.993  160.471   21.618 18.03473 28.12659 
1 1 1   27   18   30 o   79.958   24.873   5.4456   3.3678   3.1589   4.6747   7.9134   4.8562   71.774   28.500   94.361   29.941 -22.58792 41.33695 
1 1 1   27   18   31 o  130.465   18.188   13.965   3.5333   11.616   4.8178   16.698   5.1975  113.977   27.852  138.821   25.396 -24.84409 37.69254 
1 1 1   27   18   32 o  189.922   12.548   28.496   3.6270   34.308   4.8941   21.415   5.4022  206.768   15.578  158.832   22.881 47.93573 27.68098 
1 1 1   27   18   33 o   55.316   24.447  -0.3135   4.0707  -2.4310   4.6275   6.9316   8.5598   52.984   24.453   93.032   37.987 -40.04761 45.17680 
1 1 1   27   18   34 o   42.700   20.391  -4.1591   3.7339  -7.9163   6.7459  -2.4997   4.4833   54.723   26.457   51.659   23.922 3.064621 35.66834 
1 1 1   27   18   35 o   89.971   26.283   7.3859   3.8463   10.981   6.9647   5.8085   4.6136  103.970   35.956   81.342   29.168 22.62787 46.29889 
1 1 1   27   18   36 o   45.686   20.447  -0.6761   2.9398  -0.1790   3.9577  -1.2880   4.3909   54.307   24.048   53.679   24.413 0.6284599 34.26855 
1 1 1   27   18   37 o   60.417   23.342   2.5430   3.0640   2.2570   4.0079   2.9451   4.7533   63.116   25.908   68.647   28.200 -5.530857 38.29425 
1 1 1   27   19    0 o   83.989   40.189   8.3989   5.9389   8.3989   5.9389   8.3989   5.9389   83.989   40.189   83.989   40.189 0.000000 0.000000 
1 1 1   27   19    1 o   60.516   27.592  -2.9063   5.6539  -2.9063   5.6539   0.0000   0.0000   60.516   27.592  ?   ?  0.000000 27.59210 
1 1 1   27   19    2 o   65.846   22.346   3.2511   2.6870   1.7957   3.0231   8.7264   5.8638   58.978   23.074  102.452   32.943 -43.47417 40.21996 
1 1 1   27   19    3 o  155.404   12.700   18.849   2.9945   20.424   3.4252   13.741   6.1683  161.480   13.996  126.436   31.880 35.04449 34.81730 
1 1 1   27   19    4 o   51.619   21.487   0.6105   2.8099  -0.9119   3.1990   5.7524   5.8790   48.623   21.572   89.313   32.795 -40.69014 39.25404 
1 1 1   27   19    5 o  171.409   12.205   22.876   3.1813   22.950   3.6512   22.644   6.4825  171.212   14.057  165.526   26.479 5.685837 29.97855 
1 1 1   27   19    6 o  153.555   13.473   18.455   3.1345   18.988   3.6306   16.894   6.2122  155.230   15.487  141.173   29.691 14.05737 33.48700 
1 1 1   27   19    7 o  177.307   11.403   24.423   3.0782   26.140   3.5008   18.569   6.4630  183.176   12.562  148.206   29.527 34.97005 32.08844 
1 1 1   27   19    8 o   69.541   24.798   3.4529   3.3305   1.6179   3.9066   8.3340   6.3716   63.473   25.760  101.169   34.410 -37.69538 42.98409 
1 1 1   27   19    9 o  362.349   8.7914  101.158   4.8759  103.430   5.8521   95.998   8.8174  365.894   10.449  350.079   16.455 15.81555 19.49266 
1 1 1   27   19   10 o  189.408   11.563   27.879   3.3363   29.186   3.7916   23.397   7.0220  193.466   12.878  167.134   28.469 26.33124 31.24649 
1 1 1   27   19   11 o  310.080   8.2237   74.030   3.9031   79.778   4.4739   55.717   7.9860  321.678   9.0864  264.516   19.870 57.16177 21.84869 
1 1 1   27   19   12 o  323.473   6.0255   80.343   2.9833   82.375   3.1848   65.796   8.5229  327.476   6.3538  287.697   19.469 39.77887 20.47964 
1 1 1   27   19   13 o  140.860   9.2713   15.370   1.9878   15.370   1.9878   0.0000   0.0000  140.860   9.2713  ?   ?  0.000000 9.271280 
1 1 1   27   19   14 o  180.359   8.0050   25.046   2.2099   25.046   2.2099   0.0000   0.0000  180.359   8.0050  ?   ?  0.000000 8.004981 
1 1 1   27   19   15 o  123.979   10.580   11.974   1.9885   12.262   2.0575   7.8879   7.7435  125.425   10.823  101.310   37.560 24.11515 39.08847 
1 1 1   27   19   16 o   64.627   18.906   3.3767   1.9889   5.0784   2.0601 -19.9714   7.6308   78.814   17.530   48.342   24.215 30.47168 29.89462 
1 1 1   27   19   17 o  189.227   8.2298   27.590   2.3837   26.938   2.4929   34.541   8.1409  186.902   8.7141  203.915   26.726 -17.01288 28.11102 
1 1 1   27   19   18 o  224.354   7.6122   38.751   2.6141   42.761   2.8037   12.084   7.2298  235.648   7.7733  116.800   36.461 118.8480 37.28065 
1 1 1   27   19   19 o  115.409   12.858   10.491   2.2327   9.4969   2.3507   19.661   7.1387  109.335   14.396  150.131   32.041 -40.79518 35.12708 
1 1 1   27   19   20 o  153.917   13.050   18.590   3.0455   19.389   3.3226   14.390   7.6183  156.930   13.979  125.991   37.043 30.93952 39.59264 
1 1 1   27   19   21 o  174.018   9.9940   23.510   2.6508   23.099   2.7839   27.510   8.6782  172.329   10.606  176.913   33.269 -4.583633 34.91888 
1 1 1   27   19   22 o   86.658   23.718   6.3267   3.2376   5.7673   3.5157   9.4492   8.3062   83.126   25.338  106.241   38.986 -23.11478 46.49662 
1 1 1   27   19   23 o  153.271   15.281   18.653   3.5370   20.588   3.9325   10.456   8.0930  160.745   16.204  109.240   38.688 51.50524 41.94454 
1 1 1   27   19   24 o   57.987   24.024   1.1071   3.4890   1.6156   3.9150  -0.8556   7.6915   62.664   25.650   74.399   33.201 -11.73542 41.95483 
1 1 1   27   19   25 o  173.238   12.495   23.557   3.2909   28.558   4.4390   17.455   4.9038  189.632   15.427  144.667   22.909 44.96504 27.61911 
1 1 1   27   19   26 o   65.988   24.632   2.9956   3.3413   2.8800   4.1257   3.2159   5.6962   68.851   26.950   76.650   31.106 -7.798576 41.15652 
1 1 1   27   19   27 o   96.061   22.403   7.8514   3.2335   14.951   4.2730  -1.6617   4.9462  133.906   21.582   57.753   26.125 76.15238 33.88638 
1 1 1   27   19   28 o  118.942   18.860   11.648   3.3190   9.9361   4.4716   13.747   4.9527  106.054   27.364  125.509   26.607 -19.45502 38.16674 
1 1 1   27   19   29 o   38.711   18.610  -4.3140   3.2254  -0.1499   4.3985  -9.1577   4.7439   58.469   25.642   42.002   20.700 16.46721 32.95433 
1 1 1   27   19   30 o   82.842   24.591   5.9304   3.3439   11.810   4.6356  -0.4481   4.8282  115.537   26.742   59.926   26.548 55.61132 37.68180 
1 1 1   27   19   31 o  138.920   16.590   15.682   3.4578   15.508   4.6539   15.896   5.1661  134.441   23.470  134.552   26.026 -0.1108246 35.04546 
1 1 1   27   19   32 o   39.139   19.241  -7.3863   4.0139  -5.1132   4.5545 -15.2938   8.4945   46.797   22.395   54.866   27.161 -8.068645 35.20324 
1 1 1   27   19   33 o   69.506   23.517   4.0232   2.9759   5.9585   4.0512   1.7551   4.3858   82.095   27.441   63.828   26.730 18.26748 38.30739 
1 1 1   27   19   34 o   49.038   22.320  -1.3906   3.6798 -16.0786   6.7333   4.8645   4.3940   45.313   22.705   76.555   28.311 -31.24226 36.29099 
1 1 1   27   19   35 o  124.791   17.658   12.987   3.2786   5.4904   3.9911   28.546   5.7495   78.724   27.219  183.085   20.891 -104.3603 34.31184 
1 1 1   27   19   36 o   62.055   23.119   2.9193   2.9408   1.3522   3.9447   4.8798   4.4122   59.346   25.127   75.874   28.308 -16.52810 37.85114 
1 1 1   27   20    1 o  152.371   29.461   19.604   6.6225   0.0000   0.0000   19.604   6.6225  ?   ?   152.371   29.461 0.000000 29.46135 
1 1 1   27   20    2 o  162.777   19.745   21.228   4.8188   21.289   6.3935   21.148   7.3324  160.027   27.067  157.396   31.534 2.630997 41.55778 
1 1 1   27   20    3 o  123.463   17.594   12.195   3.2309   13.555   3.6281   6.9881   7.1014  129.906   18.792   97.244   35.986 32.66299 40.59720 
1 1 1   27   20    4 o  149.929   14.824   17.691   3.3572   19.620   3.7892   10.645   7.2405  157.646   15.921  111.881   36.654 45.76474 39.96272 
1 1 1   27   20    5 o  116.594   19.075   10.984   3.2864   12.942   3.7156   3.9482   7.0438  126.525   19.838   86.475   34.766 40.04984 40.02741 
1 1 1   27   20    6 o  231.300   10.856   41.369   3.8435   41.049   4.4452   42.314   7.6506  229.638   12.696  229.357   22.065 0.2804108 25.45692 
1 1 1   27   20    7 o   70.127   24.913   3.5477   3.3584   4.1884   3.8656   1.5755   6.7821   75.490   26.738   78.092   32.999 -2.602219 42.47148 
1 1 1   27   20    8 o   59.842   25.672   0.1896   4.2139   0.9863   5.2996  -1.1802   6.9487   68.947   29.154   71.632   31.786 -2.684235 43.13107 
1 1 1   27   20    9 o  258.042   9.3232   51.362   3.6823   50.911   4.1756   52.940   7.8097  256.604   10.631  257.696   19.955 -1.092255 22.61056 
1 1 1   27   20   10 o  297.506   8.6575   68.206   3.9424   72.671   4.5271   54.192   8.0198  306.839   9.6392  260.518   20.272 46.32120 22.44669 
1 1 1   27   20   11 o  261.164   9.4981   52.640   3.7968   53.340   4.2963   50.145   8.1131  262.602   10.689  249.871   21.420 12.73088 23.93882 
1 1 1   27   20   12 o  168.725   13.126   22.269   3.3631   22.426   3.7218   21.571   7.8512  168.911   14.537  157.287   33.630 11.62453 36.63774 
1 1 1   27   20   13 o  234.727   7.7291   42.409   2.7769   42.409   2.7769   0.0000   0.0000  234.727   7.7291  ?   ?  0.000000 7.729102 
1 1 1   27   20   14 o  116.349   12.210   10.621   2.1419   11.295   2.2244   2.0348   7.9405  120.003   12.283   83.785   35.572 36.21770 37.63268 
1 1 1   27   20   15 o  222.371   10.839   38.289   3.6892   41.248   4.0382   23.350   9.0725  230.653   11.438  161.079   37.499 69.57402 39.20459 
1 1 1   27   20   16 o  184.573   11.974   26.560   3.3646   29.039   3.6770   13.797   8.3416  192.868   12.523  123.694   39.241 69.17426 41.19078 
1 1 1   27   20   17 o  172.598   12.479   23.283   3.2745   27.190   3.5628   2.0254   8.3101  186.564   12.549   84.859   36.217 101.7050 38.32996 
1 1 1   27   20   18 o  176.268   12.381   24.283   3.3193   27.107   3.6497   10.767   7.9841  186.125   12.890  111.393   38.499 74.73151 40.59970 
1 1 1   27   20   19 o  157.391   10.250   19.257   2.4557   19.497   2.5697   16.734   8.3377  158.270   10.670  134.736   38.505 23.53297 39.95583 
1 1 1   27   20   20 o   46.970   19.369   0.6502   2.2530   0.6751   2.3526   0.3748   7.8267   47.930   19.782   78.355   34.288 -30.42446 39.58495 
1 1 1   27   20   21 o   60.653   20.520   2.8021   2.2657   3.2783   2.3597  -2.8188   8.1076   64.430   20.916   72.538   33.061 -8.108452 39.12195 
1 1 1   27   20   22 o   84.040   23.740   5.9541   3.1885   7.1388   3.4685  -0.5078   8.1005   91.637   24.324   77.057   34.250 14.57973 42.00827 
1 1 1   27   20   23 o   98.322   22.155   8.1403   3.2542   10.375   3.5515  -3.5557   8.1250  111.516   21.587   70.794   32.575 40.72117 39.07884 
1 1 1   27   20   24 o   84.742   24.360   6.1020   3.3280   6.1837   3.6419   5.6884   8.1943   85.297   25.741   92.633   37.407 -7.335823 45.40846 
1 1 1   27   20   25 f  106.995   24.166   9.8037   3.8642   9.8037   3.8642   0.0000   0.0000  106.995   24.166  ?   ?  0.000000 24.16613 
1 1 1   27   20   26 o   84.612   25.278   6.1341   3.5251   4.5444   3.8806   13.637   8.4306   75.876   26.799  118.909   39.581 -43.03304 47.79965 
1 1 1   27   20   27 o  230.644   10.212   41.368   3.6051   44.502   4.7137   36.950   5.5958  237.730   13.004  214.292   17.205 23.43756 21.56658 
1 1 1   27   20   28 o  123.069   17.850   12.393   3.2644   13.835   4.3945   10.619   4.8759  127.426   23.393  108.743   28.827 18.68368 37.12504 
1 1 1   27   20   29 f  101.309   21.859   8.7593   3.2901   9.1190   4.4739   8.3356   4.8553  100.850   27.993   96.193   29.855 4.657089 40.92596 
1 1 1   27   20   30 o  210.651   11.499   34.869   3.6936   35.201   4.9312   34.445   5.5747  209.460   15.491  205.627   17.891 3.833878 23.66517 
1 1 1   27   20   31 o   84.603   26.231   6.3368   3.7491   5.4660   4.2706   9.2629   7.8285   80.133   28.131   99.380   37.576 -19.24723 46.93899 
1 1 1   27   20   32 o   80.468   24.646   5.7068   3.3212   5.0630   4.4189   6.5426   5.0349   77.960   28.462   85.778   30.501 -7.818878 41.71781 
1 1 1   27   20   33 o   81.373   28.011   5.8770   4.2244   4.3271   6.8764   6.8166   5.3537   80.516   33.573   86.758   31.381 -6.241356 45.95515 
1 1 1   27   20   34 o   43.601   19.925  -1.3772   2.9692  -0.2943   4.0326  -2.6594   4.3880   54.445   24.184   50.282   23.414 4.162731 33.66130 
1 1 1   27   20   35 o   59.634   23.178   2.4034   3.0352   0.8345   4.1416   4.2236   4.4609   58.540   25.284   73.062   28.182 -14.52114 37.86228 
1 1 1   27   21    0 f  250.726   19.781   49.825   7.4827   49.825   7.4827   49.825   7.4827  250.726   19.781  250.726   19.781 0.000000 0.000000 
1 1 1   27   21    1 o   69.296   28.176   2.0169   4.6846   9.8539   6.5717  -6.0799   6.6797  107.767   34.898   60.047   28.259 47.72016 44.90458 
1 1 1   27   21    2 o   77.965   33.250   1.2075   6.9946   0.0000   0.0000   1.2075   6.9946  ?   ?    77.965   33.250 0.000000 33.25005 
1 1 1   27   21    3 o  309.096   9.5183   73.718   4.5032   79.718   5.3499   59.133   8.3410  321.027   10.888  272.349   20.152 48.67883 22.90498 
1 1 1   27   21    4 o  234.880   11.044   42.689   3.9704   43.425   4.6067   40.564   7.8294  236.124   12.794  223.801   23.192 12.32214 26.48711 
1 1 1   27   21    5 o  194.967   13.001   29.665   3.8575   32.459   4.5069   22.014   7.4593  203.486   14.566  160.285   31.528 43.20152 34.73018 
1 1 1   27   21    6 o  112.355   22.120   10.405   3.6687   11.537   4.2546   7.1236   7.2442  117.668   24.423   97.721   36.309 19.94693 43.75867 
1 1 1   27   21    7 o  123.026   22.376   12.446   4.0584   16.374   4.8101   2.7397   7.5608  141.275   23.038   84.501   35.216 56.77351 42.08271 
1 1 1   27   21    8 o   80.582   25.945   5.2255   3.6363   6.3220   4.1380   1.5077   7.6192   87.704   27.618   81.329   34.694 6.375046 44.34465 
1 1 1   27   21    9 o  107.762   23.053   9.6503   3.6874   6.6400   4.1627   20.621   7.9466   89.501   27.622  153.135   34.705 -63.63411 44.35527 
1 1 1   27   21   10 o  120.138   19.349   11.697   3.4372   15.183   3.8104  -3.5303   7.9636  137.474   18.585   71.397   32.628 66.07674 37.55015 
1 1 1   27   21   11 o   55.297   23.232   0.6091   3.3307  -0.3770   3.6696   5.2197   7.9346   53.976   23.552   92.879   37.052 -38.90365 43.90416 
1 1 1   27   21   12 o  231.069   11.510   41.398   4.0708   41.398   4.0708   0.0000   0.0000  231.069   11.510  ?   ?  0.000000 11.50972 
1 1 1   27   21   13 f   66.827   24.734   2.9978   3.3550   4.0603   3.7020  -1.8870   7.9377   73.955   26.169   74.409   33.428 -0.4538651 42.45311 
1 1 1   27   21   14 o  208.993   11.656   33.992   3.7138   34.873   4.0977   29.938   8.7878  211.360   12.726  186.458   31.941 24.90218 34.38227 
1 1 1   27   21   15 o   85.435   16.751   5.9336   2.1122   6.2793   2.1859   1.0588   8.2085   87.923   16.856   82.063   35.520 5.859100 39.31653 
1 1 1   27   21   16 o  120.183   12.136   11.337   2.2020   11.254   2.2810   12.470   8.4392  119.610   12.651  118.096   39.605 1.514465 41.57611 
1 1 1   27   21   17 o  193.264   8.4866   28.812   2.5105   29.074   2.6147   25.722   8.9803  194.082   8.8017  169.454   35.748 24.62808 36.81538 
1 1 1   27   21   18 o   32.533   15.433  -2.4142   2.0678  -2.2742   2.1315  -4.6521   8.5218   33.661   15.878   71.260   32.992 -37.59961 36.61413 
1 1 1   27   21   19 o  224.810   8.3869   38.997   2.8859   40.415   3.0459   26.559   9.0224  228.788   8.6980  171.853   35.476 56.93567 36.52650 
1 1 1   27   21   20 o   38.878   17.679  -1.2486   2.3012  -0.5887   2.3825 -10.4280   8.8861   42.258   18.688   64.024   30.806 -21.76624 36.03170 
1 1 1   27   21   21 o  177.232   9.8187   24.404   2.6532   26.253   2.7954   7.6215   8.4241  183.796   9.9741   99.616   38.643 84.17954 39.90968 
1 1 1   27   21   22 o  244.133   10.396   46.262   3.8846   48.013   4.2638   37.712   9.4227  248.425   11.213  208.248   30.462 40.17711 32.46036 
1 1 1   27   21   23 o  108.188   19.405   9.6638   3.0953   10.712   3.3379   3.2310   8.2690  113.845   19.879   85.849   36.366 27.99577 41.44422 
1 1 1   27   21   24 o  147.670   16.254   17.508   3.6131   17.508   3.6131   0.0000   0.0000  147.670   16.254  ?   ?  0.000000 16.25414 
1 1 1   27   21   25 o  147.968   17.315   17.711   3.8475   17.711   3.8475   0.0000   0.0000  147.968   17.315  ?   ?  0.000000 17.31528 
1 1 1   27   21   26 o  173.724   14.303   23.977   3.7696   26.317   4.1493   12.922   9.0198  181.699   15.055  115.387   40.846 66.31210 43.53191 
1 1 1   27   21   27 o   78.054   25.688   5.1109   3.5546   7.9842   3.9074  -8.6803   8.5606   95.321   26.042   63.503   30.473 31.81839 40.08469 
1 1 1   27   21   28 o  162.073   13.693   20.881   3.3651   26.713   4.4317   12.939   5.1715  182.234   16.052  119.868   28.588 62.36610 32.78601 
1 1 1   27   21   29 o   63.605   25.136   2.4437   3.6201   2.0865   4.0698   3.7976   7.9228   64.177   26.197   83.714   35.536 -19.53658 44.14885 
1 1 1   27   21   30 o   45.424   21.070  -2.3175   3.4998  -1.0985   3.9894  -6.3886   7.2907   52.353   23.592   59.930   28.585 -7.577557 37.06334 
1 1 1   27   21   31 o  110.177   20.823   10.385   3.3830   3.4536   4.5467   18.982   5.0634   71.088   28.146  148.242   23.065 -77.15337 36.38921 
1 1 1   27   21   32 o   71.321   27.114   3.9083   4.0903   5.0700   7.3352   3.3840   4.9275   83.735   34.774   71.721   28.992 12.01433 45.27453 
1 1 1   27   21   33 o   97.339   22.400   8.3654   3.2680   7.4032   4.2266   9.7957   5.1533   89.237   27.882  100.579   30.680 -11.34186 41.45691 
1 1 1   27   21   34 o   44.773   20.524  -1.5140   3.1841  -4.4750   4.1499   2.7243   4.9649   44.662   21.375   68.755   28.586 -24.09266 35.69353 
1 1 1   27   22    0 o   78.739   43.599   7.3937   7.7042   7.3937   7.7042   7.3937   7.7042   78.739   43.599   78.739   43.599 0.000000 0.000000 
1 1 1   27   22    1 f   77.488   30.547   3.3848   5.3343  -0.0419   7.4017   7.0879   7.6944   76.420   33.395   98.551   37.255 -22.13074 50.03159 
1 1 1   27   22    2 o   82.010   30.631   4.6529   5.1686   9.3297   6.9893  -0.9910   7.6781  105.695   36.039   75.453   33.450 30.24150 49.17054 
1 1 1   27   22    3 o  161.590   21.732   21.190   5.2387   23.792   7.2531   18.353   7.5748  167.760   29.314  144.318   34.715 23.44127 45.43557 
1 1 1   27   22    4 o  213.986   14.739   35.924   4.7981   34.079   5.9232   39.444   8.1828  206.762   18.926  219.575   24.781 -12.81316 31.18141 
1 1 1   27   22    5 o  142.496   35.697   18.033   7.7694   0.0000   0.0000   18.033   7.7694  ?   ?   142.496   35.697 0.000000 35.69680 
1 1 1   27   22    6 o  121.569   27.321   12.535   4.9600   9.0869   6.3044   18.136   8.0353  103.787   34.212  142.406   36.650 -38.61916 50.13656 
1 1 1   27   22    7 o  227.861   11.208   40.220   3.9090   41.996   4.4056   33.646   8.4752  232.198   12.441  200.471   28.416 31.72777 31.02022 
1 1 1   27   22    8 o   45.305   20.913  -2.4158   3.3867  -3.3253   3.7660   1.4296   7.7437   46.020   21.517   81.433   34.864 -35.41353 40.96867 
1 1 1   27   22    9 o  103.948   24.487   9.0790   3.8319   6.5801   4.3989   16.941   7.8025   89.295   28.514  137.463   36.479 -48.16786 46.30055 
1 1 1   27   22   10 o  209.523   13.186   34.310   4.2072   34.956   4.8396   32.310   8.5122  210.821   15.098  195.619   29.333 15.20171 32.99072 
1 1 1   27   22   11 o  137.827   19.242   15.338   3.9486   15.338   3.9486   0.0000   0.0000  137.827   19.242  ?   ?  0.000000 19.24216 
1 1 1   27   22   12 o   36.246   17.756  -6.2288   3.3255  -6.8567   3.6199  -2.8329   8.4185   37.630   18.452   74.565   33.870 -36.93548 38.57071 
1 1 1   27   22   13 o  108.167   22.314   9.7275   3.5717   11.468   3.8694  -0.2945   9.2845  117.676   22.299   83.209   36.841 34.46700 43.06382 
1 1 1   27   22   14 o   74.752   25.285   4.3743   3.4400   6.0012   3.7287  -4.9270   8.9156   84.955   26.130   72.798   33.719 12.15748 42.65815 
1 1 1   27   22   15 o  289.001   9.3913   64.546   4.1543   68.630   4.6009   46.521   9.6654  297.780   10.094  235.832   27.280 61.94794 29.08750 
1 1 1   27   22   16 o  199.324   8.7129   30.669   2.6582   31.434   2.7811   22.578   9.0419  201.736   9.0067  156.662   38.079 45.07472 39.12960 
1 1 1   27   22   17 o  135.975   11.590   14.472   2.3891   14.189   2.4882   17.816   8.5513  134.463   12.223  138.227   38.819 -3.763351 40.69828 
1 1 1   27   22   18 o  181.685   9.4349   25.602   2.6147   27.898   2.7466   3.3957   8.5417  189.900   9.4493   88.163   37.132 101.7365 38.31504 
1 1 1   27   22   19 o  173.523   10.331   23.432   2.7315   23.936   2.8775   18.842   8.6841  175.259   10.779  141.314   38.913 33.94521 40.37873 
1 1 1   27   22   20 o  152.479   11.139   18.172   2.5817   18.298   2.7036   16.866   8.6940  152.865   11.643  132.914   39.696 19.95093 41.36799 
1 1 1   27   22   21 o  124.672   13.238   12.304   2.4875   12.693   2.5936   7.8446   8.7842  126.531   13.606  100.279   39.304 26.25198 41.59238 
1 1 1   27   22   22 o  117.071   14.750   10.966   2.5844   13.397   2.7182 -11.9245   8.3396  129.864   13.890   59.001   28.731 70.86375 31.91276 
1 1 1   27   22   23 o  153.418   14.647   18.731   3.3976   17.664   3.6691   25.157   9.0014  148.208   16.451  163.478   36.854 -15.26965 40.35933 
1 1 1   27   22   24 o  172.589   15.122   23.749   3.9544   23.749   3.9544   0.0000   0.0000  172.589   15.122  ?   ?  0.000000 15.12163 
1 1 1   27   22   25 o   94.084   23.355   7.6203   3.3477   7.3213   3.6046   9.4963   9.0291   91.768   24.989  103.966   40.097 -12.19796 47.24633 
1 1 1   27   22   26 o  105.971   21.491   9.5208   3.3666   9.1421   3.6499   11.680   8.7148  102.847   23.676  110.230   40.012 -7.383194 46.49189 
1 1 1   27   22   27 o  257.833   10.599   51.881   4.1828   55.323   4.6993   38.757   9.1770  265.764   11.552  208.444   29.594 57.31938 31.76934 
1 1 1   27   22   28 o   90.788   24.540   7.2661   3.4915   7.5480   3.8586   5.9924   8.2022   91.993   26.161   90.145   37.039 1.847694 45.34663 
1 1 1   27   22   29 o  147.514   14.734   17.526   3.2822   17.050   4.1957   18.278   5.2688  142.767   19.728  144.619   24.689 -1.852432 31.60219 
1 1 1   27   22   30 o   78.499   26.506   5.3638   3.7803   5.3638   3.7803   0.0000   0.0000   78.499   26.506  ?   ?  0.000000 26.50597 
1 1 1   27   22   31 o   70.957   27.691   3.6697   4.3455   9.7598   10.136   2.2983   4.8100  100.004   41.143   67.257   28.064 32.74664 49.80284 
1 1 1   27   22   32 o   91.051   22.681   7.3606   3.1493   7.3219   4.0501   7.4198   5.0085   88.959   27.211   88.866   30.505 0.9387970E-01 40.87778 
1 1 1   27   22   33 o   76.507   24.995   5.2058   3.3677   4.2465   4.5118   6.4127   5.0605   73.336   28.327   83.814   30.480 -10.47781 41.61076 
1 1 1   27   23    0 o   97.115   46.517   11.614   7.9585   11.614   7.9585   11.614   7.9585   97.115   46.517   97.115   46.517 0.000000 0.000000 
1 1 1   27   23    1 o  183.202   21.189   27.123   5.8320   33.411   7.9053   19.614   8.6390  200.847   26.351  147.242   38.056 53.60463 46.28838 
1 1 1   27   23    2 o   97.822   31.536   8.0253   5.3711   13.214   7.0916   1.0447   8.2256  122.069   35.697   82.419   35.615 39.65089 50.42523 
1 1 1   27   23    3 o  162.305   22.865   21.543   5.5229   23.491   7.3706   19.049   8.3402  165.969   30.123  145.435   37.290 20.53336 47.93662 
1 1 1   27   23    4 o  106.282   30.773   9.7231   5.2935   1.0033   6.5697   25.863   8.9380   75.062   32.123  171.244   35.274 -96.18183 47.70947 
1 1 1   27   23    5 o   78.045   26.772   4.7199   3.8575   5.2128   4.3816   3.0211   8.1338   82.042   28.511   87.051   36.424 -5.009476 46.25531 
1 1 1   27   23    6 f   80.227   29.805   4.5211   4.8808   5.2046   6.0585   3.2574   8.2385   86.863   33.005   88.026   36.729 -1.163010 49.38002 
1 1 1   27   23    7 o   74.466   27.338   3.9025   4.0847   3.2235   4.7489   5.8333   8.0083   74.089   28.938   94.729   37.402 -20.63929 47.28932 
1 1 1   27   23    8 f  101.482   27.382   8.7820   4.3515   7.7764   5.1280   11.369   8.2251   96.162   30.795  114.200   39.095 -18.03776 49.76694 
1 1 1   27   23    9 o  148.785   16.652   17.628   3.7271   18.963   4.0958   11.200   8.9897  154.000   17.697  114.110   40.736 39.88924 44.41449 
1 1 1   27   23   10 o   86.763   28.249   6.1828   4.3030   6.1828   4.3030   0.0000   0.0000   86.763   28.249  ?   ?  0.000000 28.24858 
1 1 1   27   23   11 o   54.962   24.060  -0.4311   3.8567   1.4514   4.2179 -10.0328   9.5259   64.116   26.477   67.948   32.482 -3.832581 41.90616 
1 1 1   27   23   12 o  139.917   18.921   15.817   3.9482   12.473   4.3708   30.644   9.2034  121.946   24.270  187.074   33.365 -65.12865 41.25862 
1 1 1   27   23   13 o  119.561   20.203   11.710   3.5655   10.993   3.9026   15.331   8.7687  114.714   23.027  128.527   40.160 -13.81310 46.29297 
1 1 1   27   23   14 o  212.027   12.136   35.097   3.9223   37.871   4.3811   23.896   8.8037  219.929   13.073  162.355   36.334 57.57391 38.61432 
1 1 1   27   23   15 o  172.800   14.026   23.527   3.6778   28.951   4.1057   1.5030   8.2732  191.774   14.086   82.639   35.715 109.1351 38.39188 
1 1 1   27   23   16 o  122.273   19.644   12.235   3.5519   13.668   3.9797   6.6248   7.8756  128.861   20.892   95.558   37.282 33.30322 42.73644 
1 1 1   27   23   17 o  119.402   13.331   11.283   2.3949   11.036   2.5258   13.487   7.5363  117.779   14.304  120.842   37.145 -3.063622 39.80378 
1 1 1   27   23   18 o  236.415   8.5312   43.180   3.0871   46.565   3.3413   23.435   8.0697  245.407   8.8953  161.310   33.767 84.09679 34.91883 
1 1 1   27   23   19 o  210.478   8.8817   34.266   2.8614   37.033   3.0846   17.204   7.6606  218.721   9.2139  135.817   36.195 82.90404 37.34914 
1 1 1   27   23   20 f   57.099   22.109   1.9071   2.7536   2.5109   2.9606  -1.9633   7.4959   61.573   23.146   70.586   32.024 -9.013332 39.51258 
1 1 1   27   23   21 o  156.703   13.430   19.413   3.1900   20.153   3.4657   15.313   8.1614  159.319   14.367  126.090   38.637 33.22900 41.22184 
1 1 1   27   23   22 o   62.423   23.250   2.6758   2.9738   3.0261   3.1817   0.2553   8.3637   65.286   24.102   78.493   34.849 -13.20766 42.37155 
1 1 1   27   23   23 o   49.824   22.031  -0.5727   3.3099  -0.5727   3.3099   0.0000   0.0000   49.824   22.031  ?   ?  0.000000 22.03123 
1 1 1   27   23   24 o  118.932   19.937   11.768   3.5008   10.978   3.8218   15.887   8.7275  113.460   22.798  125.974   40.157 -12.51421 46.17691 
1 1 1   27   23   25 o  136.937   17.057   15.254   3.4976   17.749   3.8481   3.4023   8.3874  147.698   17.352   84.800   36.294 62.89830 40.22866 
1 1 1   27   23   26 o   47.745   21.503  -1.0910   3.3086   1.8590   3.6417 -15.0397   7.9187   61.123   24.847   52.743   26.130 8.380772 36.05773 
1 1 1   27   23   27 o  237.291   11.236   44.142   4.0810   51.192   4.6774   21.665   8.3518  255.124   11.978  147.352   37.064 107.7725 38.95188 
1 1 1   27   23   28 f  135.825   17.071   15.147   3.4707   14.221   3.9143   18.550   7.5060  129.751   20.381  136.493   35.568 -6.741730 40.99351 
1 1 1   27   23   29 o  143.214   16.422   16.783   3.5349   20.120   4.0148   5.2761   7.4554  156.577   17.027   84.974   35.154 71.60262 39.06059 
1 1 1   27   23   30 o  173.111   20.546   25.370   5.3379   0.0000   0.0000   25.370   5.3379  ?   ?   173.111   20.546 0.000000 20.54644 
1 1 1   27   23   31 o  243.984   14.119   47.846   5.2503   47.846   5.2503   0.0000   0.0000  243.984   14.119  ?   ?  0.000000 14.11939 
1 1 1   27   24    0 o  121.881   45.068   16.263   7.7962   16.263   7.7962   16.263   7.7962  121.881   45.068  121.881   45.068 0.000000 0.000000 
1 1 1   27   24    1 o  154.571   24.980   19.863   5.7083   17.760   7.8899   22.174   8.2690  140.350   36.415  157.922   35.118 -17.57170 50.58932 
1 1 1   27   24    2 o  198.900   19.441   31.733   5.8431   31.566   7.7488   31.952   8.8964  194.563   26.726  193.046   31.170 1.517258 41.05891 
1 1 1   27   24    3 o  141.655   26.613   16.922   5.5583   12.000   6.9892   25.392   9.1684  116.301   35.775  168.234   36.642 -51.93256 51.21029 
1 1 1   27   24    4 f   99.193   32.102   8.3447   5.5614   8.1316   7.0166   8.7048   9.1207  100.202   35.966  105.986   40.442 -5.784203 54.12150 
1 1 1   27   24    5 o  233.738   13.008   42.689   4.6352   43.689   5.2073   38.870   10.172  235.891   14.492  212.261   32.331 23.63068 35.43004 
1 1 1   27   24    6 f   79.520   27.506   4.9245   4.0759   4.1040   4.5130   8.5551   9.4934   76.832   28.637  106.077   41.058 -29.24552 50.05809 
1 1 1   27   24    7 o  164.202   15.844   21.375   3.9326   21.152   4.3409   22.400   9.2881  162.635   17.725  155.929   39.013 6.706009 42.85052 
1 1 1   27   24    8 o   88.245   25.642   6.5545   3.6696   8.8096   3.9899  -5.8239   9.3477  101.778   25.627   73.170   34.106 28.60830 42.66128 
1 1 1   27   24    9 o  334.974   10.193   86.868   5.2263   86.868   5.2263   0.0000   0.0000  334.974   10.193  ?   ?  0.000000 10.19337 
1 1 1   27   24   10 o   60.615   26.067   0.2804   4.3639  -1.2848   4.9848   5.4154   9.0290   59.723   26.684   95.526   39.010 -35.80256 47.26366 
1 1 1   27   24   11 o  212.738   15.431   35.760   4.9906   39.091   6.0326   28.536   8.8833  221.265   17.968  179.837   33.505 41.42802 38.01845 
1 1 1   27   24   12 o  151.852   24.555   19.274   5.5124   15.228   7.1113   25.364   8.7255  129.567   35.022  168.035   35.059 -38.46786 49.55493 
1 1 1   27   24   13 o  160.538   22.463   21.250   5.3685   18.014   7.3163   25.025   7.9018  141.295   34.198  168.912   31.728 -27.61720 46.64904 
1 1 1   27   24   14 o  116.612   25.960   11.647   4.5145   12.233   5.6715   10.635   7.4585  117.419   31.073  109.275   37.229 8.143394 48.49279 
1 1 1   27   24   15 o  196.044   16.720   30.657   4.9692   42.509   6.6915   16.084   7.4199  229.643   19.214  132.084   35.804 97.55939 40.63379 
1 1 1   27   24   16 o  109.198   28.035   10.429   4.7097   6.7308   6.2535   15.275   7.1591   91.817   33.807  128.684   35.289 -36.86710 48.86985 
1 1 1   27   24   17 o   75.513   30.979   2.8151   5.7269   8.0610   9.2794  -0.4122   7.2783  101.776   40.236   73.188   32.501 28.58760 51.72294 
1 1 1   27   24   18 o  152.559   21.744   19.289   4.9338   24.714   6.6401   12.602   7.3721  170.191   26.341  116.138   36.895 54.05209 45.33293 
1 1 1   27   24   19 o   55.862   20.985   2.0189   2.4329   3.8393   2.5645 -14.3621   7.6928   68.589   21.758   53.071   26.194 15.51742 34.05167 
1 1 1   27   24   20 o   53.119   20.970   1.4739   2.5171   2.3840   2.6664  -5.9735   7.6274   59.272   22.028   63.578   30.004 -4.306068 37.22200 
1 1 1   27   24   21 o  188.557   10.047   27.705   2.8893   29.222   3.0938   17.355   8.0816  193.511   10.484  133.938   37.782 59.57283 39.20924 
1 1 1   27   24   22 o  130.061   14.366   13.517   2.8123   13.517   2.8123   0.0000   0.0000  130.061   14.366  ?   ?  0.000000 14.36650 
1 1 1   27   24   23 o   87.550   23.035   6.6131   3.1285   6.5514   3.4064   6.9458   7.9090   86.829   24.542   93.731   37.118 -6.902588 44.49744 
1 1 1   27   24   24 o  188.715   12.735   28.155   3.6571   29.487   4.1209   23.218   7.9347  192.467   14.086  156.871   34.025 35.59627 36.82582 
1 1 1   27   24   25 o  139.777   16.958   15.948   3.5538   18.935   4.0334   5.5858   7.5137  152.062   17.658   87.515   35.645 64.54771 39.77938 
1 1 1   27   24   26 o   46.930   21.455  -1.6311   3.4470  -2.2464   3.9391   0.3806   7.1222   48.814   22.540   71.926   32.033 -23.11186 39.16893 
1 1 1   27   24   27 o   79.420   25.926   5.5276   3.6235   8.2926   4.2537  -1.7854   6.9179   95.123   27.598   66.016   30.259 29.10728 40.95408 
1 1 1   27   24   28 o   58.306   27.187  -3.1931   5.9477 -15.7550   10.273   3.1416   7.2948   60.951   30.118   78.459   33.721 -17.50779 45.21255 
1 1 1   27   24   29 o   65.652   28.507   1.1790   5.3213   2.3842   7.6509   0.0498   7.4060   77.150   33.827   71.070   32.075 6.079559 46.61603 
1 1 1   27   24   30 f  142.149   18.459   16.923   3.9214   19.890   4.6243   9.3269   7.3990  152.978   20.246   96.611   36.530 56.36660 41.76570 
1 1 1   27   25    0 o  148.633   38.910   21.082   7.6487   21.082   7.6487   21.082   7.6487  148.633   38.910  148.633   38.910 0.000000 0.000000 
1 1 1   27   25    1 o   79.522   30.472   4.1962   5.1917   8.1448   7.3045   0.1652   7.3804  100.374   36.601   76.057   33.289 24.31675 49.47527 
1 1 1   27   25    2 o  299.505   13.953   70.147   6.3966   66.982   8.7047   73.862   9.4313  288.981   19.799  303.058   20.451 -14.07700 28.46488 
1 1 1   27   25    3 o  172.971   21.739   24.423   5.6282   16.019   7.5588   34.879   8.4315  132.763   36.200  203.451   27.803 -70.68887 45.64522 
1 1 1   27   25    4 o  131.381   28.279   14.848   5.5184   17.082   7.4273   12.094   8.2451  137.583   35.143  116.112   39.145 21.47186 52.60590 
1 1 1   27   25    5 o  167.591   22.671   23.085   5.6662   20.423   7.4413   26.757   8.7411  151.950   32.944  173.742   34.087 -21.79135 47.40508 
1 1 1   27   25    6 o  201.414   14.319   31.929   4.3858   33.674   5.1075   27.030   8.5576  206.031   16.330  175.199   33.125 30.83182 36.93172 
1 1 1   27   25    7 o  170.156   16.689   23.074   4.2906   23.074   4.2906   0.0000   0.0000  170.156   16.689  ?   ?  0.000000 16.68877 
1 1 1   27   25    8 o  173.277   17.008   23.968   4.4528   23.968   4.4528   0.0000   0.0000  173.277   17.008  ?   ?  0.000000 17.00813 
1 1 1   27   25    9 f  319.000   9.4671   78.719   4.6225   92.330   5.3891   40.827   8.9920  345.182   10.200  220.110   27.274 125.0715 29.11893 
1 1 1   27   25   10 f   88.325   25.474   6.6231   3.6339   5.0754   4.1707   11.501   7.4043   80.107   27.817  112.882   37.070 -32.77482 46.34677 
1 1 1   27   25   11 f   99.324   23.964   8.3836   3.6013   9.1722   4.1969   6.1815   7.0133  103.151   26.455   91.835   35.361 11.31595 44.16200 
1 1 1   27   25   12 o  251.457   10.683   49.098   4.1118   58.333   4.9428   28.348   7.4090  273.654   11.800  182.486   27.370 91.16847 29.80505 
1 1 1   27   25   13 o  124.979   21.439   12.964   3.9536   12.625   4.7479   13.732   7.1402  121.072   26.367  121.908   35.867 -0.8351440 44.51610 
1 1 1   27   25   14 o  138.522   18.723   15.613   3.8680   19.961   4.7395   6.9420   6.6934  156.125   20.314   93.338   34.858 62.78716 40.34539 
1 1 1   27   25   15 f  134.634   17.821   14.695   3.5822   19.510   4.1955   1.7449   6.8809  155.337   17.978   76.876   32.887 78.46120 37.48015 
1 1 1   27   25   16 o  127.664   21.197   13.546   3.9967   15.054   4.8730   10.447   6.9860  132.886   24.872  107.177   36.033 25.70863 43.78384 
1 1 1   27   25   17 o  120.636   20.011   12.039   3.5654   15.517   4.0834   0.8764   7.3145  137.277   20.023   76.070   33.221 61.20773 38.78848 
1 1 1   27   25   18 o  152.359   15.868   18.605   3.6461   19.456   4.1487   15.717   7.6429  154.954   17.816  128.340   36.923 26.61313 40.99692 
1 1 1   27   25   19 o   60.251   24.261   1.7959   3.4361   0.4921   3.8231   7.2752   7.8376   57.223   24.498   95.552   37.216 -38.32832 44.55511 
1 1 1   27   25   20 o   63.802   21.640   3.2025   2.5199   2.5516   2.6736   8.3773   7.5387   60.171   22.113   98.432   36.948 -38.26159 43.05943 
1 1 1   27   25   21 o  104.474   18.121   9.0202   2.7927   9.0202   2.7927   0.0000   0.0000  104.474   18.121  ?   ?  0.000000 18.12103 
1 1 1   27   25   22 o   89.433   21.646   6.8620   2.9313   6.8620   2.9313   0.0000   0.0000   89.433   21.646  ?   ?  0.000000 21.64632 
1 1 1   27   25   23 o   85.026   24.023   6.3205   3.2646   6.8592   3.6710   4.2832   7.1391   88.072   25.662   82.830   34.345 5.241531 42.87336 
1 1 1   27   25   24 o  104.248   21.979   9.3703   3.3967   9.1883   3.9029   9.9386   6.8960  101.611   25.214  101.633   35.742 -0.2156830E-01 43.74097 
1 1 1   27   25   25 o  210.080   12.471   34.962   3.9922   44.636   4.8516   14.673   7.0258  236.823   13.439  120.976   35.575 115.8471 38.02872 
1 1 1   27   25   26 o   72.156   29.138   3.3906   4.9719   11.519   7.3657  -3.4126   6.7386  106.397   36.966   61.873   28.880 44.52448 46.90997 
1 1 1   27   25   27 o  194.884   19.025   31.640   5.6026   35.900   8.2474   27.990   7.6345  199.086   27.825  173.625   29.801 25.46033 40.77171 
1 1 1   27   25   28 o   63.773   24.926   2.7679   3.5255   2.2371   4.0164   4.5496   7.3585   63.494   25.984   81.835   34.465 -18.34027 43.16254 
1 1 1   27   26    0 o   61.977   38.433   2.9957   7.2752   2.9957   7.2752   2.9957   7.2752   61.977   38.433   61.977   38.433 0.000000 0.000000 
1 1 1   27   26    1 o  114.198   29.445   11.418   5.1799   5.2244   7.0277   18.786   7.6645   88.816   35.047  143.813   35.122 -54.99718 49.61691 
1 1 1   27   26    2 o  249.697   15.217   49.222   5.7880   53.307   7.9568   44.630   8.4352  256.824   20.409  232.489   24.052 24.33466 31.54399 
1 1 1   27   26    3 o  175.127   20.293   24.922   5.3388   23.360   7.1366   26.908   8.0453  164.470   29.429  175.701   31.051 -11.23119 42.78149 
1 1 1   27   26    4 o  174.579   20.425   24.793   5.3546   33.515   7.3934   15.171   7.7654  200.816   24.566  127.986   37.333 72.82993 44.69047 
1 1 1   27   26    5 f  242.757   15.175   46.549   5.6102   54.258   8.1466   39.595   7.7373  258.769   20.743  219.151   23.429 39.61829 31.29187 
1 1 1   27   26    6 o  127.421   24.957   13.759   4.6934   13.759   4.6934   0.0000   0.0000  127.421   24.957  ?   ?  0.000000 24.95744 
1 1 1   27   26    7 f  210.775   12.701   34.813   4.0785   38.483   4.8314   25.712   7.6081  220.936   14.365  172.046   29.981 48.89085 33.24437 
1 1 1   27   26    8 o   84.505   26.071   6.0214   3.7087   4.8577   4.3755   8.9909   6.9893   79.330   28.409  102.078   35.975 -22.74813 45.83965 
1 1 1   27   26    9 o   86.511   25.935   6.3637   3.7060   7.4640   4.4311   3.8023   6.7606   93.031   28.463   82.821   33.782 10.20929 44.17404 
1 1 1   27   26   10 o   76.902   26.280   4.7362   3.7166   5.0706   4.4837   4.0018   6.6440   80.504   28.766   82.939   33.616 -2.434853 44.24417 
1 1 1   27   26   11 o   71.593   25.797   3.8347   3.6131   5.6748   4.4193   0.1250   6.2748   83.310   28.651   69.928   30.648 13.38208 41.95458 
1 1 1   27   26   12 o   41.478   19.778  -4.1224   3.4849  -4.6607   4.1882  -2.9110   6.2828   45.794   21.793   62.689   28.771 -16.89491 36.09363 
1 1 1   27   26   13 o  149.340   16.357   17.896   3.6777   20.647   4.4417   11.896   6.5588  159.525   18.536  113.696   34.597 45.82867 39.24982 
1 1 1   27   26   14 o  116.835   22.818   11.537   3.9341   15.069   4.8602   4.8244   6.7001  132.909   24.803   85.340   34.047 47.56930 42.12316 
1 1 1   27   26   15 o  148.391   21.483   18.281   4.7375   22.654   6.2193   12.235   7.3124  162.849   25.812  114.168   36.796 48.68067 44.94640 
1 1 1   27   26   16 o  144.956   18.963   17.185   4.1065   20.658   5.0086   10.061   7.1729  157.894   21.265  105.059   36.480 52.83508 42.22600 
1 1 1   27   26   17 o  100.114   36.682   8.8290   7.3496   0.0000   0.0000   8.8290   7.3496  ?   ?   100.114   36.682 0.000000 36.68246 
1 1 1   27   26   18 o  122.675   21.507   12.654   3.8912   16.915   4.5817   1.6254   7.3707  142.093   21.759   77.460   33.593 64.63302 40.02414 
1 1 1   27   26   19 o   75.422   26.808   4.5547   3.8891   2.3766   4.5738   10.240   7.3894   68.028   27.771  104.573   36.975 -36.54456 46.24305 
1 1 1   27   26   20 o   73.666   28.532   3.8061   4.5866   3.8061   4.5866   0.0000   0.0000   73.666   28.532  ?   ?  0.000000 28.53156 
1 1 1   27   26   21 f  113.833   17.310   10.661   2.9209   10.661   2.9209   0.0000   0.0000  113.833   17.310  ?   ?  0.000000 17.30967 
1 1 1   27   26   22 o  183.783   10.733   26.511   3.0060   29.159   3.2872   12.988   7.4282  192.560   11.201  113.682   37.120 78.87836 38.77351 
1 1 1   27   26   23 o   68.095   28.018   2.4884   4.7013   3.8277   7.0138   1.3957   6.3351   80.334   33.731   71.261   31.024 9.072983 45.82840 
1 1 1   27   26   24 o  125.868   26.873   14.332   5.0199   18.320   7.5565   11.181   6.7159  134.738   35.967  105.893   35.331 28.84451 50.41748 
1 1 1   27   26   25 o   63.230   27.330   1.0119   4.8459   4.4777   7.5979  -1.3647   6.2916   82.815   34.957   63.793   29.094 19.02180 45.48049 
1 1 1   27   26   26 o  133.065   18.100   14.762   3.5908   19.959   4.2095   0.8753   6.8805  155.009   18.082   71.089   31.583 83.91987 36.39293 
1 1 1   27   27    0 o  527.820   16.022  217.408   12.917  217.408   12.917  217.408   12.917  527.820   16.022  527.820   16.022 0.000000 0.000000 
1 1 1   27   27    1 o   55.023   25.781  -4.3714   5.4561   7.9039   7.6996 -16.7526   7.7328   98.797   37.287   51.130   25.415 47.66767 45.12482 
1 1 1   27   27    2 o  382.535   12.320  114.247   7.2136  113.786   10.099  114.727   10.308  378.022   17.453  379.326   17.754 -1.304230 24.89572 
1 1 1   27   27    3 o  167.570   22.848   23.306   5.7075   18.437   7.9486   28.489   8.2006  140.588   36.586  180.228   30.836 -39.63985 47.84695 
1 1 1   27   27    4 f   50.497   24.993 -14.4750   7.1775 -14.4750   7.1775   0.0000   0.0000   50.497   24.993  ?   ?  0.000000 24.99275 
1 1 1   27   27    5 o   73.406   32.144   0.3607   6.8886   0.3607   6.8886   0.0000   0.0000   73.406   32.144  ?   ?  0.000000 32.14365 
1 1 1   27   27    6 o  181.197   19.639   26.698   5.3596   24.442   7.5218   29.025   7.6390  166.652   30.616  183.746   28.050 -17.09415 41.52277 
1 1 1   27   27    7 o  112.500   25.480   10.898   4.2858   10.439   5.2426   11.821   7.4412  108.241   30.394  113.114   37.163 -4.872871 48.00982 
1 1 1   27   27    8 o   93.815   27.576   7.6465   4.2224   8.4773   5.1818   6.0046   7.2843   98.146   30.905   91.103   35.766 7.043259 47.26899 
1 1 1   27   27    9 o  118.591   24.192   11.985   4.2426   12.503   5.2704   11.030   7.1508  118.772   29.197  109.667   36.451 9.105278 46.70222 
1 1 1   27   27   10 o  156.882   18.335   19.962   4.3197   26.419   5.5810   10.315   6.8220  179.432   20.701  106.538   35.609 72.89438 41.18873 
1 1 1   27   27   11 o   72.287   26.034   3.9622   3.6792   4.4444   4.5237   3.0202   6.3235   77.289   28.698   78.181   32.362 -0.8917007 43.25366 
1 1 1   27   27   12 o   60.948   24.727   1.7252   3.5986   0.9208   4.3975   3.3562   6.2614   62.292   26.460   78.929   32.388 -16.63744 41.82271 
1 1 1   27   27   13 o   60.347   24.522   1.6717   3.5456   1.1661   4.2717   2.7915   6.3571   62.399   26.268   77.346   32.268 -14.94715 41.60814 
1 1 1   27   27   14 o   56.358   24.774  -0.3150   4.1273   1.2123   5.3456  -2.5694   6.4946   67.984   29.032   64.048   29.343 3.936012 41.27800 
1 1 1   27   27   15 o   57.277   24.473   0.5728   3.8021  -1.4671   4.6235   4.8338   6.6821   56.032   25.310   84.550   33.907 -28.51831 42.31218 
1 1 1   27   27   16 o  142.578   19.372   16.765   4.1182   15.307   4.9156   20.197   7.5424  133.053   25.056  146.585   34.236 -13.53214 42.42545 
1 1 1   27   27   17 o   46.982   21.415  -1.5991   3.4024  -0.9071   3.9025  -3.7919   6.9469   52.715   23.577   63.336   29.482 -10.62047 37.75009 
1 1 1   27   27   18 o  111.563   21.874   10.622   3.6018   12.378   4.1205   4.9336   7.4155  119.883   23.295   85.760   35.226 34.12236 42.23135 
1 1 1   27   27   19 o   95.717   27.586   8.2733   4.2628   8.2733   4.2628   0.0000   0.0000   95.717   27.586  ?   ?  0.000000 27.58621 
1 1 1   27   27   20 o  107.510   26.764   10.423   4.3871   10.423   4.3871   0.0000   0.0000  107.510   26.764  ?   ?  0.000000 26.76427 
1 1 1   27   27   21 o   69.481   25.622   3.7319   3.5939   9.3582   4.2436 -10.5410   6.7589  101.509   26.886   51.496   25.244 50.01277 36.87960 
1 1 1   27   27   22 o   87.671   25.149   6.8795   3.5504   6.8539   4.2433   6.9392   6.4829   86.997   28.029   88.997   34.064 -2.000717 44.11278 
1 1 1   27   27   23 o   87.639   22.931   6.7834   3.1115   9.2272   3.5534  -1.2499   6.4426  102.279   23.228   64.782   29.505 37.49721 37.55103 
1 1 1   27   27   24 o  102.153   21.678   9.0855   3.2846   13.756   3.7535  -6.1825   6.7867  127.396   19.900   57.139   27.343 70.25676 33.81752 
1 1 1   27   28    0 f   42.237   29.917  -8.9194   8.0197  -8.9194   8.0197  -8.9194   8.0197   42.237   29.917   42.237   29.917 0.000000 0.000000 
1 1 1   27   28    1 o  279.868   16.471   62.430   7.0248   67.942   10.117   57.298   9.7617  286.464   23.275  261.750   24.656 24.71378 33.90606 
1 1 1   27   28    2 o  169.769   36.368   26.795   9.1659   26.795   9.1659   0.0000   0.0000  169.769   36.368  ?   ?  0.000000 36.36832 
1 1 1   27   28    3 o  246.124   24.883   50.804   9.2453   50.804   9.2453   0.0000   0.0000  246.124   24.883  ?   ?  0.000000 24.88318 
1 1 1   27   28    4 o   66.801   29.075   0.3477   5.5613   6.9326   7.6501  -7.0323   8.0989   94.750   36.806   64.363   30.536 30.38752 47.82356 
1 1 1   27   28    5 o  135.359   27.978   16.019   5.6049   13.477   7.9791   18.494   7.8750  119.009   38.445  140.106   36.394 -21.09704 52.93941 
1 1 1   27   28    6 o  129.631   24.761   14.354   4.7337   22.438   6.0051   1.0870   7.6933  162.706   24.905   78.087   34.087 84.61884 42.21610 
1 1 1   27   28    7 o  220.812   15.216   38.746   5.1115   43.674   6.5158   30.861   8.2422  232.518   18.460  187.615   29.690 44.90268 34.96079 
1 1 1   27   28    8 o   81.829   27.039   5.6160   3.9369   8.1532   4.5476  -1.9727   7.8649   96.159   28.708   71.882   32.685 24.27734 43.50193 
1 1 1   27   28    9 f  222.422   12.654   38.895   4.2901   42.024   5.1488   31.792   7.7585  230.173   14.691  192.132   27.137 38.04112 30.85879 
1 1 1   27   28   10 o  161.368   16.504   20.952   4.0190   28.626   4.8204   3.4531   7.2787  188.649   16.872   82.367   34.459 106.2820 38.36792 
1 1 1   27   28   11 o  149.833   17.348   18.200   3.9050   23.528   4.8684   8.5871   6.5393  169.641   19.081   98.290   34.780 71.35090 39.67040 
1 1 1   27   28   12 o   61.408   25.832   1.1857   4.1263   7.8313   5.4223  -7.9575   6.3601   94.001   31.745   53.565   25.846 40.43619 40.93618 
1 1 1   27   28   13 o  102.259   26.902   9.2918   4.2675   10.889   5.6344   7.1425   6.5357  108.478   31.846   92.038   34.431 16.44003 46.90024 
1 1 1   27   28   14 o   66.554   25.515   2.9964   3.6409   4.7076   4.3171  -1.2188   6.7757   77.105   28.135   67.755   30.620 9.349777 41.58321 
1 1 1   27   28   15 o  138.005   18.404   15.676   3.7907   21.759   4.4942   0.6788   7.0566  162.940   18.339   73.141   32.264 89.79855 37.11157 
1 1 1   27   28   16 o   80.852   27.148   5.6211   3.9654   6.2176   4.7388   4.2277   7.2424   84.806   29.640   82.951   34.510 1.855011 45.49139 
1 1 1   27   28   17 o   90.581   26.695   7.3481   3.9523   9.7158   4.7659   2.1336   7.0728  102.786   29.021   76.361   33.012 26.42436 43.95422 
1 1 1   27   28   18 o   49.481   23.083  -2.9781   4.2964  -2.9781   4.2964   0.0000   0.0000   49.481   23.083  ?   ?  0.000000 23.08347 
1 1 1   27   28   19 o  107.598   27.306   10.560   4.5046   10.560   4.5046   0.0000   0.0000  107.598   27.306  ?   ?  0.000000 27.30620 
1 1 1   27   28   20 o   93.694   25.861   7.9335   3.8302   10.036   4.6372   3.4192   6.7948  104.049   28.347   78.138   33.024 25.91132 43.52183 
1 1 1   27   28   21 o   81.765   26.357   5.9605   3.7518   4.8462   4.4652   8.6361   6.9189   76.766   28.510   95.256   35.467 -18.48938 45.50483 
1 1 1   27   28   22 o   92.932   25.313   7.8216   3.6982   11.656   4.4640  -0.5696   6.6034  113.179   26.274   66.807   30.207 46.37181 40.03436 
1 1 1   27   29    1 o  201.504   30.248   35.886   9.0413   35.886   9.0413   0.0000   0.0000  201.504   30.248  ?   ?  0.000000 30.24813 
1 1 1   27   29    2 o  208.317   19.532   35.420   6.1552   33.157   8.5749   37.825   8.8407  193.871   29.855  208.452   28.451 -14.58122 41.24040 
1 1 1   27   29    3 o   54.329   25.658  -4.9326   5.5962   4.3227   7.9499 -14.0233   7.8789   86.789   36.135   54.113   26.670 32.67537 44.91179 
1 1 1   27   29    4 o  141.753   27.637   17.627   5.7810   23.341   8.1661   11.887   8.1851  158.240   34.673  111.677   38.959 46.56319 52.15402 
1 1 1   27   29    5 f   89.067   32.432   6.6073   5.7323   17.176   8.0152  -4.4583   8.2014  132.840   37.680   68.385   31.899 64.45528 49.36965 
1 1 1   27   29    6 o   80.710   29.803   5.1105   4.8656   5.0401   6.0986   5.2338   8.0706   83.608   32.755   89.349   36.730 -5.741043 49.21352 
1 1 1   27   29    7 o  122.061   26.384   13.071   4.7855   12.441   6.1688   14.023   7.5838  115.363   33.167  120.074   37.320 -4.711143 49.92820 
1 1 1   27   29    8 o   80.045   27.295   5.3661   4.0091   5.2175   4.6688   5.7834   7.8231   80.557   29.279   90.016   36.480 -9.459221 46.77674 
1 1 1   27   29    9 o   91.332   27.189   7.3807   4.0835   9.1986   4.8116   2.7002   7.7205  100.788   29.384   80.987   34.746 19.80063 45.50453 
1 1 1   27   29   10 o   93.785   27.038   7.8244   4.0945   13.523   4.9093  -5.1971   7.4211  123.636   26.721   63.103   29.724 60.53331 39.96911 
1 1 1   27   29   11 o   63.775   26.653   1.5963   4.3480  -1.4484   5.5388   6.4855   7.0188   60.986   27.611   89.944   35.166 -28.95872 44.71091 
1 1 1   27   29   12 f   54.033   23.802  -0.2884   3.8274  -5.1298   4.5632   11.200   7.0293   46.970   22.462  107.551   36.145 -60.58111 42.55555 
1 1 1   27   29   13 o  133.271   20.503   14.913   4.0483   14.371   4.7926   16.263   7.5635  127.918   25.374  127.774   36.723 0.1438522 44.63588 
1 1 1   27   29   14 o   65.333   25.916   2.6213   3.8617   1.6453   4.4631   5.5284   7.7026   64.197   26.929   87.535   35.922 -23.33747 44.89448 
1 1 1   27   29   15 o   40.901   19.775  -5.2541   3.7692  -2.6709   4.3226 -13.4492   7.6993   50.393   23.390   52.994   26.165 -2.601028 35.09525 
1 1 1   27   29   16 o  163.692   16.299   21.786   4.0295   23.569   4.6455   16.367   8.0980  169.102   18.236  125.440   38.495 43.66211 42.59610 
1 1 1   27   29   17 o   63.792   27.215   1.3264   4.6888   1.3264   4.6888   0.0000   0.0000   63.792   27.215  ?   ?  0.000000 27.21498 
1 1 1   27   29   18 o  181.661   16.322   26.867   4.4900   31.326   5.3872   16.724   8.1253  194.810   18.281  125.864   38.549 68.94599 42.66393 
1 1 1   27   29   19 o   48.633   22.211  -1.5561   3.6832   2.2227   4.3779 -10.7104   6.8139   65.316   26.973   51.285   25.183 14.03070 36.90155 
1 1 1   27   30    0 o  153.954   39.506   23.200   8.0469   23.200   8.0469   23.200   8.0469  153.954   39.506  153.954   39.506 0.000000 0.000000 
1 1 1   27   30    1 o  138.037   27.259   16.854   5.5550   25.505   8.0262   8.8996   7.6962  166.018   32.749   99.437   37.330 66.58092 49.65921 
1 1 1   27   30    2 f  215.807   25.883   40.169   8.3791   0.0000   0.0000   40.169   8.3791  ?   ?   215.807   25.883 0.000000 25.88287 
1 1 1   27   30    3 f  185.230   29.712   30.729   8.1391   0.0000   0.0000   30.729   8.1391  ?   ?   185.230   29.712 0.000000 29.71209 
1 1 1   27   30    4 o   97.890   30.804   8.7623   5.1489   11.134   7.4127   6.5514   7.1572  107.447   37.098   90.452   35.471 16.99413 51.32692 
1 1 1   27   30    5 o   64.686   28.156   0.5619   5.2162  -0.0855   7.8022   1.0852   7.0141   74.292   33.275   73.986   32.415 0.3062286 46.45406 
1 1 1   27   30    6 o   77.100   28.865   4.6066   4.5953   7.4631   6.1251   0.9282   6.9505   92.094   33.526   73.265   32.180 18.82895 46.47086 
1 1 1   27   30    7 o  158.030   20.785   20.885   4.9057   28.044   6.4484   11.049   7.5584  181.164   23.833  106.641   37.424 74.52301 44.36897 
1 1 1   27   30    8 o  140.189   22.345   16.721   4.6337   12.610   6.1036   22.315   7.1191  114.991   32.971  155.792   30.946 -40.80132 45.21851 
1 1 1   27   30    9 o  186.562   17.272   28.334   4.8763   35.783   6.5673   19.181   7.2799  206.961   21.023  141.352   34.051 65.60872 40.01848 
1 1 1   27   30   10 o   89.389   28.883   7.1906   4.5034   11.066   6.0160   2.2513   6.7917  107.458   33.213   75.660   32.528 31.79829 46.48857 
1 1 1   27   30   11 o   70.133   26.710   3.5892   3.9735   5.0607   4.7305   0.0630   7.3227   78.999   29.343   72.092   32.267 6.907600 43.61389 
1 1 1   27   30   12 o   54.366   24.098  -0.4119   3.9838   1.6480   4.8043  -4.9458   7.1275   65.623   27.754   61.393   28.983 4.230717 40.12821 
1 1 1   27   30   13 o   58.905   25.081   0.9676   3.9682  -0.1957   4.6158   4.2625   7.7685   58.705   25.985   83.481   35.299 -24.77594 43.83146 
1 1 1   27   30   14 o  133.340   20.431   15.032   4.0369   15.126   4.6767   14.757   7.9962  131.419   24.139  118.716   38.500 12.70313 45.44192 
1 1 1   27   30   15 o  122.227   22.496   12.938   4.0536   13.337   4.6613   11.699   8.2101  122.024   25.766  106.595   38.814 15.42841 46.58747 
1 1 1   27   30   16 o   87.272   28.351   6.9451   4.3352   6.9451   4.3352   0.0000   0.0000   87.272   28.351  ?   ?  0.000000 28.35135 
1 1 1   27   31    0 o  336.680   18.150   90.219   9.2913   90.219   9.2913   90.219   9.2913  336.680   18.150  336.680   18.150 0.000000 0.000000 
1 1 1   27   31    1 o   72.229   29.392   3.1077   5.1025   8.2521   7.1114  -2.3510   7.3255   95.449   35.874   67.188   30.922 28.26028 47.36133 
1 1 1   27   31    2 o  113.161   30.168   11.928   5.3205   11.190   7.6455   12.621   7.4088  106.448   37.614  112.284   37.092 -5.836380 52.82598 
1 1 1   27   31    3 o   71.074   29.487   2.6188   5.2666   2.8687   7.5131   2.3774   7.3849   79.592   34.215   77.932   33.711 1.660339 48.03244 
1 1 1   27   31    4 o   94.191   31.437   8.1828   5.3172   16.706   8.1526   1.8738   7.0143  127.328   38.534   75.325   32.719 52.00294 50.55064 
1 1 1   27   31    5 o  128.273   35.492   16.301   7.2039   0.0000   0.0000   16.301   7.2039  ?   ?   128.273   35.492 0.000000 35.49154 
1 1 1   27   31    6 o  107.366   32.350   11.026   5.7553   22.522   10.249   5.7317   6.9555  142.911   43.195   86.227   34.589 56.68380 55.33732 
1 1 1   27   31    7 o   68.728   29.552   1.5207   5.6069   13.826   10.005  -4.1129   6.7698  113.631   42.582   61.121   28.663 52.51068 51.33042 
1 1 1   27   31    8 o   72.659   30.133   2.9156   5.4970  -3.1030   9.3625   6.0818   6.7907   73.326   34.163   86.840   34.392 -13.51442 48.47631 
1 1 1   27   31    9 f   55.897   25.171  -0.9968   4.5311   4.5058   5.8798  -9.0427   7.1099   79.251   31.798   55.103   26.763 24.14846 41.56191 
1 1 1   27   31   10 o  129.116   21.515   14.247   4.1024   17.443   4.8871   6.6239   7.5486  141.911   23.308   89.622   36.004 52.28846 42.89056 
1 1 1   27   31   11 o   82.484   27.336   6.0411   4.0229   8.2156   4.7191   0.2587   7.6953   94.028   29.475   73.291   32.921 20.73667 44.18758 
1 1 1   27   31   12 o   98.288   26.276   8.7822   4.0293   7.8436   4.7060   11.360   7.7988   91.979   29.505  105.509   37.913 -13.52984 48.04121 
1 1 1   27   32    0 o   60.344   38.323   2.8131   7.7077   2.8131   7.7077   2.8131   7.7077   60.344   38.323   60.344   38.323 0.000000 0.000000 
1 1 1   27   32    1 o   74.865   30.379   3.6603   5.4329  -3.0738   7.5226   11.002   7.8547   66.172   30.761  104.626   37.985 -38.45390 48.87840 
1 1 1   27   32    2 o  106.804   31.275   10.884   5.4402   7.5735   7.8662   13.920   7.5319   93.041   36.963  116.305   37.329 -23.26471 52.53288 
1 1 1   27   32    3 o  124.130   29.620   14.368   5.5492   11.529   7.8167   17.251   7.8792  106.505   37.990  129.246   37.579 -22.74133 53.43557 
1 1 1   27   32    4 o  132.372   27.627   15.922   5.4167   15.604   7.9495   16.197   7.4007  122.146   38.250  126.216   36.340 -4.069351 52.75984 
1 1 1   28    0    0 o  206.585   13.148   33.138   4.1189   33.138   4.1189   33.138   4.1189  206.585   13.148  206.585   13.148 0.000000 0.000000 
1 1 1   28    0    1 o  456.854   7.7361  160.152   5.4062  160.152   5.4062  160.152   5.4062  456.854   7.7361  456.854   7.7361 0.000000 0.000000 
1 1 1   28    0    2 o   86.370   20.656   6.6525   2.3691   6.6525   2.3691   6.6525   2.3691   86.370   20.656   86.370   20.656 0.000000 0.000000 
1 1 1   28    0    3 o  173.367   10.127   23.306   2.6664   23.306   2.6664   23.306   2.6664  173.367   10.127  173.367   10.127 0.000000 0.000000 
1 1 1   28    0    4 o   69.366   23.010   4.7668   2.1735   4.7668   2.1735   4.7668   2.1735   69.366   23.010   69.366   23.010 0.000000 0.000000 
1 1 1   28    0    5 o   22.082   15.258  -1.3745   1.7443  -1.3745   1.7443  -1.3745   1.7443   22.082   15.258   22.082   15.258 0.000000 0.000000 
1 1 1   28    0    6 o  279.097   7.9945   59.877   3.4089   59.877   3.4089   59.877   3.4089  279.097   7.9945  279.097   7.9945 0.000000 0.000000 
1 1 1   28    0    7 o  258.936   7.7289   51.545   3.0570   51.545   3.0570   51.545   3.0570  258.936   7.7289  258.936   7.7289 0.000000 0.000000 
1 1 1   28    0    8 o  409.657   11.147  129.221   6.9779  129.221   6.9779  129.221   6.9779  409.657   11.147  409.657   11.147 0.000000 0.000000 
1 1 1   28    0    9 o   61.711   28.074   4.3188   2.8727   4.3188   2.8727   4.3188   2.8727   61.711   28.074   61.711   28.074 0.000000 0.000000 
1 1 1   28    0   10 o  231.475   10.481   41.405   3.6963   41.405   3.6963   41.405   3.6963  231.475   10.481  231.475   10.481 0.000000 0.000000 
1 1 1   28    0   11 o  163.772   13.865   21.093   3.4183   21.093   3.4183   21.093   3.4183  163.772   13.865  163.772   13.865 0.000000 0.000000 
1 1 1   28    0   12 o  159.729   15.006   20.184   3.5944   20.184   3.5944   20.184   3.5944  159.729   15.006  159.729   15.006 0.000000 0.000000 
1 1 1   28    0   13 o  219.500   12.257   37.410   4.0885   37.410   4.0885   37.410   4.0885  219.500   12.257  219.500   12.257 0.000000 0.000000 
1 1 1   28    0   14 o   56.250   30.594   3.5608   3.7202   3.5608   3.7202   3.5608   3.7202   56.250   30.594   56.250   30.594 0.000000 0.000000 
1 1 1   28    0   15 f  200.543   14.441   31.487   4.3800   31.487   4.3800   31.487   4.3800  200.543   14.441  200.543   14.441 0.000000 0.000000 
1 1 1   28    0   16 o  281.062   11.601   61.070   4.9713   61.070   4.9713   61.070   4.9713  281.062   11.601  281.062   11.601 0.000000 0.000000 
1 1 1   28    0   17 o   29.704   21.033  -4.8990   3.9528  -4.8990   3.9528  -4.8990   3.9528   29.704   21.033   29.704   21.033 0.000000 0.000000 
1 1 1   28    0   18 o   63.698   33.313   4.7350   4.2647   4.7350   4.2647   4.7350   4.2647   63.698   33.313   63.698   33.313 0.000000 0.000000 
1 1 1   28    0   19 f   55.294   32.229   3.0474   4.5156   3.0474   4.5156   3.0474   4.5156   55.294   32.229   55.294   32.229 0.000000 0.000000 
1 1 1   28    0   20 o   47.056   30.343   0.2679   5.0661   0.2679   5.0661   0.2679   5.0661   47.056   30.343   47.056   30.343 0.000000 0.000000 
1 1 1   28    0   21 o   80.214   43.405   7.7288   7.4524   7.7288   7.4524   7.7288   7.4524   80.214   43.405   80.214   43.405 0.000000 0.000000 
1 1 1   28    0   22 o  173.712   28.368   25.562   6.9387   25.562   6.9387   25.562   6.9387  173.712   28.368  173.712   28.368 0.000000 0.000000 
1 1 1   28    0   23 o  111.940   35.398   12.501   5.3333   12.501   5.3333   12.501   5.3333  111.940   35.398  111.940   35.398 0.000000 0.000000 
1 1 1   28    0   24 o   76.644   37.606   7.0376   5.2440   7.0376   5.2440   7.0376   5.2440   76.644   37.606   76.644   37.606 0.000000 0.000000 
1 1 1   28    0   25 o   72.936   37.786   6.4048   5.4477   6.4048   5.4477   6.4048   5.4477   72.936   37.786   72.936   37.786 0.000000 0.000000 
1 1 1   28    0   26 o   29.372   20.321  -2.4155   3.1185  -2.4155   3.1185  -2.4155   3.1185   29.372   20.321   29.372   20.321 0.000000 0.000000 
1 1 1   28    0   27 o   56.160   29.376   3.6880   3.3165   3.6880   3.3165   3.6880   3.3165   56.160   29.376   56.160   29.376 0.000000 0.000000 
1 1 1   28    0   28 o  174.389   14.708   24.034   3.8617   24.034   3.8617   24.034   3.8617  174.389   14.708  174.389   14.708 0.000000 0.000000 
1 1 1   28    0   29 o   96.707   30.668   9.3179   3.9943   9.3179   3.9943   9.3179   3.9943   96.707   30.668   96.707   30.668 0.000000 0.000000 
1 1 1   28    0   30 o  303.729   10.800   71.352   5.0065   71.352   5.0065   71.352   5.0065  303.729   10.800  303.729   10.800 0.000000 0.000000 
1 1 1   28    0   31 o   34.029   22.477  -0.5283   3.0323  -0.5283   3.0323  -0.5283   3.0323   34.029   22.477   34.029   22.477 0.000000 0.000000 
1 1 1   28    0   32 f   41.661   25.549   1.2686   3.1314   1.2686   3.1314   1.2686   3.1314   41.661   25.549   41.661   25.549 0.000000 0.000000 
1 1 1   28    0   33 o  191.105   13.650   28.729   3.9461   28.729   3.9461   28.729   3.9461  191.105   13.650  191.105   13.650 0.000000 0.000000 
1 1 1   28    0   34 f   37.053   24.048   0.0218   3.2526   0.0218   3.2526   0.0218   3.2526   37.053   24.048   37.053   24.048 0.000000 0.000000 
1 1 1   28    0   35 o   57.615   29.903   3.9996   3.4164   3.9996   3.4164   3.9996   3.4164   57.615   29.903   57.615   29.903 0.000000 0.000000 
1 1 1   28    0   36 o   32.169   21.958  -1.7801   3.3676  -1.7801   3.3676  -1.7801   3.3676   32.169   21.958   32.169   21.958 0.000000 0.000000 
1 1 1   28    0   37 o   60.780   32.073   4.5388   3.9798   4.5388   3.9798   4.5388   3.9798   60.780   32.073   60.780   32.073 0.000000 0.000000 
1 1 1   28    0   38 o  145.392   23.099   18.058   4.7519   18.058   4.7519   18.058   4.7519  145.392   23.099  145.392   23.099 0.000000 0.000000 
1 1 1   28    0   39 o  202.341   13.554   32.339   4.1547   32.339   4.1547   32.339   4.1547  202.341   13.554  202.341   13.554 0.000000 0.000000 
1 1 1   28    0   40 o   30.754   21.448  -3.0420   3.6612  -3.0420   3.6612  -3.0420   3.6612   30.754   21.448   30.754   21.448 0.000000 0.000000 
1 1 1   28    0   41 o  142.296   21.333   17.268   4.3385   17.268   4.3385   17.268   4.3385  142.296   21.333  142.296   21.333 0.000000 0.000000 
1 1 1   28    0   42 f   62.093   33.476   5.0274   4.4178   5.0274   4.4178   5.0274   4.4178   62.093   33.476   62.093   33.476 0.000000 0.000000 
1 1 1   28    0   43 o  149.945   24.941   19.846   5.2480   19.846   5.2480   19.846   5.2480  149.945   24.941  149.945   24.941 0.000000 0.000000 
1 1 1   28    1    0 o  438.128   7.6947  147.298   5.1565  147.298   5.1565  147.298   5.1565  438.128   7.6947  438.128   7.6947 0.000000 0.000000 
1 1 1   28    1    1 o   75.908   14.678   4.6129   1.6438   5.7462   2.3308   3.4915   2.3185   84.211   18.581   66.707   20.619 17.50473 27.75584 
1 1 1   28    1    2 f  234.457   6.2789   42.167   2.2533   43.484   3.2215   40.907   3.1528  237.816   8.8502  230.651   8.9305 7.164322 12.57297 
1 1 1   28    1    3 o  196.364   6.6107   29.586   1.9869   28.667   2.8272   30.484   2.7929  193.014   9.5697  199.083   9.1655 -6.068405 13.25084 
1 1 1   28    1    4 o  130.276   8.4866   13.099   1.6830   16.924   2.4849   9.8584   2.2876  147.759   11.068  112.081   13.614 35.67802 17.54536 
1 1 1   28    1    5 o  186.296   6.0984   26.621   1.7389   22.456   2.7553   29.378   2.2419  170.394   10.617  195.594   7.4883 -25.19974 12.99215 
1 1 1   28    1    6 o  145.734   8.0918   16.369   1.7979   19.537   3.1781   14.878   2.1803  158.394   13.230  138.596   10.353 19.79816 16.79890 
1 1 1   28    1    7 o  160.854   10.007   20.000   2.4517   19.341   3.2110   20.922   3.7965  157.535   13.445  163.460   15.354 -5.924164 20.40907 
1 1 1   28    1    8 o  144.811   10.823   16.256   2.3816   21.355   4.2491   13.920   2.8757  164.689   17.106  133.269   14.322 31.42087 22.31014 
1 1 1   28    1    9 o   96.959   15.759   7.4883   2.2585   6.7321   4.0805   7.8223   2.7117   90.904   27.205   98.464   18.676 -7.560249 32.99911 
1 1 1   28    1   10 o  338.097   9.2985   87.982   4.8120   87.982   4.8120   0.0000   0.0000  338.097   9.2985  ?   ?  0.000000 9.298457 
1 1 1   28    1   11 o  114.288   13.231   10.244   2.2718   9.7507   3.3478   10.666   3.0928  109.633   20.709  115.493   18.090 -5.859985 27.49743 
1 1 1   28    1   12 o   84.632   18.572   5.8210   2.3398   6.5135   3.4615   5.2383   3.1750   88.998   24.593   80.486   23.978 8.512543 34.34756 
1 1 1   28    1   13 o  112.253   15.154   9.9679   2.5372   10.161   3.7077   9.7978   3.4795  111.405   22.518  109.619   21.506 1.785492 31.13794 
1 1 1   28    1   14 o   69.226   21.803   3.7693   2.5788   0.8232   3.7103   6.5223   3.5868   59.211   24.673   89.016   25.191 -29.80484 35.26090 
1 1 1   28    1   15 o  129.219   14.150   13.116   2.7530   15.043   4.1123   11.550   3.7059  136.801   20.251  119.301   21.065 17.49952 29.22058 
1 1 1   28    1   16 o  255.779   8.6312   50.351   3.3791   57.580   5.0956   44.677   4.5146  272.761   12.205  239.930   12.335 32.83060 17.35268 
1 1 1   28    1   17 o  312.785   8.0156   75.246   3.8375   77.316   5.7117   73.543   5.1812  316.147   11.803  308.560   10.970 7.587158 16.11421 
1 1 1   28    1   18 o   96.222   21.411   7.6107   3.0722   13.250   4.7392   3.5228   4.0348  126.415   25.374   73.000   27.103 53.41564 37.12724 
1 1 1   28    1   19 o  256.990   10.648   51.011   4.1886   61.891   7.8066   46.613   4.9635  280.028   18.314  244.689   13.303 35.33881 22.63562 
1 1 1   28    1   20 o   80.951   28.828   4.8260   4.4995   8.3264   6.5162   1.6357   6.2207  101.457   34.796   75.852   31.803 25.60509 47.14072 
1 1 1   28    1   21 o  154.760   17.433   19.027   4.0577   26.672   9.0500   17.104   4.5395  175.320   34.951  145.430   21.002 29.88928 40.77554 
1 1 1   28    1   22 o   94.543   24.135   7.4598   3.5045   13.766   5.4478   3.0074   4.5774  127.337   28.644   72.801   28.417 54.53674 40.34888 
1 1 1   28    1   23 o  120.722   20.174   11.845   3.5962   10.506   5.6550   12.754   4.6599  110.492   31.752  123.475   25.500 -12.98306 40.72448 
1 1 1   28    1   24 o  275.285   12.090   58.802   5.0941   59.605   6.6437   57.655   7.9355  275.397   15.828  269.085   19.397 6.311920 25.03508 
1 1 1   28    1   25 o   54.076   23.487  -0.2303   3.6137   3.8690   5.6286  -3.1048   4.7133   80.354   31.471   53.577   24.710 26.77644 40.01296 
1 1 1   28    1   26 o  128.485   12.314   12.941   2.3919   14.781   3.4748   11.284   3.2976  135.999   17.069  117.987   18.898 18.01205 25.46484 
1 1 1   28    1   27 o  288.568   7.1327   64.072   3.1504   65.993   4.5345   62.279   4.3803  292.063   10.143  283.744   10.086 8.319000 14.30417 
1 1 1   28    1   28 o  220.653   9.9574   37.666   3.3630   39.503   4.1372   34.090   5.7737  225.101   12.052  206.505   18.461 18.59625 22.04664 
1 1 1   28    1   29 o  106.777   19.561   9.3545   3.0792   6.4931   3.7386   15.389   5.4292   87.777   25.989  134.219   27.356 -46.44135 37.73289 
1 1 1   28    1   30 o  195.275   8.8705   29.455   2.6513   31.988   4.2863   27.885   3.3743  201.681   13.971  189.006   11.722 12.67503 18.23715 
1 1 1   28    1   31 o  180.283   10.739   25.317   2.9500   17.868   6.2967   27.412   3.3391  143.076   29.724  187.316   11.705 -44.24039 31.94538 
1 1 1   28    1   32 o  191.128   9.3661   28.279   2.7400   26.812   4.4976   29.145   3.4552  183.405   16.187  193.065   11.748 -9.660492 20.00133 
1 1 1   28    1   33 o  152.617   11.392   18.242   2.6420   20.671   3.9373   16.253   3.5634  160.702   16.229  142.141   16.696 18.56139 23.28424 
1 1 1   28    1   34 o  158.702   10.557   19.676   2.5498   23.380   3.7713   16.558   3.4606  171.574   14.496  143.594   16.018 27.97931 21.60362 
1 1 1   28    1   35 o  162.364   10.404   20.602   2.5719   21.879   3.7325   19.448   3.5490  165.590   14.886  155.979   15.052 9.610550 21.16934 
1 1 1   28    1   36 o  217.202   8.8319   36.582   2.9362   39.115   4.5706   34.803   3.8314  222.297   13.497  210.405   11.946 11.89258 18.02421 
1 1 1   28    1   37 o  133.046   12.762   14.057   2.5670   10.097   3.6776   17.820   3.5847  108.226   22.914  148.476   16.027 -40.24951 27.96311 
1 1 1   28    1   38 o   65.615   26.584   2.3803   4.1533   0.9127   4.9213   6.0121   7.7421   64.004   27.603   89.115   36.227 -25.11089 45.54508 
1 1 1   28    1   39 o   40.719   18.629  -1.3787   2.6051  -1.1625   3.5624  -1.6273   3.8195   49.075   22.188   49.526   22.619 -0.4502563 31.68476 
1 1 1   28    1   40 o  153.778   12.584   18.863   2.9360   24.696   3.9389   11.570   4.4043  174.739   14.868  112.752   26.045 61.98797 29.99026 
1 1 1   28    1   41 o  106.050   17.530   9.4476   2.7460   11.652   3.8256   7.1049   3.9441  114.949   22.549   87.474   26.869 27.47534 35.07676 
1 1 1   28    1   42 o  105.858   18.557   9.5603   2.8971   8.2259   3.7990   11.415   4.4786   93.948   25.683  110.195   26.809 -16.24705 37.12573 
1 1 1   28    1   43 o   56.852   21.782   2.2948   2.6525   4.4201   3.7650   0.2002   3.7377   71.609   26.252   53.540   23.555 18.06817 35.27076 
1 1 1   28    2    0 o   22.404   15.858  -2.8212   2.2404  -2.8212   2.2404  -2.8212   2.2404   22.404   15.858   22.404   15.858 0.000000 0.000000 
1 1 1   28    2    1 o  249.616   6.0475   47.789   2.3106   50.447   3.3519   45.382   3.1894  256.189   8.5480  242.983   8.5756 13.20605 12.10827 
1 1 1   28    2    2 o  225.986   6.3070   39.177   2.1816   39.629   3.2156   38.791   2.9696  226.978   9.2556  224.640   8.6365 2.338120 12.65916 
1 1 1   28    2    3 o  372.362   6.3951  106.373   3.6449  113.786   7.0299  103.648   4.2626  383.950   11.962  367.380   7.5803 16.57001 14.16165 
1 1 1   28    2    4 o  185.647   11.398   26.681   3.2232   25.656   4.8655   27.482   4.3029  180.544   17.840  187.629   15.111 -7.085541 23.37953 
1 1 1   28    2    5 o  292.793   8.4552   65.894   3.7893   66.785   6.1037   65.335   4.8335  293.764   13.574  291.142   10.846 2.621185 17.37562 
1 1 1   28    2    6 o  191.696   6.1658   28.189   1.8091   26.846   3.3925   28.723   2.1386  186.099   11.973  193.418   7.2238 -7.319275 13.98374 
1 1 1   28    2    7 o  100.792   10.908   7.9221   1.6560   8.8365   4.8562   7.8018   1.7616  103.237   29.345   99.867   11.749 3.370163 31.60985 
1 1 1   28    2    8 o  110.195   9.9476   9.4264   1.6597   4.1627   4.8305   10.131   1.7673   79.709   29.643  114.230   10.216 -34.52015 31.35409 
1 1 1   28    2    9 f   76.595   14.683   4.7000   1.6587   0.0000   0.0000   4.7000   1.6587  ?   ?    76.595   14.683 0.000000 14.68294 
1 1 1   28    2   10 o   37.922   15.555   0.3877   1.4436   3.4230   5.1999   0.1342   1.5027   78.039   30.336   36.956   15.570 41.08315 34.09839 
1 1 1   28    2   11 o   95.279   10.992   7.0951   1.5736   10.955   5.6994   6.7766   1.6372  113.978   31.580   92.944   11.772 21.03413 33.70284 
1 1 1   28    2   12 f  128.860   14.965   13.070   2.8966   22.785   6.2130   10.372   3.2743  167.357   25.022  113.427   19.566 53.92953 31.76412 
1 1 1   28    2   13 o  189.999   10.927   27.952   3.1644   29.957   6.3692   27.295   3.6462  193.471   21.893  187.343   12.792 6.128021 25.35649 
1 1 1   28    2   14 o  152.347   13.254   18.120   3.0598   19.529   6.2363   17.673   3.5115  153.585   27.540  149.893   15.531 3.691681 31.61744 
1 1 1   28    2   15 o   38.787   18.303  -3.0722   2.8366   1.3844   6.1763  -4.2635   3.1933   75.249   31.627   39.176   18.749 36.07243 36.76698 
1 1 1   28    2   16 o  178.666   12.244   24.820   3.3283   23.520   6.7220   25.242   3.8309  168.988   26.889  179.750   14.035 -10.76198 30.33160 
1 1 1   28    2   17 o  230.870   9.1943   41.059   3.2490   47.857   5.4361   37.281   4.0525  247.684   14.401  219.141   12.129 28.54327 18.82829 
1 1 1   28    2   18 o  187.385   10.672   27.201   3.0482   31.855   5.1617   24.708   3.7772  201.084   16.928  177.780   13.994 23.30397 21.96350 
1 1 1   28    2   19 o   98.988   23.453   8.1294   3.4989   11.043   5.2329   5.7740   4.7054  113.985   29.696   86.281   29.570 27.70405 41.90717 
1 1 1   28    2   20 o   45.090   20.895  -2.6776   3.4302  -1.4496   5.0340  -3.7420   4.6868   60.231   26.870   52.139   24.252 8.092281 36.19601 
1 1 1   28    2   21 o  171.627   12.570   22.968   3.2792   31.566   5.9662   19.247   3.9253  198.831   19.870  155.884   16.712 42.94653 25.96359 
1 1 1   28    2   22 o   98.289   24.032   8.0646   3.5854   14.324   10.096   7.1612   3.8354  127.192   43.315   92.561   25.999 34.63116 50.51873 
1 1 1   28    2   23 o  194.768   12.238   29.544   3.6299   30.952   6.4441   28.889   4.3932  195.778   21.878  191.730   15.092 4.047958 26.57887 
1 1 1   28    2   24 f   58.050   21.783   2.1001   2.6199  -4.4586   6.2526   3.4969   2.8855   60.466   28.087   67.948   23.156 -7.482533 36.40197 
1 1 1   28    2   25 o   47.714   20.349   0.1330   2.6200  -8.8851   6.4088   1.9426   2.8709   53.741   25.935   58.586   22.606 -4.845341 34.40406 
1 1 1   28    2   26 o  107.321   15.538   9.2040   2.4781   12.504   3.3501   5.2164   3.6825  124.590   18.097   80.391   26.131 44.19901 31.78539 
1 1 1   28    2   27 o  218.535   9.3642   36.890   3.1323   34.628   4.0433   40.284   4.9534  210.588   12.602  226.537   14.360 -15.94958 19.10519 
1 1 1   28    2   28 o  248.906   7.0193   47.671   2.6742   46.019   4.3607   48.667   3.3856  243.390   11.705  251.103   8.8088 -7.713104 14.64953 
1 1 1   28    2   29 o  202.099   8.4130   31.511   2.6025   29.520   4.1722   32.779   3.3296  193.707   14.170  205.371   10.629 -11.66391 17.71324 
1 1 1   28    2   30 o  162.980   11.305   20.731   2.8026   24.924   4.1256   17.137   3.8191  177.397   15.345  146.116   17.420 31.28055 23.21465 
1 1 1   28    2   31 o  155.571   12.191   18.976   2.8797   21.226   4.3156   17.169   3.8664  162.568   17.626  146.026   17.657 16.54126 24.94883 
1 1 1   28    2   32 o  121.472   19.551   12.110   3.5118   5.5742   6.5019   14.802   4.1728   88.002   34.002  133.883   21.058 -45.88136 39.99440 
1 1 1   28    2   33 o  223.017   9.1431   38.509   3.1211   33.707   6.8849   39.752   3.5015  201.733   22.691  226.294   10.109 -24.56154 24.84094 
1 1 1   28    2   34 o   90.126   21.098   6.8662   2.8590   2.6974   6.1871   7.9981   3.2238   76.472   31.862   97.007   22.193 -20.53466 38.82976 
1 1 1   28    2   35 o  265.873   9.8945   54.946   4.0266   0.0000   0.0000   54.946   4.0266  ?   ?   265.873   9.8945 0.000000 9.894516 
1 1 1   28    2   36 o   39.340   18.073  -1.5449   2.4872  -3.9475   3.4660   1.0054   3.5711   41.434   19.748   57.345   24.073 -15.91124 31.13645 
1 1 1   28    2   37 o  138.509   14.900   15.420   3.1092   17.642   5.0962   14.102   3.9242  143.166   24.113  129.749   20.436 13.41756 31.60764 
1 1 1   28    2   38 o   76.929   24.948   5.0759   3.3576   5.5426   3.8185   3.4851   7.0503   80.097   26.637   79.968   33.710 0.1289215 42.96376 
1 1 1   28    2   39 o  157.570   12.433   19.725   2.9742   18.489   3.8755   21.496   4.6392  150.070   17.181  160.603   19.256 -10.53244 25.80701 
1 1 1   28    2   40 o   78.108   20.820   5.3138   2.5343   6.6467   3.6806   4.1121   3.4948   85.569   25.890   70.673   25.381 14.89636 36.25598 
1 1 1   28    2   41 o   40.532   18.643  -1.4844   2.6577  -2.1774   3.5495  -0.6001   4.0094   45.607   21.177   53.154   23.827 -7.547417 31.87807 
1 1 1   28    2   42 o   55.171   21.405   2.0210   2.5850   5.1426   3.7192  -0.8963   3.5954   75.799   26.272   49.354   22.304 26.44511 34.46290 
1 1 1   28    2   43 f   81.256   21.083   5.8905   2.6447   5.4940   3.7882   6.2675   3.6940   77.362   26.531   81.836   26.130 -4.474632 37.23787 
1 1 1   28    3    0 o   71.648   24.752   5.1756   2.4458   5.1756   2.4458   5.1756   2.4458   71.648   24.752   71.648   24.752 0.000000 0.000000 
1 1 1   28    3    1 o  188.193   8.5283   27.223   2.4566   29.317   4.7900   26.475   2.8616  193.531   16.323  185.154   10.136 8.376541 19.21365 
1 1 1   28    3    2 o  163.760   9.2697   20.694   2.3139   18.917   4.6198   21.289   2.6735  154.175   20.051  165.900   10.584 -11.72475 22.67315 
1 1 1   28    3    3 o  267.502   14.077   55.566   5.7434   55.566   5.7434   0.0000   0.0000  267.502   14.077  ?   ?  0.000000 14.07672 
1 1 1   28    3    4 o   61.464   21.605   2.6526   2.5194   14.400   4.7893  -1.8418   2.9624  132.884   24.448   43.665   19.934 89.21867 31.54420 
1 1 1   28    3    5 o  121.383   9.4712   11.406   1.7457   8.0544   5.0596   11.859   1.8600   99.300   30.421  123.717   9.9051 -24.41794 31.99262 
1 1 1   28    3    6 o  145.404   7.5725   16.282   1.6795   17.471   3.4906   15.924   1.9158  149.210   15.511  143.640   8.7557 5.570450 17.81119 
1 1 1   28    3    7 o   95.291   10.460   7.0797   1.5005   6.0362   3.1662   7.3819   1.7041   85.914   23.430   97.111   11.700 -11.19659 26.18877 
1 1 1   28    3    8 o   99.088   9.8730   7.6347   1.4775   10.383   3.2251   6.9047   1.6621  113.681   19.220   93.841   11.835 19.83991 22.57138 
1 1 1   28    3    9 o  111.696   8.8791   9.6570   1.5055   12.580   3.4979   8.9924   1.6679  125.482   18.790  107.548   10.256 17.93364 21.40691 
1 1 1   28    3   10 o   59.056   14.802   2.8131   1.3354   0.7941   4.1847   3.0420   1.4091   62.309   26.103   61.380   15.101 0.9292412 30.15634 
1 1 1   28    3   11 o  206.188   5.7502   32.610   1.8147   29.159   4.0709   33.465   2.0273  193.454   13.840  208.825   6.3426 -15.37059 15.22369 
1 1 1   28    3   12 o  179.655   6.7493   24.780   1.8559   26.509   4.0969   24.334   2.0818  184.177   14.654  177.950   7.6432 6.227310 16.52758 
1 1 1   28    3   13 o  119.852   8.1741   11.097   1.4906   10.269   3.9450   11.234   1.6099  111.639   23.813  120.509   8.7885 -8.870621 25.38284 
1 1 1   28    3   14 o  246.254   6.1041   46.536   2.3008   44.346   4.7614   47.203   2.6279  238.883   13.072  247.917   6.9253 -9.034103 14.79288 
1 1 1   28    3   15 o  165.292   8.7842   21.088   2.2144   27.387   4.6179   19.207   2.5235  186.649   16.328  157.426   10.533 29.22250 19.43103 
1 1 1   28    3   16 o  139.549   10.424   15.109   2.2105   22.516   4.7320   13.041   2.5001  168.350   18.678  129.119   12.820 39.23112 22.65446 
1 1 1   28    3   17 o  113.836   12.858   10.167   2.2012   17.841   4.8729   8.2004   2.4672  148.449   22.121  101.226   16.492 47.22308 27.59236 
1 1 1   28    3   18 o  262.195   7.5660   52.853   3.0364   59.678   5.9718   50.473   3.5263  276.701   14.148  255.982   8.9999 20.71869 16.76753 
1 1 1   28    3   19 o   99.653   22.054   8.1890   3.2749   0.0000   0.0000   8.1890   3.2749  ?   ?    99.653   22.054 0.000000 22.05380 
1 1 1   28    3   20 f   64.025   21.520   3.0957   2.4917   5.1362   5.5346   2.5769   2.7905   85.630   31.753   61.995   22.620 23.63511 38.98596 
1 1 1   28    3   21 o  128.784   12.042   12.961   2.3462   12.327   6.0423   13.073   2.5460  119.486   32.277  129.114   13.063 -9.628563 34.81984 
1 1 1   28    3   22 o   86.268   19.031   6.0958   2.4455   18.409   9.5090   5.2237   2.5306  142.160   41.268   79.638   20.604 62.52179 46.12560 
1 1 1   28    3   23 o   71.733   20.533   4.1976   2.3689   13.710   6.2415   2.5968   2.5605  125.589   32.289   60.862   21.739 64.72710 38.92556 
1 1 1   28    3   24 o   50.751   20.369   1.0749   2.4133  -4.9753   6.2499   2.1351   2.6162   59.429   27.764   58.235   21.784 1.194702 35.28987 
1 1 1   28    3   25 o  138.568   10.606   14.942   2.2323   16.544   3.4566   13.797   2.9239  144.423   15.900  132.095   14.711 12.32813 21.66143 
1 1 1   28    3   26 o   93.655   15.485   7.0460   2.1422   9.7899   3.3243   5.0973   2.8015  109.134   20.657   78.507   22.280 30.62698 30.38262 
1 1 1   28    3   27 o  220.362   9.3288   37.508   3.1465   35.634   4.1568   40.023   4.8153  213.568   12.775  225.928   13.993 -12.35956 18.94742 
1 1 1   28    3   28 o  167.145   9.0104   21.634   2.2967   16.797   3.8385   24.331   2.8664  144.704   17.699  176.893   10.636 -32.18811 20.64937 
1 1 1   28    3   29 o  177.838   8.9686   24.488   2.4334   27.470   4.2316   23.014   2.9744  186.530   14.947  171.779   11.377 14.75037 18.78421 
1 1 1   28    3   30 o  100.472   15.757   8.1273   2.3435   13.902   4.0093   5.1302   2.8883  130.074   20.842   78.470   22.734 51.60433 30.84151 
1 1 1   28    3   31 o   40.692   18.159  -0.7715   2.3011  -4.1075   4.1014   0.7611   2.7799   46.472   21.953   51.583   21.413 -5.110962 30.66693 
1 1 1   28    3   32 o   57.063   22.338   1.7928   2.8346  -2.6631   4.1658   5.6346   3.8681   50.264   23.199   82.295   26.783 -32.03070 35.43325 
1 1 1   28    3   33 o   69.408   25.412   3.5047   3.5263   5.4474   8.9594   3.1486   3.8359   93.442   38.588   68.817   26.235 24.62462 46.66120 
1 1 1   28    3   34 o  139.575   15.404   15.605   3.2360   19.313   5.4607   13.599   4.0173  150.779   24.502  127.640   21.314 23.13887 32.47569 
1 1 1   28    3   35 o  133.243   13.915   14.147   2.7959   20.203   4.7444   10.925   3.4607  156.325   20.308  114.235   20.548 42.09045 28.88998 
1 1 1   28    3   36 o  123.798   14.884   12.326   2.7638   19.501   5.0009   9.1703   3.3162  152.214   22.112  103.807   21.575 48.40720 30.89380 
1 1 1   28    3   37 o   89.457   20.268   6.8037   2.7110   2.5503   4.8547   8.7311   3.2680   69.572   28.530  100.943   21.790 -31.37118 35.89957 
1 1 1   28    3   38 o  129.706   14.455   13.538   2.8209   8.4120   5.1795   15.700   3.3635   95.434   30.989  138.999   16.108 -43.56458 34.92496 
1 1 1   28    3   39 o   48.703   22.113  -1.3190   3.5832   0.3613   4.7289  -3.5845   5.4908   60.822   26.633   55.248   25.878 5.574139 37.13483 
1 1 1   28    3   40 o   70.005   21.979   4.2216   2.6230   2.2342   3.6357   6.3790   3.7879   61.788   24.929   83.818   26.428 -22.03057 36.32994 
1 1 1   28    3   41 o   61.466   21.431   3.0642   2.4767   7.3942   3.6098  -0.7872   3.4045   89.727   25.230   48.599   21.857 41.12825 33.38090 
1 1 1   28    3   42 o  102.687   17.132   8.8827   2.5979   7.1509   3.6055   10.753   3.7465   87.727   25.396  109.448   23.090 -21.72061 34.32330 
1 1 1   28    3   43 o   84.182   21.135   6.3252   2.7193   5.8153   3.6110   6.9931   4.1330   79.198   25.882   85.479   27.675 -6.280998 37.89196 
1 1 1   28    4    0 o  248.704   13.743   48.037   5.1952   48.037   5.1952   48.037   5.1952  248.704   13.743  248.704   13.743 0.000000 0.000000 
1 1 1   28    4    1 o   58.842   25.530  -0.3692   4.2609  -0.3692   4.2609   0.0000   0.0000   58.842   25.530  ?   ?  0.000000 25.52995 
1 1 1   28    4    2 o  220.649   10.280   37.500   3.4719   43.783   5.4773   33.279   4.4889  237.065   15.175  206.780   14.270 30.28575 20.83038 
1 1 1   28    4    3 o  283.601   7.3073   61.755   3.1720   65.994   6.2871   60.307   3.6738  291.891   14.072  280.086   8.5696 11.80450 16.47613 
1 1 1   28    4    4 o  213.867   6.6472   35.100   2.1760   37.260   5.8090   34.747   2.3468  217.923   17.565  212.739   7.2071 5.183563 18.98563 
1 1 1   28    4    5 o  272.997   5.9096   57.161   2.4694   60.112   6.6207   56.684   2.6614  277.731   15.638  271.806   6.3972 5.925598 16.89596 
1 1 1   28    4    6 o  190.501   6.2403   27.842   1.8196   25.498   3.9489   28.474   2.0502  180.803   14.388  192.593   6.9549 -11.78964 15.98091 
1 1 1   28    4    7 o  183.490   7.6518   25.864   2.1490   27.187   3.9265   25.298   2.5678  186.842   13.828  181.077   9.2959 5.765381 16.66204 
1 1 1   28    4    8 o   82.510   20.130   5.5546   2.5197   4.2133   3.5061   6.9872   3.6235   75.001   25.525   92.137   25.039 -17.13602 35.75633 
1 1 1   28    4    9 o   41.780   18.858  -1.2675   2.5612  -2.2980   3.4300   0.0312   3.8505   46.347   21.267   57.248   24.549 -10.90141 32.47933 
1 1 1   28    4   10 o  241.155   10.438   44.836   3.8527   45.392   5.6612   44.357   5.2582  241.135   15.419  238.640   14.464 2.495239 21.14116 
1 1 1   28    4   11 o  143.986   13.898   16.221   3.0248   12.965   4.0317   20.414   4.5750  126.529   21.593  160.290   19.018 -33.76116 28.77378 
1 1 1   28    4   12 o  103.894   18.874   8.7122   2.8909   11.660   3.9889   5.4512   4.1956  119.495   22.638   83.727   27.925 35.76776 35.94794 
1 1 1   28    4   13 o  208.348   10.920   33.597   3.4703   37.745   4.7070   28.658   5.1365  220.087   14.046  190.561   17.817 29.52562 22.68767 
1 1 1   28    4   14 o  232.961   10.149   41.850   3.6188   45.900   4.9058   37.016   5.3597  242.985   13.241  217.251   16.235 25.73413 20.94988 
1 1 1   28    4   15 o  150.459   14.565   17.758   3.3122   17.288   4.5703   18.277   4.8070  146.561   20.971  150.603   21.460 -4.042023 30.00526 
1 1 1   28    4   16 o  110.908   20.428   9.9937   3.3401   5.3937   4.6989   14.691   4.7486   84.570   29.517  133.819   24.068 -49.24873 38.08626 
1 1 1   28    4   17 o  224.476   16.810   39.623   5.7338   0.0000   0.0000   39.623   5.7338  ?   ?   224.476   16.810 0.000000 16.81002 
1 1 1   28    4   18 o  107.654   18.708   9.3596   2.9707   12.775   5.1895   7.6949   3.6231  123.109   28.152   96.163   24.535 26.94547 37.34332 
1 1 1   28    4   19 o  157.387   7.7552   19.052   1.8682   18.887   5.7022   19.072   1.9774  151.302   25.531  157.206   8.2465 -5.903900 26.82983 
1 1 1   28    4   20 o  112.699   10.602   9.8977   1.8073   17.811   5.9709   9.0996   1.8962  145.808   27.768  107.806   11.678 38.00169 30.12378 
1 1 1   28    4   21 o  199.954   7.6039   30.753   2.3272   33.434   6.5552   30.367   2.4894  204.023   21.306  198.613   8.1886 5.409912 22.82500 
1 1 1   28    4   22 o  305.319   6.8580   71.646   3.2050   82.587   11.024   70.636   3.3496  320.480   22.619  303.089   7.2204 17.39136 23.74356 
1 1 1   28    4   23 f   64.855   19.657   3.3692   2.1204   7.3963   6.7892   2.9339   2.2321   97.645   35.335   61.803   20.356 35.84211 40.77950 
1 1 1   28    4   24 o  117.387   13.229   10.852   2.3356   11.324   6.9061   10.791   2.4818  113.946   35.646  116.813   14.171 -2.867126 38.35952 
1 1 1   28    4   25 o  147.937   9.4517   16.966   2.1290   22.677   3.5658   13.801   2.6540  169.991   13.824  132.503   13.264 37.48839 19.15858 
1 1 1   28    4   26 o  124.050   11.478   12.035   2.1547   11.018   3.5689   12.618   2.7028  115.838   20.897  126.340   14.224 -10.50239 25.27907 
1 1 1   28    4   27 o   62.269   19.504   3.0812   2.0668   0.4986   3.4033   4.5902   2.6015   55.205   23.354   74.659   21.560 -19.45457 31.78444 
1 1 1   28    4   28 o  101.806   16.498   8.3603   2.4828   5.2971   3.6954   10.881   3.3521   80.653   26.174  115.362   19.691 -34.70957 32.75378 
1 1 1   28    4   29 o  148.682   10.193   17.199   2.3058   18.854   4.1309   16.450   2.7789  153.202   17.957  144.750   12.670 8.452881 21.97690 
1 1 1   28    4   30 o   44.738   18.889   0.2860   2.2193   6.2086   4.1874  -2.0274   2.6171   86.284   27.848   39.362   18.245 46.92186 33.29274 
1 1 1   28    4   31 o   34.924   16.543  -2.6402   2.3588  -6.1398   4.1180  -0.9314   2.8776   42.563   20.600   45.367   20.272 -2.804790 28.90198 
1 1 1   28    4   32 o  160.652   11.359   20.188   2.7753   22.627   5.1040   19.165   3.3069  166.299   20.485  155.623   14.034 10.67610 24.83072 
1 1 1   28    4   33 o   55.064   21.150   1.8146   2.5047   7.3413   4.3710  -0.8875   3.0563   91.937   28.293   46.865   20.920 45.07218 35.18712 
1 1 1   28    4   34 o  108.352   17.903   9.6315   2.8654  -8.5627   8.8997   11.736   3.0265   65.507   31.338  120.230   16.914 -54.72306 35.61089 
1 1 1   28    4   35 o  170.404   11.465   22.795   2.9729   16.072   4.9150   26.674   3.7331  136.936   24.342  183.582   13.377 -46.64621 27.77531 
1 1 1   28    4   36 o  195.566   10.524   29.910   3.1387   32.292   5.2970   28.622   3.8964  199.553   17.520  189.997   13.486 9.556213 22.10879 
1 1 1   28    4   37 o  144.073   13.656   16.555   2.9755   14.458   5.0632   17.661   3.6775  127.608   26.777  147.482   16.578 -19.87454 31.49311 
1 1 1   28    4   38 o   94.159   18.810   7.4651   2.6161   13.978   4.8520   4.7955   3.1063  125.334   26.138   74.872   23.967 50.46227 35.46285 
1 1 1   28    4   39 o   71.099   24.033   4.2596   3.1078   7.6958   4.6904   1.5704   4.1493   91.166   29.479   61.874   25.960 29.29236 39.27998 
1 1 1   28    4   40 o   79.285   23.537   5.5894   3.0633   1.5805   4.4347   9.2479   4.2365   62.837   26.625   99.784   27.057 -36.94681 37.96029 
1 1 1   28    4   41 o   74.285   22.115   4.8743   2.7016   3.6869   4.4570   5.5640   3.3968   70.586   27.892   78.529   25.054 -7.943092 37.49253 
1 1 1   28    4   42 o   60.423   22.095   2.8597   2.6646   1.0016   4.3380   3.9855   3.3766   59.613   25.812   68.832   24.918 -9.219147 35.87709 
1 1 1   28    5    1 o  304.272   9.2912   71.231   4.3272   68.055   6.3103   74.050   5.9451  296.439   13.907  309.560   12.547 -13.12122 18.73091 
1 1 1   28    5    2 f  103.045   22.248   8.6766   3.4062   7.1914   5.1574   9.8257   4.5364   95.055   30.925  108.768   27.293 -13.71278 41.24642 
1 1 1   28    5    3 o  321.980   9.1548   79.755   4.5118   81.533   7.0324   78.511   5.8819  324.377   14.164  318.854   12.052 5.523254 18.59745 
1 1 1   28    5    4 o  282.090   5.7892   61.028   2.4997   58.672   6.6234   61.419   2.6993  274.293   15.844  282.946   6.2326 -8.652863 17.02539 
1 1 1   28    5    5 o  204.186   6.0825   31.982   1.9010   29.477   6.2077   32.242   1.9969  192.384   21.446  204.989   6.3644 -12.60492 22.37036 
1 1 1   28    5    6 o  341.064   7.7038   89.364   4.0217   92.757   5.3409   84.921   6.1118  347.015   10.055  331.568   12.043 15.44687 15.68891 
1 1 1   28    5    7 o   99.855   17.950   8.0141   2.6426   13.012   3.8146   3.4023   3.6644  127.252   20.264   71.124   25.926 56.12781 32.90578 
1 1 1   28    5    8 o   77.453   21.536   4.8750   2.6457   3.5502   3.7346   6.2098   3.7486   72.178   26.194   87.389   26.058 -15.21055 36.94793 
1 1 1   28    5    9 o  215.346   9.7978   35.721   3.2295   41.440   4.4559   29.392   4.6873  231.117   12.644  193.693   15.952 37.42342 20.35534 
1 1 1   28    5   10 o  200.235   10.492   31.000   3.2043   28.482   4.3140   34.098   4.7859  190.913   14.881  208.936   15.066 -18.02312 21.17582 
1 1 1   28    5   11 o  275.807   10.163   58.640   4.2903   61.364   6.6385   56.686   5.6221  280.388   15.529  270.064   13.645 10.32477 20.67195 
1 1 1   28    5   12 o   60.681   22.514   2.3305   2.7832   2.4750   4.0512   2.2014   3.8302   68.337   26.717   65.901   25.915 2.435371 37.22109 
1 1 1   28    5   13 o  186.594   11.973   27.032   3.4015   26.780   4.6558   27.322   4.9815  184.491   16.667  186.042   17.707 -1.551041 24.31770 
1 1 1   28    5   14 o  198.747   11.545   30.630   3.4968   31.578   4.8784   29.628   5.0149  200.619   16.021  193.964   17.065 6.655151 23.40680 
1 1 1   28    5   15 o  245.638   10.238   46.545   3.8493   47.378   5.4286   45.703   5.4588  246.460   14.454  241.933   14.813 4.527191 20.69599 
1 1 1   28    5   16 o  126.614   17.628   12.785   3.3236   10.467   4.8595   14.823   4.5557  111.435   28.406  134.815   22.896 -23.38023 36.48473 
1 1 1   28    5   17 o  140.222   15.246   15.494   3.2196   13.897   5.2918   16.433   4.0568  128.729   27.680  143.375   18.950 -14.64603 33.54506 
1 1 1   28    5   18 o  155.132   12.056   18.744   2.8403   13.510   5.5345   20.616   3.3094  126.266   29.216  162.406   13.433 -36.14061 32.15643 
1 1 1   28    5   19 o  108.759   16.150   9.4372   2.6068   11.330   5.4976   8.8881   2.9609  115.138   30.652  104.653   19.191 10.48577 36.16412 
1 1 1   28    5   20 o   77.002   21.513   4.8596   2.6334   11.650   5.8610   3.1421   2.9477  116.360   31.938   66.129   23.356 50.23113 39.56731 
1 1 1   28    5   21 o  263.793   6.1890   53.436   2.4989   64.557   7.1922   51.909   2.6650  286.579   16.466  259.921   6.6985 26.65811 17.77600 
1 1 1   28    5   22 o  191.173   7.4103   28.110   2.1684   25.601   6.6062   28.413   2.2956  176.400   25.182  192.148   7.8051 -15.74811 26.36367 
1 1 1   28    5   23 o  106.163   12.163   8.8547   1.9407   4.2569   9.6996   9.0465   1.9807   95.882   39.917  107.293   12.282 -11.41050 41.76433 
1 1 1   28    5   24 o   64.914   18.250   3.4244   1.8889   2.6264   6.7015   3.4932   1.9687   80.487   33.316   65.587   18.699 14.90008 38.20511 
1 1 1   28    5   25 o   71.605   16.559   4.1868   1.7787   5.8101   3.1824   3.4492   2.1451   83.576   23.755   65.454   19.756 18.12289 30.89717 
1 1 1   28    5   26 o  129.320   10.321   13.021   2.0260   21.148   3.6826   9.4933   2.4262  163.726   14.857  109.177   14.908 54.54897 21.04710 
1 1 1   28    5   27 o  117.872   11.819   10.897   2.1036   14.560   3.7430   9.2054   2.5433  134.265   18.723  107.124   16.002 27.14160 24.62911 
1 1 1   28    5   28 o  150.669   10.108   17.649   2.3175   18.893   3.9191   16.980   2.8738  153.827   16.925  147.053   12.898 6.774704 21.27927 
1 1 1   28    5   29 o  118.937   15.447   11.295   2.7457   18.312   4.0715   5.4424   3.7185  150.930   17.978   81.409   26.240 69.52068 31.80752 
1 1 1   28    5   30 o   78.877   19.751   5.1751   2.3793   4.1397   4.4231   5.5967   2.8224   76.231   28.362   81.698   22.055 -5.467171 35.92862 
1 1 1   28    5   31 o   71.695   20.609   4.2576   2.3819  -1.4352   4.3691   6.6653   2.8413   55.033   24.755   89.129   21.146 -34.09624 32.55714 
1 1 1   28    5   32 o  111.552   14.436   9.9405   2.4071   8.7516   4.5888   10.392   2.8274   99.916   28.569  113.286   16.816 -13.36921 33.15096 
1 1 1   28    5   33 o  126.094   13.080   12.592   2.4877   9.9142   4.7408   13.610   2.9224  105.805   28.594  130.511   14.896 -24.70636 32.24119 
1 1 1   28    5   34 o  103.598   18.477   8.8643   2.8225   4.0658   9.3154   9.3493   2.9617   89.973   38.372  106.291   18.897 -16.31821 42.77227 
1 1 1   28    5   35 f  168.020   10.684   22.097   2.7333   22.427   5.0989   21.964   3.2378  164.435   20.719  166.718   12.785 -2.283173 24.34601 
1 1 1   28    5   36 o  193.644   9.5463   29.154   2.8295   30.566   5.2809   28.585   3.3511  193.750   18.014  190.740   11.532 3.010315 21.38897 
1 1 1   28    5   37 o   76.092   22.857   4.9629   2.8763   4.5879   4.9977   5.1486   3.5171   77.981   29.894   77.702   25.551 0.2789612 39.32537 
1 1 1   28    5   38 o  108.065   20.134   9.8968   3.2078   8.9895   4.7457   10.660   4.3528   98.588   29.302  108.821   26.402 -10.23322 39.44178 
1 1 1   28    5   39 o   41.516   19.100  -1.6141   2.7917   2.6100   4.4591  -4.3373   3.5803   67.155   27.418   41.074   19.709 26.08063 33.76717 
1 1 1   28    5   40 o   88.568   24.485   7.0999   3.4304   5.5034   4.4324   9.4844   5.4170   79.194   28.567   98.429   31.664 -19.23533 42.64663 
1 1 1   28    5   41 o   49.340   20.553   0.9067   2.5736  -3.8010   4.1886   3.7617   3.2619   46.171   21.921   67.629   24.490 -21.45808 32.86742 
1 1 1   28    5   42 o   72.254   22.216   4.6373   2.6956   3.9194   4.3351   5.0898   3.4418   70.678   27.636   75.183   25.292 -4.504837 37.46265 
1 1 1   28    6    1 o   86.339   24.629   6.0794   3.4144   0.7908   4.8797   11.153   4.7793   66.673   28.072  115.820   27.389 -49.14689 39.22009 
1 1 1   28    6    2 o   59.852   23.713   1.6474   3.2292  -0.8818   5.2136   3.2216   4.1132   63.466   27.873   72.302   27.261 -8.836487 38.98827 
1 1 1   28    6    3 o  213.896   10.567   35.263   3.4596   35.039   6.3120   35.359   4.1363  210.494   19.825  213.484   12.716 -2.989456 23.55232 
1 1 1   28    6    4 o   78.706   31.662   2.7990   5.8461   2.7990   5.8461   0.0000   0.0000   78.706   31.662  ?   ?  0.000000 31.66167 
1 1 1   28    6    5 o  158.299   14.296   19.583   3.4265   17.910   6.5761   20.207   4.0145  146.306   30.360  160.252   16.608 -13.94585 34.60579 
1 1 1   28    6    6 o  196.021   10.442   29.699   3.1218   35.538   4.5886   24.668   4.2595  213.650   14.111  177.404   15.854 36.24626 21.22387 
1 1 1   28    6    7 o  366.015   7.8700  102.950   4.4091  107.092   5.9190   97.786   6.6086  372.741   10.375  355.711   12.138 17.02979 15.96736 
1 1 1   28    6    8 o  148.960   13.163   17.310   2.9704   12.933   4.2290   21.571   4.1731  126.058   22.755  165.542   16.698 -39.48354 28.22448 
1 1 1   28    6    9 o  180.222   11.360   25.175   3.1176   28.450   4.4761   22.089   4.3448  190.645   15.473  167.368   17.205 23.27716 23.13906 
1 1 1   28    6   10 f  183.328   11.326   26.049   3.1626   30.624   4.6520   22.117   4.3124  197.807   15.489  167.486   17.060 30.32085 23.04192 
1 1 1   28    6   11 o  155.570   14.189   18.937   3.3414   22.061   5.6966   17.299   4.1257  165.229   23.161  147.426   18.704 17.80304 29.77026 
1 1 1   28    6   12 o  289.247   8.9417   64.401   3.9587   71.240   5.5925   57.533   5.6045  303.505   12.038  272.398   13.442 31.10672 18.04473 
1 1 1   28    6   13 o   48.705   20.926  -0.0632   2.8076  -1.0070   4.4438   0.5638   3.6222   57.816   25.548   57.539   24.204 0.2765007 35.19292 
1 1 1   28    6   14 o  165.144   10.500   21.128   2.6403   29.312   5.2279   18.326   3.0591  192.613   17.939  153.202   13.174 39.41051 22.25660 
1 1 1   28    6   15 o  277.695   7.8448   59.296   3.3344   59.423   6.0246   59.239   4.0035  276.136   14.303  277.273   9.4333 -1.136749 17.13363 
1 1 1   28    6   16 o  210.548   18.289   35.055   5.8356   35.055   5.8356   0.0000   0.0000  210.548   18.289  ?   ?  0.000000 18.28941 
1 1 1   28    6   17 o  175.365   10.593   23.832   2.8301   22.101   5.6999   24.398   3.2604  165.005   23.210  177.113   12.099 -12.10767 26.17441 
1 1 1   28    6   18 o   81.198   20.342   5.4166   2.5228   5.6684   5.6878   5.3549   2.8149   88.426   32.290   80.709   22.126 7.716980 39.14305 
1 1 1   28    6   19 o  170.710   11.464   22.650   2.9780   22.252   6.0533   22.776   3.4206  164.744   24.772  170.769   13.189 -6.025345 28.06441 
1 1 1   28    6   20 o  132.931   14.837   13.943   2.9674   13.351   6.2839   14.112   3.3663  124.176   32.634  133.169   16.895 -8.992599 36.74847 
1 1 1   28    6   21 o   59.907   22.736   2.1546   2.8730   3.4423   6.1117   1.7893   3.2550   81.062   32.456   60.265   23.829 20.79674 40.26448 
1 1 1   28    6   22 o  237.301   9.9550   43.492   3.6159   54.288   7.3396   40.032   4.1551  261.660   18.444  226.894   12.007 34.76599 22.00794 
1 1 1   28    6   23 o  123.723   17.501   12.272   3.2217   7.9707   9.4449   12.838   3.4272  105.292   40.897  126.353   18.250 -21.06126 44.78444 
1 1 1   28    6   24 o  182.381   7.5767   25.601   2.1151   26.208   7.1300   25.542   2.2148  177.126   27.166  182.121   7.9452 -4.994232 28.30373 
1 1 1   28    6   25 f  226.067   6.4150   39.277   2.2197   49.381   4.0877   35.051   2.6435  252.576   10.573  213.295   8.0970 39.28065 13.31759 
1 1 1   28    6   26 o  110.620   11.805   9.6056   1.9679   10.892   3.5783   9.0480   2.3562  115.037   21.100  106.545   14.852 8.492371 25.80280 
1 1 1   28    6   27 o  204.126   7.9358   32.109   2.4795   38.791   4.2802   28.734   3.0418  222.869   12.599  192.365   10.369 30.50363 16.31715 
1 1 1   28    6   28 o  141.314   11.491   15.610   2.4639   18.015   4.4889   14.573   2.9476  148.840   20.228  135.690   14.413 13.14928 24.83751 
1 1 1   28    6   29 o   75.303   17.816   4.6730   2.0214   2.7688   4.2371   5.2341   2.3000   69.407   27.269   79.484   19.135 -10.07710 33.31240 
1 1 1   28    6   30 o  216.006   10.083   36.160   3.3336   39.629   4.7759   32.864   4.6551  224.447   13.971  203.876   15.023 20.57010 20.51570 
1 1 1   28    6   31 o  110.998   13.507   9.7845   2.2475   17.614   4.5508   7.2590   2.5847  146.373   20.906   93.806   18.658 52.56686 28.02126 
1 1 1   28    6   32 o  138.934   11.645   15.149   2.4534   19.115   4.7143   13.676   2.8732  152.426   20.745  131.029   14.573 21.39700 25.35216 
1 1 1   28    6   33 o  217.199   8.2478   36.466   2.7420   31.291   4.9847   38.711   3.2834  197.603   16.635  223.393   9.6026 -25.79008 19.20790 
1 1 1   28    6   34 o  156.388   12.895   19.326   3.0591   0.0000   0.0000   19.326   3.0591  ?   ?   156.388   12.895 0.000000 12.89466 
1 1 1   28    6   35 f   41.661   18.785  -1.0130   2.5332   0.7232   6.3242  -1.3448   2.7647   70.654   30.872   42.580   19.368 28.07402 36.44449 
1 1 1   28    6   36 o   67.551   22.433   3.7206   2.7088   1.1227   4.8021   4.9330   3.2805   64.441   27.518   76.306   24.651 -11.86566 36.94479 
1 1 1   28    6   37 f   80.195   22.359   5.5585   2.8476   4.8561   4.9263   5.9109   3.4897   78.822   29.807   82.238   25.276 -3.416084 39.08064 
1 1 1   28    6   38 o  133.384   13.433   14.242   2.7051   24.137   4.8670   9.8188   3.2540  170.631   18.955  107.325   20.557 63.30608 27.96221 
1 1 1   28    6   39 o   40.048   18.666  -2.1068   2.7987  -1.1486   4.5129  -2.7056   3.5676   55.042   24.921   44.654   20.898 10.38753 32.52408 
1 1 1   28    6   40 o  135.565   14.358   14.906   2.9338   13.368   4.3503   16.189   3.9734  122.394   24.079  138.365   19.286 -15.97150 30.85058 
1 1 1   28    6   41 o   74.271   24.752   4.8990   3.2965   1.1524   4.1517   11.291   5.4228   59.430   25.488  106.318   31.251 -46.88780 40.32683 
1 1 1   28    6   42 o   71.433   24.020   4.5115   3.1043   4.1440   4.1341   4.9866   4.7006   71.125   27.207   75.986   29.024 -4.861862 39.78197 
1 1 1   28    7    0 o   48.240   30.329   1.0569   4.6944   1.0569   4.6944   1.0569   4.6944   48.240   30.329   48.240   30.329 0.000000 0.000000 
1 1 1   28    7    1 o  228.152   14.413   40.526   5.0075   0.0000   0.0000   40.526   5.0075  ?   ?   228.152   14.413 0.000000 14.41332 
1 1 1   28    7    2 o  220.210   10.090   37.357   3.4008   29.383   5.9135   41.298   4.1570  192.372   20.394  230.962   11.798 -38.59032 23.56104 
1 1 1   28    7    3 o   70.507   29.944   0.6724   5.6302   0.6724   5.6302   0.0000   0.0000   70.507   29.944  ?   ?  0.000000 29.94448 
1 1 1   28    7    4 o  285.568   16.657   63.754   7.2490   63.754   7.2490   0.0000   0.0000  285.568   16.657  ?   ?  0.000000 16.65675 
1 1 1   28    7    5 o  206.046   22.050   33.882   6.8461   33.882   6.8461   0.0000   0.0000  206.046   22.050  ?   ?  0.000000 22.04964 
1 1 1   28    7    6 o  262.908   18.785   54.408   7.5096   54.408   7.5096   0.0000   0.0000  262.908   18.785  ?   ?  0.000000 18.78506 
1 1 1   28    7    7 o  148.362   12.959   17.163   2.9133   18.771   4.3190   15.821   3.9462  153.730   18.743  140.954   18.756 12.77615 26.51603 
1 1 1   28    7    8 o   51.085   20.879   0.8248   2.5890  -2.9702   4.0411   3.4672   3.3720   49.441   22.830   70.140   24.959 -20.69861 33.82517 
1 1 1   28    7    9 o  197.674   10.736   30.234   3.2361   31.531   4.7824   29.138   4.3951  200.666   15.696  193.051   14.991 7.614517 21.70461 
1 1 1   28    7   10 o  115.160   16.880   10.560   2.8871   12.381   4.4617   9.2488   3.7868  122.595   24.632  105.824   23.939 16.77077 34.34826 
1 1 1   28    7   11 o   78.694   17.394   5.0254   2.0394   7.4083   4.5320   4.4203   2.2836   94.892   28.733   73.693   19.816 21.19914 34.90349 
1 1 1   28    7   12 f  194.536   9.0603   29.138   2.6978   48.884   6.6947   25.310   2.9477  249.301   17.659  180.784   10.700 68.51630 20.64765 
1 1 1   28    7   13 o   83.175   18.106   5.6246   2.2396   6.2807   4.7113   5.4330   2.5457   89.098   29.585   81.433   20.452 7.664772 35.96611 
1 1 1   28    7   14 o  247.233   7.9587   47.005   3.0117   64.736   6.0264   41.102   3.4771  288.799   13.633  230.895   9.8386 57.90358 16.81237 
1 1 1   28    7   15 o   98.395   20.879   7.9288   3.0472   5.4280   5.1663   9.2629   3.7734   86.048   30.864  105.750   23.877 -19.70222 39.02225 
1 1 1   28    7   16 o  200.344   12.624   31.226   3.8514   37.760   5.8636   26.268   5.1078  218.764   17.662  181.905   18.607 36.85907 25.65456 
1 1 1   28    7   17 o  258.397   8.5811   51.407   3.3939   54.532   6.3855   50.177   4.0067  263.775   15.890  254.957   10.267 8.818558 18.91838 
1 1 1   28    7   18 o  171.957   11.257   22.965   2.9466   13.221   5.9641   26.111   3.3891  124.099   31.379  183.190   12.156 -59.09068 33.65146 
1 1 1   28    7   19 o   93.830   19.579   7.1993   2.7210   5.7238   5.9467   7.5900   3.0601   89.258   32.950   95.959   21.382 -6.701141 39.27954 
1 1 1   28    7   20 o  146.416   13.409   16.799   2.9717   23.188   6.5224   15.126   3.3384  167.365   26.331  138.146   16.089 29.21866 30.85729 
1 1 1   28    7   21 o  102.604   18.487   8.5382   2.7966  -1.2168   6.4664   10.783   3.1017   68.991   30.636  115.724   18.104 -46.73321 35.58530 
1 1 1   28    7   22 o   86.032   24.287   6.1522   3.3382   0.0000   0.0000   6.1522   3.3382  ?   ?    86.032   24.287 0.000000 24.28689 
1 1 1   28    7   23 o  186.663   12.928   27.220   3.6710   29.581   9.7531   26.830   3.9624  183.159   36.073  184.959   14.103 -1.800186 38.73139 
1 1 1   28    7   24 o  151.029   18.935   18.331   4.2810   15.163   6.9769   20.244   5.4215  130.808   34.391  157.028   23.260 -26.21954 41.51846 
1 1 1   28    7   25 o   77.850   27.780   4.5238   4.1804   10.456   9.6649   3.1585   4.6365  112.539   41.915   73.268   28.600 39.27075 50.74242 
1 1 1   28    7   26 f  187.916   11.734   27.525   3.3583   28.698   4.2406   25.552   5.4999  190.951   14.620  177.708   20.602 13.24272 25.26236 
1 1 1   28    7   27 o  141.494   9.1469   15.527   1.9704   21.733   4.0023   13.541   2.2637  165.475   16.002  131.614   11.348 33.86035 19.61704 
1 1 1   28    7   28 o  211.486   7.9351   34.477   2.5687   40.037   4.5032   31.796   3.1273  226.158   13.064  202.649   10.082 23.50946 16.50243 
1 1 1   28    7   29 o   71.622   18.499   4.2375   2.0422   4.3625   3.9866   4.1931   2.3778   75.966   27.127   71.319   20.617 4.646858 34.07240 
1 1 1   28    7   30 o  162.965   11.520   20.764   2.8551   21.963   4.5826   20.002   3.6501  164.996   18.462  158.697   15.213 6.298965 23.92263 
1 1 1   28    7   31 o  183.819   8.5549   26.111   2.4070   23.706   4.8582   26.894   2.7710  171.110   18.863  186.035   9.7655 -14.92546 21.24067 
1 1 1   28    7   32 o   84.017   18.242   5.8532   2.2787   9.1475   4.7029   4.8425   2.6049  101.781   28.860   75.958   21.458 25.82269 35.96357 
1 1 1   28    7   33 o   37.342   17.159  -1.4642   2.2441  -1.2682   4.4591  -1.5307   2.5969   55.708   25.039   40.564   18.573 15.14459 31.17496 
1 1 1   28    7   34 o   91.337   18.170   6.9276   2.4508   10.466   5.6124   6.0939   2.7243  106.766   31.896   84.669   21.098 22.09681 38.24229 
1 1 1   28    7   35 o   77.920   22.236   5.1859   2.7826   4.9621   6.4392   5.2373   3.0856   83.831   33.399   78.269   23.710 5.561317 40.95912 
1 1 1   28    7   36 o   91.063   19.516   6.9990   2.6384   4.4483   5.9773   7.6162   2.9403   80.370   32.126   94.534   20.878 -14.16410 38.31445 
1 1 1   28    7   37 o  160.152   11.119   20.184   2.7087   14.602   4.9443   22.578   3.2377  128.361   26.055  168.769   12.625 -40.40855 28.95312 
1 1 1   28    7   38 o   45.267   19.857  -0.2259   2.6391   2.2369   5.9701  -0.8240   2.9422   72.006   30.714   45.473   20.396 26.53255 36.86898 
1 1 1   28    7   39 o   97.812   19.582   8.1844   2.8294   9.9325   4.5968   7.1182   3.5900  102.884   28.304   88.612   25.246 14.27184 37.92730 
1 1 1   28    7   40 o   83.429   20.197   6.0683   2.5515  -0.1775   4.2056   9.7061   3.2096   55.614   24.701  105.864   20.549 -50.24976 32.13055 
1 1 1   28    7   41 o  148.344   13.910   17.835   3.1215   16.751   4.4186   18.916   4.4102  138.628   21.522  148.717   19.872 -10.08904 29.29289 
1 1 1   28    7   42 o   83.219   21.963   6.2295   2.8384   2.8537   4.3177   8.7987   3.7667   66.049   26.975   97.165   25.136 -31.11599 36.87129 
1 1 1   28    8    0 o  487.665   11.227  183.055   8.3700  183.055   8.3700  183.055   8.3700  487.665   11.227  487.665   11.227 0.000000 0.000000 
1 1 1   28    8    1 o  151.761   15.579   18.089   3.5676   0.0000   0.0000   18.089   3.5676  ?   ?   151.761   15.579 0.000000 15.57949 
1 1 1   28    8    2 o  132.053   10.803   13.537   2.1644   19.896   5.0870   12.132   2.3917  157.452   21.683  124.606   12.718 32.84692 25.13784 
1 1 1   28    8    3 o  265.011   16.339   54.907   6.5951   54.907   6.5951   0.0000   0.0000  265.011   16.339  ?   ?  0.000000 16.33852 
1 1 1   28    8    4 o  122.039   31.959   12.621   6.0405   12.621   6.0405   0.0000   0.0000  122.039   31.959  ?   ?  0.000000 31.95889 
1 1 1   28    8    5 o  190.047   23.832   29.101   6.7801   29.101   6.7801   0.0000   0.0000  190.047   23.832  ?   ?  0.000000 23.83203 
1 1 1   28    8    6 o   99.079   34.864   7.5217   6.5618   7.5217   6.5618   0.0000   0.0000   99.079   34.864  ?   ?  0.000000 34.86364 
1 1 1   28    8    7 o  280.513   12.234   60.850   5.2530   60.850   5.2530   0.0000   0.0000  280.513   12.234  ?   ?  0.000000 12.23446 
1 1 1   28    8    8 o   91.936   27.822   6.9163   4.2502   6.9163   4.2502   0.0000   0.0000   91.936   27.822  ?   ?  0.000000 27.82239 
1 1 1   28    8    9 o  250.563   7.2537   48.229   2.7819   48.857   5.1284   47.967   3.3114  250.707   13.413  249.681   8.6649 1.026169 15.96838 
1 1 1   28    8   10 o  103.629   13.552   8.4637   2.0981   8.4197   4.3827   8.4768   2.3897  100.478   27.634  103.238   15.610 -2.759384 31.73857 
1 1 1   28    8   11 o  244.442   7.5298   45.920   2.8173   40.789   5.2193   48.030   3.3467  228.505   15.006  249.811   8.7526 -21.30663 17.37224 
1 1 1   28    8   12 o  340.939   7.2312   89.308   3.7736  102.210   8.3252   85.972   4.2335  362.405   15.008  334.309   8.2733 28.09598 17.13757 
1 1 1   28    8   13 o  112.478   17.534   10.126   2.9202   5.8647   4.7184   12.772   3.7178   86.973   29.611  125.885   19.961 -38.91127 35.71104 
1 1 1   28    8   14 o   65.891   22.741   3.1874   2.7852   1.3581   4.8086   4.1110   3.4167   67.869   28.168   73.831   25.198 -5.962608 37.79347 
1 1 1   28    8   15 o  271.647   8.0089   56.761   3.3300   57.163   6.1802   56.596   3.9530  270.511   14.985  270.968   9.5309 -0.4573669 17.75882 
1 1 1   28    8   16 o  126.065   14.221   12.511   2.6961   17.971   5.4543   10.745   3.1016  147.795   25.002  115.687   18.110 32.10796 30.87188 
1 1 1   28    8   17 o  101.050   22.991   8.4575   3.4758   12.262   5.4666   5.8757   4.5034  119.957   29.883   86.278   28.931 33.67943 41.59358 
1 1 1   28    8   18 o  171.526   11.121   22.846   2.9039   29.881   5.9936   20.688   3.3195  193.166   20.589  162.632   13.456 30.53371 24.59587 
1 1 1   28    8   19 o   60.188   21.957   2.4240   2.6290   10.853   5.8689   0.3079   2.9405  112.385   32.362   51.233   21.693 61.15190 38.96025 
1 1 1   28    8   20 o  193.975   10.880   29.191   3.2174   28.947   6.5495   29.269   3.6938  188.787   23.151  193.812   12.519 -5.025314 26.31878 
1 1 1   28    8   21 o   68.270   22.761   3.5898   2.7875   11.223   6.2487   1.6933   3.1146  113.759   33.577   58.875   23.300 54.88366 40.86936 
1 1 1   28    8   22 o  105.123   26.378   9.3482   4.2374  -1.9849   9.8756   11.906   4.6912   82.812   37.237  118.749   26.484 -35.93784 45.69488 
1 1 1   28    8   23 o  212.200   17.432   35.708   5.6117   0.0000   0.0000   35.708   5.6117  ?   ?   212.200   17.432 0.000000 17.43167 
1 1 1   28    8   24 o  133.222   12.474   13.913   2.5141   13.403   2.8955   15.473   5.0679  130.113   14.802  136.022   25.272 -5.909546 29.28791 
1 1 1   28    8   25 f  143.442   11.791   16.080   2.5659   23.954   3.4754   6.6442   3.8044  174.887   13.078   88.960   26.183 85.92784 29.26731 
1 1 1   28    8   26 f   54.878   22.854   0.7983   3.1808  -1.8091   6.6725   1.5650   3.6184   68.069   30.608   61.075   24.789 6.993465 39.38736 
1 1 1   28    8   27 o  253.618   8.4770   49.625   3.2907   55.256   4.6183   43.818   4.6902  266.784   11.310  236.702   12.995 30.08200 17.22742 
1 1 1   28    8   28 o  120.132   22.780   12.035   4.0355   12.035   4.0355   0.0000   0.0000  120.132   22.780  ?   ?  0.000000 22.78037 
1 1 1   28    8   29 o  143.855   12.570   16.260   2.7399   24.410   4.4092   11.134   3.4970  174.920   16.670  116.221   20.402 58.69878 26.34683 
1 1 1   28    8   30 o   64.982   18.319   3.4682   1.9005   9.8301   4.3817   1.9940   2.1093  106.510   26.877   54.050   19.674 52.45985 33.30846 
1 1 1   28    8   31 o  183.897   10.883   26.386   3.0496   29.368   4.9459   24.557   3.8736  191.468   17.055  176.081   14.501 15.38641 22.38659 
1 1 1   28    8   32 o  138.619   11.144   15.061   2.3445   12.311   4.8166   15.915   2.6839  118.686   27.108  142.107   12.465 -23.42184 29.83678 
1 1 1   28    8   33 o  116.240   14.678   10.834   2.5533   8.0131   4.7657   11.970   3.0240   95.132   29.587  121.492   16.703 -26.36027 33.97659 
1 1 1   28    8   34 o  177.894   10.831   24.772   2.9350   20.065   5.2871   26.869   3.5287  154.033   23.140  184.596   12.563 -30.56331 26.33082 
1 1 1   28    8   35 o   85.075   19.993   6.1342   2.5595   10.632   5.6569   4.9765   2.8700  106.908   32.041   76.390   22.806 30.51726 39.32870 
1 1 1   28    8   36 o  126.629   14.026   12.850   2.6729   2.9690   6.4517   14.897   2.9367   76.913   32.325  136.336   14.285 -59.42298 35.34114 
1 1 1   28    8   37 o   42.072   18.671  -0.5282   2.3983   1.2794   4.6465  -1.1846   2.8001   63.686   27.129   43.169   19.580 20.51661 33.45685 
1 1 1   28    8   38 o   58.609   21.443   2.5397   2.5101  -7.4291   4.6557   6.6250   2.9804   43.310   21.172   86.883   22.299 -43.57350 30.74896 
1 1 1   28    8   39 o   51.496   21.110   1.1841   2.6565   0.3778   4.5796   1.5929   3.2612   59.583   26.147   57.001   23.381 2.581409 35.07549 
1 1 1   28    8   40 o  190.316   10.432   28.562   3.0273   13.125   5.6614   34.744   3.5826  115.127   31.303  209.485   11.214 -94.35860 33.25077 
1 1 1   28    8   41 o   40.344   18.815  -2.0367   2.8506   5.6605   5.0565  -5.6227   3.4513   79.626   30.177   37.235   18.208 42.39193 35.24456 
1 1 1   28    9    0 o  382.849   10.465  112.845   6.1222  112.845   6.1222  112.845   6.1222  382.849   10.465  382.849   10.465 0.000000 0.000000 
1 1 1   28    9    1 o  227.027   8.2892   39.631   2.8805   41.223   4.8899   38.785   3.5645  230.152   13.947  224.293   10.383 5.859116 17.38724 
1 1 1   28    9    3 f  172.811   20.975   23.858   5.4343   23.858   5.4343   0.0000   0.0000  172.811   20.975  ?   ?  0.000000 20.97480 
1 1 1   28    9    4 o  341.535   14.557   90.587   7.6096   90.587   7.6096   0.0000   0.0000  341.535   14.557  ?   ?  0.000000 14.55655 
1 1 1   28    9    5 o  268.182   17.349   56.422   7.0836   56.422   7.0836   0.0000   0.0000  268.182   17.349  ?   ?  0.000000 17.34949 
1 1 1   28    9    6 o   92.332   34.043   6.0131   6.3442   6.0131   6.3442   0.0000   0.0000   92.332   34.043  ?   ?  0.000000 34.04345 
1 1 1   28    9    7 o  170.823   10.282   22.580   2.6760   26.875   4.5260   20.273   3.3180  185.013   16.144  161.147   13.579 23.86552 21.09527 
1 1 1   28    9    8 o   81.645   19.096   5.4376   2.3439   5.8032   4.2095   5.2733   2.8218   85.629   27.943   80.327   22.208 5.301331 35.69294 
1 1 1   28    9    9 o  109.423   18.648   9.6375   3.0112   0.0000   0.0000   9.6375   3.0112  ?   ?   109.423   18.648 0.000000 18.64766 
1 1 1   28    9   10 o  148.689   12.245   17.220   2.7619   21.651   4.7427   14.946   3.3975  164.960   19.139  137.449   16.478 27.51129 25.25510 
1 1 1   28    9   11 o   83.427   16.830   5.6251   2.0750   10.850   4.5717   4.2694   2.3286  113.943   26.683   72.503   20.221 41.44009 33.47888 
1 1 1   28    9   12 o  381.055   8.8010  111.781   5.1332  115.951   8.8201  109.645   6.3123  385.980   14.929  376.794   10.945 9.185944 18.51160 
1 1 1   28    9   13 o   42.353   18.084   0.0205   2.0735   2.2982   4.7695  -0.5103   2.3024   71.185   28.612   42.147   18.516 29.03857 34.08039 
1 1 1   28    9   14 o  300.230   7.5204   69.293   3.4559   82.995   6.4085   63.674   4.1038  327.198   12.796  287.455   9.3271 39.74295 15.83464 
1 1 1   28    9   15 o   96.274   17.987   7.4972   2.5530   6.5120   5.2087   7.8088   2.9290   91.050   31.111   97.726   20.247 -6.675919 37.11945 
1 1 1   28    9   16 o   71.284   20.859   4.1123   2.4208   9.3540   5.0732   2.5669   2.7546  105.140   30.031   61.780   22.484 43.36004 37.51575 
1 1 1   28    9   17 o   54.570   22.789   0.6577   3.1754   3.9468   5.1824  -1.3195   4.0180   79.432   30.443   53.654   23.966 25.77789 38.74462 
1 1 1   28    9   18 o   59.875   22.420   2.2410   2.7726   3.5256   9.2943   2.1155   2.9048   93.289   38.976   59.919   22.833 33.36933 45.17162 
1 1 1   28    9   19 o  201.823   10.802   31.584   3.3247   44.696   10.271   30.050   3.5138  231.312   29.697  196.614   11.729 34.69801 31.92938 
1 1 1   28    9   20 o  158.933   17.616   20.101   4.2133   15.736   10.079   21.025   4.6379  131.797   43.249  162.074   19.060 -30.27733 47.26257 
1 1 1   28    9   21 o  152.389   18.308   18.568   4.1848   9.5810   10.407   20.301   4.5706  112.023   43.093  159.122   19.150 -47.09888 47.15620 
1 1 1   28    9   22 o  174.319   15.372   23.960   4.0594   30.741   6.7006   20.028   5.1023  194.366   22.967  156.888   21.840 37.47758 31.69322 
1 1 1   28    9   23 f   69.144   24.007   3.5799   3.1063   11.652   8.5532   2.3536   3.3339  115.700   39.856   63.337   24.383 52.36272 46.72238 
1 1 1   28    9   24 o  202.988   7.9788   31.742   2.4790   37.113   3.1546   23.071   4.0086  219.209   9.4019  170.862   15.496 48.34712 18.12534 
1 1 1   28    9   25 o  201.461   8.7484   31.316   2.6977   35.382   3.5470   25.737   4.1548  213.396   10.896  180.583   15.172 32.81270 18.67925 
1 1 1   28    9   26 o  145.237   15.649   16.755   3.4239   18.131   7.2742   16.364   3.8807  142.703   33.820  142.614   18.192 0.8847046E-01 38.40224 
1 1 1   28    9   27 o   43.886   20.034  -1.6993   2.9916  -3.7880   3.6924   2.2917   5.1040   44.149   20.848   71.689   29.309 -27.53929 35.96753 
1 1 1   28    9   28 o   69.680   26.464   3.1726   3.8939   3.1726   3.8939   0.0000   0.0000   69.680   26.464  ?   ?  0.000000 26.46376 
1 1 1   28    9   29 o   39.093   18.157  -2.0866   2.6120  -2.9229   4.4310  -1.6413   3.2335   51.607   23.857   46.021   20.938 5.585587 31.74186 
1 1 1   28    9   30 o   82.737   21.612   5.7621   2.7668   3.4502   4.5783   7.0923   3.4727   73.429   28.487   91.116   24.409 -17.68728 37.51427 
1 1 1   28    9   31 f   80.004   22.936   5.4076   2.9539   3.8084   4.6754   6.4699   3.8107   75.083   28.883   86.923   26.354 -11.83952 39.09901 
1 1 1   28    9   32 o  148.604   15.699   17.690   3.5168   21.326   5.0105   14.158   4.9374  160.748   20.856  127.882   26.107 32.86552 33.41489 
1 1 1   28    9   33 o  146.699   14.003   17.121   3.1060   19.145   5.0257   15.871   3.9509  151.008   22.424  138.980   19.076 12.02797 29.44049 
1 1 1   28    9   34 o  196.444   8.8615   29.923   2.6645   27.884   5.2956   30.614   3.0832  184.561   19.018  198.032   10.206 -13.47050 21.58403 
1 1 1   28    9   35 o   75.105   20.728   4.7963   2.4607  -1.1795   5.8864   6.0617   2.7088   63.486   28.629   84.191   21.070 -20.70511 35.54699 
1 1 1   28    9   36 o  122.415   14.141   12.038   2.6008   8.0155   6.5038   12.804   2.8376   94.291   34.514  125.924   15.019 -31.63245 37.63963 
1 1 1   28    9   37 o   45.840   19.386   0.4367   2.3438   1.8916   4.7257  -0.0379   2.6992   65.983   27.695   46.565   20.262 19.41846 34.31554 
1 1 1   28    9   38 o   45.729   19.581   0.2791   2.4433  -2.6000   4.6439   1.3811   2.8731   52.198   24.233   53.962   22.018 -1.763367 32.74173 
1 1 1   28    9   39 o   92.846   19.741   7.4346   2.7191   2.9904   4.4933   10.002   3.4155   68.176   27.641  107.004   21.598 -38.82755 35.07834 
1 1 1   28    9   40 o   73.777   22.795   4.8258   2.8340   10.343   5.0107   2.2307   3.4365  102.725   29.996   60.370   24.279 42.35420 38.59043 
1 1 1   28    9   41 o   43.399   19.224  -0.3279   2.5307   2.7531   4.3448  -1.9099   3.1133   65.891   27.002   42.794   19.858 23.09649 33.51801 
1 1 1   28   10    0 o  283.945   10.372   62.182   4.4943   62.182   4.4943   62.182   4.4943  283.945   10.372  283.945   10.372 0.000000 0.000000 
1 1 1   28   10    1 o  141.376   9.8160   15.473   2.1110   14.437   3.8037   15.934   2.5376  134.422   19.018  143.141   11.684 -8.719162 22.32023 
1 1 1   28   10    3 o  183.733   18.116   26.672   5.0283   26.672   5.0283   0.0000   0.0000  183.733   18.116  ?   ?  0.000000 18.11552 
1 1 1   28   10    4 f  213.976   18.089   36.093   5.8689   36.093   5.8689   0.0000   0.0000  213.976   18.089  ?   ?  0.000000 18.08878 
1 1 1   28   10    5 o  208.654   9.4414   33.532   3.0153   34.672   6.1195   33.166   3.4652  209.246   19.325  206.999   10.976 2.246719 22.22463 
1 1 1   28   10    6 o  124.534   32.504   13.233   6.2620   13.233   6.2620   0.0000   0.0000  124.534   32.504  ?   ?  0.000000 32.50438 
1 1 1   28   10    7 o   55.927   20.838   1.9343   2.3891   14.183   6.4121  -0.0403   2.5745  128.857   32.512   46.794   20.070 82.06323 38.20732 
1 1 1   28   10    8 o  118.784   15.602   11.169   2.7681   11.049   7.1275   11.190   3.0039  114.421   36.270  118.527   17.048 -4.105545 40.07685 
1 1 1   28   10    9 o  180.907   11.931   25.418   3.2852   33.731   8.0074   23.736   3.6024  203.328   26.349  174.405   13.602 28.92303 29.65242 
1 1 1   28   10   10 o  237.625   10.298   43.559   3.7455   61.392   8.8250   39.642   4.1365  277.982   20.894  226.060   11.998 51.92215 24.09338 
1 1 1   28   10   11 o   79.464   22.128   5.1649   2.7910   11.539   7.2020   4.0385   3.0275  116.362   36.402   72.212   23.704 44.14967 43.43924 
1 1 1   28   10   12 o  354.316   8.4918   96.616   4.6053   0.0000   0.0000   96.616   4.6053  ?   ?   354.316   8.4918 0.000000 8.491821 
1 1 1   28   10   13 o  179.958   10.655   25.093   2.9219   35.425   9.1350   23.915   3.0839  206.347   29.785  175.481   11.546 30.86652 31.94469 
1 1 1   28   10   14 o  108.138   17.177   9.3717   2.7481   21.440   8.8320   8.0782   2.8916  155.977   37.464   99.580   19.669 56.39754 42.31304 
1 1 1   28   10   15 o  181.293   11.324   25.517   3.1265   32.423   9.7078   24.717   3.3024  194.764   33.789  178.221   12.179 16.54346 35.91727 
1 1 1   28   10   16 o  231.308   9.1592   41.237   3.2428   49.521   6.5671   38.566   3.7291  250.709   17.218  223.362   10.908 27.34656 20.38200 
1 1 1   28   10   17 o  205.844   12.618   32.991   3.9564   29.844   5.7915   35.745   5.4176  193.300   19.857  212.940   16.757 -19.63998 25.98238 
1 1 1   28   10   18 o   44.195   19.560  -0.7148   2.6148   5.4987   5.3944  -2.6231   2.9895   86.592   31.472   41.334   19.274 45.25823 36.90507 
1 1 1   28   10   19 o  135.633   17.867   14.713   3.6191   16.485   5.8724   13.628   4.5955  139.590   28.450  128.212   24.307 11.37854 37.41953 
1 1 1   28   10   20 o  149.131   17.052   17.689   3.8223   13.964   6.1856   19.990   4.8616  126.845   31.893  157.320   20.691 -30.47414 38.01704 
1 1 1   28   10   21 f  180.516   11.855   25.380   3.2574   31.670   6.9568   23.613   3.6865  197.079   23.527  173.493   14.001 23.58614 27.37836 
1 1 1   28   10   22 o  194.383   11.518   29.397   3.4116   29.584   6.8812   29.336   3.9285  189.895   24.226  193.646   13.335 -3.751740 27.65412 
1 1 1   28   10   23 o  121.122   18.903   11.882   3.3901   7.7655   9.2440   12.521   3.6440  103.631   40.402  124.070   19.858 -20.43851 45.01855 
1 1 1   28   10   24 f  164.357   14.244   21.263   3.5479   12.466   7.2106   24.074   4.0754  118.225   36.332  174.555   15.412 -56.33012 39.46563 
1 1 1   28   10   25 o   35.254   16.464  -1.9932   2.1948   1.6417   2.7744  -8.0720   3.5879   56.204   22.070   35.455   17.570 20.74862 28.20994 
1 1 1   28   10   26 o   48.405   20.843  -0.0129   2.7968   2.3879   3.2953  -6.1956   5.2883   63.083   24.252   50.847   24.278 12.23522 34.31632 
1 1 1   28   10   27 o  130.161   16.487   13.569   3.2111   19.486   3.9627   2.2541   5.4798  156.174   16.844   73.194   30.198 82.98060 34.57786 
1 1 1   28   10   28 o   60.769   24.112   1.9045   3.3435   5.1182   4.2172  -3.5341   5.4860   80.425   27.970   57.146   26.462 23.27901 38.50381 
1 1 1   28   10   29 o   62.308   23.465   2.5337   3.0456   2.5474   4.5526   2.5226   4.0976   69.666   27.970   67.415   26.710 2.250854 38.67525 
1 1 1   28   10   30 o   44.228   20.325  -1.9630   3.1491  -4.5074   4.7164   0.0838   4.2302   49.882   23.557   58.667   25.446 -8.784351 34.67605 
1 1 1   28   10   31 o  181.088   11.529   25.675   3.1789   26.809   5.0883   24.949   4.0713  181.907   18.534  177.054   15.169 4.852509 23.95032 
1 1 1   28   10   32 o   93.534   21.332   7.4126   2.9863   2.1584   4.7554   10.834   3.8373   68.431   28.170  112.796   23.005 -44.36563 36.37019 
1 1 1   28   10   33 o  168.368   12.326   22.342   3.1545   20.726   5.1457   23.315   3.9928  157.339   21.966  170.631   15.456 -13.29239 26.85821 
1 1 1   28   10   34 o  142.749   15.721   16.425   3.3780   6.1889   6.3927   20.390   3.9788   88.014   33.793  158.763   16.620 -70.74980 37.65859 
1 1 1   28   10   35 o  115.393   18.343   11.024   3.1314   13.361   5.1763   9.6750   3.9327  121.609   28.334  104.884   24.874 16.72431 37.70335 
1 1 1   28   10   36 o   46.402   21.131  -1.4579   3.3033   2.5391   6.4277  -2.8924   3.8507   75.088   31.945   46.602   21.778 28.48562 38.66227 
1 1 1   28   10   37 o   81.940   25.233   5.9633   3.4760   3.1531   6.7686   6.9699   4.0510   77.215   32.814   87.643   27.282 -10.42793 42.67379 
1 1 1   28   10   38 o   41.911   18.754  -0.6685   2.4718   1.8505   5.2056  -1.4018   2.8087   67.171   28.667   42.231   19.329 24.94027 34.57413 
1 1 1   28   10   39 o  111.238   17.128   10.340   2.8227   6.5829   5.1754   11.931   3.3677   84.540   30.812  118.411   19.242 -33.87166 36.32630 
1 1 1   28   10   40 o   71.827   22.076   4.5544   2.6620   4.2238   4.4272   4.7416   3.3315   72.475   28.042   73.251   24.882 -0.7759781 37.48983 
1 1 1   28   11    0 o   42.372   24.644   1.7261   2.6315   1.7261   2.6315   1.7261   2.6315   42.372   24.644   42.372   24.644 0.000000 0.000000 
1 1 1   28   11    1 o  262.482   7.1566   52.923   2.8753   54.230   4.5826   52.074   3.6925  264.976   11.299  260.044   9.2770 4.931702 14.61937 
1 1 1   28   11    3 o  249.978   7.9983   48.046   3.0603   48.178   5.3124   47.980   3.7440  248.758   14.009  249.518   9.8031 -0.7599487 17.09856 
1 1 1   28   11    4 o  255.456   8.3474   50.196   3.2639   59.867   6.0316   46.192   3.8813  277.289   14.259  244.720   10.362 32.56879 17.62668 
1 1 1   28   11    5 o   87.372   17.565   6.1762   2.2676  -1.4795   5.0595   8.1006   2.5366   60.562   26.984  100.498   17.103 -39.93556 31.94757 
1 1 1   28   11    6 o   32.017   15.373  -3.1203   2.1857  -5.1641   5.3283  -2.7068   2.3966   53.721   25.268   35.408   16.743 18.31310 30.31212 
1 1 1   28   11    7 o  119.160   13.278   11.140   2.3806   12.715   4.1407   10.362   2.9095  124.852   22.495  113.918   17.224 10.93422 28.33155 
1 1 1   28   11    8 o  251.165   8.6545   48.551   3.3272   50.622   5.1313   47.049   4.3704  255.199   13.182  246.705   11.574 8.493866 17.54148 
1 1 1   28   11    9 o  222.741   9.7361   38.244   3.3194   38.962   5.3591   37.797   4.2280  222.995   15.803  220.564   12.576 2.430740 20.19647 
1 1 1   28   11   10 o  210.573   9.9832   34.195   3.2177   39.104   5.2267   31.199   4.0831  223.519   15.371  200.096   13.409 23.42310 20.39776 
1 1 1   28   11   11 o   65.097   22.125   3.1598   2.6341   1.7155   4.5556   3.8851   3.2285   67.759   27.695   71.845   24.494 -4.086029 36.97231 
1 1 1   28   11   12 o   84.098   22.363   5.8267   2.9285   8.6860   6.1657   4.9938   3.3278  102.759   33.832   78.917   24.753 23.84241 41.92068 
1 1 1   28   11   13 o  171.327   12.725   22.881   3.3132   24.371   5.3386   21.948   4.2254  174.459   20.376  166.656   16.793 7.803391 26.40470 
1 1 1   28   11   14 o  166.155   11.123   21.438   2.8126   26.476   5.5176   19.669   3.2692  181.962   20.149  158.544   13.603 23.41788 24.31103 
1 1 1   28   11   15 o   43.621   19.120  -0.4701   2.4429  -5.0616   5.0811   0.9104   2.7861   52.069   24.547   52.854   21.637 -0.7847214 32.72180 
1 1 1   28   11   16 o  231.801   9.3495   41.432   3.3172   55.090   6.1307   35.778   3.9445  265.269   15.162  214.546   12.061 50.72273 19.37387 
1 1 1   28   11   17 o   90.878   31.784   6.4294   5.4496   6.4294   5.4496   0.0000   0.0000   90.878   31.784  ?   ?  0.000000 31.78412 
1 1 1   28   11   18 o  165.484   15.218   21.566   3.8115   24.070   5.8822   19.755   5.0041  172.003   22.912  156.146   21.508 15.85706 31.42587 
1 1 1   28   11   19 o  101.530   18.989   8.3924   2.8425   14.618   5.9352   6.5395   3.2380  130.439   30.306   88.603   23.493 41.83550 38.34543 
1 1 1   28   11   20 o  105.011   18.655   8.9542   2.8886   10.127   6.1757   8.6257   3.2682  108.457   33.673  102.162   21.577 6.295097 39.99234 
1 1 1   28   11   21 f  161.820   13.063   20.503   3.2079   27.217   6.8100   18.588   3.6367  181.599   25.177  153.243   15.727 28.35616 29.68574 
1 1 1   28   11   22 o   73.326   23.440   4.3054   2.9719   1.3413   6.7947   5.0066   3.3048   76.938   32.791   78.465   24.677 -1.526611 41.03899 
1 1 1   28   11   23 o  242.847   11.014   45.707   4.0939   51.717   10.311   44.582   4.4605  249.143   27.497  239.197   12.224 9.946167 30.09152 
1 1 1   28   11   24 o   86.576   23.818   6.2856   3.2552   24.905   7.4127   1.8372   3.6232  170.814   29.413   62.335   24.979 108.4790 38.58841 
1 1 1   28   11   25 o   92.289   19.305   7.0180   2.6394   7.0253   2.9844   6.9919   5.6549   91.733   21.611   92.786   32.382 -1.052719 38.93054 
1 1 1   28   11   26 o   95.404   20.686   7.5622   2.9338   11.085   3.4933  -0.8695   5.4044  116.119   20.399   63.306   28.064 52.81360 34.69450 
1 1 1   28   11   27 o   49.609   22.270  -1.2361   3.5157  -2.2852   7.6954  -0.9593   3.9523   71.607   32.471   53.707   23.895 17.89996 40.31571 
1 1 1   28   11   28 o   60.192   24.370   1.6134   3.4876   0.0341   4.3592   4.4225   5.8137   59.496   25.818   81.960   32.016 -22.46392 41.12943 
1 1 1   28   11   29 o   54.548   22.556   0.9794   3.0670  -1.8207   4.6302   3.1685   4.0940   55.623   25.209   70.176   27.018 -14.55375 36.95221 
1 1 1   28   11   30 o   80.831   22.780   5.5286   2.9394   10.403   4.9420   2.8603   3.6565  108.306   29.162   66.646   25.565 41.65984 38.78148 
1 1 1   28   11   31 f  145.133   13.560   16.694   2.9774   14.055   4.8718   18.266   3.7616  127.515   25.846  150.633   16.590 -23.11827 30.71208 
1 1 1   28   11   32 o  114.939   17.573   10.811   2.9934   6.5989   4.7909   13.509   3.8339   87.690   29.838  127.453   20.336 -39.76299 36.10922 
1 1 1   28   11   33 o   55.801   22.547   1.4686   2.9790  -1.2954   4.8923   3.0973   3.7555   57.977   26.127   67.642   25.918 -9.664474 36.80107 
1 1 1   28   11   34 o   51.725   22.308   0.2046   3.2140  -1.8509   6.4140   0.8938   3.7140   64.581   29.424   57.671   24.397 6.910534 38.22259 
1 1 1   28   11   35 o   47.319   21.091  -0.7054   3.0941  -2.5636   5.1833   0.3233   3.8566   56.159   25.905   56.234   24.343 -0.7529831E-01 35.54823 
1 1 1   28   11   36 o   69.611   23.928   3.9924   3.0821  -1.5464   4.6687   8.2713   4.1034   55.273   25.152   95.419   26.924 -40.14550 36.84462 
1 1 1   28   11   37 o   69.796   25.977   3.8111   3.7108  -5.6121   8.5741   5.9830   4.1163   65.838   31.289   81.879   27.659 -16.04109 41.76118 
1 1 1   28   11   38 o  181.377   12.166   26.173   3.3581   19.548   4.7446   32.823   4.7535  150.982   21.108  200.833   15.585 -49.85114 26.23854 
1 1 1   28   11   39 o   40.480   19.655  -5.4396   3.8276  -5.7565   4.4872  -4.5929   7.3344   44.455   21.513   61.314   29.080 -16.85833 36.17294 
1 1 1   28   11   40 o  140.891   15.338   16.311   3.2542   18.200   4.7471   14.637   4.4697  143.803   22.289  127.600   23.760 16.20292 32.57762 
1 1 1   28   12    0 o  316.888   10.096   77.373   4.8859   77.373   4.8859   77.373   4.8859  316.888   10.096  316.888   10.096 0.000000 0.000000 
1 1 1   28   12    1 o  155.927   6.9295   18.673   1.6539   21.713   3.6299   17.877   1.8579  166.579   14.377  152.270   7.9995 14.30861 16.45290 
1 1 1   28   12    2 o  114.441   13.588   10.296   2.3336   0.0000   0.0000   10.296   2.3336  ?   ?   114.441   13.588 0.000000 13.58790 
1 1 1   28   12    3 o   76.640   17.448   4.7730   2.0009   0.2612   3.8463   6.4469   2.3428   57.927   24.679   89.255   17.774 -31.32788 30.41334 
1 1 1   28   12    4 o  103.971   14.282   8.5478   2.2128   18.710   4.7005   5.6545   2.5081  152.706   20.639   83.122   19.964 69.58383 28.71445 
1 1 1   28   12    5 o  225.038   16.493   39.745   5.6414   39.745   5.6414   0.0000   0.0000  225.038   16.493  ?   ?  0.000000 16.49304 
1 1 1   28   12    6 o  254.946   9.1705   50.059   3.5786   53.618   6.3754   48.423   4.3240  261.711   15.992  250.337   11.285 11.37387 19.57275 
1 1 1   28   12    7 o  136.685   12.656   14.591   2.6177   14.970   4.2637   14.362   3.3162  136.122   21.150  134.678   16.428 1.443481 26.78074 
1 1 1   28   12    8 o  239.515   9.0149   44.179   3.3050   46.099   5.1049   42.794   4.3364  243.284   13.765  234.843   12.105 8.441071 18.33068 
1 1 1   28   12    9 o   72.016   21.850   4.1586   2.6189   3.0091   4.5220   4.7387   3.2125   72.857   28.298   77.110   24.340 -4.253067 37.32623 
1 1 1   28   12   10 o  131.297   14.602   13.573   2.8847   16.126   4.8975   12.216   3.5697  140.411   23.627  123.094   19.604 17.31670 30.70090 
1 1 1   28   12   11 o   59.714   22.682   2.1092   2.8609   2.1870   4.7161   2.0640   3.5986   70.376   28.393   63.769   25.106 6.606747 37.90055 
1 1 1   28   12   12 o  288.090   10.557   64.099   4.6553   64.385   8.1535   63.961   5.6703  285.386   18.770  287.138   12.902 -1.751648 22.77681 
1 1 1   28   12   13 o   51.274   21.834   0.1814   3.0081  -3.2461   4.9141   2.2353   3.8040   54.883   25.284   65.659   25.824 -10.77558 36.14061 
1 1 1   28   12   14 o  103.085   22.025   8.7604   3.3697   12.719   5.3017   6.0771   4.3647  122.451   28.774   87.007   28.457 35.44415 40.46867 
1 1 1   28   12   15 o   55.350   23.091   0.7102   3.2556   9.2903   5.4668  -4.0046   4.0525  104.691   31.526   46.802   22.021 57.88910 38.45503 
1 1 1   28   12   16 o  183.350   21.007   27.038   5.7890   27.038   5.7890   0.0000   0.0000  183.350   21.007  ?   ?  0.000000 21.00696 
1 1 1   28   12   17 o  244.530   11.295   46.292   4.2274   56.317   6.4557   38.766   5.5934  267.807   15.819  221.732   16.601 46.07463 22.93141 
1 1 1   28   12   18 o  157.939   12.367   19.475   2.9659   19.225   6.1066   19.552   3.3930  151.430   27.353  157.762   14.203 -6.332031 30.82056 
1 1 1   28   12   19 o   94.188   20.254   7.3026   2.8332   5.4246   5.7895   7.8940   3.2488   87.147   32.444   97.478   22.263 -10.33138 39.34759 
1 1 1   28   12   20 o   95.477   20.770   7.5288   2.9489   1.3087   6.0354   9.4795   3.3799   73.437   31.086  107.228   21.344 -33.79103 37.70765 
1 1 1   28   12   21 o  137.128   15.438   14.909   3.1839   14.624   6.5565   14.996   3.6421  128.916   33.067  136.767   17.822 -7.851257 37.56391 
1 1 1   28   12   22 o  101.493   21.252   8.5278   3.1956   15.115   6.8168   6.6724   3.6178  130.580   33.832   89.130   25.326 41.44921 42.26168 
1 1 1   28   12   23 o  149.050   16.789   17.714   3.7635   12.244   9.5304   18.724   4.0965  117.891   41.959  152.906   17.839 -35.01468 45.59326 
1 1 1   28   12   24 o  231.744   14.870   42.264   5.2466   47.555   7.7499   37.788   7.1286  242.612   21.079  215.635   21.902 26.97635 30.39790 
1 1 1   28   12   25 o  137.109   13.611   14.825   2.8187   17.620   3.2072   5.3411   5.9083  149.400   14.196   86.322   32.643 63.07719 35.59577 
1 1 1   28   12   26 o   98.908   18.866   8.0336   2.7519   7.7288   3.7443   8.3917   4.0581   95.208   25.273   98.913   26.336 -3.704712 36.50048 
1 1 1   28   12   27 o  281.249   10.569   61.380   4.5500   71.487   8.9884   57.899   5.2759  297.849   19.829  272.345   12.656 25.50388 23.52416 
1 1 1   28   12   28 o  124.002   20.360   12.672   3.7302   11.299   4.7513   14.880   6.0225  113.928   27.549  129.384   30.846 -15.45621 41.35711 
1 1 1   28   12   29 o   51.510   22.253   0.0310   3.2094   2.5530   4.8148  -1.9856   4.3054   70.617   28.619   52.928   24.111 17.68929 37.42170 
1 1 1   28   12   30 o  234.183   10.570   42.656   3.7889   40.422   5.3180   44.958   5.3995  225.422   15.507  238.131   14.889 -12.70938 21.49750 
1 1 1   28   12   31 o  114.984   17.339   10.790   2.9567   8.3213   4.8013   12.298   3.7527   96.700   29.636  121.289   20.973 -24.58946 36.30600 
1 1 1   28   12   32 o   89.798   22.321   6.9152   3.0547  -0.5250   4.8987   11.649   3.9075   60.207   26.704  116.980   22.642 -56.77255 35.01040 
1 1 1   28   12   33 o  149.789   14.119   17.899   3.1988   21.079   5.2436   16.014   4.0370  158.209   22.270  139.101   19.497 19.10881 29.59830 
1 1 1   28   12   34 o   57.961   23.442   1.6640   3.2235   10.202   6.0837  -1.6684   3.8008  103.935   33.569   49.629   22.626 54.30561 40.48245 
1 1 1   28   12   35 o  121.996   18.450   12.363   3.3376   7.6545   5.5621   15.012   4.1722   91.739   32.109  133.095   21.191 -41.35652 38.47137 
1 1 1   28   12   36 o  125.882   17.578   13.122   3.2945   7.3724   5.1592   17.081   4.2811   89.541   30.948  142.259   20.231 -52.71812 36.97360 
1 1 1   28   12   37 o  121.494   20.273   12.603   3.6371   17.293   6.7002   10.643   4.3308  132.189   33.169  107.659   26.467 24.52982 42.43457 
1 1 1   28   12   38 o   93.913   24.309   8.0077   3.5215   10.281   4.6305   4.8892   5.4234  104.001   28.323   77.949   30.778 26.05232 41.82713 
1 1 1   28   12   39 o  108.396   22.093   10.402   3.5411   9.0298   4.6682   12.263   5.4344   96.428   29.153  111.086   30.858 -14.65762 42.45166 
1 1 1   28   13    0 o   20.847   14.218  -0.8324   1.4054  -0.8324   1.4054  -0.8324   1.4054   20.847   14.218   20.847   14.218 0.000000 0.000000 
1 1 1   28   13    1 o   46.974   17.243   1.3981   1.6249  -0.2415   2.9491   2.1129   1.9471   49.145   21.281   54.543   19.003 -5.397362 28.53074 
1 1 1   28   13    2 o  211.493   8.0500   34.400   2.6059   34.588   4.3552   34.296   3.2524  210.701   13.577  210.879   10.076 -0.1785278 16.90711 
1 1 1   28   13    3 o   39.237   17.131  -0.3424   1.9438   6.3999   3.8423  -2.6616   2.2535   88.351   26.390   34.008   16.127 54.34304 30.92725 
1 1 1   28   13    4 o   55.781   20.200   2.0741   2.2193   9.6751   4.2798  -0.7216   2.5956  107.597   26.226   44.094   19.503 63.50266 32.68270 
1 1 1   28   13    5 o   91.747   28.866   6.8639   4.5214   6.8639   4.5214   0.0000   0.0000   91.747   28.866  ?   ?  0.000000 28.86573 
1 1 1   28   13    6 o  131.448   14.067   13.573   2.7863   20.941   5.0837   10.409   3.3311  161.425   21.078  113.363   19.925 48.06198 29.00503 
1 1 1   28   13    7 o   68.707   21.808   3.7106   2.5761   7.6587   4.0055   0.9257   3.3641   95.863   26.440   57.166   23.629 38.69740 35.46031 
1 1 1   28   13    8 o  315.855   8.3776   76.779   4.0502   86.140   5.8613   68.225   5.6032  333.743   11.474  296.775   12.335 36.96744 16.84641 
1 1 1   28   13    9 o  206.885   10.508   33.131   3.3167   39.370   5.1842   28.809   4.3153  224.241   15.194  191.783   14.815 32.45758 21.22145 
1 1 1   28   13   10 o   94.390   20.842   7.3175   2.9306   11.830   4.7845   4.6079   3.7076  118.712   26.948   77.478   26.249 41.23384 37.61913 
1 1 1   28   13   11 o  111.589   18.733   10.049   3.0863   13.931   5.0824   7.7806   3.8845  129.118   26.602   96.496   25.801 32.62250 37.05880 
1 1 1   28   13   12 o  247.686   11.879   47.508   4.5034   70.050   8.6282   39.068   5.2796  297.483   19.049  223.170   15.553 74.31331 24.59227 
1 1 1   28   13   13 f  131.713   17.025   13.813   3.3519   19.823   5.3457   9.9198   4.3028  155.970   23.090  108.665   26.180 47.30459 34.90727 
1 1 1   28   13   14 o  114.573   20.776   10.711   3.5092   15.207   5.2391   7.0530   4.7260  134.958   26.308   92.648   29.552 42.31013 39.56535 
1 1 1   28   13   15 o  140.163   17.844   15.687   3.7415   14.357   5.5701   16.781   5.0506  130.032   28.750  142.818   23.952 -12.78546 37.41994 
1 1 1   28   13   16 o  157.318   25.027   20.422   5.8245   20.422   5.8245   0.0000   0.0000  157.318   25.027  ?   ?  0.000000 25.02695 
1 1 1   28   13   17 o  117.852   16.418   11.088   2.8812   17.741   5.5585   8.6438   3.3692  145.997   25.818  102.154   22.183 43.84281 34.03926 
1 1 1   28   13   18 o  130.072   15.212   13.402   2.9713   16.257   5.6289   12.298   3.4985  138.807   27.466  123.320   19.156 15.48634 33.48637 
1 1 1   28   13   19 o  123.005   16.708   12.094   3.0643   10.683   5.8645   12.625   3.5939  110.951   32.466  124.826   19.443 -13.87480 37.84322 
1 1 1   28   13   20 o   76.229   23.236   4.7427   2.9567   6.2893   5.9741   4.2410   3.4026   90.943   33.110   74.028   25.146 16.91464 41.57665 
1 1 1   28   13   21 o   74.038   23.485   4.4142   2.9879   3.2338   6.2396   4.7654   3.4035   80.272   32.563   77.113   25.124 3.158150 41.12835 
1 1 1   28   13   22 o   82.791   24.241   5.7042   3.2685   2.2673   6.4031   6.9153   3.8011   77.726   32.402   90.560   26.035 -12.83385 41.56542 
1 1 1   28   13   23 o  237.716   15.792   44.610   5.7134   52.554   9.9291   40.677   6.9858  251.718   26.152  224.587   20.550 27.13132 33.26012 
1 1 1   28   13   24 f  111.268   22.126   10.301   3.6356   11.750   7.2969   9.8223   4.1930  114.594   36.738  107.325   25.835 7.269035 44.91292 
1 1 1   28   13   25 o  159.940   11.462   19.978   2.7874   25.367   3.6884   12.803   4.2562  179.654   13.512  123.725   23.330 55.92961 26.96075 
1 1 1   28   13   26 o  180.413   11.284   25.395   3.1003   27.889   4.3385   22.793   4.4320  187.661   15.236  168.650   17.420 19.01082 23.14250 
1 1 1   28   13   27 o   48.046   21.866  -1.7462   3.5294  -6.6185   7.6006  -0.4068   3.9852   63.001   29.799   55.575   24.389 7.426006 38.50743 
1 1 1   28   13   28 o   72.391   25.574   4.0268   3.5341   4.4170   4.5719   3.4475   5.5708   77.574   28.841   77.125   30.949 0.4497986 42.30406 
1 1 1   28   13   29 o  130.691   16.619   13.778   3.2492   14.100   4.8032   13.507   4.4119  128.174   25.381  126.222   23.707 1.952202 34.73034 
1 1 1   28   13   30 o   93.227   23.314   7.4626   3.3182   8.3268   4.7179   6.6167   4.6677   96.882   29.312   87.902   29.454 8.980141 41.55418 
1 1 1   28   13   31 o   67.830   23.056   3.6675   2.8605   1.1756   4.7198   5.1142   3.5963   64.579   27.421   78.166   25.843 -13.58633 37.68040 
1 1 1   28   13   32 o  137.617   14.632   15.166   3.0347   15.810   4.9245   14.772   3.8534  135.405   24.669  133.629   19.407 1.775497 31.38817 
1 1 1   28   13   33 o  142.874   15.235   16.425   3.2804   18.423   5.6697   15.419   4.0220  144.811   26.558  136.120   19.891 8.690430 33.18105 
1 1 1   28   13   34 o   93.298   23.671   7.6323   3.3857   17.016   6.5627   4.2291   3.9522  134.202   32.332   73.344   26.896 60.85848 42.05616 
1 1 1   28   13   35 o  109.523   19.582   10.136   3.1622   4.1663   4.6224   15.388   4.3354   74.421   28.693  134.073   21.881 -59.65234 36.08445 
1 1 1   28   13   36 o  122.349   17.212   12.403   3.1342   15.462   4.5662   9.6774   4.3098  132.983   23.281  102.422   27.079 30.56154 35.71094 
1 1 1   28   13   37 o   73.283   27.313   4.4086   4.1053  -0.1475   6.5102   7.4164   5.2895   66.849   30.130   88.665   31.291 -21.81542 43.43895 
1 1 1   28   13   38 o   96.373   23.952   8.4270   3.5178   8.3910   4.5696   8.4795   5.5116   93.451   28.957   92.755   31.991 0.6961670 43.15005 
1 1 1   28   13   39 o  130.177   18.459   14.357   3.5749   8.9777   4.6105   22.467   5.6610   96.032   28.959  158.376   24.114 -62.34431 37.68420 
1 1 1   28   14    0 o   32.250   18.919   0.9489   1.5727   0.9489   1.5727   0.9489   1.5727   32.250   18.919   32.250   18.919 0.000000 0.000000 
1 1 1   28   14    1 o  191.766   7.0004   28.252   2.0548   29.825   2.7512   26.268   3.0900  196.768   9.1347  184.068   11.018 12.69978 14.31240 
1 1 1   28   14    2 o   83.751   10.546   5.4982   1.3220   4.7581   1.5466   7.5048   2.5468   77.201   13.585   96.371   17.925 -19.16999 22.49143 
1 1 1   28   14    3 o  129.521   12.774   13.125   2.4994   14.014   4.1295   12.612   3.1399  131.504   21.240  125.965   16.697 5.539680 27.01678 
1 1 1   28   14    4 o  286.626   8.5207   63.238   3.7382   67.509   5.9371   60.432   4.8117  294.980   13.150  279.601   11.243 15.37955 17.30092 
1 1 1   28   14    5 o  137.211   22.503   15.331   4.5622   15.331   4.5622   0.0000   0.0000  137.211   22.503  ?   ?  0.000000 22.50331 
1 1 1   28   14    6 o  172.103   11.770   23.025   3.0818   25.374   5.1131   21.684   3.8622  178.587   18.997  166.085   15.367 12.50191 24.43414 
1 1 1   28   14    7 o  218.828   10.838   36.997   3.6300   38.060   5.9202   36.357   4.5951  219.545   17.770  215.820   13.986 3.725296 22.61345 
1 1 1   28   14    8 o  390.012   8.9865  117.183   5.3646  142.774   9.0344  103.245   6.6674  428.599   13.771  365.169   11.929 63.42984 18.21927 
1 1 1   28   14    9 o   67.032   23.387   3.2783   2.9496   7.0106   4.6592   0.7821   3.8103   92.510   29.325   59.515   24.918 32.99464 38.48201 
1 1 1   28   14   10 o  157.104   14.025   19.345   3.3370   23.367   5.1248   16.386   4.3968  170.853   19.974  142.437   20.779 28.41571 28.82235 
1 1 1   28   14   11 f  167.191   15.479   22.004   3.9163   26.917   7.6875   20.282   4.5511  179.431   28.979  159.323   19.039 20.10826 34.67356 
1 1 1   28   14   12 o  289.627   11.171   64.893   4.9521   81.034   8.8919   57.637   5.9623  320.341   18.210  271.635   14.392 48.70642 23.21043 
1 1 1   28   14   13 o   99.613   25.019   8.3114   3.8095   23.604   7.7454   3.4315   4.3753  166.295   31.585   73.772   28.044 92.52277 42.23787 
1 1 1   28   14   14 f  114.907   24.809   11.025   4.2357   19.134   7.9621   7.8248   5.0022  147.279   35.693   96.843   30.344 50.43611 46.84831 
1 1 1   28   14   15 o  185.895   16.722   27.325   4.7071   22.089   8.6046   29.562   5.6231  157.979   36.341  192.390   19.358 -34.41075 41.17540 
1 1 1   28   14   16 o  170.805   35.290   25.600   8.9210   25.600   8.9210   0.0000   0.0000  170.805   35.290  ?   ?  0.000000 35.29009 
1 1 1   28   14   17 o  233.583   14.940   42.815   5.3133   57.091   10.045   37.270   6.2608  264.228   25.141  216.151   19.121 48.07730 31.58622 
1 1 1   28   14   18 o   87.461   23.204   6.3824   3.1575   4.0235   8.7891   6.7320   3.3833   92.076   38.137   89.681   24.122 2.394859 45.12541 
1 1 1   28   14   19 o   62.887   23.974   2.4017   3.2033   5.1481   9.0882   2.0121   3.4230   95.864   39.142   62.134   24.478 33.73051 46.16554 
1 1 1   28   14   20 o  159.513   13.314   19.960   3.2209   23.090   6.1293   18.766   3.7858  167.039   24.719  153.684   16.345 13.35480 29.63429 
1 1 1   28   14   21 o  169.846   13.294   22.622   3.4284   28.240   6.6120   20.556   4.0095  185.316   23.865  160.796   16.526 24.52008 29.02846 
1 1 1   28   14   22 o   76.489   27.888   4.2455   4.2405   8.8243   6.4088   0.6798   5.6556  101.965   34.511   69.265   29.728 32.70026 45.54995 
1 1 1   28   14   23 o   52.631   23.217  -0.6662   3.6543   9.9951   8.9000  -2.8280   4.0077  109.156   40.307   48.956   22.651 60.20012 46.23595 
1 1 1   28   14   24 o   45.665   21.071  -2.3481   3.4329  -9.9031   6.9883   0.0549   3.9412   55.216   26.752   57.048   24.652 -1.832348 36.37841 
1 1 1   28   14   25 o  185.465   10.950   26.801   3.0946   35.541   4.3479   17.827   4.4055  212.768   13.419  147.913   19.969 64.85487 24.05949 
1 1 1   28   14   26 o  165.824   12.685   21.596   3.1951   26.402   4.6461   17.283   4.4010  181.742   16.895  145.292   20.348 36.44960 26.44762 
1 1 1   28   14   27 o  139.946   21.948   16.263   4.5468   12.372   7.6054   18.428   5.6720  115.468   37.554  146.875   26.190 -31.40695 45.78434 
1 1 1   28   14   28 o   47.556   20.993  -0.5539   2.9926   2.2985   4.4701  -2.8708   4.0286   67.936   27.560   48.615   22.570 19.32125 35.62257 
1 1 1   28   14   29 o   57.125   23.142   1.4780   3.1471  -7.1774   4.6169   8.9902   4.3012   44.159   21.475  101.065   27.203 -56.90566 34.65858 
1 1 1   28   14   30 o   97.863   23.385   8.2450   3.4550   11.675   5.3058   5.7203   4.5524  113.526   30.060   83.021   29.049 30.50470 41.80288 
1 1 1   28   14   31 o   47.505   21.443  -1.2283   3.3117  -2.2894   4.9992  -0.3985   4.4209   56.130   25.726   57.716   25.494 -1.586143 36.21825 
1 1 1   28   14   32 o   74.005   23.584   4.6113   3.0104   4.2799   4.6777   4.8456   3.9332   76.091   28.980   76.910   26.997 -0.8185425 39.60608 
1 1 1   28   14   33 o  100.999   20.351   8.6492   3.0374   16.415   4.6595   2.9108   4.0054  138.640   22.747   67.368   26.498 71.27221 34.92208 
1 1 1   28   14   34 o  112.064   19.763   10.600   3.2661   3.1051   5.3078   15.168   4.1433   72.674   29.821  133.826   20.912 -61.15198 36.42209 
1 1 1   28   14   35 o  142.680   14.860   16.479   3.1976   16.152   4.7042   16.760   4.3596  136.061   23.434  140.326   20.938 -4.264557 31.42537 
1 1 1   28   14   36 o   82.211   24.736   6.0766   3.3666   7.2949   4.3928   4.3426   5.2408   88.532   28.518   75.920   30.167 12.61192 41.51296 
1 1 1   28   14   37 o  155.328   18.758   20.294   4.3693   12.196   6.7442   26.151   5.7359  107.749   35.379  173.697   22.073 -65.94816 41.70008 
1 1 1   28   14   38 o   72.878   25.258   4.6558   3.4378   0.4702   4.3987   11.226   5.5109   58.351   25.615  105.567   31.621 -47.21677 40.69445 
1 1 1   28   15    0 o   66.161   25.613   4.6550   2.4650   4.6550   2.4650   4.6550   2.4650   66.161   25.613   66.161   25.613 0.000000 0.000000 
1 1 1   28   15    1 o   63.105   16.787   3.2266   1.6498   3.6140   2.1624   2.6870   2.5519   67.041   19.743   61.569   21.733 5.471863 29.36164 
1 1 1   28   15    2 o   71.088   14.037   4.0614   1.4731   3.6116   1.7126   5.3411   2.8885   66.660   16.793   80.670   22.529 -14.00961 28.09893 
1 1 1   28   15    3 o  105.739   9.3208   8.6827   1.4931   9.1947   1.6868   6.8290   3.2095  108.674   10.262   90.805   23.051 17.86816 25.23244 
1 1 1   28   15    4 o   94.207   27.204   7.3890   4.1419   7.3890   4.1419   0.0000   0.0000   94.207   27.204  ?   ?  0.000000 27.20418 
1 1 1   28   15    5 o  117.351   16.080   10.949   2.8123   13.957   4.4367   8.9288   3.6361  130.529   23.050  103.784   23.443 26.74516 32.87614 
1 1 1   28   15    6 o  146.802   13.703   16.888   3.0434   14.296   4.6949   18.767   3.9970  131.718   24.178  153.810   17.277 -22.09181 29.71606 
1 1 1   28   15    7 o  160.431   12.490   20.071   3.0429   20.045   4.4234   20.094   4.1924  158.578   18.576  159.124   17.502 -0.5461426 25.52249 
1 1 1   28   15    8 o  192.413   12.703   28.841   3.7202   37.420   6.3501   24.357   4.5904  216.943   19.326  175.397   17.325 41.54564 25.95449 
1 1 1   28   15    9 o   81.729   24.755   5.4509   3.3636   11.228   6.2734   3.1199   3.9848  114.186   33.627   70.657   26.786 43.52895 42.99122 
1 1 1   28   15   10 o  240.678   11.768   44.866   4.3354   55.707   7.5394   39.510   5.2991  265.198   18.693  224.371   15.526 40.82704 24.29983 
1 1 1   28   15   11 o  181.120   18.788   26.136   5.1328   0.0000   0.0000   26.136   5.1328  ?   ?   181.120   18.788 0.000000 18.78820 
1 1 1   28   15   12 o  176.226   16.111   24.507   4.2975   31.999   7.8325   21.280   5.1404  196.863   26.681  162.314   21.197 34.54907 34.07610 
1 1 1   28   15   13 o  100.087   25.977   8.4316   4.0141   15.548   7.4181   5.4851   4.7733  132.617   35.737   84.704   29.740 47.91308 46.49332 
1 1 1   28   15   14 o  267.637   13.054   55.687   5.3476   58.371   8.8517   54.145   6.7106  269.617   21.631  262.067   16.818 7.550323 27.40005 
1 1 1   28   15   15 o  208.926   16.558   34.472   5.2518   47.670   8.8559   27.312   6.5225  241.908   24.244  182.736   23.892 59.17262 34.03768 
1 1 1   28   15   16 o  178.039   31.919   27.228   8.3787   27.228   8.3787   0.0000   0.0000  178.039   31.919  ?   ?  0.000000 31.91881 
1 1 1   28   15   17 o  167.832   20.230   22.712   5.0920   26.795   8.7631   20.630   6.2566  175.219   33.900  156.818   27.043 18.40112 43.36495 
1 1 1   28   15   18 o   70.711   29.045   1.9957   5.0415  -4.4799   8.6126   5.3712   6.2182   72.487   33.422   87.941   33.432 -15.45463 47.27242 
1 1 1   28   15   19 o   95.083   30.301   7.6001   4.9694   3.2046   8.7219   9.7128   6.0468   89.349   37.570  106.010   33.386 -16.66051 50.26098 
1 1 1   28   15   20 o   43.884   21.511  -8.9900   4.9042   4.3642   9.2619 -14.1927   5.7811   93.886   39.040   43.257   21.577 50.62888 44.60583 
1 1 1   28   15   21 o   88.896   28.491   6.5757   4.3888   3.3263   6.3111   9.6186   6.1074   80.601   32.730  105.291   33.595 -24.68998 46.90335 
1 1 1   28   15   22 f  218.654   12.564   37.360   4.1873   52.112   9.9390   34.176   4.6171  250.232   26.345  208.356   14.569 41.87640 30.10541 
1 1 1   28   15   23 o  186.007   13.408   27.170   3.7919   31.482   7.3264   25.593   4.4316  194.418   25.213  179.406   16.316 15.01207 30.03237 
1 1 1   28   15   24 o  108.871   17.434   9.6148   2.8072   9.1821   3.7721   10.152   4.2028  104.002   24.158  108.908   25.638 -4.905418 35.22598 
1 1 1   28   15   25 o  109.480   18.821   9.8206   3.0402   15.328   4.3531   4.5760   4.2478  136.142   21.612   77.603   27.970 58.53839 35.34711 
1 1 1   28   15   26 o   57.472   24.325   0.6878   3.6948  -3.6068   7.5374   2.0462   4.2390   67.756   31.249   65.979   26.812 1.777603 41.17559 
1 1 1   28   15   27 f  180.680   13.545   25.762   3.7186   27.079   4.6599   23.454   6.1704  183.831   16.745  166.536   24.977 17.29517 30.07036 
1 1 1   28   15   28 o  104.746   21.359   9.2388   3.3083   5.7457   4.8581   12.260   4.5177   84.043   29.952  119.039   25.558 -34.99673 39.37463 
1 1 1   28   15   29 o  137.037   16.777   15.198   3.4455   5.1433   4.9113   24.942   4.8349   81.103   29.944  175.173   18.303 -94.07005 35.09410 
1 1 1   28   15   30 o  115.791   18.893   11.090   3.2329   6.9626   4.3842   16.009   4.7863   89.123   28.467  137.004   23.681 -47.88082 37.02927 
1 1 1   28   15   31 o   57.111   23.162   1.5335   3.1560   0.0887   4.2905   3.2369   4.6587   58.351   25.464   71.693   28.457 -13.34208 38.18667 
1 1 1   28   15   32 f  139.637   14.589   15.649   3.0721   11.691   4.3920   19.442   4.2987  115.085   25.595  153.663   18.660 -38.57784 31.67432 
1 1 1   28   15   33 o   53.150   21.981   1.0872   2.9133   5.6769   4.1799  -3.2485   4.0626   81.029   27.864   47.245   22.171 33.78331 35.60903 
1 1 1   28   15   34 o  110.604   19.676   10.364   3.2089   2.3784   4.5977   17.949   4.4808   66.957   27.646  145.581   20.691 -78.62322 34.53135 
1 1 1   28   15   35 o  114.467   18.345   11.004   3.1057   10.508   4.2227   11.588   4.5836  107.322   25.983  112.138   27.023 -4.816475 37.48835 
1 1 1   28   15   36 o   95.325   23.195   8.1331   3.3521   7.9134   4.2278   8.5050   5.5007   91.801   27.742   93.404   31.971 -1.603577 42.32932 
1 1 1   28   15   37 o   69.417   25.798   3.9278   3.6575  -0.0422   6.5723   5.7089   4.4022   66.745   30.161   79.534   28.494 -12.78951 41.49206 
1 1 1   28   16    0 o  201.945   11.791   31.708   3.6161   31.708   3.6161   31.708   3.6161  201.945   11.791  201.945   11.791 0.000000 0.000000 
1 1 1   28   16    1 o  195.262   7.2169   29.307   2.1569   29.945   2.6507   28.056   3.7107  197.170   8.7832  189.740   12.853 7.430389 15.56733 
1 1 1   28   16    2 o  157.984   8.3949   19.268   2.0227   18.883   2.3943   20.226   3.7801  156.099   10.075  160.222   15.612 -4.123245 18.58077 
1 1 1   28   16    3 o   74.362   15.282   4.4663   1.6813   2.7783   1.8879   10.936   3.6962   59.534   18.640  115.584   21.689 -56.04921 28.59799 
1 1 1   28   16    4 o  246.901   7.5144   46.877   2.8398   46.877   2.8398   0.0000   0.0000  246.901   7.5144  ?   ?  0.000000 7.514369 
1 1 1   28   16    5 o   85.968   21.832   6.1060   2.8781   6.8987   4.1679   5.3834   3.9792   91.280   27.536   82.423   27.181 8.857300 38.69135 
1 1 1   28   16    6 o  162.175   13.495   20.577   3.3195   25.458   4.8661   16.329   4.5398  179.086   17.996  141.839   21.592 37.24696 28.10810 
1 1 1   28   16    7 o  122.380   16.481   11.926   3.0086   11.152   4.0915   12.837   4.4394  115.992   23.842  124.538   24.161 -8.545319 33.94404 
1 1 1   28   16    8 o  240.326   9.9076   44.582   3.6445   51.198   5.0977   37.665   5.2125  256.428   13.031  218.982   15.654 37.44641 20.36813 
1 1 1   28   16    9 o  185.764   13.679   26.985   3.8620   30.654   6.3462   24.828   4.8669  195.091   21.616  176.664   18.262 18.42674 28.29727 
1 1 1   28   16   10 o   71.300   28.013   2.7774   4.4717   0.0000   0.0000   2.7774   4.4717  ?   ?    71.300   28.013 0.000000 28.01295 
1 1 1   28   16   11 o  106.299   29.629   9.6375   5.0013   0.0000   0.0000   9.6375   5.0013  ?   ?   106.299   29.629 0.000000 29.62923 
1 1 1   28   16   12 o   55.194   24.011  -0.2951   3.7888   10.296   6.6922  -5.2912   4.5963  109.614   35.188   48.079   22.866 61.53468 41.96473 
1 1 1   28   16   13 o   63.117   26.369   1.0545   4.2539   2.6315   7.1730   0.1990   5.2832   82.567   34.347   66.246   28.585 16.32101 44.68554 
1 1 1   28   16   14 o  185.569   17.615   27.361   4.9432   33.825   8.2883   23.792   6.1584  201.528   27.594  170.114   24.346 31.41371 36.79905 
1 1 1   28   16   15 o  336.166   19.184   89.871   9.8303   89.871   9.8303   0.0000   0.0000  336.166   19.184  ?   ?  0.000000 19.18443 
1 1 1   28   16   16 f  145.103   22.861   17.296   4.9093   12.922   7.7971   20.169   6.3192  120.426   37.909  154.649   27.714 -34.22334 46.95896 
1 1 1   28   16   17 f  138.620   24.540   15.988   5.0163   4.4686   7.8934   23.792   6.4970   90.163   36.607  169.051   25.937 -78.88765 44.86449 
1 1 1   28   16   18 f   65.893   28.063   0.7330   4.9704   4.2418   8.8695  -0.8734   6.0012   92.495   38.311   66.923   29.625 25.57177 48.42922 
1 1 1   28   16   19 o   77.486   29.975   3.7850   5.0577  -5.4032   9.2854   7.6610   6.0309   73.684   34.227   96.559   33.455 -22.87547 47.86180 
1 1 1   28   16   20 o  269.405   14.555   56.994   5.9796  315.476   16.259   16.564   6.4303  632.291   16.800  137.623   31.241 494.6683 35.47126 
1 1 1   28   16   21 o  199.890   13.809   31.382   4.1989   43.124   10.859   29.318   4.5531  222.555   32.865  192.496   15.587 30.05852 36.37405 
1 1 1   28   16   22 f   61.757   25.541   1.3256   3.9335   0.0000   0.0000   1.3256   3.9335  ?   ?    61.757   25.541 0.000000 25.54098 
1 1 1   28   16   23 o   78.732   14.602   5.0121   1.6949   4.7207   1.8798   6.2793   3.9193   75.871   16.644   86.354   26.827 -10.48340 31.57113 
1 1 1   28   16   24 o   78.879   23.341   5.2054   3.0162   4.5656   4.4814   5.7353   4.0782   78.241   28.648   83.297   27.520 -5.056213 39.72427 
1 1 1   28   16   25 o   56.269   22.483   1.5366   2.9261   7.3312   4.3234  -3.3611   3.9748   92.160   28.099   47.121   22.055 45.03831 35.72083 
1 1 1   28   16   26 o   71.292   26.898   3.5223   4.0060   10.607   10.695   2.3659   4.3206  110.543   43.356   67.531   27.201 43.01175 51.18243 
1 1 1   28   16   27 o   93.215   23.115   7.4380   3.2817   7.7203   3.9900   6.8479   5.7696   94.060   26.552   90.602   32.604 3.457748 42.04835 
1 1 1   28   16   28 o  125.402   16.635   12.742   3.1142   10.641   4.1266   15.522   4.7464  110.799   24.935  135.036   23.835 -24.23714 34.49428 
1 1 1   28   16   29 o  183.642   12.012   26.522   3.3578   23.658   4.4154   30.449   5.1708  171.060   17.092  193.940   17.611 -22.88014 24.54163 
1 1 1   28   16   30 o   86.109   23.071   6.4050   3.1022   5.9160   4.0795   7.0753   4.7768   83.030   27.528   89.655   29.791 -6.625519 40.56262 
1 1 1   28   16   31 o   66.121   23.541   3.3821   3.0001  -0.3376   3.8949   8.8082   4.7042   54.342   23.971   98.379   29.159 -44.03634 37.74677 
1 1 1   28   16   32 o  155.298   13.769   19.271   3.2391   12.594   4.1127   30.177   5.2563  120.652   23.112  191.842   18.115 -71.18958 29.36513 
1 1 1   28   16   33 o  111.015   18.662   10.334   3.0586   13.753   4.4605   7.3004   4.2020  125.087   24.172   89.496   27.774 35.59105 36.81913 
1 1 1   28   16   34 f   88.248   23.848   6.9604   3.2978   6.6562   4.0685   7.5429   5.6311   85.469   27.436   89.947   32.227 -4.477798 42.32379 
1 1 1   28   16   35 o   68.578   24.416   3.8843   3.2274   4.2121   3.9231   3.1977   5.6768   71.912   26.720   72.924   30.464 -1.012039 40.52150 
1 1 1   28   16   36 o   69.362   25.963   3.8686   3.7175  -3.7604   6.4113   7.7328   4.5629   58.676   27.635   90.010   29.072 -31.33443 40.11099 
1 1 1   28   17    0 o   39.410   24.936   0.5675   3.2302   0.5675   3.2302   0.5675   3.2302   39.410   24.936   39.410   24.936 0.000000 0.000000 
1 1 1   28   17    1 o  100.045   16.461   8.0307   2.4331   4.8470   3.1730   12.574   3.7904   77.547   24.146  124.427   20.625 -46.88046 31.75569 
1 1 1   28   17    2 o  167.295   8.9298   21.628   2.2784   21.351   2.6608   22.390   4.4107  165.903   10.533  168.014   17.404 -2.111145 20.34282 
1 1 1   28   17    3 o   93.232   16.997   7.0172   2.3361   7.0172   2.3361   0.0000   0.0000   93.232   16.997  ?   ?  0.000000 16.99654 
1 1 1   28   17    4 o  271.585   6.9241   56.686   2.8783   58.604   3.3513   51.293   5.6196  275.960   7.9341  256.184   14.389 19.77606 16.43180 
1 1 1   28   17    5 o  120.397   10.701   11.291   1.9515   12.893   2.1661   4.3858   4.4975  128.633   11.111   78.688   28.716 49.94492 30.79052 
1 1 1   28   17    6 o  256.572   6.7645   50.585   2.6565   51.470   2.9776   47.133   5.8810  258.682   7.5203  244.997   15.766 13.68462 17.46805 
1 1 1   28   17    7 o  115.206   18.708   10.717   3.1858   10.696   4.1725   10.748   4.9331  113.159   24.777  112.358   28.609 0.8012085 37.84647 
1 1 1   28   17    8 o  227.278   10.714   39.945   3.7272   46.476   5.1021   32.470   5.4580  243.990   13.718  202.374   17.801 41.61586 22.47350 
1 1 1   28   17    9 o   54.641   22.874   0.6413   3.2099   1.6304   4.3284  -0.5673   4.7847   65.821   26.960   61.009   26.750 4.811810 37.97895 
1 1 1   28   17   10 o  130.629   27.268   14.400   5.2760   0.0000   0.0000   14.400   5.2760  ?   ?   130.629   27.268 0.000000 27.26822 
1 1 1   28   17   11 o  109.908   24.570   10.115   4.0295   9.2516   6.4024   10.682   5.1852  104.686   34.476  111.534   29.804 -6.848160 45.57248 
1 1 1   28   17   12 o   83.161   27.966   5.4864   4.2082   3.9152   6.7871   6.4676   5.3636   84.963   34.137   90.529   31.540 -5.565468 46.47708 
1 1 1   28   17   13 o  100.978   28.482   8.6810   4.5930   9.0831   7.4440   8.4337   5.8365  105.064   37.116  100.263   32.912 4.800087 49.60604 
1 1 1   28   17   14 o  119.513   26.689   12.102   4.7588   7.7071   7.4147   15.181   6.2055   99.744   36.799  132.258   31.165 -32.51326 48.22248 
1 1 1   28   17   15 o  149.473   35.711   19.943   8.0583   19.943   8.0583   0.0000   0.0000  149.473   35.711  ?   ?  0.000000 35.71065 
1 1 1   28   17   16 o  127.511   27.247   13.822   5.1565   18.221   7.9969   10.692   6.7463  142.169   36.547  110.667   35.309 31.50198 50.81761 
1 1 1   28   17   17 o  267.006   15.082   56.039   6.1387   65.589   9.1818   48.319   8.2548  285.384   21.171  244.043   22.347 41.34106 30.78289 
1 1 1   28   17   18 o  140.107   25.892   16.515   5.3481   31.341   8.4519   6.6154   6.9067  191.779   29.757   94.089   35.356 97.69016 46.21154 
1 1 1   28   17   19 o   64.544   28.237  -0.2608   5.3048   0.6490   8.7731  -0.7851   6.6604   82.938   36.297   70.344   31.171 12.59387 47.84499 
1 1 1   28   17   20 o  105.355   31.950   9.7100   5.6005   19.557   9.9591   5.1557   6.7729  142.909   42.442   88.115   34.519 54.79377 54.70705 
1 1 1   28   17   21 o  140.714   28.759   17.108   5.9849   18.155   10.918   16.659   7.1558  136.342   45.027  135.794   34.391 0.5477600 56.65851 
1 1 1   28   17   22 o  164.402   18.287   21.769   4.5237   0.0000   0.0000   21.769   4.5237  ?   ?   164.402   18.287 0.000000 18.28682 
1 1 1   28   17   23 o  188.180   7.8628   27.318   2.2647   27.659   2.6022   26.253   4.5987  189.121   8.9893  181.259   16.765 7.861481 19.02329 
1 1 1   28   17   24 o  126.663   15.205   12.824   2.8890   10.210   3.8558   16.169   4.3621  109.619   23.673  139.971   21.009 -30.35214 31.65120 
1 1 1   28   17   25 o   47.257   21.622  -1.9145   3.5110   1.1381   6.9527  -2.9594   4.0677   75.403   32.664   48.691   22.630 26.71200 39.73681 
1 1 1   28   17   26 o   64.073   23.403   2.9507   2.9880   3.2995   3.5895   2.1637   5.3920   68.392   25.530   71.455   29.756 -3.062973 39.20705 
1 1 1   28   17   27 o   36.938   17.662  -3.5251   2.8196  -3.0388   3.6509  -4.2439   4.4386   45.176   21.142   48.231   22.800 -3.055122 31.09396 
1 1 1   28   17   28 f  108.458   18.969   9.7565   3.0344   11.546   4.0012   7.3339   4.6551  116.144   23.317   91.230   29.354 24.91319 37.48804 
1 1 1   28   17   29 o   68.373   23.711   3.7056   3.0299   3.3000   3.9154   4.3109   4.7836   69.185   26.474   76.684   29.282 -7.498482 39.47554 
1 1 1   28   17   30 f  159.284   13.364   20.167   3.2282   20.663   4.1287   19.387   5.1783  159.352   17.200  150.802   23.176 8.549622 28.86083 
1 1 1   28   17   31 o   68.702   23.424   3.8598   2.9525   3.1955   3.8686   4.7866   4.5694   67.952   26.235   77.464   28.826 -9.511604 38.97756 
1 1 1   28   17   32 o   59.240   22.913   2.2848   2.9548   1.8103   3.7907   3.0195   4.7169   61.163   25.161   70.005   28.342 -8.842079 37.89929 
1 1 1   28   17   33 o   61.017   24.451   2.1960   3.4717  -0.4367   3.9708   10.739   7.1527   53.822   23.948  102.914   36.379 -49.09189 43.55440 
1 1 1   28   17   34 o   54.117   22.899   0.9149   3.2732  -1.2371   3.6351   10.136   7.5250   48.988   22.254   99.537   37.002 -50.54957 43.17846 
1 1 1   28   17   35 o  141.592   14.654   16.312   3.1300   14.584   3.8578   19.640   5.3543  130.644   19.923  148.346   24.431 -17.70166 31.52464 
1 1 1   28   17   36 o   68.795   25.846   3.8067   3.6906   4.1252   6.4333   3.6504   4.5057   77.078   32.331   70.323   27.963 6.755089 42.74599 
1 1 1   28   18    0 o   64.965   33.241   4.9825   4.1836   4.9825   4.1836   4.9825   4.1836   64.965   33.241   64.965   33.241 0.000000 0.000000 
1 1 1   28   18    1 o  220.036   10.522   37.424   3.5436   34.945   4.6980   40.696   5.3974  211.179   14.624  227.615   15.586 -16.43599 21.37277 
1 1 1   28   18    2 o   72.010   22.028   4.1769   2.6540   4.1769   2.6540   0.0000   0.0000   72.010   22.028  ?   ?  0.000000 22.02765 
1 1 1   28   18    3 o  128.218   12.524   12.877   2.4265   13.429   2.7976   11.200   4.8755  130.539   14.232  114.814   27.996 15.72543 31.40544 
1 1 1   28   18    4 o   38.761   17.543  -1.1456   2.2334   0.6786   2.5255  -7.6930   4.7845   49.590   20.484   45.189   21.950 4.400757 30.02278 
1 1 1   28   18    5 o  149.672   10.984   17.424   2.4988   17.505   2.8113   17.120   5.4533  149.697   12.381  143.419   25.790 6.278091 28.60756 
1 1 1   28   18    6 o  128.822   28.705   14.127   5.5152   0.0000   0.0000   14.127   5.5152  ?   ?   128.822   28.705 0.000000 28.70501 
1 1 1   28   18    7 o  129.426   11.694   13.085   2.2916   12.835   2.5262   14.249   5.4453  127.845   13.095  129.521   28.261 -1.676041 31.14758 
1 1 1   28   18    8 o  167.310   9.1382   21.655   2.3313   21.386   2.5537   23.002   5.7125  166.068   10.094  167.982   22.807 -1.913773 24.94125 
1 1 1   28   18    9 o  142.538   27.178   17.091   5.7130   0.0000   0.0000   17.091   5.7130  ?   ?   142.538   27.178 0.000000 27.17781 
1 1 1   28   18   10 o   71.990   27.290   3.3194   4.1358   7.7297   6.2894  -0.0405   5.4896   97.837   34.149   66.624   28.942 31.21247 44.76438 
1 1 1   28   18   11 o  223.964   14.369   39.316   4.8997   60.328   7.7239   25.167   6.3382  275.661   18.412  174.959   24.326 100.7016 30.50820 
1 1 1   28   18   12 o  126.802   23.602   13.338   4.4123   10.325   6.8258   15.501   5.7829  109.363   35.577  134.652   28.921 -25.28899 45.84967 
1 1 1   28   18   13 o  193.522   17.264   29.738   5.0602   32.508   7.6063   27.538   6.7776  198.279   25.665  182.694   24.885 15.58447 35.74814 
1 1 1   28   18   14 o  146.560   34.782   19.096   7.6855   19.096   7.6855   0.0000   0.0000  146.560   34.782  ?   ?  0.000000 34.78215 
1 1 1   28   18   15 o  180.771   19.652   26.289   5.3500   35.576   7.9838   18.720   7.2077  207.272   25.717  145.857   33.050 61.41536 41.87690 
1 1 1   28   18   16 o  314.098   13.619   77.005   6.5476   35.538   8.7844  128.845   9.8217  205.134   28.768  404.897   15.848 -199.7626 32.84462 
1 1 1   28   18   17 o  147.371   25.579   18.216   5.5605   10.748   8.2334   24.480   7.5398  111.301   39.060  168.635   30.326 -57.33406 49.45005 
1 1 1   28   18   18 o  101.555   28.024   8.8820   4.4983   11.328   6.0832   5.9312   6.6820  113.092   33.058   90.721   34.616 22.37167 47.86576 
1 1 1   28   18   19 o   77.024   28.753   4.1803   4.5533   13.172   6.2843  -5.7561   6.6063  121.467   32.961   59.513   28.036 61.95459 43.27172 
1 1 1   28   18   20 o  222.667   8.7620   38.297   2.9863   40.167   3.2577   28.461   7.4724  227.895   9.3392  183.181   27.500 44.71400 29.04246 
1 1 1   28   18   21 o  193.186   8.6357   28.830   2.5535   30.222   2.7124   17.976   7.5726  197.726   8.9623  140.159   35.314 57.56696 36.43330 
1 1 1   28   18   22 o  171.706   11.079   23.017   2.8963   25.907   3.1326   6.0027   7.6016  182.137   11.292   92.333   36.445 89.80432 38.15400 
1 1 1   28   18   23 o  144.939   10.496   16.400   2.3128   16.592   2.4239   14.456   7.7281  145.659   10.952  123.867   37.524 21.79270 39.08943 
1 1 1   28   18   24 o  109.650   23.849   10.269   3.8887   6.1275   7.2341   11.952   4.6117   91.135   35.682  117.334   26.326 -26.19892 44.34275 
1 1 1   28   18   25 o   88.968   21.375   6.7090   2.8745   7.3651   3.7133   5.7279   4.5406   92.112   25.479   83.314   29.019 8.797523 38.61751 
1 1 1   28   18   26 o  104.841   20.791   9.2393   3.2185   11.379   3.9383   4.9373   5.5847  115.564   23.072   82.022   31.563 33.54182 39.09661 
1 1 1   28   18   27 o   72.087   23.641   4.2818   3.0118   7.0933   3.9886   0.5525   4.5937   89.934   26.894   61.795   26.660 28.13830 37.86835 
1 1 1   28   18   28 o   83.657   23.418   6.0431   3.1173   6.7001   4.1310   5.1743   4.7506   87.430   27.602   80.430   29.489 6.999619 40.39102 
1 1 1   28   18   29 o   62.526   23.481   2.7271   3.0456   2.8602   4.0032   2.5442   4.6929   67.271   26.481   68.886   28.127 -1.615746 38.63116 
1 1 1   28   18   30 o   53.343   22.309   0.9225   3.0494  -3.1965   3.9299   7.1559   4.8345   46.466   21.806   89.201   29.975 -42.73536 37.06781 
1 1 1   28   18   31 o   43.689   19.971  -1.4720   2.9856   2.0225   3.8433  -6.7898   4.7412   62.321   25.451   44.958   21.840 17.36352 33.53749 
1 1 1   28   18   32 o   70.720   25.062   4.1282   3.3967   4.7017   3.7535   1.5350   7.9813   74.571   26.354   76.543   34.010 -1.971504 43.02618 
1 1 1   28   18   33 o   62.023   23.824   2.7078   3.1781   3.9098   4.0103   0.6783   5.2110   70.789   26.863   63.542   27.887 7.246254 38.72124 
1 1 1   28   18   34 f   50.840   21.334   0.8792   2.8029   1.4507   3.7338   0.1413   4.2424   58.668   24.621   56.787   25.035 1.880398 35.11307 
1 1 1   28   18   35 o   67.022   23.005   3.8093   2.8485   4.0915   3.7231   3.4109   4.4237   70.386   26.054   69.166   27.641 1.219521 37.98520 
1 1 1   28   19    0 o  109.612   34.731   11.990   5.1260   11.990   5.1260   11.990   5.1260  109.612   34.731  109.612   34.731 0.000000 0.000000 
1 1 1   28   19    1 o   92.842   30.208   7.0926   4.9209   7.0926   4.9209   0.0000   0.0000   92.842   30.208  ?   ?  0.000000 30.20786 
1 1 1   28   19    2 o   83.294   24.920   5.7200   3.4240   0.4063   4.6048   12.292   5.1209   62.940   26.914  120.081   28.321 -57.14080 39.06950 
1 1 1   28   19    3 o  196.609   9.9689   29.936   2.9902   27.982   3.4798   35.453   5.8461  189.544   12.057  211.209   18.263 -21.66481 21.88416 
1 1 1   28   19    4 o  150.924   12.553   17.810   2.8736   18.140   3.3214   16.828   5.7304  151.804   14.470  141.292   27.487 10.51158 31.06254 
1 1 1   28   19    5 o  205.000   9.9185   32.465   3.1122   35.082   3.6250   25.129   6.0696  212.551   11.182  175.477   23.164 37.07382 25.72180 
1 1 1   28   19    6 o  139.962   13.518   15.390   2.8599   17.156   3.2908   9.9386   5.7806  147.489   14.776  107.451   32.432 40.03847 35.63898 
1 1 1   28   19    7 o  222.790   8.8900   38.278   3.0315   40.636   3.4834   30.917   6.1547  229.334   9.9235  195.938   20.842 33.39671 23.08397 
1 1 1   28   19    8 o  197.841   9.6391   30.228   2.9189   31.877   3.3355   24.837   6.0317  202.656   10.792  174.336   23.179 28.32021 25.56781 
1 1 1   28   19    9 o  207.800   10.686   33.507   3.3872   35.569   4.0043   28.319   6.3508  213.646   12.297  186.487   22.718 27.15901 25.83285 
1 1 1   28   19   10 o  137.538   13.441   14.872   2.7933   16.156   3.1626   10.315   5.9572  143.061   14.649  109.040   32.926 34.02173 36.03755 
1 1 1   28   19   11 o  250.346   8.2644   48.299   3.1668   49.448   3.5805   44.169   6.7864  253.088   9.2428  235.256   19.009 17.83179 21.13687 
1 1 1   28   19   12 o  113.081   24.441   10.737   4.1069   12.642   5.3252   7.9415   6.4517  121.133   29.088   98.630   34.578 22.50285 45.18579 
1 1 1   28   19   13 o  141.746   26.793   16.964   5.6001   16.964   5.6001   0.0000   0.0000  141.746   26.793  ?   ?  0.000000 26.79337 
1 1 1   28   19   14 o  162.775   22.790   21.742   5.5224   21.742   5.5224   0.0000   0.0000  162.775   22.790  ?   ?  0.000000 22.79004 
1 1 1   28   19   15 o  191.868   15.800   29.125   4.5987   39.346   5.9236   13.619   7.2959  222.389   17.545  122.841   36.289 99.54752 40.30730 
1 1 1   28   19   16 o   80.863   29.068   4.9502   4.5847   6.4196   5.7801   2.4574   7.5286   90.467   32.624   82.552   34.819 7.915771 47.71473 
1 1 1   28   19   17 o  128.278   14.748   13.066   2.8430   15.543   3.1057   0.2564   7.0628  140.056   14.707   74.670   32.626 65.38535 35.78776 
1 1 1   28   19   18 o  118.247   11.895   10.985   2.1238   12.473   2.2201  -5.0474   7.2880  126.140   11.630   64.368   30.041 61.77219 32.21319 
1 1 1   28   19   19 o   43.814   18.361   0.3712   2.0718   0.9080   2.1693  -5.1990   6.9878   47.630   19.242   62.408   29.220 -14.77859 34.98706 
1 1 1   28   19   20 o  282.175   6.9012   61.309   2.9807   64.191   3.2074   43.058   8.0709  288.638   7.2599  228.352   23.423 60.28590 24.52205 
1 1 1   28   19   21 o  221.015   11.503   38.140   3.8779   40.922   4.4152   28.752   8.1107  228.475   12.675  181.479   30.264 46.99609 32.81144 
1 1 1   28   19   22 o   77.683   22.006   5.0737   2.7356   5.7379   2.9519   1.0325   7.2810   82.315   22.696   76.590   33.302 5.724648 40.30025 
1 1 1   28   19   23 o   54.404   21.414   1.5815   2.6174   1.3556   2.7765   3.3853   7.8451   54.241   21.820   84.474   35.582 -30.23389 41.73949 
1 1 1   28   19   24 o   90.286   24.261   7.0311   3.4245   7.2624   3.8377   6.1269   7.5869   91.351   26.129   91.457   36.311 -0.1060104 44.73479 
1 1 1   28   19   25 o   71.783   24.909   4.0947   3.3438   3.1302   4.0596   6.1298   5.8969   69.264   26.838   87.478   32.709 -18.21432 42.30996 
1 1 1   28   19   26 o  169.796   12.921   22.786   3.3329   23.577   4.3704   21.685   5.1524  170.844   16.936  161.327   21.393 9.517517 27.28574 
1 1 1   28   19   27 o  121.655   17.693   12.137   3.1980   11.948   4.2605   12.380   4.8398  117.331   24.514  117.909   27.348 -0.5775909 36.72643 
1 1 1   28   19   28 o  148.873   14.356   17.739   3.2308   19.205   4.2726   15.781   4.9372  152.742   18.663  134.721   24.859 18.02063 31.08508 
1 1 1   28   19   29 o   56.567   22.730   1.6688   3.0094  -0.0425   3.8964   4.1990   4.7379   55.098   24.150   75.264   29.041 -20.16519 37.76982 
1 1 1   28   19   30 o   70.229   23.434   4.1420   2.9545   1.8261   3.7549   7.9065   4.7874   61.051   25.070   92.450   29.770 -31.39918 38.92014 
1 1 1   28   19   31 o  198.688   12.360   31.342   3.7401   32.560   4.1382   25.910   8.7399  201.847   13.472  159.990   36.497 41.85687 38.90402 
1 1 1   28   19   32 o   43.388   19.981  -1.7013   3.0654  -2.9270   3.9414   0.1754   4.8769   46.694   21.889   60.511   26.751 -13.81735 34.56468 
1 1 1   28   19   33 o   75.791   23.797   5.0999   3.0748   6.0731   3.8083   3.2776   5.2112   81.620   26.575   71.510   29.469 10.11059 39.68236 
1 1 1   28   19   34 o  112.491   19.394   10.834   3.2187   7.1448   3.9190   18.479   5.6419   87.456   26.770  141.316   27.069 -53.86045 38.07033 
1 1 1   28   20    1 o  164.968   17.320   21.651   4.3080   18.522   6.0180   24.941   6.1699  148.247   27.535  174.456   23.721 -26.20844 36.34341 
1 1 1   28   20    2 o  155.594   18.222   19.363   4.2576   18.202   5.9268   20.602   6.1202  147.010   27.346  157.077   26.391 -10.06790 38.00400 
1 1 1   28   20    3 o  271.220   9.1165   56.757   3.7846   56.575   4.4414   57.241   7.2316  270.360   10.733  268.855   17.671 1.504425 20.67522 
1 1 1   28   20    4 o   77.164   23.631   4.8558   3.0535   7.6578   3.5607  -2.9317   5.9361   95.492   24.301   61.741   28.198 33.75095 37.22436 
1 1 1   28   20    5 o  244.662   9.8361   46.253   3.6835   49.668   4.3427   37.496   6.9540  253.174   11.207  215.598   21.353 37.57652 24.11554 
1 1 1   28   20    6 o   76.758   23.917   4.7843   3.1124   5.5761   3.5846   2.3585   6.2741   82.439   25.664   77.713   32.208 4.726135 41.18208 
1 1 1   28   20    7 o  265.700   8.9563   54.467   3.6424   54.658   4.1484   53.825   7.6101  265.848   10.195  259.725   19.281 6.123505 21.80995 
1 1 1   28   20    8 o  198.842   13.075   30.913   3.9574   28.680   4.7418   36.037   7.1833  190.325   16.439  210.535   22.647 -20.20949 27.98444 
1 1 1   28   20    9 o  154.072   13.908   18.671   3.2445   18.538   3.6893   19.124   6.8157  152.860   16.005  148.699   30.952 4.161087 34.84547 
1 1 1   28   20   10 o  147.381   14.991   17.175   3.3346   22.122   3.8506   2.3407   6.6687  167.370   15.196   79.167   33.040 88.20321 36.36735 
1 1 1   28   20   11 o   83.531   23.669   5.8207   3.1643   8.0276   3.6582  -0.7365   6.3058   97.520   24.530   68.848   30.428 28.67230 39.08446 
1 1 1   28   20   12 o   92.537   13.018   6.7964   1.7929   7.1221   1.8556   2.2174   6.9583   94.733   13.152   79.837   33.563 14.89663 36.04814 
1 1 1   28   20   13 o  126.391   10.692   12.465   2.0490   12.465   2.0490   0.0000   0.0000  126.391   10.692  ?   ?  0.000000 10.69196 
1 1 1   28   20   14 o  230.914   7.0494   41.037   2.4916   41.628   2.6164   35.284   8.1621  232.514   7.3518  205.370   26.590 27.14368 27.58738 
1 1 1   28   20   15 o   44.987   18.123   0.8065   1.9184   1.0912   1.9931  -2.7802   7.0740   47.377   18.674   67.765   30.884 -20.38744 36.09077 
1 1 1   28   20   16 o  125.424   11.187   12.311   2.1251   12.519   2.2192   10.014   7.3741  126.382   11.602  107.144   37.001 19.23839 38.77718 
1 1 1   28   20   17 o  205.068   7.8649   32.428   2.4687   33.037   2.6061   27.105   7.7025  206.912   8.2289  177.391   29.398 29.52095 30.52752 
1 1 1   28   20   18 o  188.552   8.5341   27.460   2.4630   29.875   2.6102   7.8521   7.4380  196.639   8.6724   98.531   36.756 98.10754 37.76518 
1 1 1   28   20   19 o   59.541   19.866   2.7434   2.1234   2.5099   2.2250   5.1256   7.1075   58.234   20.312   88.149   35.098 -29.91525 40.55228 
1 1 1   28   20   20 o   80.128   23.032   5.4143   2.9751   5.2411   3.2731   6.2380   7.1366   79.137   24.505   91.684   35.567 -12.54695 43.19157 
1 1 1   28   20   21 o  178.894   12.004   25.100   3.2680   28.653   3.6112   9.0248   7.6809  191.029   12.418  102.058   37.484 88.97108 39.48768 
1 1 1   28   20   22 o  126.343   12.942   12.640   2.4674   14.140   2.5912  -1.9548   8.0813  133.740   12.815   72.864   33.131 60.87625 35.52335 
1 1 1   28   20   23 o  281.549   9.5937   61.523   4.1344   66.957   4.6247   39.896   9.2261  293.409   10.298  213.823   28.933 79.58675 30.71092 
1 1 1   28   20   24 o   79.364   25.186   5.3362   3.4361   4.1604   3.8116   10.437   7.9390   73.392   26.489  106.178   38.242 -32.78609 46.51974 
1 1 1   28   20   25 o   62.281   25.704   1.6405   3.9720   1.6405   3.9720   0.0000   0.0000   62.281   25.704  ?   ?  0.000000 25.70400 
1 1 1   28   20   26 o   57.280   22.812   1.7564   3.0032   5.9771   3.9619  -3.9438   4.6043   83.180   27.107   49.748   23.427 33.43201 35.82753 
1 1 1   28   20   27 o   51.923   22.002   0.6005   3.0284   3.2986   3.9538  -3.2291   4.7104   68.960   26.551   51.823   24.174 17.13666 35.90767 
1 1 1   28   20   28 o   52.940   21.987   1.0127   2.9326   2.0737   3.8296  -0.4918   4.5601   62.681   25.480   57.649   25.657 5.032272 36.15913 
1 1 1   28   20   29 o  139.358   14.875   15.703   3.1239   15.965   3.9415   15.260   5.1230  138.203   19.147  130.230   26.600 7.972824 32.77426 
1 1 1   28   20   30 o  150.623   15.860   18.498   3.6015   18.016   4.0439   20.348   7.9188  147.142   18.354  141.018   36.429 6.123718 40.79194 
1 1 1   28   20   31 o   59.413   22.971   2.3794   2.9692   3.5352   3.7573   0.4572   4.8456   68.268   25.979   61.179   26.870 7.089149 37.37528 
1 1 1   28   20   32 o  102.601   21.587   9.2297   3.2828   5.1353   4.2610   15.210   5.1494   76.942   27.970  128.290   27.075 -51.34785 38.92774 
1 1 1   28   21    0 o   61.989   37.131   3.6432   6.2932   3.6432   6.2932   3.6432   6.2932   61.989   37.131   61.989   37.131 0.000000 0.000000 
1 1 1   28   21    1 o   70.132   30.852  -0.4987   6.4112   0.0000   0.0000  -0.4987   6.4112  ?   ?    70.132   30.852 0.000000 30.85231 
1 1 1   28   21    2 o  159.561   30.243   21.825   7.1160   0.0000   0.0000   21.825   7.1160  ?   ?   159.561   30.243 0.000000 30.24337 
1 1 1   28   21    3 o  254.190   13.704   50.539   5.3120   53.524   7.1871   46.945   7.8862  259.505   18.209  241.143   21.595 18.36177 28.24724 
1 1 1   28   21    4 o  323.379   8.8420   80.676   4.3766   80.680   5.0843   80.667   8.5995  322.930   10.286  319.121   17.675 3.809143 20.44975 
1 1 1   28   21    5 f  290.611   9.5416   65.244   4.2443   66.091   4.9539   62.907   8.2298  292.015   11.083  280.766   19.267 11.24850 22.22725 
1 1 1   28   21    6 o   84.363   25.155   5.9202   3.4934   8.7073   4.0338  -2.4414   6.9868  101.285   25.914   68.428   30.993 32.85680 40.39930 
1 1 1   28   21    7 o   96.399   26.864   7.8978   4.1119   7.4331   5.0088   8.8582   7.2006   94.201   30.463  103.313   36.503 -9.111908 47.54459 
1 1 1   28   21    8 o   66.216   24.848   2.8611   3.4091   2.2854   3.8929   4.7547   7.0610   65.846   26.052   88.103   35.014 -22.25787 43.64259 
1 1 1   28   21    9 o  100.742   22.644   8.4895   3.4068   8.0007   3.8555   10.230   7.2759   97.082   25.586  108.651   36.772 -11.56871 44.79748 
1 1 1   28   21   10 o  125.661   18.077   12.746   3.3768   11.951   3.8434   15.435   7.0711  120.304   21.669  131.134   34.692 -10.83003 40.90387 
1 1 1   28   21   11 o  142.223   16.084   16.114   3.4398   15.954   3.8179   16.800   7.9282  140.775   18.140  135.497   37.128 5.277710 41.32229 
1 1 1   28   21   12 f   57.652   24.233   0.7592   3.6265   0.7592   3.6265   0.0000   0.0000   57.652   24.233  ?   ?  0.000000 24.23324 
1 1 1   28   21   13 o  159.399   14.257   20.053   3.4417   18.992   3.7717   25.336   8.4130  154.410   16.200  168.974   33.710 -14.56389 37.40045 
1 1 1   28   21   14 o  161.160   14.456   20.525   3.5280   22.170   3.9182   13.477   8.1095  167.161   15.490  120.938   38.725 46.22268 41.70847 
1 1 1   28   21   15 o  141.557   15.860   15.988   3.3774   17.128   3.7013   10.315   8.2554  146.201   16.848  108.698   39.012 37.50310 42.49509 
1 1 1   28   21   16 o  282.297   9.0794   61.628   3.9231   66.046   4.4254   45.411   8.4785  291.954   9.9030  234.223   23.988 57.73134 25.95162 
1 1 1   28   21   17 o  119.828   17.901   11.666   3.1826   12.846   3.5129   6.2578   7.5182  125.471   18.876   92.959   36.382 32.51141 40.98728 
1 1 1   28   21   18 o  121.497   17.392   11.965   3.1421   12.073   3.4953   11.510   7.1733  121.227   19.498  112.016   36.473 9.211205 41.35776 
1 1 1   28   21   19 o   95.927   16.403   7.4894   2.3219   8.6001   2.4421  -2.9618   7.4913  103.085   15.996   68.557   31.447 34.52852 35.28154 
1 1 1   28   21   20 o  101.955   14.939   8.3695   2.2622   8.5402   2.3584   6.4046   8.0008  102.836   15.462   93.581   37.246 9.254898 40.32752 
1 1 1   28   21   21 o  155.255   10.555   18.839   2.4933   20.283   2.6147   4.3679   8.2771  161.086   10.665   88.124   36.797 72.96133 38.31116 
1 1 1   28   21   22 o   33.891   16.133  -2.7351   2.2981  -2.2660   2.4066  -7.5904   7.7429   36.348   17.060   61.438   29.347 -25.08973 33.94512 
1 1 1   28   21   23 o   69.395   20.993   4.0108   2.4201   4.0107   2.5423   4.0122   7.9032   69.534   21.607   85.506   35.849 -15.97173 41.85698 
1 1 1   28   21   24 o  120.995   20.898   12.291   3.7304   12.291   3.7304   0.0000   0.0000  120.995   20.898  ?   ?  0.000000 20.89830 
1 1 1   28   21   25 o  138.092   17.099   15.543   3.5370   15.149   3.9316   17.214   8.1000  135.064   19.589  131.154   38.092 3.910400 42.83431 
1 1 1   28   21   26 o   93.022   24.326   7.6232   3.5029   6.3354   3.9337   12.555   7.6981   84.756   26.953  111.994   37.824 -27.23749 46.44543 
1 1 1   28   21   27 o   45.751   20.451  -0.7472   2.9317  -3.2350   3.8294   2.7756   4.5568   45.558   21.426   68.651   27.835 -23.09312 35.12629 
1 1 1   28   21   28 o   83.873   25.041   6.2692   3.4601   8.9897   3.9248  -3.2206   7.3304   99.832   25.572   64.925   30.243 34.90704 39.60459 
1 1 1   28   21   29 o  110.839   19.160   10.392   3.1329   13.976   4.0232   4.8694   4.9936  127.550   21.363   77.784   29.867 49.76555 36.72015 
1 1 1   28   21   30 o   66.399   23.590   3.5854   3.0112   2.7315   3.8865   4.8678   4.7627   64.965   25.927   76.911   29.254 -11.94609 39.08947 
1 1 1   28   21   31 o   88.340   24.034   7.0609   3.3363   5.0244   4.4138   9.7752   5.0957   76.644   28.369  100.120   30.501 -23.47604 41.65480 
1 1 1   28   22    0 o  217.103   23.752   38.380   7.6526   38.380   7.6526   38.380   7.6526  217.103   23.752  217.103   23.752 0.000000 0.000000 
1 1 1   28   22    1 o  137.046   24.578   15.682   4.9662   15.859   6.9721   15.501   7.0758  133.413   34.033  131.620   34.648 1.793289 48.56691 
1 1 1   28   22    2 f  231.752   15.635   42.366   5.5137   43.783   7.7738   40.931   7.8215  232.223   22.139  223.876   23.160 8.346725 32.03920 
1 1 1   28   22    3 o  182.279   27.717   27.999   7.4895   0.0000   0.0000   27.999   7.4895  ?   ?   182.279   27.717 0.000000 27.71718 
1 1 1   28   22    4 o   79.963   25.026   5.2497   3.4035   9.2286   3.9030  -7.3787   6.9534  104.435   24.788   58.926   28.053 45.50846 37.43596 
1 1 1   28   22    5 o   64.204   24.836   2.4167   3.4719   2.1403   3.9379   3.3816   7.3578   65.368   26.094   84.681   34.969 -19.31261 43.63222 
1 1 1   28   22    6 o  228.578   15.950   41.297   5.5454   43.406   7.4292   38.644   8.3332  231.624   21.190  215.724   25.746 15.89919 33.34456 
1 1 1   28   22    7 o  100.709   23.054   8.5179   3.4771   5.6974   3.8900   19.727   7.7549   83.263   26.838  148.335   34.762 -65.07227 43.91692 
1 1 1   28   22    8 o  180.792   13.568   25.672   3.7272   27.019   4.2199   20.894   7.9483  184.969   15.035  152.640   34.794 32.32884 37.90334 
1 1 1   28   22    9 o   86.218   25.027   6.2573   3.4973   6.1200   3.9169   6.7970   7.7670   85.647   26.854   96.323   37.178 -10.67631 45.86222 
1 1 1   28   22   10 o  127.767   18.667   13.238   3.5428   10.822   3.9977   22.080   7.6473  113.378   23.795  158.096   32.682 -44.71789 40.42664 
1 1 1   28   22   11 o  103.744   24.423   9.1385   3.8139   9.1385   3.8139   0.0000   0.0000  103.744   24.423  ?   ?  0.000000 24.42294 
1 1 1   28   22   12 o   67.981   24.742   3.3030   3.3357   2.5832   3.6873   6.5467   7.8275   65.852   25.560   95.190   37.159 -29.33860 45.10150 
1 1 1   28   22   13 o  185.936   12.979   27.139   3.6707   27.143   4.0841   27.124   8.3724  185.374   14.510  175.236   32.408 10.13799 35.50823 
1 1 1   28   22   14 o  193.254   12.482   29.268   3.6724   31.258   4.1060   21.308   8.2105  199.338   13.538  152.336   35.815 47.00116 38.28855 
1 1 1   28   22   15 o   91.241   16.487   6.7804   2.2178   8.1359   2.3211  -7.4361   7.5172  100.437   15.605   61.228   29.155 39.20922 33.06808 
1 1 1   28   22   16 o  110.896   13.958   9.7999   2.3167   9.4442   2.4373   13.129   7.4568  108.479   15.088  118.607   37.030 -10.12794 39.98555 
1 1 1   28   22   17 o   76.661   19.014   4.9033   2.2203   4.6443   2.3283   7.5039   7.3767   74.519   19.996   96.295   36.460 -21.77676 41.58308 
1 1 1   28   22   18 o  145.050   11.045   16.477   2.4337   16.022   2.5522   21.035   8.0791  142.799   11.782  150.082   35.691 -7.282410 37.58530 
1 1 1   28   22   19 o  168.827   10.461   22.251   2.6899   22.051   2.8330   24.075   8.5712  167.863   11.089  160.455   35.808 7.407928 37.48528 
1 1 1   28   22   20 o   74.400   20.275   4.6548   2.3720   4.6722   2.4706   4.4498   8.4808   74.503   20.845   88.703   37.160 -14.20024 42.60718 
1 1 1   28   22   21 o   93.542   17.643   7.2248   2.4335   7.7579   2.5500   1.7901   8.1421   96.941   17.843   80.735   35.160 16.20604 39.42826 
1 1 1   28   22   22 o  138.074   12.390   15.070   2.5906   14.452   2.7208   21.063   8.4769  134.848   13.358  147.074   37.531 -12.22626 39.83768 
1 1 1   28   22   23 o  102.360   16.726   8.5894   2.5300   8.0100   2.6541   14.353   8.3704   98.144   18.342  119.551   39.422 -21.40667 43.48055 
1 1 1   28   22   24 o  118.389   20.684   11.822   3.6117   11.822   3.6117   0.0000   0.0000  118.389   20.684  ?   ?  0.000000 20.68382 
1 1 1   28   22   25 o  137.753   16.213   15.437   3.3531   14.409   3.7274   19.802   7.6779  131.581   19.062  142.088   35.426 -10.50664 40.22904 
1 1 1   28   22   26 o   42.796   19.901  -2.2444   3.1526  -4.0030   3.5024   5.2620   7.2361   41.291   19.727   84.989   34.840 -43.69775 40.03717 
1 1 1   28   22   27 o   47.782   21.304  -0.6245   3.1595  -0.5180   3.5450  -1.0362   6.9668   50.894   22.637   67.550   30.733 -16.65599 38.17044 
1 1 1   28   22   28 o   63.403   23.235   3.0850   2.9488   3.2038   3.8000   2.9052   4.6753   66.989   25.963   68.900   28.097 -1.911652 38.25577 
1 1 1   28   22   29 o  105.708   20.270   9.6162   3.1604   6.9159   4.0534   13.803   5.0471   86.585   27.342  121.884   27.684 -35.29832 38.91042 
1 1 1   28   22   30 o  162.301   13.352   21.168   3.2875   19.688   4.1885   23.542   5.3054  153.443   18.188  165.335   21.471 -11.89136 28.13916 
1 1 1   28   23    0 o   76.828   42.857   7.1490   7.5065   7.1490   7.5065   7.1490   7.5065   76.828   42.857   76.828   42.857 0.000000 0.000000 
1 1 1   28   23    1 o   62.213   27.469  -0.6888   5.1268  -5.3693   7.4312   3.5623   7.0821   64.681   30.236   84.009   34.456 -19.32804 45.84151 
1 1 1   28   23    2 o  133.186   25.924   15.019   5.0947   14.033   7.3851   15.915   7.0374  124.180   36.460  133.038   34.329 -8.857635 50.07871 
1 1 1   28   23    3 o  110.606   28.907   10.630   4.9484   14.964   7.1251   6.5919   6.8776  128.576   35.183   93.515   35.253 35.06028 49.80577 
1 1 1   28   23    4 o   75.981   29.271   3.7269   4.8075   5.5820   6.6319   1.6724   6.9792   89.174   34.372   78.029   33.244 11.14503 47.81839 
1 1 1   28   23    5 o  205.957   25.369   35.303   7.8285   0.0000   0.0000   35.303   7.8285  ?   ?   205.957   25.369 0.000000 25.36945 
1 1 1   28   23    6 o   86.905   29.321   6.1902   4.6258   5.4107   5.9065   7.4267   7.4392   86.398   32.646   97.564   36.687 -11.16625 49.10883 
1 1 1   28   23    7 o  122.954   19.459   12.346   3.5402   15.326   4.0294   2.2607   7.4128  137.133   19.768   81.214   34.418 55.91959 39.69113 
1 1 1   28   23    8 o  233.673   11.050   42.410   3.9524   44.918   4.6092   35.444   7.6823  239.641   12.610  206.470   24.805 33.17137 27.82670 
1 1 1   28   23    9 o  220.346   11.544   37.869   3.8798   41.859   4.5669   27.519   7.3550  231.137   12.961  179.853   27.599 51.28430 30.49064 
1 1 1   28   23   10 o  154.894   17.880   19.319   4.1612   19.319   4.1612   0.0000   0.0000  154.894   17.880  ?   ?  0.000000 17.87990 
1 1 1   28   23   11 o  158.068   15.186   19.851   3.6289   20.726   4.2173   17.355   7.1223  160.630   17.433  138.315   33.904 22.31493 38.12355 
1 1 1   28   23   12 o  159.342   14.856   20.150   3.5816   22.087   4.1834   14.833   6.9314  166.140   16.676  127.171   34.661 38.96926 38.46379 
1 1 1   28   23   13 o  200.059   12.451   31.383   3.7938   39.339   4.4210   9.1565   7.3892  223.854   12.958  102.752   36.906 121.1025 39.11471 
1 1 1   28   23   14 o   56.474   23.551   0.9538   3.3845   3.9367   3.9498  -7.2874   6.5653   73.190   26.880   56.230   26.904 16.96064 38.03123 
1 1 1   28   23   15 o   61.041   24.268   1.9753   3.3931   3.6886   3.8999  -3.3609   6.8827   71.679   26.639   64.759   29.865 6.920212 40.01977 
1 1 1   28   23   16 o  221.953   8.4031   38.090   2.8548   41.006   3.0693   19.388   7.7719  230.207   8.7108  144.040   35.483 86.16687 36.53685 
1 1 1   28   23   17 o   54.194   20.333   1.8993   2.2826   2.5411   2.4107  -3.6620   7.0964   59.053   21.094   65.029   30.107 -5.975895 36.76118 
1 1 1   28   23   18 f  198.229   9.4365   30.483   2.8632   32.566   3.0693   16.527   7.9464  204.781   9.7923  130.767   37.657 74.01451 38.90982 
1 1 1   28   23   19 o  159.760   10.661   19.966   2.5920   20.912   2.7357   11.661   8.1052  163.404   11.002  110.814   38.762 52.58950 40.29309 
1 1 1   28   23   20 o  140.983   12.042   15.677   2.5736   15.061   2.6953   22.042   8.6631  137.856   12.924  150.554   37.682 -12.69841 39.83683 
1 1 1   28   23   21 o  131.890   13.016   13.818   2.5933   13.738   2.7279   14.569   8.3585  131.215   13.789  120.580   39.376 10.63561 41.72094 
1 1 1   28   23   22 o  114.485   15.797   10.648   2.6944   10.702   2.8752   10.259   7.7202  114.295   16.948  103.908   37.668 10.38696 41.30552 
1 1 1   28   23   23 o   81.928   25.825   5.8691   3.6172   5.8691   3.6172   0.0000   0.0000   81.928   25.825  ?   ?  0.000000 25.82454 
1 1 1   28   23   24 o  134.852   16.439   14.848   3.3229   15.613   3.7124   11.764   7.4516  137.456   18.084  108.257   37.206 29.19893 41.36794 
1 1 1   28   23   25 o   58.905   23.244   2.0963   3.0913   1.7113   3.4868   3.5105   6.6831   59.147   24.208   78.113   32.868 -18.96590 40.82126 
1 1 1   28   23   26 o  122.004   17.702   12.372   3.2092   12.378   3.6213   12.348   6.9273  120.576   20.346  109.974   35.844 10.60145 41.21569 
1 1 1   28   23   27 o   77.122   24.298   5.2539   3.2026   7.6063   3.6258  -3.0955   6.8309   91.569   25.115   62.437   29.121 29.13196 38.45495 
1 1 1   28   23   28 o   49.448   21.813  -0.2089   3.2255  -0.3455   3.6075   0.3351   7.2016   51.560   22.890   70.577   31.761 -19.01662 39.15009 
1 1 1   28   24    0 o   52.709   33.299   1.4710   5.7353   1.4710   5.7353   1.4710   5.7353   52.709   33.299   52.709   33.299 0.000000 0.000000 
1 1 1   28   24    1 o  101.872   27.051   8.9645   4.2890   12.414   6.1704   5.7401   5.9658  117.623   32.955   87.631   32.873 29.99176 46.54750 
1 1 1   28   24    2 o  221.616   14.068   38.651   4.7474   33.995   6.7021   43.340   6.7257  203.883   21.815  232.107   19.101 -28.22339 28.99528 
1 1 1   28   24    3 o   97.177   27.172   8.1444   4.1992   4.6023   5.9655   11.623   5.9121   83.216   32.453  114.059   32.364 -30.84337 45.83232 
1 1 1   28   24    4 o  246.360   13.169   47.584   4.9478   55.585   7.1293   40.150   6.8724  263.811   17.759  222.528   20.404 41.28290 27.05012 
1 1 1   28   24    5 o   94.954   33.975   7.4304   6.2566   0.0000   0.0000   7.4304   6.2566  ?   ?    94.954   33.975 0.000000 33.97527 
1 1 1   28   24    6 o  109.694   23.197   10.153   3.7731   11.178   4.6434   8.1617   6.4733  113.621   27.083   98.213   34.620 15.40757 43.95532 
1 1 1   28   24    7 o   73.771   25.157   4.3028   3.4056   3.8421   4.0559   5.4041   6.2708   73.332   27.184   86.881   33.442 -13.54865 43.09665 
1 1 1   28   24    8 o  102.386   25.923   9.0437   4.0666   8.5112   5.2722   9.8257   6.3896   98.663   31.186  105.061   34.433 -6.398018 46.45673 
1 1 1   28   24    9 o  104.635   31.428   9.7344   5.4381   9.7344   5.4381   0.0000   0.0000  104.635   31.428  ?   ?  0.000000 31.42793 
1 1 1   28   24   10 o  180.166   14.150   25.662   3.8707   31.241   4.7004   13.910   6.8223  198.221   15.619  122.824   34.737 75.39675 38.08690 
1 1 1   28   24   11 o  116.787   21.273   11.376   3.6625   16.562   4.3055  -2.2004   6.9667  141.856   20.418   67.663   30.765 74.19371 36.92345 
1 1 1   28   24   12 o  135.847   18.203   15.006   3.6898   13.382   4.2911   19.614   7.2275  125.974   23.106  146.996   32.939 -21.02197 40.23516 
1 1 1   28   24   13 o  108.832   22.730   10.039   3.6642   13.508   4.3522   1.5943   6.7903  126.380   23.359   75.837   32.562 50.54293 40.07423 
1 1 1   28   24   14 o   98.376   24.016   8.3223   3.5847   9.0289   4.2694   6.6342   6.5993  101.448   27.014   91.329   34.508 10.11924 43.82390 
1 1 1   28   24   15 o   74.693   25.450   4.5110   3.4855   3.9489   4.1080   5.9557   6.5855   73.465   27.333   88.640   34.228 -15.17475 43.80260 
1 1 1   28   24   16 o  194.012   13.032   29.682   3.8474   38.677   4.5871   8.3377   7.0657  221.290   13.609   98.071   35.962 123.2195 38.45079 
1 1 1   28   24   17 o  150.934   12.039   17.940   2.7582   19.303   2.9883   10.099   7.1679  156.394   12.590  104.669   36.461 51.72517 38.57335 
1 1 1   28   24   18 o   80.976   19.605   5.5303   2.4040   6.1409   2.5365   0.1409   7.5358   85.318   19.805   74.395   33.052 10.92307 38.53146 
1 1 1   28   24   19 o  194.882   9.5499   29.520   2.8487   30.613   3.0479   21.967   8.0111  198.039   10.088  151.922   35.149 46.11748 36.56808 
1 1 1   28   24   20 o  126.355   16.051   12.956   3.0343   15.328   3.2998  -0.0279   7.7205  137.615   15.962   74.079   33.146 63.53617 36.78886 
1 1 1   28   24   21 o  158.229   13.658   19.965   3.2755   21.937   3.6200   11.059   7.6927  165.530   14.432  106.265   37.710 59.26469 40.37746 
1 1 1   28   24   22 o   53.437   22.782   0.5957   3.2819   0.5957   3.2819   0.0000   0.0000   53.437   22.782  ?   ?  0.000000 22.78232 
1 1 1   28   24   23 o  212.373   9.6631   35.185   3.1411   38.938   3.4655   17.901   7.4362  223.199   10.144  133.725   35.672 89.47330 37.08617 
1 1 1   28   24   24 o   70.576   24.870   4.1029   3.3401   3.9325   3.8636   4.6070   6.6457   70.977   26.488   81.089   33.332 -10.11211 42.57484 
1 1 1   28   24   25 o  139.753   17.823   16.212   3.7258   21.814   4.4695   3.4531   6.7453  162.002   18.348   77.490   32.836 84.51147 37.61435 
1 1 1   28   24   26 o   57.666   23.848   1.5338   3.4291   0.5871   3.9530   4.4122   6.8927   56.914   24.642   80.274   33.554 -23.35942 41.63030 
1 1 1   28   24   27 o  127.424   18.879   13.704   3.5707   18.533   4.1704   0.4427   6.9112  148.557   18.759   69.694   31.259 78.86291 36.45586 
1 1 1   28   25    0 o  102.477   38.805   11.586   5.7106   11.586   5.7106   11.586   5.7106  102.477   38.805  102.477   38.805 0.000000 0.000000 
1 1 1   28   25    1 o  172.477   16.570   23.795   4.3207   25.129   6.2074   22.541   6.0178  173.361   24.040  163.622   24.806 9.738831 34.54397 
1 1 1   28   25    2 o  277.079   11.926   59.879   5.0579   59.519   7.4473   60.187   6.8910  272.515   17.955  275.041   16.444 -2.525757 24.34719 
1 1 1   28   25    3 o  152.681   19.673   19.027   4.4905   14.757   6.7813   22.362   5.9927  126.842   34.164  162.905   24.818 -36.06279 42.22682 
1 1 1   28   25    4 o   90.905   29.030   7.0952   4.5595   11.699   7.1643   3.9613   5.9112  112.761   36.429   80.203   31.985 32.55833 48.47849 
1 1 1   28   25    5 o  188.452   17.544   28.539   5.0023   30.164   7.8058   27.407   6.5163  187.234   28.105  180.936   24.131 6.298233 37.04295 
1 1 1   28   25    6 o   74.368   26.259   4.2952   3.7257   4.7705   4.6695   3.4625   6.1804   79.410   29.217   79.340   32.323 0.7066345E-01 43.57132 
1 1 1   28   25    7 o  130.499   18.595   13.892   3.6092   16.372   4.4875   9.3495   6.0738  140.464   21.561  102.377   33.573 38.08670 39.89986 
1 1 1   28   25    8 o   54.827   24.425  -0.9133   4.1434  -0.9133   4.1434   0.0000   0.0000   54.827   24.425  ?   ?  0.000000 24.42461 
1 1 1   28   25    9 o  115.858   21.570   11.242   3.6843   8.2021   4.4010   18.362   6.7358   96.720   28.075  142.859   31.639 -46.13956 42.29878 
1 1 1   28   25   10 o  172.302   14.795   23.597   3.8641   27.637   4.6186   14.174   7.0544  185.792   16.410  122.976   35.500 62.81538 39.10935 
1 1 1   28   25   11 o   56.806   23.947   0.7978   3.5581   0.6726   4.2809   1.0776   6.3989   60.752   25.963   72.645   31.402 -11.89294 40.74564 
1 1 1   28   25   12 o  201.036   15.501   32.214   4.7331   35.614   6.1918   27.435   7.3412  209.027   19.581  177.837   27.887 31.19040 34.07454 
1 1 1   28   25   13 o  131.682   22.631   14.614   4.3971   16.161   5.6435   12.226   7.0145  135.464   28.138  113.930   35.967 21.53407 45.66591 
1 1 1   28   25   14 o   63.250   26.328   1.5066   4.2189   3.2505   5.6132  -0.7574   6.3959   75.824   30.838   67.592   30.211 8.232773 43.17049 
1 1 1   28   25   15 o  148.048   20.445   18.166   4.5094   19.468   6.0647   16.555   6.7438  148.959   27.616  133.387   33.170 15.57143 43.16182 
1 1 1   28   25   16 o   83.437   31.099   5.5430   5.3225   12.508   8.4546   0.9703   6.8504  113.066   39.586   73.525   32.129 39.54115 50.98355 
1 1 1   28   25   17 o   55.747   25.117  -1.2347   4.5193   4.0485   5.9315  -8.5457   6.9775   79.050   31.860   55.792   26.958 23.25806 41.73472 
1 1 1   28   25   18 o   88.982   24.545   6.9498   3.4517   6.6962   3.9861   7.7100   6.9009   87.050   27.057   93.892   35.329 -6.841087 44.49985 
1 1 1   28   25   19 o   40.999   18.466  -0.9156   2.4401  -1.2593   2.5935   1.7355   7.2033   41.164   18.737   75.875   33.056 -34.71161 37.99741 
1 1 1   28   25   20 o  144.784   12.714   16.669   2.7890   14.980   3.0324   25.948   7.1062  136.301   14.771  169.880   28.327 -33.57860 31.94672 
1 1 1   28   25   21 o   39.013   18.249  -2.2489   2.7145  -2.2489   2.7145   0.0000   0.0000   39.013   18.249  ?   ?  0.000000 18.24886 
1 1 1   28   25   22 o   64.234   22.436   3.3041   2.7149   3.1535   2.9262   4.2362   7.2776   63.950   23.189   81.666   34.328 -17.71615 41.42662 
1 1 1   28   25   23 o   50.629   21.131   0.8759   2.7280   3.1430   2.9735 -11.1810   6.8572   63.907   23.345   50.891   25.043 13.01561 34.23660 
1 1 1   28   25   24 o   99.370   21.801   8.6366   3.2248   7.2826   3.6551   13.393   6.8505   89.498   25.466  114.013   35.476 -24.51501 43.66949 
1 1 1   28   25   25 o   89.914   23.673   7.2565   3.3027   6.4883   3.7564   9.8728   6.9327   84.343   26.274   98.787   35.713 -14.44450 44.33676 
1 1 1   28   26    0 o  157.918   31.115   22.211   6.6895   22.211   6.6895   22.211   6.6895  157.918   31.115  157.918   31.115 0.000000 0.000000 
1 1 1   28   26    1 o  129.662   24.192   14.288   4.6247   12.273   6.7737   16.047   6.3295  115.015   35.192  133.395   31.503 -18.38012 47.23270 
1 1 1   28   26    2 o  137.505   24.310   16.044   4.9293   15.115   7.1308   16.894   6.8217  127.142   35.358  135.928   33.097 -8.785278 48.43163 
1 1 1   28   26    3 o   66.074   27.875   1.3258   4.8266   7.7034   7.4272  -3.3364   6.3504   96.871   36.607   61.998   28.625 34.87330 46.46983 
1 1 1   28   26    4 o  178.370   19.380   25.922   5.2060   26.710   8.2583   25.402   6.7064  172.321   32.502  172.408   26.241 -0.8723450E-01 41.77300 
1 1 1   28   26    5 f   77.971   29.392   4.4333   4.7807   6.4949   7.9882   3.2828   5.9674   93.850   37.259   77.662   31.714 16.18846 48.92928 
1 1 1   28   26    6 o  292.497   21.123   70.060   9.3931   70.060   9.3931   0.0000   0.0000  292.497   21.123  ?   ?  0.000000 21.12260 
1 1 1   28   26    7 o   73.662   29.454   3.1970   5.0259   3.1970   5.0259   0.0000   0.0000   73.662   29.454  ?   ?  0.000000 29.45400 
1 1 1   28   26    8 o   65.873   26.371   2.3513   4.0344   2.1651   5.1362   2.6512   6.5187   70.298   29.139   77.551   32.538 -7.252541 43.67802 
1 1 1   28   26    9 o   86.680   27.149   6.4793   4.0046   10.273   5.0693   0.1831   6.5311  106.906   29.841   70.688   31.117 36.21842 43.11361 
1 1 1   28   26   10 o   95.103   26.744   7.9410   4.0558   4.7563   5.0872   13.496   6.7189   79.951   30.276  119.815   34.663 -39.86314 46.02338 
1 1 1   28   26   11 o  174.449   16.341   24.459   4.3126   35.555   5.5552   7.6309   6.8415  209.911   17.448   94.849   35.277 115.0620 39.35616 
1 1 1   28   26   12 o   66.233   26.213   2.5953   3.9422   4.0901   5.0551   0.2753   6.2976   76.851   29.901   69.530   30.583 7.320808 42.77091 
1 1 1   28   26   13 o   60.911   25.259   1.4598   3.8620  -2.2230   5.0281   6.7585   6.0310   56.436   25.842   89.765   33.174 -33.32841 42.05111 
1 1 1   28   26   14 o   44.889   21.194  -3.6062   3.8135  -5.9138   4.9130  -0.1087   6.0485   47.988   23.043   67.039   29.706 -19.05098 37.59550 
1 1 1   28   26   15 o  100.530   28.142   9.1353   4.5017  -3.1934   6.1564   23.303   6.5996   60.349   27.976  162.413   27.531 -102.0634 39.25087 
1 1 1   28   26   16 o  105.128   25.509   9.8014   4.0629   6.4736   4.9640   16.555   7.0716   86.271   30.326  130.631   34.758 -44.36019 46.12778 
1 1 1   28   26   17 o  196.960   14.326   31.006   4.2894   35.976   5.2709   21.261   7.3807  210.830   16.464  149.694   33.092 61.13631 36.96174 
1 1 1   28   26   18 o  175.558   14.601   24.737   3.8879   29.147   4.6774   14.880   6.9930  189.617   16.274  122.358   35.352 67.25879 38.91808 
1 1 1   28   26   19 o   86.671   25.078   6.6978   3.5167   9.0568   4.2409   1.5049   6.2922   99.634   27.094   71.254   30.970 28.38048 41.14831 
1 1 1   28   26   20 o  152.768   13.384   18.669   3.0980   18.669   3.0980   0.0000   0.0000  152.768   13.384  ?   ?  0.000000 13.38387 
1 1 1   28   26   21 o   52.618   21.603   1.2074   2.7873   1.2074   2.7873   0.0000   0.0000   52.618   21.603  ?   ?  0.000000 21.60261 
1 1 1   28   26   22 o  101.967   18.173   8.7544   2.7323   10.155   2.9878   1.6000   6.7521  109.864   18.420   72.407   31.762 37.45715 36.71643 
1 1 1   28   26   23 o   75.912   21.621   5.0468   2.6334   5.5716   2.8341   1.7299   7.1248   79.434   22.362   73.733   32.477 5.700859 39.43148 
1 1 1   28   27    0 o  157.837   37.525   23.557   7.8685   23.557   7.8685   23.557   7.8685  157.837   37.525  157.837   37.525 0.000000 0.000000 
1 1 1   28   27    1 o  108.709   30.364   10.681   5.2467   11.830   7.7612   9.7128   7.1201  111.807   37.978  103.426   36.322 8.380310 52.55070 
1 1 1   28   27    2 o  158.149   23.119   21.034   5.4311   13.129   7.7933   28.498   7.5728  116.899   38.014  180.750   28.301 -63.85090 47.39233 
1 1 1   28   27    3 o  229.758   16.425   42.275   5.7381   54.898   8.4778   31.604   7.7949  257.879   21.679  191.109   27.435 66.77017 34.96640 
1 1 1   28   27    4 o   94.654   31.005   7.9276   5.1809  -0.1393   7.5477   15.115   7.1244   74.139   33.001  126.235   35.426 -52.09676 48.41582 
1 1 1   28   27    5 o  219.784   25.537   41.129   8.4308   41.129   8.4308   0.0000   0.0000  219.784   25.537  ?   ?  0.000000 25.53728 
1 1 1   28   27    6 o   67.679   27.247   2.5004   4.3333   9.5672   5.9907  -5.2545   6.2756  102.314   33.332   57.559   27.180 44.75573 43.00893 
1 1 1   28   27    7 o   84.819   26.205   6.2206   3.7455   11.678   4.6141  -4.3227   6.4132  115.123   26.703   59.940   28.042 55.18301 38.72196 
1 1 1   28   27    8 o  100.119   25.675   8.8066   3.9533   9.6817   5.1153   7.5086   6.2297  103.188   30.358   93.215   33.830 9.972572 45.45438 
1 1 1   28   27    9 o  138.296   20.306   15.908   4.1703   22.338   5.4192   6.5702   6.5306  163.030   22.302   89.856   34.237 73.17428 40.85986 
1 1 1   28   27   10 o  191.102   13.741   28.992   3.9925   36.137   5.0244   16.753   6.5762  212.408   15.562  134.089   32.402 78.31906 35.94584 
1 1 1   28   27   11 o   67.114   25.647   3.1004   3.6714   2.3438   4.4643   4.6813   6.4530   67.201   27.436   82.613   33.254 -15.41151 43.11040 
1 1 1   28   27   12 o  100.999   24.001   8.9158   3.6556   11.088   4.5547   4.9825   6.1283  111.273   27.014   82.583   32.683 28.69048 42.40152 
1 1 1   28   27   13 o   52.522   23.148  -0.3162   3.6242  -0.1516   4.4053  -0.6610   6.3752   57.975   25.537   66.768   29.980 -8.793255 39.38171 
1 1 1   28   27   14 o  167.658   16.723   22.853   4.2343   30.209   5.7163   13.910   6.3030  190.774   19.868  120.317   33.161 70.45710 38.65677 
1 1 1   28   27   15 o  145.497   17.292   17.351   3.7756   24.938   4.6665   2.9703   6.4246  174.451   17.722   76.234   32.160 98.21687 36.71988 
1 1 1   28   27   16 o   51.839   22.721  -0.1040   3.4493   3.6696   4.2013  -7.9086   6.0420   71.059   27.367   51.128   24.796 19.93137 36.92908 
1 1 1   28   27   17 o   75.193   25.724   4.8136   3.5611   6.3621   4.3184   1.5228   6.2954   84.384   28.331   71.209   30.964 13.17509 41.96898 
1 1 1   28   27   18 o  149.518   15.988   18.220   3.6023   24.298   4.3908   5.7034   6.3007  172.303   16.865   83.995   33.172 88.30742 37.21260 
1 1 1   28   27   19 f  180.227   16.798   26.596   4.5806   26.596   4.5806   0.0000   0.0000  180.227   16.798  ?   ?  0.000000 16.79821 
1 1 1   28   27   20 o  132.698   22.509   15.298   4.4085   15.298   4.4085   0.0000   0.0000  132.698   22.509  ?   ?  0.000000 22.50946 
1 1 1   28   28    0 o   46.492   31.840  -3.3675   7.2115  -3.3675   7.2115  -3.3675   7.2115   46.492   31.840   46.492   31.840 0.000000 0.000000 
1 1 1   28   28    1 o   72.758   29.632   2.9802   5.1919   9.9763   7.4224  -3.7223   7.2650  103.362   37.003   65.011   30.224 38.35045 47.77791 
1 1 1   28   28    2 o  156.467   22.547   20.673   5.2439   31.162   7.7807   11.943   7.0983  188.394   27.819  111.294   36.284 77.10036 45.72135 
1 1 1   28   28    3 o   55.381   26.841  -9.1311   7.0509  -9.1311   7.0509   0.0000   0.0000   55.381   26.841  ?   ?  0.000000 26.84130 
1 1 1   28   28    4 o  220.750   24.854   41.656   8.2516   41.656   8.2516   0.0000   0.0000  220.750   24.854  ?   ?  0.000000 24.85354 
1 1 1   28   28    5 o  121.901   27.753   13.309   5.0621   21.778   7.3047   5.4832   7.0215  153.435   32.133   86.692   34.761 66.74300 47.33757 
1 1 1   28   28    6 o  275.554   12.315   59.687   5.1940   60.937   6.7566   57.881   8.1209  275.459   16.095  264.926   20.178 10.53262 25.81137 
1 1 1   28   28    7 o   63.219   26.517   1.4961   4.3273   0.3672   5.5767   3.2046   6.8603   65.827   28.871   79.031   33.281 -13.20400 44.05816 
1 1 1   28   28    8 o  217.809   12.872   37.535   4.2722   44.449   5.2579   24.103   7.3288  235.979   14.629  162.447   30.597 73.53210 33.91472 
1 1 1   28   28    9 o  140.589   20.453   16.566   4.2721   14.926   5.3957   19.322   6.9941  128.512   28.204  143.163   32.642 -14.65005 43.13940 
1 1 1   28   28   10 o  156.334   18.651   20.169   4.3748   23.770   5.5755   14.400   7.0569  167.392   22.317  120.634   35.704 46.75798 42.10480 
1 1 1   28   28   11 o  117.517   22.444   11.891   3.8898   16.275   4.8554   4.0338   6.4994  136.913   24.046   79.806   32.902 57.10642 40.75272 
1 1 1   28   28   12 o   74.049   26.630   4.4630   3.8484   3.6929   4.7418   5.9491   6.5869   73.031   28.798   86.167   33.952 -13.13564 44.52047 
1 1 1   28   28   13 o   62.758   26.182   1.6957   4.1852   6.6689   5.6178  -4.5072   6.2740   87.154   32.050   57.853   27.275 29.30030 42.08485 
1 1 1   28   28   14 o   73.857   26.195   4.5247   3.7113   5.1834   4.4922   3.1086   6.5868   78.679   28.701   76.704   32.472 1.975052 43.33826 
1 1 1   28   28   15 o   91.402   25.535   7.5344   3.7101   13.079   4.5473  -3.5049   6.4165  121.024   25.359   60.174   28.118 60.84956 37.86483 
1 1 1   28   28   16 o  126.947   19.681   13.605   3.7004   16.737   4.4375   6.4554   6.7043  139.916   21.401   87.152   34.281 52.76440 40.41296 
1 1 1   28   28   17 o  148.671   16.704   18.149   3.7354   19.326   4.5709   15.783   6.4815  151.153   20.267  126.579   33.084 24.57436 38.79863 
1 1 1   28   29    0 o   79.721   42.799   8.5278   7.1927   8.5278   7.1927   8.5278   7.1927   79.721   42.799   79.721   42.799 0.000000 0.000000 
1 1 1   28   29    1 o  258.847   20.305   55.566   7.9805   55.566   7.9805   0.0000   0.0000  258.847   20.305  ?   ?  0.000000 20.30549 
1 1 1   28   29    2 o   49.079   24.311 -13.2327   6.8429 -13.2327   6.8429   0.0000   0.0000   49.079   24.311  ?   ?  0.000000 24.31102 
1 1 1   28   29    3 o   90.289   29.958   7.3621   4.8310   4.6634   7.1428   9.6375   6.5587   83.628   34.487  100.658   34.888 -17.03033 49.05582 
1 1 1   28   29    4 o   72.406   28.881   3.4279   4.8202  -2.4997   7.0463   8.6417   6.6084   65.636   30.251   96.532   34.873 -30.89694 46.16529 
1 1 1   28   29    5 o   74.337   29.282   3.8576   4.8979   0.4575   6.9765   7.1622   6.8779   71.686   31.828   91.130   35.037 -19.44389 47.33479 
1 1 1   28   29    6 o   52.721   24.133  -1.8891   4.3803  -6.3392   5.6177   5.0126   6.9960   51.236   24.613   84.100   34.341 -32.86390 42.25024 
1 1 1   28   29    7 o  101.884   27.423   9.4569   4.3710   16.347   5.7819   0.2669   6.6774  133.475   29.120   69.869   31.074 63.60569 42.58572 
1 1 1   28   29    8 o  113.529   23.621   11.276   3.9711   18.534   4.9509  -1.8183   6.6496  146.940   22.748   64.966   29.737 81.97396 37.43944 
1 1 1   28   29    9 f   80.785   26.834   5.7218   3.8756   4.7427   4.6476   7.9566   7.0216   77.081   28.995   93.569   35.537 -16.48870 45.86490 
1 1 1   28   29   10 o   85.882   28.036   6.6377   4.2375   9.8625   5.4598   1.7524   6.7199  101.648   31.678   73.434   31.961 28.21334 44.99999 
1 1 1   28   29   11 f  143.257   25.388   18.168   5.3631   19.313   7.8299   17.157   7.3609  137.891   36.519  130.356   35.797 7.534882 51.13800 
1 1 1   28   29   12 o   60.314   26.053   0.7704   4.3983   3.3242   5.7276  -2.8997   6.8663   74.380   30.795   63.390   29.441 10.98988 42.60457 
1 1 1   28   29   13 o  139.279   19.499   16.306   4.0428   18.831   4.8373   10.456   7.3627  148.110   22.007  101.993   36.815 46.11750 42.89066 
1 1 1   28   29   14 o  129.685   20.571   14.323   3.9471   13.267   4.6570   17.016   7.4374  121.281   25.875  128.621   36.232 -7.340172 44.52261 
1 1 1   28   30    0 o   42.424   29.406  -4.1919   6.6090  -4.1919   6.6090  -4.1919   6.6090   42.424   29.406   42.424   29.406 0.000000 0.000000 
1 1 1   28   30    1 o  230.838   22.249   45.251   7.7640   0.0000   0.0000   45.251   7.7640  ?   ?   230.838   22.249 0.000000 22.24947 
1 1 1   28   30    2 o   71.498   31.906   0.3789   7.1035   0.0000   0.0000   0.3789   7.1035  ?   ?    71.498   31.906 0.000000 31.90606 
1 1 1   28   30    3 o   58.764   26.241  -0.5198   4.8134   0.4826   6.9879  -1.4249   6.6398   71.264   31.735   65.552   29.893 5.711685 43.59741 
1 1 1   28   30    4 o   61.862   27.144   0.3437   4.9348  -5.8032   7.0463   6.2606   6.9133   59.343   28.249   87.289   34.660 -27.94638 44.71320 
1 1 1   28   30    5 o   55.527   25.347  -1.6706   4.7886   2.7002   6.9537  -5.6131   6.6041   76.619   32.926   57.462   27.352 19.15657 42.80473 
1 1 1   28   30    6 o  176.210   17.878   25.582   4.7552   26.019   6.0489   24.875   7.6936  173.566   23.362  161.830   32.193 11.73553 39.77668 
1 1 1   28   30    7 o   68.181   27.387   2.9322   4.3671   4.0986   5.7682   1.3656   6.6846   77.150   31.304   72.071   31.609 5.079460 44.48684 
1 1 1   28   30    8 o  126.355   24.645   14.139   4.5952   18.535   6.1133   8.4281   6.9673  141.477   29.199   94.561   35.515 46.91621 45.97681 
1 1 1   28   30    9 o  150.878   17.899   18.843   4.0530   21.472   4.9547   13.524   7.0464  159.147   20.841  114.879   36.017 44.26735 41.61249 
1 1 1   29    0    1 o   21.167   15.115  -3.2850   2.2057  -3.2850   2.2057  -3.2850   2.2057   21.167   15.115   21.167   15.115 0.000000 0.000000 
1 1 1   29    0    2 o   52.149   24.852   3.1146   2.2686   3.1146   2.2686   3.1146   2.2686   52.149   24.852   52.149   24.852 0.000000 0.000000 
1 1 1   29    0    3 o  162.106   10.887   20.467   2.6733   20.467   2.6733   20.467   2.6733  162.106   10.887  162.106   10.887 0.000000 0.000000 
1 1 1   29    0    4 o   71.791   22.930   5.0439   2.2205   5.0439   2.2205   5.0439   2.2205   71.791   22.930   71.791   22.930 0.000000 0.000000 
1 1 1   29    0    5 o  229.395   7.3244   40.475   2.5658   40.475   2.5658   40.475   2.5658  229.395   7.3244  229.395   7.3244 0.000000 0.000000 
1 1 1   29    0    6 o   78.107   18.044   5.3946   1.8773   5.3946   1.8773   5.3946   1.8773   78.107   18.044   78.107   18.044 0.000000 0.000000 
1 1 1   29    0    7 o  192.835   8.9225   28.725   2.6207   28.725   2.6207   28.725   2.6207  192.835   8.9225  192.835   8.9225 0.000000 0.000000 
1 1 1   29    0    8 o   25.435   16.772  -0.3310   1.6766  -0.3310   1.6766  -0.3310   1.6766   25.435   16.772   25.435   16.772 0.000000 0.000000 
1 1 1   29    0    9 o   38.328   23.756   0.8505   2.7758   0.8505   2.7758   0.8505   2.7758   38.328   23.756   38.328   23.756 0.000000 0.000000 
1 1 1   29    0   10 o   56.037   27.896   3.6402   2.9026   3.6402   2.9026   3.6402   2.9026   56.037   27.896   56.037   27.896 0.000000 0.000000 
1 1 1   29    0   11 o  245.893   10.665   46.740   3.9969   46.740   3.9969   46.740   3.9969  245.893   10.665  245.893   10.665 0.000000 0.000000 
1 1 1   29    0   12 o   57.092   29.853   3.7690   3.4244   3.7690   3.4244   3.7690   3.4244   57.092   29.853   57.092   29.853 0.000000 0.000000 
1 1 1   29    0   13 o  294.505   10.664   66.945   4.7928   66.945   4.7928   66.945   4.7928  294.505   10.664  294.505   10.664 0.000000 0.000000 
1 1 1   29    0   14 o  219.638   13.505   37.613   4.5007   37.613   4.5007   37.613   4.5007  219.638   13.505  219.638   13.505 0.000000 0.000000 
1 1 1   29    0   15 o   59.516   32.114   4.0663   4.0688   4.0663   4.0688   4.0663   4.0688   59.516   32.114   59.516   32.114 0.000000 0.000000 
1 1 1   29    0   16 o   50.000   30.112   2.1063   4.1838   2.1063   4.1838   2.1063   4.1838   50.000   30.112   50.000   30.112 0.000000 0.000000 
1 1 1   29    0   17 o  207.225   16.002   33.813   5.0061   33.813   5.0061   33.813   5.0061  207.225   16.002  207.225   16.002 0.000000 0.000000 
1 1 1   29    0   18 o   34.535   23.988  -3.6869   4.4569  -3.6869   4.4569  -3.6869   4.4569   34.535   23.988   34.535   23.988 0.000000 0.000000 
1 1 1   29    0   19 o  204.167   17.367   33.026   5.3368   33.026   5.3368   33.026   5.3368  204.167   17.367  204.167   17.367 0.000000 0.000000 
1 1 1   29    0   20 o   92.547   45.796   10.597   7.8042   10.597   7.8042   10.597   7.8042   92.547   45.796   92.547   45.796 0.000000 0.000000 
1 1 1   29    0   21 o  231.891   16.179   42.273   5.6785   42.273   5.6785   42.273   5.6785  231.891   16.179  231.891   16.179 0.000000 0.000000 
1 1 1   29    0   22 o   75.346   41.192   6.8253   6.7780   6.8253   6.7780   6.8253   6.7780   75.346   41.192   75.346   41.192 0.000000 0.000000 
1 1 1   29    0   23 f   72.340   40.888   6.0827   6.9496   6.0827   6.9496   6.0827   6.9496   72.340   40.888   72.340   40.888 0.000000 0.000000 
1 1 1   29    0   24 o   71.771   36.918   6.2343   5.1759   6.2343   5.1759   6.2343   5.1759   71.771   36.918   71.771   36.918 0.000000 0.000000 
1 1 1   29    0   26 o  131.944   32.637   16.151   5.7055   16.151   5.7055   16.151   5.7055  131.944   32.637  131.944   32.637 0.000000 0.000000 
1 1 1   29    0   27 o   37.850   24.649  -0.1126   3.4566  -0.1126   3.4566  -0.1126   3.4566   37.850   24.649   37.850   24.649 0.000000 0.000000 
1 1 1   29    0   28 o  100.602   26.705   9.4676   3.5529   9.4676   3.5529   9.4676   3.5529  100.602   26.705  100.602   26.705 0.000000 0.000000 
1 1 1   29    0   29 o   50.141   28.921   2.6536   3.5779   2.6536   3.5779   2.6536   3.5779   50.141   28.921   50.141   28.921 0.000000 0.000000 
1 1 1   29    0   30 o   89.183   39.097   9.4436   5.5709   9.4436   5.5709   9.4436   5.5709   89.183   39.097   89.183   39.097 0.000000 0.000000 
1 1 1   29    0   31 o   40.160   25.852   0.3175   3.6558   0.3175   3.6558   0.3175   3.6558   40.160   25.852   40.160   25.852 0.000000 0.000000 
1 1 1   29    0   32 o  168.732   14.564   22.624   3.6969   22.624   3.6969   22.624   3.6969  168.732   14.564  168.732   14.564 0.000000 0.000000 
1 1 1   29    0   33 o   70.191   29.653   5.6215   3.2190   5.6215   3.2190   5.6215   3.2190   70.191   29.653   70.191   29.653 0.000000 0.000000 
1 1 1   29    0   34 o  286.802   10.764   63.858   4.7102   63.858   4.7102   63.858   4.7102  286.802   10.764  286.802   10.764 0.000000 0.000000 
1 1 1   29    0   35 o   73.690   30.142   6.1477   3.3500   6.1477   3.3500   6.1477   3.3500   73.690   30.142   73.690   30.142 0.000000 0.000000 
1 1 1   29    0   36 o  114.868   22.024   11.533   3.4603   11.533   3.4603   11.533   3.4603  114.868   22.024  114.868   22.024 0.000000 0.000000 
1 1 1   29    0   37 o  112.148   34.376   12.934   5.1582   12.934   5.1582   12.934   5.1582  112.148   34.376  112.148   34.376 0.000000 0.000000 
1 1 1   29    0   38 o   67.236   33.336   5.7528   4.1383   5.7528   4.1383   5.7528   4.1383   67.236   33.336   67.236   33.336 0.000000 0.000000 
1 1 1   29    0   39 o   96.541   32.110   9.8998   4.2248   9.8998   4.2248   9.8998   4.2248   96.541   32.110   96.541   32.110 0.000000 0.000000 
1 1 1   29    0   40 o   37.214   24.347   0.0324   3.4302   0.0324   3.4302   0.0324   3.4302   37.214   24.347   37.214   24.347 0.000000 0.000000 
1 1 1   29    0   41 o   62.065   31.363   4.9695   3.6975   4.9695   3.6975   4.9695   3.6975   62.065   31.363   62.065   31.363 0.000000 0.000000 
1 1 1   29    1    0 o  170.372   10.852   22.577   2.8036   22.577   2.8036   22.577   2.8036  170.372   10.852  170.372   10.852 0.000000 0.000000 
1 1 1   29    1    1 f  100.859   11.126   7.9478   1.6890   6.2710   2.3575   9.7161   2.4209   87.948   18.116  110.905   14.617 -22.95675 23.27764 
1 1 1   29    1    2 o   88.100   12.539   6.1241   1.6432   7.2185   2.3249   5.0316   2.3227   94.863   16.617   78.497   19.435 16.36612 25.57061 
1 1 1   29    1    3 o  177.830   7.1359   24.292   1.9423   24.932   2.7549   23.660   2.7389  179.552   10.065  174.857   10.279 4.694717 14.38579 
1 1 1   29    1    4 o  124.013   8.9734   11.900   1.6918   12.202   2.3848   11.595   2.4004  124.920   12.647  121.645   13.098 3.275719 18.20737 
1 1 1   29    1    5 o  126.870   7.8726   12.422   1.5213   12.753   2.4155   12.204   1.9585  127.761   12.513  125.377   10.296 2.383301 16.20417 
1 1 1   29    1    6 o  274.452   6.7291   57.841   2.8268   56.479   5.7633   58.273   3.2438  269.339   14.028  275.331   7.6970 -5.992035 16.00117 
1 1 1   29    1    7 o  192.817   7.7636   28.582   2.2913   33.292   3.5229   25.130   3.0165  207.309   11.143  180.061   10.998 27.24806 15.65608 
1 1 1   29    1    8 o  433.496   6.6686  144.303   4.4247  162.068   8.2215  137.059   5.2499  457.790   11.733  422.131   8.1252 35.65945 14.27182 
1 1 1   29    1    9 o  240.672   7.1873   44.505   2.6477   44.925   3.9587   44.166   3.5614  241.220   10.722  239.359   9.7209 1.860931 14.47254 
1 1 1   29    1   10 o   81.366   12.556   5.2440   1.5134   5.5839   3.2078   5.1467   1.7165   82.607   23.966   80.170   14.523 2.437416 28.02245 
1 1 1   29    1   11 o  243.344   7.6063   45.526   2.8331   43.062   4.1147   47.746   3.9066  236.003   11.391  248.745   10.261 -12.74115 15.33070 
1 1 1   29    1   12 o  154.184   11.109   18.466   2.6041   19.444   3.8319   17.626   3.5497  156.978   16.180  149.507   15.749 7.471436 22.57905 
1 1 1   29    1   13 o  234.885   8.4972   42.473   3.0549   41.712   4.4895   43.129   4.1689  231.597   12.713  236.109   11.536 -4.512390 17.16690 
1 1 1   29    1   14 o  209.794   9.4941   33.938   3.0487   36.394   4.5988   32.012   4.0721  215.880   13.993  202.639   13.201 13.24135 19.23721 
1 1 1   29    1   15 f  104.078   18.465   8.7635   2.8339   7.2605   4.2275   9.9899   3.8189   93.380   27.634  109.806   23.435 -16.42559 36.23318 
1 1 1   29    1   16 o  121.944   16.744   11.858   3.0428   13.364   4.5650   10.654   4.0818  127.044   24.362  113.166   24.291 13.87819 34.40301 
1 1 1   29    1   17 o   47.813   21.279  -0.9742   3.1367   5.9693   4.7428  -6.3725   4.1819   87.079   29.688   43.015   20.805 44.06335 36.25200 
1 1 1   29    1   18 o  135.128   16.386   14.509   3.3198   13.354   4.9167   15.477   4.5006  126.124   26.320  137.673   22.106 -11.54956 34.37133 
1 1 1   29    1   19 o  183.098   15.102   26.372   4.1947   19.849   7.4741   29.372   5.0682  150.983   33.241  192.472   17.391 -41.48871 37.51588 
1 1 1   29    1   20 o  164.402   20.374   21.796   5.0170   26.127   7.3480   18.014   6.8667  176.455   28.152  144.129   31.964 32.32587 42.59376 
1 1 1   29    1   21 o  164.637   17.403   21.581   4.3191   21.327   9.3610   21.650   4.8683  152.614   39.697  163.992   19.795 -11.37804 44.35915 
1 1 1   29    1   22 o  179.211   14.012   25.216   3.8129   26.872   6.0558   24.129   4.9079  181.696   22.239  173.553   18.774 8.142960 29.10430 
1 1 1   29    1   23 o  175.091   14.166   24.106   3.7639   34.048   6.1098   18.025   4.7782  205.955   19.618  148.510   21.658 57.44547 29.22222 
1 1 1   29    1   24 o   60.315   25.794   0.4062   4.2303  -3.9526   5.5840   6.2775   6.4807   57.152   26.546   91.743   34.292 -34.59066 43.36662 
1 1 1   29    1   25 o   92.839   28.487   7.3103   4.4350   6.8562   5.9669   7.8709   6.6292   92.728   33.179   98.110   34.986 -5.382111 48.21716 
1 1 1   29    1   26 o   75.842   26.507   4.4305   3.7899   5.5529   5.9355   3.6578   4.9244   87.127   32.769   76.143   29.543 10.98383 44.12025 
1 1 1   29    1   27 o  352.665   7.4202   95.818   4.0054   98.663   5.1143   91.305   6.4416  357.167   9.3550  342.291   12.295 14.87628 15.44945 
1 1 1   29    1   28 f   83.662   22.157   5.8910   2.8823   7.7912   3.5209   2.0309   5.0184   95.661   24.067   69.967   28.885 25.69381 37.59777 
1 1 1   29    1   29 o  165.108   12.682   21.425   3.1805   22.947   3.9411   18.584   5.3857  169.903   15.320  148.494   24.553 21.40952 28.94053 
1 1 1   29    1   30 o   83.028   18.937   5.7414   2.3533   7.7186   3.7116   4.4123   3.0432   94.599   25.186   73.420   23.745 21.17876 34.61488 
1 1 1   29    1   31 o   88.763   19.816   6.6038   2.6241   2.8989   5.4392   7.7277   2.9958   74.214   30.289   95.746   21.018 -21.53237 36.86738 
1 1 1   29    1   32 o   64.821   21.465   3.3620   2.4807   3.1453   3.9019   3.5090   3.2139   68.673   26.393   67.990   24.348 0.6831665 35.90841 
1 1 1   29    1   33 o   62.386   21.812   2.9888   2.5663   5.9332   4.4989   1.5686   3.1246   83.683   28.901   57.148   23.092 26.53439 36.99292 
1 1 1   29    1   34 o   38.866   17.937  -1.6813   2.4899  -2.9278   4.1011  -0.9535   3.1335   48.540   22.614   46.888   21.038 1.651596 30.88668 
1 1 1   29    1   35 o   81.050   20.690   5.6244   2.5756   6.4482   4.2741   5.1546   3.2274   85.575   28.168   77.448   24.391 8.127434 37.26040 
1 1 1   29    1   36 o  131.549   14.518   13.945   2.8746   10.532   5.2694   15.391   3.4299  105.751   30.727  137.218   16.673 -31.46681 34.95877 
1 1 1   29    1   37 o   51.672   20.887   1.3061   2.5576   9.3479   4.1390  -3.6613   3.2530  101.177   26.435   39.942   19.063 61.23524 32.59160 
1 1 1   29    1   38 o   93.339   20.783   7.5838   2.8930   6.6238   3.4415   9.8966   5.3414   85.510   24.828  100.600   31.329 -15.09018 39.97419 
1 1 1   29    1   39 f   50.473   20.453   1.2766   2.4589  -2.8978   3.4438   5.6181   3.5121   42.922   20.227   78.766   25.513 -35.84427 32.55807 
1 1 1   29    1   40 o   78.072   21.994   5.4593   2.7406   1.7859   3.5533   10.853   4.3058   58.693   24.275  107.475   26.372 -48.78200 35.84308 
1 1 1   29    1   41 o  128.287   14.841   13.536   2.8604   13.094   3.8089   14.109   4.3319  122.021   21.161  124.927   23.517 -2.906052 31.63604 
1 1 1   29    2    0 o  480.923   7.9415  177.559   5.8422  177.559   5.8422  177.559   5.8422  480.923   7.9415  480.923   7.9415 0.000000 0.000000 
1 1 1   29    2    1 o  192.606   7.0278   28.493   2.0719   28.580   2.9863   28.413   2.8769  192.256   10.184  191.758   9.8347 0.4975891 14.15782 
1 1 1   29    2    2 o  175.683   7.2974   23.713   1.9623   26.068   2.8512   21.594   2.7049  183.586   10.186  166.955   10.640 16.63130 14.73006 
1 1 1   29    2    3 o   40.302   16.357   0.5385   1.5754   1.1966   2.3139  -0.0302   2.1510   50.910   20.103   42.893   18.369 8.016525 27.23199 
1 1 1   29    2    4 o  184.795   10.687   26.441   3.0098   23.087   4.9684   28.385   3.7830  170.327   19.404  190.969   13.020 -20.64172 23.36689 
1 1 1   29    2    5 o  208.821   9.9069   33.616   3.1665   32.461   5.2720   34.268   3.9605  203.076   17.120  210.060   12.373 -6.983597 21.12319 
1 1 1   29    2    6 o  142.032   7.8757   15.557   1.7055   11.999   3.2874   16.868   1.9949  122.509   18.074  147.766   8.8611 -25.25769 20.12959 
1 1 1   29    2    7 o  148.158   7.6005   16.916   1.7178   17.992   3.3433   16.531   2.0023  151.444   14.604  146.252   8.9880 5.192078 17.14836 
1 1 1   29    2    8 o  155.564   7.3483   18.597   1.7497   18.689   3.4616   18.566   2.0278  154.303   14.840  155.085   8.5761 -0.7820129 17.13945 
1 1 1   29    2    9 o   56.991   17.477   2.5530   1.6696   0.0000   0.0000   2.5530   1.6696  ?   ?    56.991   17.477 0.000000 17.47741 
1 1 1   29    2   10 o  179.565   7.3104   24.779   2.0092   20.320   5.8286   25.381   2.1404  157.489   25.016  181.690   7.6967 -24.20117 26.17322 
1 1 1   29    2   11 o  125.811   8.9621   12.251   1.7146   25.487   5.9636   11.059   1.7901  177.759   22.417  119.346   9.8887 58.41291 24.50096 
1 1 1   29    2   12 o  234.577   6.4241   42.252   2.3066   47.463   6.8724   41.591   2.4486  245.063   18.457  232.677   6.8753 12.38586 19.69595 
1 1 1   29    2   13 o  159.658   12.905   19.898   3.1267   16.621   6.4908   20.889   3.5679  139.523   31.179  163.216   14.430 -23.69307 34.35624 
1 1 1   29    2   14 o   56.121   22.314   1.4413   2.8690   1.9811   6.0006   1.2813   3.2666   75.908   31.482   58.012   23.551 17.89610 39.31614 
1 1 1   29    2   15 o  113.409   18.493   10.369   3.0996   5.5575   6.3367   11.882   3.5537   89.773   33.839  121.151   19.852 -31.37837 39.23266 
1 1 1   29    2   16 o  151.636   14.284   18.060   3.2762   23.472   6.7162   16.371   3.7529  168.139   27.011  143.385   17.461 24.75417 32.16329 
1 1 1   29    2   17 o  149.774   13.341   17.572   3.0265   11.599   5.0783   20.861   3.7689  116.732   28.638  162.732   15.311 -46.00010 32.47406 
1 1 1   29    2   18 o  128.320   15.530   13.054   2.9881   7.9680   5.1835   15.585   3.6569   97.661   30.928  139.769   17.476 -42.10749 35.52374 
1 1 1   29    2   19 o  192.805   13.185   29.044   3.8678   32.410   5.8493   26.428   5.1559  201.501   19.197  181.958   18.783 19.54390 26.85738 
1 1 1   29    2   20 o  121.480   17.985   11.872   3.2430   9.5558   5.8969   12.876   3.8829  105.624   32.922  125.604   20.934 -19.98064 39.01377 
1 1 1   29    2   21 o   99.431   24.102   8.2995   3.6299   21.167   10.006   6.3496   3.8952  150.805   41.865   87.424   26.675 63.38034 49.64154 
1 1 1   29    2   22 o  236.848   10.482   43.417   3.8002   39.528   6.7472   45.224   4.5990  221.914   20.082  240.845   12.519 -18.93115 23.66399 
1 1 1   29    2   23 o  139.180   16.930   15.477   3.5324   9.1342   6.3650   18.300   4.2464  103.468   34.389  150.802   18.806 -47.33454 39.19546 
1 1 1   29    2   24 o   97.337   23.435   7.9686   3.4497   12.809   6.5995   6.1488   4.0465  119.884   34.256   86.133   27.331 33.75063 43.82303 
1 1 1   29    2   25 o   72.161   25.201   3.9537   3.4252  -1.8250   6.4084   6.2648   4.0527   66.516   29.945   86.685   27.336 -20.16816 40.54583 
1 1 1   29    2   26 o  237.910   14.221   44.488   5.1549   45.125   7.1124   43.783   7.4820  236.738   19.810  232.297   21.279 4.440964 29.07322 
1 1 1   29    2   27 o  101.073   15.892   8.2327   2.3774   11.317   3.4741   5.5157   3.2604  117.362   20.060   81.228   24.321 36.13320 31.52616 
1 1 1   29    2   28 f   81.025   17.995   5.4201   2.1736   3.8112   3.6330   6.3171   2.7127   71.732   25.865   86.884   20.694 -15.15218 33.12487 
1 1 1   29    2   29 o  121.657   12.738   11.689   2.3368   13.621   3.9755   10.669   2.8884  128.329   20.963  114.806   16.947 13.52319 26.95648 
1 1 1   29    2   30 o  103.007   15.376   8.5537   2.3500   8.0943   3.8645   8.8232   2.9602   96.693   25.679  103.200   19.454 -6.506645 32.21569 
1 1 1   29    2   31 f   41.612   18.379  -0.4991   2.2969  -1.4212   3.7323   0.0629   2.9141   50.297   22.728   49.259   21.243 1.037670 31.10984 
1 1 1   29    2   32 o   42.127   19.213  -1.4448   2.7434  -4.9438   5.6539  -0.3672   3.1375   54.592   25.785   49.200   21.615 5.391842 33.64588 
1 1 1   29    2   33 o   49.956   20.424   0.9784   2.4787  -1.8059   4.5671   2.1409   2.9511   54.610   24.860   59.058   22.882 -4.447559 33.78828 
1 1 1   29    2   34 o  136.819   12.579   14.842   2.6047   13.539   4.3075   15.592   3.2704  125.605   23.262  138.986   15.645 -13.38166 28.03376 
1 1 1   29    2   35 o  100.205   18.684   8.4004   2.7602   4.2944   5.3041   9.9254   3.2324   77.557   30.497  108.404   20.225 -30.84752 36.59383 
1 1 1   29    2   36 o   70.241   21.961   4.1856   2.6216   4.0183   4.3619   4.2802   3.2803   73.196   27.959   71.801   24.685 1.394165 37.29648 
1 1 1   29    2   37 o  132.371   13.707   14.093   2.7369   11.268   4.4036   15.871   3.4936  111.348   26.264  138.958   16.764 -27.60983 31.15806 
1 1 1   29    2   38 o   54.401   22.032   1.5395   2.8513  -6.1254   4.2210   7.9726   3.8669   42.223   20.534   93.025   26.097 -50.80143 33.20715 
1 1 1   29    2   39 o   79.993   21.405   5.6662   2.6724   4.3319   3.4782   7.5890   4.1753   71.253   25.349   89.641   27.663 -18.38836 37.52111 
1 1 1   29    2   40 o   57.504   21.175   2.5196   2.4532   1.5131   3.5600   3.4299   3.3854   57.574   24.094   65.789   24.747 -8.215630 34.53879 
1 1 1   29    2   41 o  136.805   13.270   15.170   2.7437   12.459   3.7580   18.265   4.0151  118.733   21.469  146.764   18.269 -28.03076 28.18974 
1 1 1   29    3    0 o  224.143   9.3038   38.769   3.1794   38.769   3.1794   38.769   3.1794  224.143   9.3038  224.143   9.3038 0.000000 0.000000 
1 1 1   29    3    1 o  206.817   6.8323   32.847   2.1628   34.583   3.1354   31.272   2.9875  211.848   9.6693  201.449   9.6887 10.39890 13.68818 
1 1 1   29    3    2 o   62.498   21.282   2.8847   2.4374   0.0000   0.0000   2.8847   2.4374  ?   ?    62.498   21.282 0.000000 21.28249 
1 1 1   29    3    3 o  163.127   20.257   21.270   4.9490   21.270   4.9490   0.0000   0.0000  163.127   20.257  ?   ?  0.000000 20.25681 
1 1 1   29    3    4 o  144.528   10.672   16.207   2.3442   20.216   4.9879   15.070   2.6557  158.696   21.054  138.955   12.624 19.74084 24.54880 
1 1 1   29    3    5 o   76.989   14.806   4.7593   1.6814  -1.2150   4.8264   5.5845   1.7937   59.758   26.505   83.612   14.544 -23.85378 30.23301 
1 1 1   29    3    6 o  113.697   9.5595   10.030   1.6482   5.5373   3.3225   11.497   1.8982   82.477   24.519  121.657   10.290 -39.17981 26.59048 
1 1 1   29    3    7 o  183.257   6.6365   25.788   1.8615   25.276   3.7536   25.955   2.1437  179.947   13.732  183.752   7.6220 -3.804260 15.70513 
1 1 1   29    3    8 o   26.079   12.498  -2.0076   1.4293   0.9891   3.2238  -2.7408   1.5946   56.505   23.219   26.052   12.658 30.45262 26.44568 
1 1 1   29    3    9 o   56.273   16.314   2.5263   1.4869   4.0931   4.5634   2.3402   1.5728   77.896   28.843   54.751   16.992 23.14517 33.47602 
1 1 1   29    3   10 o   31.414   13.997  -0.5155   1.3612   7.4257   4.6709  -1.2525   1.4230   94.902   29.255   28.793   13.383 66.10913 32.17034 
1 1 1   29    3   11 o   66.968   14.695   3.6230   1.4649   0.2492   3.8209   4.2044   1.5861   57.613   24.573   72.218   14.845 -14.60484 28.70854 
1 1 1   29    3   12 o  202.101   11.170   31.668   3.4418   32.919   4.4930   29.891   5.3545  205.204   14.396  194.253   18.222 10.95116 23.22201 
1 1 1   29    3   13 o   54.465   22.398   0.9080   3.0026   1.7605   4.0330  -0.1522   4.4975   64.885   26.229   60.685   26.279 4.199749 37.12878 
1 1 1   29    3   14 o   99.998   22.034   8.2524   3.2816   6.7343   4.5178   9.9480   4.7747   90.789   28.887  108.386   28.428 -17.59774 40.52926 
1 1 1   29    3   15 o  144.575   7.4732   16.116   1.6481   13.948   4.8579   16.398   1.7520  129.498   25.416  145.778   7.8812 -16.27963 26.60978 
1 1 1   29    3   16 o   60.667   19.000   2.8931   1.9615   2.2306   4.9275   3.0178   2.1382   71.411   28.948   62.196   19.882 9.214340 35.11779 
1 1 1   29    3   17 o  139.898   11.293   15.245   2.3976   14.088   5.2677   15.547   2.6927  129.241   27.475  140.987   12.611 -11.74658 30.23096 
1 1 1   29    3   18 o   48.145   20.311   0.3187   2.5627   9.1413   5.4181  -2.2240   2.9087  103.659   31.423   41.719   19.301 61.94022 36.87737 
1 1 1   29    3   19 f  162.174   11.036   20.451   2.7231   26.628   6.0246   18.865   3.0528  181.199   22.186  155.257   12.965 25.94189 25.69617 
1 1 1   29    3   20 o   60.930   21.543   2.6546   2.5083  -4.0399   6.0713   4.0324   2.7544   60.199   27.863   71.091   22.548 -10.89144 35.84363 
1 1 1   29    3   21 o  143.358   12.981   16.117   2.8175   19.357   6.3627   15.327   3.1423  151.007   28.574  139.214   14.983 11.79277 32.26425 
1 1 1   29    3   22 o  141.374   14.488   15.780   3.0907   25.327   10.528   14.879   3.2332  164.746   41.711  136.870   15.718 27.87688 44.57443 
1 1 1   29    3   23 o  122.988   13.333   11.925   2.4697   15.845   6.3096   11.216   2.6838  134.751   31.206  118.740   15.109 16.01112 34.67097 
1 1 1   29    3   24 f   92.740   18.101   7.0311   2.4772   0.8958   6.2336   8.1817   2.6995   72.759   31.218  100.166   18.281 -27.40690 36.17709 
1 1 1   29    3   25 o   83.370   19.692   5.7616   2.4728   1.2857   6.2818   6.5823   2.6899   73.975   31.528   89.060   20.198 -15.08543 37.44308 
1 1 1   29    3   26 o  125.063   14.099   12.392   2.6517   17.089   6.7958   11.549   2.8801  138.696   32.567  120.070   16.074 18.62661 36.31840 
1 1 1   29    3   27 o  118.133   14.676   11.114   2.5965   13.053   3.5666   8.9282   3.7873  126.630   18.986  102.438   24.487 24.19185 30.98551 
1 1 1   29    3   28 o   58.432   20.797   2.4566   2.3414   0.2907   3.6628   3.9532   3.0446   55.857   23.947   70.728   23.788 -14.87091 33.75414 
1 1 1   29    3   29 o   81.188   18.189   5.4587   2.2042   11.768   3.9933   2.6941   2.6434  118.248   22.890   61.277   22.067 56.97164 31.79493 
1 1 1   29    3   30 o  121.012   12.823   11.587   2.3390   8.7485   4.0677   12.989   2.8589  100.294   26.207  127.491   14.933 -27.19743 30.16344 
1 1 1   29    3   31 o   78.173   20.557   5.1514   2.4924   0.0995   4.0395   8.2570   3.1672   57.254   24.849   98.805   21.549 -41.55136 32.89150 
1 1 1   29    3   32 o  109.510   14.256   9.6182   2.3329   10.833   3.9673   8.9761   2.8843  112.234   23.830  104.039   18.804 8.194939 30.35602 
1 1 1   29    3   33 o   86.868   21.865   6.4698   2.9052   0.0000   0.0000   6.4698   2.9052  ?   ?    86.868   21.865 0.000000 21.86533 
1 1 1   29    3   34 f  123.588   14.593   12.281   2.7072   10.161   5.1177   13.104   3.1901  105.070   30.210  126.736   16.864 -21.66613 34.59782 
1 1 1   29    3   35 o   91.945   18.706   7.1054   2.5429   5.1182   4.3363   8.1469   3.1394   78.692   28.271   97.342   21.632 -18.64950 35.59775 
1 1 1   29    3   36 o  113.761   15.891   10.579   2.6915   9.7194   4.7227   10.992   3.2755  102.418   28.879  114.305   19.416 -11.88653 34.79898 
1 1 1   29    3   37 o   42.725   19.124  -0.7048   2.5726   3.0453   4.4909  -2.5364   3.1386   68.904   27.739   41.740   19.556 27.16382 33.93962 
1 1 1   29    3   38 o   75.989   22.703   5.0997   2.8434   5.1025   4.3113   5.0976   3.7827   76.999   28.113   76.274   26.492 0.7242966 38.62827 
1 1 1   29    3   39 f   98.263   17.963   8.1965   2.6021   4.9242   4.2480   10.162   3.2919   75.514   27.855  108.094   20.650 -32.58074 34.67403 
1 1 1   29    3   40 o  117.146   19.305   11.789   3.3409   12.747   4.3234   10.369   5.2637  117.997   24.729  101.389   31.023 16.60876 39.67286 
1 1 1   29    4    0 o   31.914   22.527  -5.1406   4.4199  -5.1406   4.4199  -5.1406   4.4199   31.914   22.527   31.914   22.527 0.000000 0.000000 
1 1 1   29    4    1 o  277.480   9.8811   59.351   4.1967   64.667   6.1336   54.672   5.7545  288.634   13.883  264.931   14.243 23.70313 19.89015 
1 1 1   29    4    2 o  178.465   11.626   24.720   3.1584   23.237   5.4115   25.487   3.8897  170.250   21.227  180.615   14.184 -10.36421 25.53010 
1 1 1   29    4    3 o   76.220   19.537   4.7433   2.2898   7.5255   4.9251   3.9761   2.5864   95.866   30.121   70.699   21.765 25.16682 37.16166 
1 1 1   29    4    4 o  215.025   6.7575   35.506   2.2241   36.536   5.8667   35.333   2.4035  215.214   17.974  214.437   7.3226 0.7773285 19.40857 
1 1 1   29    4    5 o   60.500   16.982   2.9427   1.6369  -1.4936   5.3331   3.4040   1.7199   62.214   27.713   64.821   17.091 -2.607391 32.55929 
1 1 1   29    4    6 o   58.077   16.166   2.7102   1.4899   3.0494   3.5737   2.6388   1.6392   68.625   25.502   57.697   17.238 10.92841 30.78085 
1 1 1   29    4    7 o  112.713   11.523   9.9205   1.9599   7.8542   3.6589   10.752   2.3210   97.248   24.571  117.043   13.186 -19.79494 27.88570 
1 1 1   29    4    8 f  179.678   10.856   25.021   2.9716   25.677   3.9739   24.188   4.4757  181.167   14.451  175.097   16.910 6.069839 22.24360 
1 1 1   29    4    9 o  214.831   10.049   35.599   3.3045   34.450   4.3080   37.242   5.1506  210.275   13.455  218.030   15.535 -7.755402 20.55227 
1 1 1   29    4   10 f  133.593   16.644   14.157   3.3296   17.063   5.2028   12.141   4.3331  144.235   24.439  121.268   24.192 22.96617 34.38824 
1 1 1   29    4   11 o  141.066   13.875   15.606   2.9571   18.986   4.2764   12.508   4.0936  154.408   18.460  123.665   22.453 30.74314 29.06769 
1 1 1   29    4   12 o   94.246   21.075   7.3030   2.9640   5.9149   4.2708   8.5928   4.1169   86.058   28.149  101.267   26.319 -15.20918 38.53604 
1 1 1   29    4   13 o  156.516   13.874   19.191   3.2894   23.490   4.6166   14.757   4.6880  172.098   17.782  134.024   23.720 38.07336 29.64569 
1 1 1   29    4   14 o  106.379   20.468   9.2423   3.2117   11.640   4.5273   6.8130   4.5570  117.974   25.791   91.241   29.010 26.73270 38.81669 
1 1 1   29    4   15 o  144.872   16.750   16.654   3.6458   15.592   4.9701   17.891   5.3645  137.428   24.527  147.382   24.651 -9.954025 34.77409 
1 1 1   29    4   16 o  135.359   17.943   14.648   3.6259   16.507   5.1477   12.819   5.1082  141.359   24.690  123.116   27.769 18.24287 37.15787 
1 1 1   29    4   17 o  258.071   15.189   52.204   5.9735   52.204   5.9735   0.0000   0.0000  258.071   15.189  ?   ?  0.000000 15.18933 
1 1 1   29    4   18 o  247.370   11.628   47.420   4.4027   58.181   6.2896   37.082   6.1650  272.435   15.143  215.839   18.850 56.59546 24.17912 
1 1 1   29    4   19 o  270.773   11.198   56.783   4.6411   62.992   6.6367   50.841   6.4925  283.333   15.361  253.833   16.806 29.49939 22.76819 
1 1 1   29    4   20 o   62.037   16.561   3.1296   1.6019  -1.5145   5.9408   3.4938   1.6636   65.161   29.121   65.446   16.586 -0.2847366 33.51313 
1 1 1   29    4   21 o  202.958   7.3721   31.698   2.2902   37.537   6.6429   30.911   2.4397  216.172   20.315  200.331   7.9566 15.84140 21.81741 
1 1 1   29    4   22 o   27.566   13.402  -3.0745   1.7946  -9.0144   9.1973  -2.8394   1.8298   67.975   32.334   28.608   13.819 39.36635 35.16280 
1 1 1   29    4   23 o  148.491   10.131   17.137   2.2888   1.9810   6.4453   19.325   2.4484   77.002   32.333  157.707   10.197 -80.70502 33.90327 
1 1 1   29    4   24 o  139.075   10.945   15.088   2.3110   11.755   6.4887   15.572   2.4732  115.020   34.280  141.154   11.548 -26.13394 36.17333 
1 1 1   29    4   25 o   91.592   16.833   6.8175   2.2729  -0.9564   6.6165   7.8576   2.4201   69.604   30.945   98.551   16.636 -28.94783 35.13314 
1 1 1   29    4   26 o  144.155   10.304   16.182   2.2585   15.930   3.8032   16.319   2.8071  140.562   18.098  144.085   12.864 -3.523636 22.20355 
1 1 1   29    4   27 o   40.491   18.084  -0.7914   2.2869   3.3663   3.3892  -4.2671   3.0987   68.516   24.940   37.972   18.251 30.54386 30.90441 
1 1 1   29    4   28 o  119.625   12.757   11.300   2.2998   12.908   3.9725   10.489   2.8206  124.686   21.597  113.978   16.660 10.70777 27.27602 
1 1 1   29    4   29 o   81.027   19.817   5.4894   2.4374   7.5925   3.9429   4.1886   3.1009   93.740   26.371   72.198   24.004 21.54187 35.65992 
1 1 1   29    4   30 o  128.790   12.645   13.101   2.4606   5.2766   4.1369   17.384   3.0609   80.464   27.718  148.169   13.650 -67.70496 30.89690 
1 1 1   29    4   31 o   96.460   16.984   7.6221   2.4160   12.966   4.1062   4.7926   2.9879  123.977   22.466   75.615   23.412 48.36168 32.44780 
1 1 1   29    4   32 o  246.518   7.8365   46.972   2.9569   44.977   5.6859   47.712   3.4619  237.241   15.748  248.019   9.1193 -10.77800 18.19753 
1 1 1   29    4   33 o   66.679   20.527   3.6883   2.3005   5.7907   3.9657   2.6220   2.8243   82.200   27.136   61.098   22.677 21.10279 35.36439 
1 1 1   29    4   34 o   64.561   22.313   3.2888   2.6818  -1.3110   7.7323   3.9178   2.8593   71.410   32.446   69.114   23.053 2.296410 39.80195 
1 1 1   29    4   35 o   50.866   20.478   1.2345   2.4475   4.0633   4.4096  -0.0249   2.9424   73.832   28.133   48.648   21.161 25.18386 35.20295 
1 1 1   29    4   36 o   67.501   21.294   3.8386   2.4590   9.3407   4.5772   1.6064   2.9154  100.512   28.462   55.552   22.355 44.96077 36.19143 
1 1 1   29    4   37 o   70.260   21.473   4.2487   2.5228   1.1950   4.4811   5.6657   3.0524   61.941   26.520   80.005   23.426 -18.06386 35.38492 
1 1 1   29    4   38 o   58.051   22.266   2.3178   2.7737  -0.1346   4.3605   3.9845   3.5947   56.678   25.163   69.893   25.648 -13.21545 35.93032 
1 1 1   29    4   39 o   64.835   24.248   3.2827   3.2411   2.1265   4.2162   4.9528   5.0675   63.270   26.327   76.997   29.943 -13.72664 39.87085 
1 1 1   29    4   40 o   48.116   21.068   0.0568   2.9586   2.0757   4.1519  -2.0261   4.2172   62.444   26.066   50.109   23.203 12.33553 34.89734 
1 1 1   29    5    0 o   82.041   37.916   7.8474   5.2487   7.8474   5.2487   7.8474   5.2487   82.041   37.916   82.041   37.916 0.000000 0.000000 
1 1 1   29    5    1 o  299.475   15.105   69.975   6.9014   69.975   6.9014   0.0000   0.0000  299.475   15.105  ?   ?  0.000000 15.10463 
1 1 1   29    5    2 o  142.738   17.916   16.197   3.8281   22.682   5.9597   11.642   4.9948  167.120   23.986  117.706   28.111 49.41441 36.95313 
1 1 1   29    5    3 o  209.667   9.2598   33.860   2.9717   36.978   6.3470   32.985   3.3631  215.982   19.406  206.452   10.679 9.529739 22.15060 
1 1 1   29    5    4 o  157.893   7.8091   19.167   1.8873   22.164   6.0219   18.841   1.9874  164.899   24.612  156.274   8.3387 8.624832 25.98629 
1 1 1   29    5    5 o  228.360   5.8668   40.014   2.0506   35.284   6.4641   40.543   2.1623  210.561   20.309  229.836   6.1466 -19.27472 21.21852 
1 1 1   29    5    6 o   96.787   18.388   7.5810   2.6245   12.815   3.9135   3.3035   3.5380  125.747   21.079   69.790   25.469 55.95736 33.06055 
1 1 1   29    5    7 o  143.934   13.018   16.188   2.8369   16.263   4.0172   16.113   4.0069  142.702   18.853  142.015   18.903 0.6877289 26.69784 
1 1 1   29    5    8 o  234.928   9.4259   42.531   3.3894   51.427   4.7738   33.486   4.8132  257.760   12.100  206.761   15.318 50.99985 19.52029 
1 1 1   29    5    9 o  198.204   10.335   30.398   3.1244   34.652   4.4237   26.164   4.4135  210.784   13.787  182.421   15.967 28.36223 21.09613 
1 1 1   29    5   10 o  213.099   10.402   35.054   3.3930   37.044   4.7592   32.997   4.8385  217.775   14.358  205.129   15.525 12.64578 21.14714 
1 1 1   29    5   11 o  135.322   16.856   14.542   3.4157   9.1961   5.3619   18.193   4.4313  104.450   31.169  150.678   19.684 -46.22817 36.86450 
1 1 1   29    5   12 o  142.677   14.577   16.008   3.1387   15.809   4.4974   16.197   4.3823  139.559   21.764  141.616   20.840 -2.057343 30.13285 
1 1 1   29    5   13 o   62.822   23.290   2.5541   2.9773   0.5422   4.3653   4.3039   4.0711   62.153   26.380   76.915   27.418 -14.76234 38.04854 
1 1 1   29    5   14 o   88.658   23.127   6.5199   3.1713   1.1225   4.5598   11.576   4.4134   65.375   27.306  117.798   25.237 -52.42320 37.18229 
1 1 1   29    5   15 o  146.342   15.966   16.939   3.5183   25.887   5.2695   9.7410   4.7261  180.029   19.431  107.169   28.367 72.85957 34.38427 
1 1 1   29    5   16 o  184.185   19.802   27.145   5.4947   27.145   5.4947   0.0000   0.0000  184.185   19.802  ?   ?  0.000000 19.80155 
1 1 1   29    5   17 o   69.306   25.669   3.2117   3.6147   5.2937   5.3106   1.4146   4.9341   85.329   31.194   68.367   28.467 16.96180 42.23106 
1 1 1   29    5   18 o  187.314   10.609   27.220   3.0291   25.076   5.7845   28.030   3.5556  175.897   21.964  189.649   12.315 -13.75237 25.18110 
1 1 1   29    5   19 o  175.113   11.223   23.846   2.9922   29.934   6.1186   21.933   3.4304  192.690   21.090  167.308   13.511 25.38216 25.04619 
1 1 1   29    5   20 o  240.430   9.1831   44.609   3.3795   53.697   6.7623   41.584   3.9016  260.655   17.043  231.717   11.001 28.93842 20.28520 
1 1 1   29    5   21 o  122.346   15.869   11.929   2.9017   12.735   6.2164   11.705   3.2811  120.386   32.830  120.374   18.392 0.1186371E-01 37.63070 
1 1 1   29    5   22 o  150.050   8.3125   17.409   1.9017   11.623   9.3798   17.656   1.9420  115.854   41.584  151.097   8.4307 -35.24294 42.42999 
1 1 1   29    5   23 o  132.690   9.3402   13.667   1.8849   14.110   6.5658   13.627   1.9677  126.035   33.471  132.406   9.7785 -6.370262 34.87032 
1 1 1   29    5   24 o  116.439   11.532   10.628   2.0283   27.296   6.8581   9.0308   2.1232  181.044   25.451  106.812   13.273 74.23177 28.70445 
1 1 1   29    5   25 o   73.034   17.998   4.3958   1.9990   11.677   6.9841   3.7461   2.0863  114.172   35.868   67.606   19.240 46.56551 40.70269 
1 1 1   29    5   26 o  222.942   6.9095   38.255   2.3578   49.949   4.1912   32.841   2.8519  253.713   10.793  206.150   9.0381 47.56284 14.07724 
1 1 1   29    5   27 o  163.593   9.8621   20.803   2.4579   26.256   3.9944   17.480   3.1182  182.339   14.430  148.760   13.854 33.57896 20.00379 
1 1 1   29    5   28 o   71.560   18.849   4.2477   2.0932   3.4630   3.7199   4.6113   2.5322   70.148   26.028   74.402   21.205 -4.253937 33.57227 
1 1 1   29    5   29 o  223.924   7.3872   38.663   2.5319   38.199   4.8694   38.834   2.9641  219.790   14.557  224.114   8.6409 -4.323593 16.92815 
1 1 1   29    5   30 f  100.371   19.187   8.3537   2.8403   6.4071   4.1678   10.042   3.8810   86.578   27.766  108.257   24.047 -21.67919 36.73193 
1 1 1   29    5   31 o   65.456   20.493   3.5024   2.2819  -0.4292   4.6329   4.7617   2.6221   59.141   26.112   75.157   21.628 -16.01648 33.90611 
1 1 1   29    5   32 o   33.639   15.973  -2.5407   2.2253  -4.9182   4.0389  -1.5043   2.6665   43.881   21.023   41.184   18.843 2.697540 28.23220 
1 1 1   29    5   33 o   97.226   16.503   7.7538   2.3681   4.9583   4.2284   9.0313   2.8584   78.142   27.934  104.247   18.596 -26.10513 33.55727 
1 1 1   29    5   34 o  141.584   11.952   15.843   2.5660   21.929   5.1024   13.782   2.9687  161.819   21.103  130.749   15.113 31.07034 25.95599 
1 1 1   29    5   35 f   90.659   19.481   6.9692   2.6227   3.0356   5.9820   7.9053   2.9181   75.078   31.310   96.280   20.434 -21.20265 37.38763 
1 1 1   29    5   36 o  151.950   11.111   18.218   2.5663   21.334   4.5702   16.783   3.1014  160.113   19.020  144.439   14.212 15.67415 23.74379 
1 1 1   29    5   37 o   47.624   20.136   0.5580   2.5276   2.6851   4.5083  -0.4171   3.0525   67.366   27.544   47.569   21.090 19.79759 34.69088 
1 1 1   29    5   38 o   79.241   23.518   5.6210   3.0586   7.3466   4.4028   4.0113   4.2523   88.349   28.560   71.581   27.542 16.76765 39.67669 
1 1 1   29    5   39 o   43.336   19.201  -0.3555   2.5266   2.9201   4.1588  -2.2718   3.1809   66.133   26.669   42.411   19.811 23.72159 33.22226 
1 1 1   29    5   40 o  120.023   14.865   11.850   2.6724   6.5643   4.3230   15.119   3.3998   83.154   28.344  134.470   16.891 -51.31674 32.99475 
1 1 1   29    6    1 o  364.016   9.4337  102.093   5.2562  104.845   7.7629   99.763   7.1426  367.492   13.801  358.760   13.007 8.732849 18.96444 
1 1 1   29    6    2 o   87.706   25.248   6.3282   3.5727   4.8347   6.0078   7.1453   4.4438   86.403   32.858   93.242   28.500 -6.838776 43.49591 
1 1 1   29    6    3 o   45.689   20.614  -1.4349   3.0561   7.8239   6.2164  -4.3858   3.5095   99.246   33.987   41.651   19.857 57.59525 39.36300 
1 1 1   29    6    4 o  266.116   17.957   55.764   7.2717   55.764   7.2717   0.0000   0.0000  266.116   17.957  ?   ?  0.000000 17.95736 
1 1 1   29    6    5 o   71.815   23.737   3.9745   3.0341   3.1670   6.3966   4.2089   3.4465   81.867   33.054   74.518   25.308 7.349602 41.62982 
1 1 1   29    6    6 o  212.123   10.113   34.708   3.2835   40.300   4.7361   29.534   4.5563  227.443   13.668  194.075   15.467 33.36816 20.64024 
1 1 1   29    6    7 o  251.247   9.3474   48.640   3.5947   54.846   5.1879   42.907   4.9855  266.027   12.741  234.614   13.946 31.41299 18.88951 
1 1 1   29    6    8 o   82.087   22.065   5.5378   2.8320   2.5627   4.3165   7.7862   3.7526   69.919   27.506   96.708   25.124 -26.78905 37.25292 
1 1 1   29    6    9 o  181.200   11.606   25.498   3.2021   26.078   4.7040   24.997   4.3711  181.738   17.112  178.187   16.204 3.551788 23.56645 
1 1 1   29    6   10 o  100.936   19.208   8.2744   2.8591   8.6307   4.4827   8.0300   3.7122  101.360   27.977   98.178   24.719 3.181847 37.33296 
1 1 1   29    6   11 o   87.038   23.057   6.2655   3.1207   10.005   5.5382   4.5260   3.7775  108.495   31.494   77.204   26.493 31.29094 41.15496 
1 1 1   29    6   12 o  154.464   14.245   18.720   3.3300   15.964   4.8554   21.167   4.5757  139.553   23.570  162.965   18.682 -23.41209 30.07576 
1 1 1   29    6   13 o   58.515   23.055   1.6974   3.0368   3.3567   4.7512   0.5513   3.9486   75.162   29.059   59.497   25.162 15.66444 38.43897 
1 1 1   29    6   14 o  141.472   16.347   15.865   3.4746   14.675   5.1144   16.884   4.7350  132.618   26.125  144.029   22.191 -11.41019 34.27761 
1 1 1   29    6   15 o  146.180   13.818   16.770   3.0551   20.332   5.2231   14.917   3.7666  158.259   22.171  136.431   18.516 21.82831 28.88526 
1 1 1   29    6   16 o  151.770   15.501   18.186   3.5504   21.985   5.3474   15.190   4.7481  164.767   21.734  135.782   23.708 28.98512 32.16263 
1 1 1   29    6   17 f   86.993   19.586   6.2198   2.5452   5.8723   5.4440   6.3170   2.8792   88.188   31.677   87.309   21.651 0.8787231 38.36966 
1 1 1   29    6   18 o  121.312   14.898   11.661   2.7083   6.4987   5.6922   13.171   3.0791   91.447   32.440  128.725   15.971 -37.27810 36.15796 
1 1 1   29    6   19 o  154.863   12.410   18.743   2.9170   16.383   6.1861   19.418   3.3079  138.089   30.116  157.239   13.887 -19.15071 33.16327 
1 1 1   29    6   20 o   41.914   18.988  -1.3230   2.6240   6.0904   6.2573  -2.9048   2.8904   90.889   33.751   39.551   18.606 51.33849 38.53925 
1 1 1   29    6   21 o  120.100   16.166   11.522   2.8963   10.134   6.3893   11.881   3.2494  108.098   34.348  121.389   18.037 -13.29189 38.79614 
1 1 1   29    6   22 o  200.465   11.724   31.307   3.5816   21.091   9.4866   33.005   3.8679  150.637   40.339  205.654   12.345 -55.01799 42.18526 
1 1 1   29    6   23 o   66.512   24.260   3.0887   3.2095   5.8418   9.7666   2.7553   3.3982   98.931   40.506   65.563   24.765 33.36790 47.47689 
1 1 1   29    6   24 o  187.609   12.198   27.499   3.4838   22.737   7.2422   28.933   3.9738  162.238   30.278  191.984   13.611 -29.74643 33.19657 
1 1 1   29    6   25 o  221.840   7.1997   37.891   2.4447   42.642   7.7323   37.363   2.5769  228.560   22.390  220.205   7.6453 8.355087 23.65905 
1 1 1   29    6   26 o  211.056   6.9488   34.290   2.2448   43.612   4.0891   30.269   2.6857  236.897   11.277  197.934   8.8647 38.96298 14.34429 
1 1 1   29    6   27 o  165.405   9.2466   21.229   2.3316   25.046   3.9800   19.235   2.8770  177.902   14.749  156.646   12.093 21.25624 19.07283 
1 1 1   29    6   28 o  164.779   9.0719   21.068   2.2793   26.738   4.4676   19.073   2.6501  183.157   16.099  156.203   11.157 26.95409 19.58776 
1 1 1   29    6   29 o   87.755   17.880   6.3559   2.3201   5.1065   4.0977   6.9455   2.8148   79.592   27.577   90.936   20.689 -11.34332 34.47473 
1 1 1   29    6   30 o  159.715   9.4600   19.848   2.3023   22.899   4.2309   18.564   2.7442  168.860   16.584  153.759   11.749 15.10088 20.32396 
1 1 1   29    6   31 o   80.527   20.453   5.4829   2.5258   11.729   3.9489   1.1581   3.2859  117.487   22.781   56.426   23.341 61.06041 32.61552 
1 1 1   29    6   32 o  181.650   9.4856   25.699   2.6282   17.552   6.3379   27.391   2.8883  138.942   30.626  187.331   10.110 -48.38959 32.25209 
1 1 1   29    6   33 o   40.475   17.899  -0.4721   2.1853  -6.8573   4.0715   2.1116   2.5899   40.548   19.817   56.895   21.589 -16.34709 29.30498 
1 1 1   29    6   34 o  222.366   8.2716   38.320   2.8153   31.170   5.4639   40.904   3.2850  195.023   18.526  229.343   9.3579 -34.31969 20.75571 
1 1 1   29    6   35 o  119.242   13.888   11.429   2.4872   13.504   4.7893   10.662   2.9105  123.004   26.238  113.679   17.270 9.324516 31.41188 
1 1 1   29    6   36 o   56.025   22.113   1.8514   2.7984   9.1681   5.8408  -0.3285   3.1881   97.617   32.947   49.041   21.657 48.57573 39.42750 
1 1 1   29    6   37 o  113.079   16.808   10.610   2.8207   3.6599   4.4678   15.216   3.6372   71.025   27.970  135.030   18.050 -64.00461 33.28835 
1 1 1   29    6   38 o   97.090   19.228   8.0945   2.7563   1.2544   4.2492   13.063   3.6216   60.452   25.852  123.588   19.815 -63.13526 32.57210 
1 1 1   29    6   39 o   93.308   21.301   7.7095   2.9753   2.9727   4.2133   12.421   4.2020   66.449   26.827  117.003   24.259 -50.55388 36.16916 
1 1 1   29    6   40 o  118.875   15.900   11.746   2.8206   17.842   4.3662   7.3801   3.6952  143.475   20.462   88.552   25.731 54.92307 32.87496 
1 1 1   29    7    0 o   43.912   28.976  -0.8182   5.0194  -0.8182   5.0194  -0.8182   5.0194   43.912   28.976   43.912   28.976 0.000000 0.000000 
1 1 1   29    7    1 o   88.045   28.855   6.1749   4.4868   0.0000   0.0000   6.1749   4.4868  ?   ?    88.045   28.855 0.000000 28.85459 
1 1 1   29    7    2 o  111.678   18.178   10.018   3.0004   7.7768   5.9957   10.767   3.4655   98.609   33.381  115.230   20.395 -16.62103 39.11811 
1 1 1   29    7    3 f   77.944   32.266   2.1148   6.2860   2.1148   6.2860   0.0000   0.0000   77.944   32.266  ?   ?  0.000000 32.26556 
1 1 1   29    7    4 o   87.254   34.131   4.4997   6.6138   4.4997   6.6138   0.0000   0.0000   87.254   34.131  ?   ?  0.000000 34.13057 
1 1 1   29    7    5 o  213.088   22.975   36.536   7.3751   36.536   7.3751   0.0000   0.0000  213.088   22.975  ?   ?  0.000000 22.97527 
1 1 1   29    7    6 o  231.387   9.6588   41.274   3.4208   43.271   4.9536   39.453   4.7298  235.648   13.794  224.974   13.802 10.67381 19.51322 
1 1 1   29    7    7 o  197.164   10.912   30.119   3.2804   29.171   4.7932   30.955   4.4991  192.541   16.421  198.853   14.890 -6.312561 22.16669 
1 1 1   29    7    8 o   70.051   22.520   3.8430   2.7404   7.1639   4.5045   1.8917   3.4529   93.261   28.726   62.125   24.549 31.13625 37.78668 
1 1 1   29    7    9 o  161.340   12.799   20.307   3.1347   21.815   4.8164   19.200   4.1288  165.302   19.405  155.514   17.659 9.787674 26.23713 
1 1 1   29    7   10 o   87.367   21.353   6.2917   2.8313   7.9264   4.5766   5.2780   3.6037   97.399   28.732   81.125   25.798 16.27341 38.61458 
1 1 1   29    7   11 f  189.035   13.041   27.864   3.7503   35.670   6.5662   24.084   4.5688  211.283   20.565  174.416   17.344 36.86702 26.90198 
1 1 1   29    7   12 o  119.710   18.270   11.512   3.2416   9.1127   4.9927   13.261   4.2620  103.775   29.839  127.185   22.727 -23.40935 37.50863 
1 1 1   29    7   13 o  289.610   7.6416   64.514   3.3874   67.571   6.2208   63.226   4.0387  294.725   13.790  286.378   9.2136 8.347748 16.58461 
1 1 1   29    7   14 o  132.621   15.406   13.913   3.0690   14.840   5.2445   13.430   3.7846  133.126   26.667  128.931   19.812 4.195358 33.22114 
1 1 1   29    7   15 o   62.129   20.920   2.9099   2.3549   0.7570   4.8671   3.5680   2.6908   65.776   27.883   67.871   22.350 -2.094780 35.73521 
1 1 1   29    7   16 f   61.698   24.323   1.9366   3.3819  -2.7833   5.3119   5.1538   4.3855   58.431   26.682   81.998   28.522 -23.56713 39.05653 
1 1 1   29    7   17 o   33.661   16.131  -3.2541   2.3808   1.5176   5.4883  -4.3601   2.6423   71.533   29.924   33.692   16.353 37.84026 34.10094 
1 1 1   29    7   18 o  209.334   9.9218   33.855   3.1791   38.554   6.2127   32.187   3.7002  220.098   18.616  203.352   11.940 16.74590 22.11623 
1 1 1   29    7   19 o   66.974   21.747   3.5190   2.5508   9.5011   5.8582   2.1195   2.8335  105.230   32.816   59.345   22.566 45.88533 39.82609 
1 1 1   29    7   20 o   57.874   21.611   2.1301   2.5727  -1.9630   6.0558   3.0315   2.8419   64.597   29.093   64.741   22.926 -0.1441269 37.04049 
1 1 1   29    7   21 o   72.859   22.342   4.3128   2.7283  -2.6114   6.4829   5.8031   3.0077   65.385   29.709   83.432   22.870 -18.04665 37.49251 
1 1 1   29    7   22 f  159.178   13.792   19.927   3.3270   25.355   9.3151   19.133   3.5620  167.415   37.306  155.520   15.156 11.89554 40.26693 
1 1 1   29    7   23 o   51.089   22.023  -0.0114   3.1296  -4.4065   9.2714   0.5538   3.3248   75.118   34.649   54.823   23.132 20.29472 41.66109 
1 1 1   29    7   24 o   69.591   23.926   3.7111   3.0816   14.206   6.9310   1.1252   3.4404  125.524   34.842   57.954   23.921 67.56929 42.26293 
1 1 1   29    7   25 o  122.026   19.578   12.165   3.5330   13.110   10.346   12.041   3.7589  120.071   43.595  120.798   21.098 -0.7270660 48.43172 
1 1 1   29    7   26 o  170.364   14.585   22.948   3.7666   8.6445   10.638   24.998   4.0275  106.918   42.816  177.721   14.944 -70.80305 45.34958 
1 1 1   29    7   27 f  130.881   16.256   13.740   3.1864   18.974   3.7739   0.7478   5.9463  154.086   16.246   70.286   30.327 83.80035 34.40461 
1 1 1   29    7   28 o   98.970   14.844   7.8735   2.1793   5.9660   3.7962   8.8111   2.6615   84.059   26.450  103.977   17.333 -19.91797 31.62343 
1 1 1   29    7   29 o  125.151   11.783   12.326   2.2306   12.973   4.0197   12.038   2.6813  124.515   21.890  122.794   14.549 1.720360 26.28428 
1 1 1   29    7   30 o  124.672   11.247   12.215   2.1232   12.430   3.9900   12.130   2.5077  121.436   22.287  123.541   13.481 -2.104683 26.04716 
1 1 1   29    7   31 o  135.416   13.336   14.562   2.7284   13.793   4.1502   15.147   3.6208  127.956   21.983  136.290   17.780 -8.334564 28.27328 
1 1 1   29    7   32 o   58.278   20.032   2.6130   2.1603  -2.4347   4.2405   4.3820   2.5104   50.825   23.440   72.090   21.284 -21.26505 31.66140 
1 1 1   29    7   33 o  226.882   7.6664   39.807   2.6623   34.591   4.9703   41.906   3.1527  207.534   15.765  232.380   8.8638 -24.84575 18.08558 
1 1 1   29    7   34 o  142.435   11.608   16.017   2.5087   13.566   5.6282   16.625   2.8025  120.858   30.441  144.663   12.788 -23.80561 33.01800 
1 1 1   29    7   35 o  145.918   11.953   16.869   2.6461   16.801   4.6300   16.903   3.2247  140.009   22.357  144.794   14.756 -4.785446 26.78796 
1 1 1   29    7   36 o  199.188   10.520   31.189   3.1961   25.850   6.2783   33.056   3.7132  171.601   24.608  204.320   11.925 -32.71910 27.34483 
1 1 1   29    7   37 o   53.793   21.308   1.6908   2.6071   3.1293   4.3784   0.9006   3.2450   68.392   27.440   53.855   22.795 14.53680 35.67313 
1 1 1   29    7   38 o   33.693   16.356  -4.0033   2.6458  -6.5537   4.3082  -2.4588   3.3526   41.948   20.476   43.324   20.270 -1.376240 28.81226 
1 1 1   29    7   39 o   88.267   20.427   6.8567   2.7051   9.8016   4.2457   4.8442   3.5097  101.662   26.876   73.824   25.525 27.83746 37.06540 
1 1 1   29    8    0 o  245.655   14.036   46.983   5.2382   46.983   5.2382   46.983   5.2382  245.655   14.036  245.655   14.036 0.000000 0.000000 
1 1 1   29    8    1 o  154.289   15.717   18.748   3.6600   0.0000   0.0000   18.748   3.6600  ?   ?   154.289   15.717 0.000000 15.71727 
1 1 1   29    8    2 o  133.055   10.927   13.764   2.2058   15.774   5.7098   13.412   2.3915  137.233   28.128  131.105   12.052 6.128082 30.60106 
1 1 1   29    8    3 o  128.776   32.163   14.212   6.3207   14.212   6.3207   0.0000   0.0000  128.776   32.163  ?   ?  0.000000 32.16282 
1 1 1   29    8    4 o  125.274   34.310   13.562   6.7724   13.562   6.7724   0.0000   0.0000  125.274   34.310  ?   ?  0.000000 34.30985 
1 1 1   29    8    5 o  122.314   35.340   12.941   6.9880   12.941   6.9880   0.0000   0.0000  122.314   35.340  ?   ?  0.000000 35.33969 
1 1 1   29    8    6 o   68.783   30.746  -1.8193   6.6259  -1.8193   6.6259   0.0000   0.0000   68.783   30.746  ?   ?  0.000000 30.74601 
1 1 1   29    8    7 o  300.540   12.197   69.955   5.6110   69.955   5.6110   0.0000   0.0000  300.540   12.197  ?   ?  0.000000 12.19745 
1 1 1   29    8    8 o   59.471   22.463   2.1356   2.7959   8.3152   4.5177  -1.7007   3.5595   99.567   28.305   49.010   22.167 50.55704 35.95194 
1 1 1   29    8    9 o  341.615   8.6250   89.863   4.5099  102.534   6.5256   78.276   6.2399  363.968   11.714  317.654   12.834 46.31345 17.37552 
1 1 1   29    8   10 o   81.186   22.824   5.4182   2.9544   5.4042   4.8097   5.4267   3.7440   84.670   29.842   82.230   26.311 2.439514 39.78496 
1 1 1   29    8   11 o  161.880   10.343   20.318   2.5494   25.298   6.5894   19.441   2.7646  175.627   25.237  158.089   11.504 17.53830 27.73588 
1 1 1   29    8   12 o  136.348   14.072   14.616   2.8947   24.959   5.2053   9.9857   3.4829  176.720   19.572  110.373   21.388 66.34718 28.99198 
1 1 1   29    8   13 o  134.862   14.439   14.326   2.9342   14.370   5.2804   14.306   3.5292  130.729   27.272  133.844   17.658 -3.114380 32.48909 
1 1 1   29    8   14 f   61.569   20.819   2.8434   2.3321   0.5021   5.0371   3.4822   2.6311   65.930   28.169   67.106   22.101 -1.175858 35.80450 
1 1 1   29    8   15 o  194.661   9.7053   29.250   2.8917   23.517   5.6647   31.271   3.3629  170.230   22.275  200.742   10.986 -30.51180 24.83695 
1 1 1   29    8   16 o  103.453   22.115   8.8582   3.3957   5.7614   5.2954   11.021   4.4253   87.279   31.254  114.431   25.873 -27.15147 40.57318 
1 1 1   29    8   17 o   37.186   17.373  -2.2412   2.4476  -8.2596   5.3392  -0.6399   2.7540   48.036   23.299   45.680   20.153 2.356060 30.80560 
1 1 1   29    8   18 o  151.184   12.226   17.859   2.8050   24.376   5.9362   15.985   3.1827  172.768   23.021  142.279   14.833 30.48883 27.38538 
1 1 1   29    8   19 o  166.592   11.811   21.641   2.9922   22.280   6.1062   21.440   3.4326  163.963   25.132  165.286   13.691 -1.322891 28.61925 
1 1 1   29    8   20 o   75.696   22.003   4.7135   2.7016  -4.8842   6.0522   7.1018   3.0191   58.244   27.246   92.365   21.720 -34.12104 34.84386 
1 1 1   29    8   21 o  131.299   14.636   13.648   2.8914   27.681   6.4059   10.058   3.2402  183.750   23.300  110.869   19.821 72.88041 30.59041 
1 1 1   29    8   22 o   88.341   22.781   6.5418   3.1004   14.221   10.198   5.7597   3.2545  124.587   43.484   83.085   24.150 41.50241 49.74030 
1 1 1   29    8   23 o   75.583   25.350   4.5250   3.4575   0.0000   0.0000   4.5250   3.4575  ?   ?    75.583   25.350 0.000000 25.34987 
1 1 1   29    8   24 o   68.503   25.057   3.3087   3.4271 -15.2091   10.254   5.6376   3.6363   64.827   31.632   82.465   25.877 -17.63773 40.86787 
1 1 1   29    8   25 o   71.790   24.550   4.0134   3.2434  -4.3294   7.3289   6.0453   3.6169   65.841   30.523   84.804   25.666 -18.96272 39.87997 
1 1 1   29    8   26 o  128.395   12.609   12.985   2.4459   12.915   3.1172   13.097   3.9456  126.814   16.446  125.842   21.240 0.9715195 26.86330 
1 1 1   29    8   27 o  134.727   13.369   14.347   2.7205   17.691   3.6735   10.286   4.0484  148.615   16.424  109.714   24.702 38.90099 29.66387 
1 1 1   29    8   28 o   74.180   26.044   4.2947   3.6606   4.2947   3.6606   0.0000   0.0000   74.180   26.044  ?   ?  0.000000 26.04389 
1 1 1   29    8   29 o   68.159   22.826   3.7035   2.8032   0.2091   3.8734   7.5461   4.0618   56.643   24.459   93.057   26.959 -36.41404 36.40099 
1 1 1   29    8   30 o  147.996   12.576   17.288   2.8219   12.974   4.2467   20.698   3.7762  123.501   23.320  160.808   15.535 -37.30643 28.02103 
1 1 1   29    8   31 o  169.156   8.9612   22.248   2.3119   19.190   4.3698   23.437   2.7245  152.857   19.094  173.187   10.325 -20.32990 21.70621 
1 1 1   29    8   32 o  138.308   13.797   15.254   2.8819   16.759   4.5628   14.256   3.7171  141.041   21.842  131.329   19.047 9.711685 28.98034 
1 1 1   29    8   33 o   74.391   19.684   4.6928   2.2762   9.2911   4.5475   3.1557   2.6293  101.255   28.264   63.511   22.085 37.74312 35.86889 
1 1 1   29    8   34 o   53.917   21.292   1.6229   2.5958   1.7486   5.5297   1.5874   2.9399   69.328   29.565   55.786   22.449 13.54140 37.12196 
1 1 1   29    8   35 o  113.648   15.137   10.512   2.5677   5.9973   4.6464   12.497   3.0808   82.780   29.315  123.280   16.761 -40.49973 33.76830 
1 1 1   29    8   36 o   73.165   21.305   4.6480   2.5309   5.2106   4.5891   4.4020   3.0339   78.371   28.943   71.641   23.739 6.729942 37.43316 
1 1 1   29    8   37 o  137.577   13.223   15.226   2.7503   5.5577   5.9976   17.800   3.0948   81.618   32.322  148.546   13.768 -66.92773 35.13253 
1 1 1   29    8   38 o   73.888   20.696   4.8003   2.4339   10.464   4.3693   2.2519   2.9308  105.406   26.971   58.144   22.727 47.26189 35.26921 
1 1 1   29    8   39 o  166.695   11.267   22.104   2.8580   15.604   4.5321   26.395   3.6824  132.046   23.274  180.838   13.399 -48.79176 26.85560 
1 1 1   29    9    0 o   27.492   19.342  -3.4992   3.1744  -3.4992   3.1744  -3.4992   3.1744   27.492   19.342   27.492   19.342 0.000000 0.000000 
1 1 1   29    9    1 o   68.052   19.160   3.7496   2.0805  -1.8315   4.0340   5.7721   2.4284   52.341   23.643   84.014   19.291 -31.67292 30.51454 
1 1 1   29    9    3 o  162.761   23.654   21.553   5.7203   21.553   5.7203   0.0000   0.0000  162.761   23.654  ?   ?  0.000000 23.65373 
1 1 1   29    9    4 o  221.601   20.686   39.171   6.9355   39.171   6.9355   0.0000   0.0000  221.601   20.686  ?   ?  0.000000 20.68642 
1 1 1   29    9    5 o  136.757   32.898   16.113   6.8024   16.113   6.8024   0.0000   0.0000  136.757   32.898  ?   ?  0.000000 32.89810 
1 1 1   29    9    6 o  145.505   32.855   18.211   7.1442   18.211   7.1442   0.0000   0.0000  145.505   32.855  ?   ?  0.000000 32.85522 
1 1 1   29    9    7 o  124.618   24.849   12.873   4.5735   12.873   4.5735   0.0000   0.0000  124.618   24.849  ?   ?  0.000000 24.84900 
1 1 1   29    9    8 o   61.738   26.488   0.1912   4.4874   0.1912   4.4874   0.0000   0.0000   61.738   26.488  ?   ?  0.000000 26.48842 
1 1 1   29    9    9 o  280.752   8.5051   60.691   3.6549   73.740   5.9736   52.884   4.6206  308.331   12.657  261.404   11.548 46.92706 17.13407 
1 1 1   29    9   10 o  151.722   10.228   17.853   2.3614   18.162   5.1540   17.771   2.6567  149.087   23.352  151.091   11.576 -2.004272 26.06389 
1 1 1   29    9   11 o  193.220   10.818   28.949   3.1865   34.386   5.5715   26.305   3.8845  208.506   17.623  183.359   13.945 25.14726 22.47300 
1 1 1   29    9   12 o  126.763   12.644   12.589   2.4205   15.868   6.4242   12.046   2.6131  135.798   31.515  123.636   14.058 12.16216 34.50819 
1 1 1   29    9   13 o  106.186   14.625   8.9488   2.3140   15.458   5.2429   7.3741   2.5787  136.091   26.119   95.247   18.354 40.84366 31.92297 
1 1 1   29    9   14 o  174.064   10.377   23.496   2.7521   24.123   5.4632   23.283   3.1858  172.949   21.073  172.860   12.118 0.8882141E-01 24.30874 
1 1 1   29    9   15 o   98.507   16.721   7.8137   2.4310   11.726   5.3461   6.7939   2.7295  116.870   29.795   90.852   20.155 26.01899 35.97222 
1 1 1   29    9   16 o   98.825   23.587   8.1612   3.5183   16.624   6.0270   3.7863   4.3333  139.692   29.131   75.045   28.043 64.64720 40.43535 
1 1 1   29    9   17 o  118.781   16.399   11.271   2.9019  -6.7820   9.4392   13.155   3.0496   72.639   33.995  128.655   15.820 -56.01611 37.49522 
1 1 1   29    9   18 o  219.095   10.411   37.135   3.4913   32.592   9.8939   37.782   3.7314  193.028   34.766  220.846   11.038 -27.81863 36.47630 
1 1 1   29    9   19 o  149.522   13.912   17.591   3.1473   25.647   9.6017   16.621   3.3313  168.327   38.149  144.908   15.248 23.41914 41.08321 
1 1 1   29    9   20 o  184.534   12.112   26.572   3.4022   26.390   9.8946   26.596   3.6231  170.043   38.865  184.376   12.920 -14.33279 40.95583 
1 1 1   29    9   21 o  178.032   11.860   24.730   3.2134   21.063   6.5138   25.909   3.6941  157.527   28.043  181.782   13.371 -24.25511 31.06751 
1 1 1   29    9   22 o   82.725   22.916   5.7193   3.0015   7.7629   6.4478   5.1540   3.3914   97.448   34.530   79.300   25.006 18.14777 42.63404 
1 1 1   29    9   23 o   41.638   19.421  -2.5945   3.0383  -3.4748   7.9282  -2.4430   3.2894   70.601   32.372   44.241   20.488 26.36031 38.31080 
1 1 1   29    9   24 o  145.825   15.288   16.891   3.3616   29.051   7.1941   13.494   3.8022  186.193   25.948  128.481   19.984 57.71237 32.75152 
1 1 1   29    9   25 o   33.272   16.448  -6.6508   3.0757  -4.6079   7.1882  -7.1086   3.4029   64.517   30.018   35.316   17.429 29.20159 34.71067 
1 1 1   29    9   26 o  130.900   12.514   13.492   2.4767   15.889   3.2363   10.104   3.8479  141.253   15.208  109.187   23.704 32.06615 28.16317 
1 1 1   29    9   27 o  118.527   24.705   11.987   4.3367   17.529   7.6644   9.3768   5.2596  137.217   36.031  102.845   30.912 34.37105 47.47399 
1 1 1   29    9   28 o  154.454   14.206   18.926   3.3208   19.110   3.8305   18.371   6.6626  154.286   16.475  143.168   31.278 11.11821 35.35201 
1 1 1   29    9   29 o  161.651   12.727   20.602   3.1235   21.468   4.2492   19.584   4.6072  163.074   17.287  154.363   19.967 8.710236 26.41094 
1 1 1   29    9   30 o   77.924   23.505   5.1565   3.0370   3.3254   4.1655   7.2344   4.4374   70.503   27.223   90.760   28.602 -20.25645 39.48616 
1 1 1   29    9   31 o  212.841   10.949   35.456   3.5550   41.249   4.8061   28.456   5.2828  228.142   13.828  186.621   18.748 41.52115 23.29598 
1 1 1   29    9   32 o   63.933   25.157   2.4901   3.6114   5.3662   4.4421  -3.1171   6.2025   80.504   28.646   60.825   28.156 19.67858 40.16679 
1 1 1   29    9   33 o   54.357   22.692   0.9847   3.1466   0.6109   4.4837   1.3475   4.4170   60.871   26.300   63.041   26.634 -2.170296 37.43065 
1 1 1   29    9   34 o   55.359   23.808   0.5093   3.6407   4.7064   5.5307  -2.7002   4.8364   79.291   31.153   53.551   24.815 25.74050 39.82841 
1 1 1   29    9   35 o   64.481   20.400   3.4857   2.2556   5.2589   4.6539   2.9413   2.5787   79.045   29.155   61.427   21.829 17.61869 36.42207 
1 1 1   29    9   36 o   83.346   18.644   5.9414   2.3189   3.1929   4.4916   6.9401   2.7076   69.159   27.777   89.505   20.239 -20.34551 34.36793 
1 1 1   29    9   37 o   73.517   21.035   4.7393   2.4867   3.8703   5.6860   4.9448   2.7652   74.789   30.797   74.774   22.400 0.1514435E-01 38.08167 
1 1 1   29    9   38 o  140.317   11.894   15.737   2.5304   13.368   4.4103   16.900   3.0895  121.261   24.603  144.185   14.183 -22.92367 28.39803 
1 1 1   29    9   39 o   73.439   21.459   4.8031   2.5637   4.8423   4.3226   4.7818   3.1842   74.608   27.983   73.066   24.325 1.541077 37.07777 
1 1 1   29   10    0 o   68.871   27.545   5.1303   2.8160   5.1303   2.8160   5.1303   2.8160   68.871   27.545   68.871   27.545 0.000000 0.000000 
1 1 1   29   10    1 o  186.923   8.3392   26.891   2.3859   28.197   4.1963   26.268   2.9004  189.792   14.556  184.185   10.330 5.606750 17.84882 
1 1 1   29   10    3 o  120.112   27.984   12.169   5.0493   12.169   5.0493   0.0000   0.0000  120.112   27.984  ?   ?  0.000000 27.98402 
1 1 1   29   10    4 o   80.605   31.369   3.8362   5.5651   3.8362   5.5651   0.0000   0.0000   80.605   31.369  ?   ?  0.000000 31.36940 
1 1 1   29   10    5 o  171.070   25.603   24.037   6.4980   24.037   6.4980   0.0000   0.0000  171.070   25.603  ?   ?  0.000000 25.60333 
1 1 1   29   10    6 o  154.292   29.855   20.103   6.7957   20.103   6.7957   0.0000   0.0000  154.292   29.855  ?   ?  0.000000 29.85475 
1 1 1   29   10    7 o  209.435   9.2882   33.813   2.9775   39.219   4.9846   30.814   3.7126  223.917   14.624  199.041   12.246 24.87549 19.07403 
1 1 1   29   10    8 o   74.653   20.174   4.5613   2.3599   6.5939   4.4937   3.7872   2.7731   89.988   28.828   69.676   22.677 20.31243 36.67865 
1 1 1   29   10    9 o  194.335   10.303   29.246   3.0539   29.575   5.2984   29.082   3.7371  193.097   18.139  193.201   12.708 -0.1040039 22.14789 
1 1 1   29   10   10 o   79.990   21.679   5.2676   2.7205   6.8761   8.2608   5.0719   2.8812   99.732   38.384   78.676   22.681 21.05629 44.58457 
1 1 1   29   10   11 o   67.997   20.093   3.7311   2.2365   6.4771   8.1616   3.5081   2.3255   98.097   38.041   66.458   20.668 31.63908 43.29308 
1 1 1   29   10   12 o   84.082   19.293   5.8020   2.4302   0.0000   0.0000   5.8020   2.4302  ?   ?    84.082   19.293 0.000000 19.29262 
1 1 1   29   10   13 o   53.676   19.767   1.8605   2.1380   7.8845   5.1550   0.6091   2.3496   97.226   30.848   47.780   19.748 49.44566 36.62824 
1 1 1   29   10   14 f   59.796   20.799   2.5990   2.3321  -0.2541   5.0334   3.3789   2.6316   63.448   27.638   66.339   22.115 -2.891098 35.39657 
1 1 1   29   10   15 o   51.534   20.404   1.2452   2.3894   3.4890   5.2071   0.6468   2.6892   77.318   30.273   50.706   21.056 26.61215 36.87594 
1 1 1   29   10   16 f   78.917   25.056   5.0360   3.4003   2.7980   5.3088   6.5928   4.4278   75.049   30.178   89.464   28.612 -14.41570 41.58548 
1 1 1   29   10   17 o  190.826   10.590   28.263   3.0810   36.621   6.1582   25.473   3.5584  214.190   18.981  180.492   12.967 33.69814 22.98703 
1 1 1   29   10   18 o  123.695   15.222   12.153   2.8211   16.094   5.9137   10.991   3.2100  137.061   29.089  116.498   18.629 20.56284 34.54277 
1 1 1   29   10   19 o  155.509   12.763   18.943   3.0111   28.694   6.1806   15.908   3.4479  187.896   21.901  141.391   16.226 46.50478 27.25701 
1 1 1   29   10   20 o  183.240   11.284   26.142   3.1493   35.832   6.6224   23.310   3.5801  210.662   20.810  172.290   13.689 38.37274 24.90865 
1 1 1   29   10   21 o  141.921   14.506   15.924   3.1069   21.751   6.8524   14.416   3.4857  159.398   29.161  134.022   17.403 25.37541 33.95887 
1 1 1   29   10   22 o  130.765   16.493   13.681   3.2277   17.209   6.9248   12.702   3.6482  139.206   33.002  124.770   19.761 14.43638 38.46604 
1 1 1   29   10   23 o  180.312   13.611   25.555   3.7289   21.863   9.1338   26.294   4.0849  153.266   38.875  182.499   14.749 -29.23242 41.57927 
1 1 1   29   10   24 o  145.854   15.752   16.948   3.4608   11.745   7.1722   18.527   3.9512  113.972   36.411  151.976   17.294 -38.00422 40.30915 
1 1 1   29   10   25 o  218.919   11.823   37.432   3.9469   36.482   8.2133   37.717   4.5007  208.133   26.373  219.095   13.486 -10.96217 29.62132 
1 1 1   29   10   26 o   99.615   17.702   8.1159   2.6003   7.9876   2.9507   8.5617   5.5014   97.904   20.354   98.912   31.919 -1.008057 37.85682 
1 1 1   29   10   27 o  168.072   10.671   22.046   2.7308   29.542   3.6201   12.148   4.1598  194.090   12.249  119.751   23.534 74.33855 26.53064 
1 1 1   29   10   28 o  191.865   11.742   28.844   3.4316   29.801   3.9599   25.957   6.8767  194.362   13.393  173.922   26.684 20.43996 29.85626 
1 1 1   29   10   29 o  129.005   17.662   13.561   3.3959   12.932   4.0317   15.096   6.3002  123.913   22.066  128.229   32.157 -4.315445 38.99997 
1 1 1   29   10   30 o   93.132   25.310   7.5891   3.7023   9.4180   4.4763   3.6291   6.5868  102.722   27.795   80.167   33.094 22.55492 43.21785 
1 1 1   29   10   31 o  108.790   20.099   9.9319   3.2235   7.9334   4.4668   12.104   4.6567   94.151   28.529  116.933   26.616 -22.78186 39.01685 
1 1 1   29   10   32 o   56.502   22.509   1.7115   2.9247   1.2091   4.6065   2.0508   3.7857   63.652   27.061   62.718   25.391 0.9332809 37.10767 
1 1 1   29   10   33 o   62.233   23.130   2.7887   2.9401   4.3610   4.5697   1.6781   3.8407   75.590   28.678   61.195   25.267 14.39512 38.22131 
1 1 1   29   10   34 o   40.790   19.179  -2.7082   3.0651  -1.3187   5.2861  -3.4120   3.7621   59.241   26.883   44.573   21.046 14.66833 34.14121 
1 1 1   29   10   35 o   38.511   18.319  -3.1762   2.9523   2.3549   4.4486  -7.5296   3.9467   65.952   27.209   38.192   18.833 27.75986 33.09121 
1 1 1   29   10   36 o   90.633   22.247   7.2816   3.0634   3.5746   4.3076   11.075   4.3574   69.955   27.491  109.635   26.303 -39.68073 38.04733 
1 1 1   29   10   37 o   63.176   24.526   2.8501   3.3955  -0.3962   5.7075   4.6285   4.2243   62.349   28.147   74.084   27.687 -11.73505 39.48199 
1 1 1   29   10   38 o   68.146   24.274   3.9342   3.1902   0.9275   4.8354   6.2517   4.2452   61.651   26.965   81.767   28.083 -20.11604 38.93322 
1 1 1   29   11    0 f  267.638   10.291   55.302   4.2017   55.302   4.2017   55.302   4.2017  267.638   10.291  267.638   10.291 0.000000 0.000000 
1 1 1   29   11    1 o  117.579   10.502   10.760   1.8701   10.645   3.3159   10.814   2.2646  114.658   19.598  117.403   12.810 -2.744980 23.41349 
1 1 1   29   11    3 o  134.299   23.414   14.795   4.6379   14.795   4.6379   0.0000   0.0000  134.299   23.414  ?   ?  0.000000 23.41354 
1 1 1   29   11    4 o  144.263   25.628   17.223   5.4518   17.223   5.4518   0.0000   0.0000  144.263   25.628  ?   ?  0.000000 25.62848 
1 1 1   29   11    5 o   71.782   29.805   1.6517   5.3875   1.6517   5.3875   0.0000   0.0000   71.782   29.805  ?   ?  0.000000 29.80541 
1 1 1   29   11    6 o  204.943   10.015   32.419   3.1418   32.959   6.4923   32.254   3.5901  202.691   21.242  203.819   11.555 -1.127579 24.18170 
1 1 1   29   11    7 o   72.049   19.780   4.2374   2.2477   2.1160   4.1437   5.1218   2.6755   66.925   26.750   78.942   21.542 -12.01694 34.34553 
1 1 1   29   11    8 o   60.138   20.674   2.6566   2.3010   0.3129   4.4401   3.5171   2.6904   61.781   26.423   67.574   22.353 -5.792450 34.61022 
1 1 1   29   11    9 o  101.724   17.096   8.3259   2.5674   12.355   4.9152   6.8140   3.0108  121.048   27.193   90.728   21.924 30.32025 34.93021 
1 1 1   29   11   10 o   59.442   21.403   2.4277   2.4867   3.8027   4.7821   1.9181   2.9113   77.084   29.315   58.837   22.747 18.24683 37.10508 
1 1 1   29   11   11 o   91.114   19.960   6.8200   2.7067   5.7578   5.1503   7.2253   3.1815   87.001   30.858   93.268   22.537 -6.266548 38.21161 
1 1 1   29   11   12 o   91.720   21.926   6.9755   3.0364   7.3542   6.1690   6.8545   3.4882   96.283   33.809   90.603   24.545 5.680496 41.77896 
1 1 1   29   11   13 o   70.089   20.569   3.9877   2.3509  -1.5797   5.1458   5.4562   2.6429   60.380   27.035   81.264   21.071 -20.88336 34.27670 
1 1 1   29   11   14 o  160.237   13.090   20.096   3.1825   0.0000   0.0000   20.096   3.1825  ?   ?   160.237   13.090 0.000000 13.09035 
1 1 1   29   11   15 o   89.809   18.967   6.6108   2.5255   5.0831   5.1493   7.0946   2.8980   83.692   30.699   92.615   20.935 -8.922760 37.15751 
1 1 1   29   11   16 o  112.539   20.201   10.355   3.3519   13.154   5.4789   8.6812   4.2375  123.662   29.380  101.102   26.908 22.55943 39.84065 
1 1 1   29   11   17 o   66.522   22.409   3.3910   2.7019   2.6843   5.5402   3.6115   3.0950   75.495   30.663   69.268   23.968 6.227257 38.91903 
1 1 1   29   11   18 o  136.025   14.435   14.619   2.9595   7.1664   5.7032   17.365   3.4621   93.988   32.535  148.040   15.509 -54.05247 36.04288 
1 1 1   29   11   19 o  172.897   12.215   23.352   3.2117   24.495   6.3791   22.964   3.7173  171.846   24.984  170.790   14.353 1.055313 28.81319 
1 1 1   29   11   20 o  267.520   9.3338   55.294   3.8219   61.558   7.3402   52.965   4.4767  278.591   17.299  261.282   11.194 17.30869 20.60487 
1 1 1   29   11   21 o  197.494   11.444   30.387   3.4445   28.127   6.7755   31.175   3.9999  184.223   24.646  199.478   13.175 -15.25459 27.94665 
1 1 1   29   11   22 o   69.056   24.472   3.5356   3.2386  -4.4736   6.8667   5.8269   3.6728   63.317   29.419   83.653   25.967 -20.33609 39.23963 
1 1 1   29   11   23 o   82.219   25.420   5.6353   3.5237   20.545   9.5615   3.2919   3.7905  146.764   40.989   69.808   26.200 76.95587 48.64697 
1 1 1   29   11   24 o  139.783   16.889   15.686   3.5403   16.695   7.5749   15.403   4.0046  134.614   36.045  137.428   19.592 -2.813583 41.02555 
1 1 1   29   11   25 o  157.466   19.674   20.190   4.6384   19.734   7.8767   20.433   5.7389  146.507   35.498  155.737   24.915 -9.229645 43.36888 
1 1 1   29   11   26 o  151.988   10.990   18.060   2.5394   17.706   3.1645   18.700   4.2557  149.512   13.990  151.738   18.720 -2.225784 23.37050 
1 1 1   29   11   27 o  194.255   11.331   29.508   3.3545   30.490   3.8050   26.080   7.1074  196.946   12.690  173.830   27.638 23.11629 30.41189 
1 1 1   29   11   28 o  137.630   33.229   17.461   6.9206   17.461   6.9206   0.0000   0.0000  137.630   33.229  ?   ?  0.000000 33.22866 
1 1 1   29   11   29 o  141.543   16.837   16.224   3.5761   14.821   4.3515   19.143   6.2766  132.596   22.228  146.769   28.968 -14.17317 36.51325 
1 1 1   29   11   30 o   38.405   18.374  -3.7872   3.0611  -2.9413   4.4022  -4.5791   4.2593   50.706   23.558   46.117   21.955 4.589344 32.20303 
1 1 1   29   11   31 o   65.973   24.405   3.1808   3.2655   5.3648   4.5940   0.9502   4.6427   80.779   29.091   63.060   26.996 17.71877 39.68699 
1 1 1   29   11   32 o  107.986   18.690   9.7217   2.9774   12.170   4.6235   7.9868   3.8917  116.847   26.465   94.640   26.045 22.20756 37.13186 
1 1 1   29   11   33 o   70.099   23.362   4.1035   2.9367   1.0681   4.4968   6.3609   3.8779   62.147   26.586   84.567   26.748 -22.42077 37.71279 
1 1 1   29   11   34 o  139.633   16.017   15.921   3.3613   8.5831   5.4114   20.530   4.2890   95.071   31.714  157.445   18.129 -62.37321 36.52972 
1 1 1   29   11   35 o  137.333   15.007   15.344   3.1032   15.802   4.4179   14.898   4.3599  134.964   22.155  130.658   22.620 4.305588 31.66226 
1 1 1   29   11   36 o  106.539   19.524   9.7307   3.0665   6.8572   4.3186   12.653   4.3551   85.698   28.319  118.222   24.856 -32.52373 37.68013 
1 1 1   29   11   37 o  156.181   17.112   20.298   4.0238   11.849   8.3369   22.864   4.5944  102.914   38.809  164.730   18.544 -61.81577 43.01203 
1 1 1   29   11   38 o   67.462   24.794   3.7686   3.3612   5.4404   4.3619   1.3245   5.2739   77.586   28.285   64.556   28.200 13.03040 39.94117 
1 1 1   29   12    0 o  133.509   15.170   14.287   2.9967   14.287   2.9967   14.287   2.9967  133.509   15.170  133.509   15.170 0.000000 0.000000 
1 1 1   29   12    1 o  184.206   13.225   26.484   3.7041   26.484   3.7041   0.0000   0.0000  184.206   13.225  ?   ?  0.000000 13.22537 
1 1 1   29   12    3 o   97.465   13.897   7.5306   2.0145   11.303   4.0798   6.3142   2.3166  116.900   23.614   88.165   17.780 28.73526 29.55916 
1 1 1   29   12    4 o  179.749   9.8666   25.007   2.7042   28.470   5.3062   23.792   3.1430  189.266   18.555  174.889   11.810 14.37775 21.99493 
1 1 1   29   12    5 o   85.507   30.820   5.3928   5.1574   5.3928   5.1574   0.0000   0.0000   85.507   30.820  ?   ?  0.000000 30.81992 
1 1 1   29   12    6 o  160.870   11.392   20.127   2.7869   19.096   5.6341   20.461   3.2067  152.169   25.062  161.805   13.059 -9.636429 28.26061 
1 1 1   29   12    7 f  128.161   12.918   12.878   2.4994   9.6473   4.2489   14.588   3.0908  107.078   26.150  135.915   15.113 -28.83714 30.20329 
1 1 1   29   12    8 o   65.594   21.041   3.3697   2.3932   3.6193   4.3597   3.2621   2.8632   74.537   28.074   66.481   23.050 8.056297 36.32457 
1 1 1   29   12    9 o  171.325   11.485   22.829   2.9943   28.407   5.1113   19.915   3.6947  189.188   17.862  158.930   15.380 30.25769 23.57144 
1 1 1   29   12   10 o   47.290   20.009   0.2516   2.4988  -5.2031   4.7992   2.2804   2.9268   49.721   23.565   60.886   22.987 -11.16513 32.91934 
1 1 1   29   12   11 o   55.231   21.597   1.5758   2.6477  -3.2755   4.8910   3.5868   3.1490   54.487   25.145   69.488   24.169 -15.00083 34.87682 
1 1 1   29   12   12 o  137.277   16.059   14.957   3.3105   14.400   6.8827   15.124   3.7759  127.904   34.405  137.296   18.433 -9.392746 39.03223 
1 1 1   29   12   13 o  140.030   15.032   15.495   3.1715   14.954   5.3240   15.793   3.9485  133.158   27.045  140.146   18.888 -6.987305 32.98748 
1 1 1   29   12   14 o   70.334   24.326   3.7221   3.1880   4.1874   5.1674   3.4362   4.0507   79.894   30.451   72.153   27.083 7.741051 40.75304 
1 1 1   29   12   15 o  141.790   13.371   15.792   2.8676   17.692   5.6432   15.130   3.3295  145.258   26.352  137.979   16.066 7.279373 30.86318 
1 1 1   29   12   16 o  133.897   17.887   14.392   3.5743   17.681   5.7576   12.329   4.5592  144.834   26.964  121.032   25.419 23.80235 37.05661 
1 1 1   29   12   17 o  172.114   11.869   23.108   3.1077   26.162   6.0389   22.008   3.6245  179.032   22.537  167.233   14.297 11.79895 26.68909 
1 1 1   29   12   18 f  244.964   9.5143   46.368   3.5674   56.107   6.6652   42.458   4.2232  266.492   16.420  233.506   11.855 32.98578 20.25247 
1 1 1   29   12   19 o  113.046   18.212   10.360   3.0441   8.5606   6.0374   10.973   3.5250  100.435   33.498  115.546   20.691 -15.11134 39.37297 
1 1 1   29   12   20 o   51.331   21.710   0.4025   2.9396   10.895   6.1471  -2.7086   3.3472  111.085   33.425   44.023   20.483 67.06206 39.20142 
1 1 1   29   12   21 o  143.305   15.043   16.288   3.2503   18.451   6.5844   15.591   3.7375  145.508   30.537  139.146   17.968 6.361740 35.43120 
1 1 1   29   12   22 o  148.692   15.280   17.559   3.4282   31.034   7.0974   13.459   3.9152  193.322   24.538  127.996   20.690 65.32587 32.09674 
1 1 1   29   12   23 o  156.087   21.093   19.966   4.9104   27.774   9.7959   17.346   5.6748  173.241   37.989  142.398   27.025 30.84238 46.62053 
1 1 1   29   12   24 o  254.348   13.293   50.769   5.1573   52.985   8.1177   49.270   6.6782  255.258   20.962  248.202   17.695 7.055679 27.43188 
1 1 1   29   12   25 f   79.003   28.548   4.8033   4.4291   12.748   7.2106  -0.0106   5.6127  117.257   36.381   66.270   29.017 50.98724 46.53574 
1 1 1   29   12   26 o  165.600   11.437   21.473   2.8812   20.192   3.2293   26.475   6.3803  159.918   13.314  177.602   24.092 -17.68361 27.52642 
1 1 1   29   12   27 o  129.927   18.535   13.808   3.5815   13.808   3.5815   0.0000   0.0000  129.927   18.535  ?   ?  0.000000 18.53450 
1 1 1   29   12   28 o   81.825   26.025   5.7094   3.6672   8.9518   6.7302   4.3402   4.3735   99.891   35.291   75.943   28.213 23.94765 45.18234 
1 1 1   29   12   29 o   47.209   20.896  -0.5632   2.9851   4.2229   4.1444  -5.7236   4.3034   74.496   27.506   44.270   21.336 30.22623 34.81090 
1 1 1   29   12   30 o   70.558   23.995   4.0438   3.0983   10.909   4.4687  -2.3111   4.2994  110.824   26.667   51.486   23.693 59.33757 35.67195 
1 1 1   29   12   31 o   48.599   21.492  -0.4857   3.1508  -3.0471   4.4743   2.0339   4.4377   50.742   23.633   65.755   27.156 -15.01295 35.99979 
1 1 1   29   12   32 o   91.248   21.173   7.1637   2.9000   6.8423   4.5912   7.3770   3.7406   87.503   29.213   90.931   25.723 -3.427437 38.92373 
1 1 1   29   12   33 o   57.369   22.541   1.9946   2.8957   1.1125   4.3858   2.6763   3.8554   61.510   26.283   65.145   25.878 -3.634632 36.88475 
1 1 1   29   12   34 o  185.884   12.177   27.439   3.4454   20.883   5.4839   31.715   4.4285  154.275   24.004  198.292   14.696 -44.01743 28.14482 
1 1 1   29   12   35 o   62.468   23.839   2.8219   3.1694  -1.0418   4.8031   5.8018   4.2181   56.609   25.663   80.362   27.971 -23.75365 37.96056 
1 1 1   29   12   36 o   54.242   22.499   1.2985   3.0652   3.5366   4.2917  -1.0316   4.3791   69.335   27.379   53.967   24.481 15.36852 36.72753 
1 1 1   29   12   37 o   58.863   23.795   2.0674   3.3192   0.6576   4.2731   4.2122   5.2705   58.152   25.394   74.228   29.991 -16.07543 39.29798 
1 1 1   29   13    0 o  239.405   10.840   44.357   3.9538   44.357   3.9538   44.357   3.9538  239.405   10.840  239.405   10.840 0.000000 0.000000 
1 1 1   29   13    1 f  164.664   8.4893   20.937   2.1324   17.778   3.5866   22.663   2.6520  149.989   15.863  171.014   10.177 -21.02505 18.84743 
1 1 1   29   13    2 o  270.255   9.4731   56.338   3.9186   0.0000   0.0000   56.338   3.9186  ?   ?   270.255   9.4731 0.000000 9.473088 
1 1 1   29   13    3 o  110.513   12.472   9.5901   2.0728   13.016   3.9528   8.2907   2.4343  126.426   21.176  101.748   16.172 24.67739 26.64469 
1 1 1   29   13    4 o  168.861   10.118   22.097   2.6031   23.087   4.7241   21.665   3.1194  170.239   18.423  166.700   12.312 3.538605 22.15897 
1 1 1   29   13    5 o   65.310   27.095   1.3035   4.4467   1.3035   4.4467   0.0000   0.0000   65.310   27.095  ?   ?  0.000000 27.09497 
1 1 1   29   13    6 o  143.725   12.860   16.166   2.7992   13.826   5.2582   17.091   3.3068  127.934   27.658  147.279   14.872 -19.34506 31.40314 
1 1 1   29   13    7 o  338.447   7.7487   88.142   4.0141  102.760   5.9553   75.970   5.4341  364.552   10.673  313.247   11.334 51.30551 15.56791 
1 1 1   29   13    8 o  101.276   17.289   8.2708   2.5838   17.774   4.5601   3.7769   3.1358  148.278   20.653   70.611   24.139 77.66624 31.76889 
1 1 1   29   13    9 o   83.562   20.782   5.7675   2.6470   12.853   4.6314   2.3303   3.2257  124.030   25.254   62.781   24.028 61.24946 34.85877 
1 1 1   29   13   10 o  104.483   18.826   8.8701   2.9000   13.396   5.0083   6.5872   3.5571  126.057   26.783   88.857   25.066 37.20008 36.68274 
1 1 1   29   13   11 o  237.740   11.609   43.812   4.2244   41.919   7.6287   44.649   5.0733  227.846   22.155  238.952   13.932 -11.10648 26.17097 
1 1 1   29   13   12 o  122.618   17.464   12.061   3.1850   12.972   5.1644   11.501   4.0460  123.425   27.982  117.730   23.278 5.695602 36.39859 
1 1 1   29   13   13 o  178.019   12.901   24.775   3.4914   34.275   5.5989   18.729   4.4662  207.716   17.781  152.468   19.591 55.24805 26.45732 
1 1 1   29   13   14 o   56.932   23.391   1.0946   3.2711   0.6654   5.2639   1.3647   4.1751   67.412   28.799   63.701   26.327 3.711086 39.01914 
1 1 1   29   13   15 o  217.081   11.961   36.700   3.9589   42.450   5.9633   32.169   5.2937  231.563   16.942  201.257   17.354 30.30687 24.25313 
1 1 1   29   13   16 o   43.406   20.287  -2.9536   3.3427  -2.1527   5.3508  -3.4663   4.2809   59.921   27.133   49.543   23.089 10.37836 35.62734 
1 1 1   29   13   17 o   71.482   23.105   4.0726   2.8817   3.8861   5.7131   4.1362   3.3373   80.393   31.638   73.088   24.903 7.305351 40.26373 
1 1 1   29   13   18 o  204.034   11.037   32.375   3.4341   31.553   6.2600   32.729   4.1073  197.364   21.047  204.458   13.195 -7.093964 24.84118 
1 1 1   29   13   19 o  199.737   11.412   31.074   3.4744   29.716   6.4927   31.619   4.1128  190.510   22.713  200.809   13.459 -10.29913 26.40147 
1 1 1   29   13   20 o   41.480   19.281  -2.3812   2.9542  -4.9833   5.9230  -1.5196   3.4084   57.017   26.762   47.940   21.686 9.076595 34.44531 
1 1 1   29   13   21 o  105.663   20.564   9.2418   3.2062   12.192   6.4299   8.2655   3.6988  116.526   33.966   98.578   24.594 17.94817 41.93557 
1 1 1   29   13   22 o   99.898   27.916   8.6465   4.4337  -3.0537   6.8302   17.167   5.8286   65.690   30.093  141.168   27.964 -75.47799 41.08038 
1 1 1   29   13   23 o  201.385   18.389   32.617   5.6057   38.860   10.096   29.835   6.7401  210.102   32.439  189.540   23.754 20.56248 40.20669 
1 1 1   29   13   24 o   98.656   28.713   8.5136   4.5979   8.4047   7.0140   8.5956   6.0885   99.460   35.927   99.298   33.638 0.1627121 49.21662 
1 1 1   29   13   25 o   60.681   26.016   0.5407   4.3230   5.8511   6.7706  -3.1143   5.6170   89.211   34.633   58.449   26.963 30.76280 43.89194 
1 1 1   29   13   26 o  167.908   10.641   22.021   2.7206   22.405   3.4285   21.369   4.4710  168.382   13.414  162.244   18.325 6.138077 22.70985 
1 1 1   29   13   27 o  158.421   13.829   19.917   3.3197   20.356   3.9115   18.786   6.2769  159.097   16.292  145.446   29.209 13.65048 33.44588 
1 1 1   29   13   28 o  132.956   19.330   14.592   3.8186   24.052   7.2231   10.923   4.4986  164.135   29.851  111.176   26.759 52.95902 40.08861 
1 1 1   29   13   29 o  214.650   10.582   35.936   3.4766   43.929   4.9249   27.997   4.9084  235.462   13.724  185.794   17.465 49.66824 22.21233 
1 1 1   29   13   30 o   61.474   23.588   2.4731   3.1135   2.5024   4.6347   2.4490   4.2033   68.512   27.961   66.407   26.800 2.104790 38.73035 
1 1 1   29   13   31 o   74.482   24.403   4.6985   3.2093   3.4547   4.5888   5.8892   4.4900   71.819   28.326   82.741   28.855 -10.92132 40.43509 
1 1 1   29   13   32 o   76.635   25.002   5.0762   3.3702   4.1435   5.0695   5.8148   4.5114   75.664   29.795   81.883   28.898 -6.218216 41.50698 
1 1 1   29   13   33 o  140.113   15.196   15.945   3.2068   20.713   5.0793   12.785   4.1351  155.394   21.967  120.809   23.206 34.58521 31.95405 
1 1 1   29   13   34 o   87.747   22.963   6.8617   3.1198   3.7617   4.7518   9.2106   4.1362   72.230   28.718   99.790   26.597 -27.56004 39.14233 
1 1 1   29   13   35 o   66.787   23.528   3.7066   2.9894  -0.3997   4.1684   8.0549   4.2894   54.654   24.411   92.252   27.958 -37.59838 37.11547 
1 1 1   29   13   36 o   66.612   23.578   3.7127   3.0055   1.6996   4.2617   5.7048   4.2393   61.791   26.137   79.177   28.005 -17.38585 38.30703 
1 1 1   29   14    0 o   51.605   20.316   2.8378   1.5404   2.8378   1.5404   2.8378   1.5404   51.605   20.316   51.605   20.316 0.000000 0.000000 
1 1 1   29   14    1 o  103.096   8.6213   8.2450   1.3480   9.1074   1.7224   6.8818   2.1655  108.048   10.549   92.566   15.854 15.48133 19.04291 
1 1 1   29   14    2 o   64.251   17.908   3.3477   1.8270   4.9006   3.3492   2.6898   2.1798   78.136   24.873   59.823   20.128 18.31332 31.99689 
1 1 1   29   14    3 o   94.047   15.831   7.0987   2.1979   11.774   3.9254   4.9637   2.6527  119.682   22.247   77.695   21.551 41.98679 30.97423 
1 1 1   29   14    4 o  216.839   9.0925   36.256   3.0178   36.009   4.9265   36.404   3.8180  214.188   15.124  216.485   11.564 -2.297089 19.03864 
1 1 1   29   14    5 o  155.097   19.581   19.322   4.5448   19.322   4.5448   0.0000   0.0000  155.097   19.581  ?   ?  0.000000 19.58082 
1 1 1   29   14    6 o  162.479   11.925   20.575   2.9449   26.569   5.0763   17.534   3.6155  182.648   18.409  148.775   16.136 33.87360 24.47944 
1 1 1   29   14    7 o  122.809   16.122   12.008   2.9574   19.793   5.3163   8.5194   3.5588  155.599   23.017  101.070   23.457 54.52911 32.86330 
1 1 1   29   14    8 o  245.304   10.467   46.528   3.9299   44.385   6.7392   47.632   4.8376  236.249   18.792  247.248   12.827 -10.99945 22.75227 
1 1 1   29   14    9 o  152.319   14.800   18.287   3.4071   17.581   6.6229   18.541   3.9731  142.767   31.181  152.583   17.319 -9.816299 35.66779 
1 1 1   29   14   10 o  181.715   13.583   25.858   3.7506   36.103   7.6083   22.569   4.3108  210.234   24.078  168.624   16.931 41.60977 29.43432 
1 1 1   29   14   11 o   50.835   22.843  -1.4146   3.7090   0.0000   0.0000  -1.4146   3.7090  ?   ?    50.835   22.843 0.000000 22.84309 
1 1 1   29   14   12 o   77.047   25.963   4.6510   3.6268  -6.4187   7.1879   8.4318   4.2008   62.033   29.230   99.666   26.908 -37.63288 39.72943 
1 1 1   29   14   13 o   52.542   22.542   0.0930   3.2495  -1.0758   4.8884   1.0183   4.3496   59.960   26.631   63.391   26.587 -3.431141 37.63045 
1 1 1   29   14   14 o   66.492   24.952   2.8736   3.4377   5.1535   5.1034   0.9797   4.6513   83.642   30.580   64.967   27.383 18.67446 41.04822 
1 1 1   29   14   15 o   91.440   25.137   7.0487   3.6273   12.099   5.3312   2.6955   4.9497  118.231   29.543   72.760   29.181 45.47154 41.52509 
1 1 1   29   14   16 o  281.659   15.394   62.432   6.6115   62.432   6.6115   0.0000   0.0000  281.659   15.394  ?   ?  0.000000 15.39409 
1 1 1   29   14   17 o   86.021   22.934   6.1998   3.0748   7.1857   5.6403   5.7829   3.6677   93.703   32.360   83.540   25.952 10.16279 41.48098 
1 1 1   29   14   18 o  154.739   13.989   18.869   3.2775   16.470   5.9247   19.927   3.9344  138.258   28.926  158.187   16.492 -19.92867 33.29683 
1 1 1   29   14   19 o  111.500   19.532   10.185   3.2119   7.3358   5.9853   11.338   3.8063   94.637   33.297  116.810   22.099 -22.17294 39.96322 
1 1 1   29   14   20 o   80.578   23.938   5.4208   3.1677  -0.2285   6.1489   7.4618   3.6959   68.904   30.266   93.580   25.229 -24.67522 39.40165 
1 1 1   29   14   21 o  204.995   15.239   33.252   4.7473   31.104   6.9017   35.181   6.5403  193.792   23.766  208.014   20.821 -14.22229 31.59660 
1 1 1   29   14   22 o   94.293   29.762   7.6612   4.8032   8.1655   8.8728   7.4521   5.7127  101.989   39.632   94.123   32.563 7.866547 51.29433 
1 1 1   29   14   23 o   65.353   27.445   1.3190   4.6448  -1.0564   6.9754   3.2112   6.2257   70.407   31.504   78.861   32.321 -8.454727 45.13438 
1 1 1   29   14   24 o   79.686   25.601   5.2970   3.5418   10.891   6.7306   3.1546   4.1651  109.151   35.314   70.231   27.192 38.92055 44.57053 
1 1 1   29   14   25 o   78.336   25.514   5.1068   3.5102   11.398   6.8574   2.8731   4.0861  110.863   35.623   68.460   26.814 42.40289 44.58637 
1 1 1   29   14   26 o  177.409   10.686   24.598   2.8881   23.980   3.7106   25.548   4.6001  173.848   14.065  178.011   17.093 -4.163223 22.13613 
1 1 1   29   14   27 o  167.179   13.486   22.149   3.4216   20.683   4.0713   25.675   6.3138  159.978   16.881  173.766   24.412 -13.78812 29.68036 
1 1 1   29   14   28 f   70.964   25.747   3.8604   3.6080   8.1049   6.9131   2.2715   4.2297   96.113   35.518   66.026   26.801 30.08705 44.49480 
1 1 1   29   14   29 f  157.980   13.703   19.865   3.2806   19.072   4.6157   20.674   4.6636  151.323   20.452  158.077   19.702 -6.754364 28.39807 
1 1 1   29   14   30 o   80.226   24.927   5.5864   3.3836   4.7227   5.0989   6.2660   4.5230   78.719   30.191   84.770   28.991 -6.051262 41.85653 
1 1 1   29   14   31 o  110.300   21.562   10.445   3.5098   4.8931   5.0769   15.528   4.8576   78.869   30.154  132.994   24.774 -54.12467 39.02637 
1 1 1   29   14   32 o   72.665   24.307   4.5024   3.1789   4.4554   4.2790   4.5603   4.7490   74.554   27.865   76.158   29.153 -1.603882 40.32847 
1 1 1   29   14   33 o   95.130   20.946   7.8665   2.9674   9.4403   4.1916   6.2852   4.2016  101.134   26.689   83.231   27.945 17.90325 38.64198 
1 1 1   29   14   34 o   39.485   18.737  -3.0674   3.0533  -9.8580   4.6314   2.1527   4.0606   39.565   19.667   63.034   25.999 -23.46922 32.59999 
1 1 1   29   14   35 o   52.481   21.947   1.0665   2.9509   4.0321   4.2552  -1.6813   4.0959   71.337   27.523   50.483   23.192 20.85467 35.99120 
1 1 1   29   14   36 o   48.384   21.548  -0.3915   3.2222   2.3378   4.0886  -4.8654   5.2347   63.324   26.100   50.310   24.059 13.01351 35.49686 
1 1 1   29   15    0 o   30.379   19.492   0.1129   2.0575   0.1129   2.0575   0.1129   2.0575   30.379   19.492   30.379   19.492 0.000000 0.000000 
1 1 1   29   15    1 o  304.650   6.5403   71.313   3.0498   76.375   4.2681   66.032   4.3595  314.757   8.8591  292.447   9.7391 22.30966 13.16560 
1 1 1   29   15    2 o  102.009   18.099   8.4290   2.7224   0.0000   0.0000   8.4290   2.7224  ?   ?   102.009   18.099 0.000000 18.09886 
1 1 1   29   15    3 o  222.394   9.0507   38.142   3.0809   36.715   4.6767   39.237   4.0950  216.557   14.188  224.622   11.954 -8.064819 18.55200 
1 1 1   29   15    4 o   98.127   26.896   8.1316   4.1598   8.1316   4.1598   0.0000   0.0000   98.127   26.896  ?   ?  0.000000 26.89584 
1 1 1   29   15    5 o   83.764   20.103   5.7874   2.5447   4.4714   4.1954   6.5533   3.2006   77.888   27.826   88.669   23.284 -10.78119 36.28312 
1 1 1   29   15    6 o  181.059   11.455   25.501   3.1582   27.359   4.8577   24.141   4.1565  185.704   17.289  174.903   15.693 10.80119 23.34869 
1 1 1   29   15    7 o  160.959   13.501   20.310   3.2955   28.555   5.2859   15.068   4.2149  189.254   18.483  136.104   20.900 53.14946 27.90103 
1 1 1   29   15    8 o   67.741   24.333   3.2637   3.2121   8.2860   5.1934   0.1522   4.0878   99.010   30.902   58.728   25.242 40.28192 39.90055 
1 1 1   29   15    9 o  329.057   9.8063   83.654   4.9391   92.422   8.0322   78.323   6.2631  343.575   15.274  317.314   12.895 26.26157 19.98931 
1 1 1   29   15   10 o  132.437   18.794   14.140   3.7028   10.334   6.6908   15.821   4.4457  109.310   35.194  139.174   21.567 -29.86438 41.27654 
1 1 1   29   15   11 o  177.438   18.225   25.138   4.8793   0.0000   0.0000   25.138   4.8793  ?   ?   177.438   18.225 0.000000 18.22462 
1 1 1   29   15   12 o   79.730   26.467   5.0727   3.7705   9.6092   7.4736   3.5237   4.3671  106.792   37.229   73.749   28.022 33.04329 46.59593 
1 1 1   29   15   13 o  149.915   18.025   18.010   4.0531   28.790   7.6219   13.760   4.7859  185.097   27.758  127.975   25.329 57.12196 37.57780 
1 1 1   29   15   14 f  205.864   12.788   33.119   4.0096   30.715   5.6343   35.585   5.7073  195.772   19.044  211.421   17.802 -15.64906 26.06887 
1 1 1   29   15   15 o   84.190   30.794   5.2747   5.1762   5.2747   5.1762   0.0000   0.0000   84.190   30.794  ?   ?  0.000000 30.79423 
1 1 1   29   15   16 o  137.990   19.988   15.484   4.0987   14.428   5.7391   16.583   5.8555  128.943   29.692  139.055   28.470 -10.11214 41.13575 
1 1 1   29   15   17 o   81.069   27.443   5.2567   4.0524  -0.0031   5.5806   11.125   5.8943   66.749   29.088  112.251   32.464 -45.50217 43.58863 
1 1 1   29   15   18 o   95.597   27.332   7.8292   4.2001   15.230   5.9339   0.3983   5.9459  132.066   30.033   69.691   30.198 62.37505 42.58993 
1 1 1   29   15   19 o  109.215   25.689   10.202   4.2224   15.018   6.3130   6.3029   5.6798  129.974   31.957   89.395   32.324 40.57827 45.45432 
1 1 1   29   15   20 o   70.954   27.407   3.1709   4.2234  -2.1541   6.3466   7.4032   5.6580   65.072   29.500   94.015   32.414 -28.94289 43.82859 
1 1 1   29   15   21 f   76.144   28.411   4.1503   4.4446   1.1830   6.8668   6.2898   5.8308   75.663   32.619   89.278   32.679 -13.61468 46.17261 
1 1 1   29   15   22 o   59.221   24.480   1.2539   3.6110   1.5266   8.8187   1.1990   3.9581   83.754   36.530   61.071   25.468 22.68229 44.53141 
1 1 1   29   15   23 o  183.358   13.734   26.547   3.8264   34.376   7.1866   23.450   4.5204  203.129   23.551  170.603   17.562 32.52620 29.37828 
1 1 1   29   15   24 o   84.091   25.623   6.0432   3.5958 -12.2917   6.7690   13.251   4.2442   50.462   24.842  125.239   22.987 -74.77707 33.84561 
1 1 1   29   15   25 o   56.251   24.089   0.4506   3.6990  -8.2240   7.0885   3.6966   4.3362   57.261   27.543   72.952   27.874 -15.69148 39.18591 
1 1 1   29   15   26 o  136.037   14.263   14.770   2.9256   15.561   3.8601   13.701   4.4848  137.676   18.810  126.421   24.056 11.25504 30.53641 
1 1 1   29   15   27 o   94.972   24.475   7.8669   3.5802   3.3837   4.4473   16.122   6.0348   71.619   27.995  133.204   30.285 -61.58493 41.24178 
1 1 1   29   15   28 o   61.626   25.605   1.5156   3.9794   16.593   9.7484  -1.4992   4.3592  125.677   42.564   53.990   24.465 71.68729 49.09389 
1 1 1   29   15   29 o  109.505   19.863   10.085   3.2067   5.4424   4.4906   14.915   4.5805   80.685   28.793  131.533   23.620 -50.84737 37.24119 
1 1 1   29   15   30 o  139.650   15.811   15.832   3.3201   16.371   4.5115   15.196   4.9035  138.523   22.015  131.258   25.324 7.265411 33.55539 
1 1 1   29   15   31 o   40.375   19.023  -2.7801   3.0428  -1.1792   4.0884  -4.7680   4.5559   52.513   23.753   47.214   22.541 5.299118 32.74619 
1 1 1   29   15   32 o   52.256   22.159   0.7372   3.0756  -6.1724   4.0269   10.411   4.7648   40.889   19.923  105.091   28.777 -64.20255 35.00073 
1 1 1   29   15   33 o  164.526   14.435   21.902   3.5985   17.768   4.7784   27.318   5.4693  142.645   22.642  179.404   20.273 -36.75917 30.39173 
1 1 1   29   15   34 o   69.752   23.340   4.2077   2.9308   7.1128   4.1498   1.3167   4.1398   87.025   27.685   60.046   25.593 26.97820 37.70234 
1 1 1   29   15   35 o   75.613   24.672   5.1443   3.2816   5.6093   4.1832   4.4002   5.2915   78.585   27.817   75.098   30.153 3.487770 41.02425 
1 1 1   29   16    0 o  210.962   11.077   34.541   3.5544   34.541   3.5544   34.541   3.5544  210.962   11.077  210.962   11.077 0.000000 0.000000 
1 1 1   29   16    1 o   37.264   15.828   0.0755   1.5734   0.3165   1.9258  -0.4084   2.7288   42.327   17.718   46.366   20.269 -4.039562 26.92119 
1 1 1   29   16    2 f  334.057   6.0162   85.704   3.0762   87.617   3.7221   81.580   5.4640  337.510   7.2049  324.595   10.998 12.91449 13.14755 
1 1 1   29   16    3 o  136.241   8.4366   14.357   1.7507   13.432   1.9749   17.750   3.7826  131.498   9.8844  149.385   16.837 -17.88712 19.52357 
1 1 1   29   16    4 o  184.567   7.4213   26.211   2.0965   26.211   2.0965   0.0000   0.0000  184.567   7.4213  ?   ?  0.000000 7.421332 
1 1 1   29   16    5 o   51.716   21.125   0.9234   2.6485   1.4042   4.1124   0.5827   3.4621   63.544   26.182   56.100   23.634 7.444065 35.27116 
1 1 1   29   16    6 o  151.409   13.812   18.015   3.1657   17.336   4.6993   18.578   4.2835  145.777   21.724  152.143   18.793 -6.365967 28.72522 
1 1 1   29   16    7 o   66.081   23.365   3.1710   2.9505   5.3947   4.5039   1.4993   3.9051   83.269   28.908   62.683   25.633 20.58619 38.63573 
1 1 1   29   16    8 f   85.316   24.198   6.0683   3.3058   8.4949   5.2806   4.5044   4.2393   99.972   31.153   78.022   27.961 21.94978 41.86101 
1 1 1   29   16    9 o   92.573   24.248   7.2002   3.4768   13.892   5.6462   3.1134   4.4126  126.944   29.603   72.144   27.973 54.79922 40.72874 
1 1 1   29   16   10 o  162.998   16.388   21.087   4.0333   25.618   7.2302   19.040   4.8598  174.364   28.041  152.918   21.345 21.44585 35.24084 
1 1 1   29   16   11 o   86.720   29.097   6.0837   4.5552   0.0000   0.0000   6.0837   4.5552  ?   ?    86.720   29.097 0.000000 29.09701 
1 1 1   29   16   12 o  163.650   17.193   21.347   4.2422   28.159   7.6938   18.371   5.0851  182.515   28.470  149.367   22.978 33.14799 36.58595 
1 1 1   29   16   13 o  184.933   16.127   27.093   4.5193   29.138   8.2016   26.202   5.4156  184.636   30.055  180.239   19.966 4.397232 36.08224 
1 1 1   29   16   14 o  154.858   19.954   19.423   4.6198   29.185   8.1237   14.757   5.6163  184.872   29.715  130.878   28.816 53.99466 41.39267 
1 1 1   29   16   15 o   61.412   27.447  -1.3302   5.2781  -1.3302   5.2781   0.0000   0.0000   61.412   27.447  ?   ?  0.000000 27.44685 
1 1 1   29   16   16 o   85.053   26.952   6.0138   3.9361   8.6127   5.2453   2.6644   5.9548   99.889   31.036   76.738   31.548 23.15119 44.25534 
1 1 1   29   16   17 o  197.280   15.348   30.786   4.5980   31.277   6.1527   30.164   6.9199  196.258   20.799  190.790   24.243 5.467056 31.94267 
1 1 1   29   16   18 o  140.852   20.583   16.245   4.3065   19.733   6.0808   12.734   6.1000  152.179   27.099  119.344   32.511 32.83475 42.32413 
1 1 1   29   16   19 o   73.689   27.827   3.7191   4.2898  -0.0221   6.1515   7.2610   5.9855   69.274   30.354   93.826   33.267 -24.55215 45.03364 
1 1 1   29   16   20 o  159.104   19.344   20.568   4.6139   27.684   6.7115   14.193   6.3532  181.794   24.764  125.365   32.750 56.42950 41.05844 
1 1 1   29   16   21 o  146.771   16.464   17.281   3.6349   14.545   7.0328   18.278   4.2460  125.352   35.205  149.927   18.924 -24.57536 39.96868 
1 1 1   29   16   22 o  109.762   23.307   10.238   3.7948   2.6051   9.1988   11.804   4.1658   87.073   37.645  117.769   23.926 -30.69658 44.60477 
1 1 1   29   16   23 o  138.161   19.535   15.680   4.0160   19.058   9.8278   15.003   4.4002  137.418   42.447  133.779   22.272 3.639008 47.93541 
1 1 1   29   16   24 o   82.058   26.403   5.7211   3.7663   10.635   9.3882   4.7786   4.1117  108.017   41.075   77.481   27.562 30.53616 49.46526 
1 1 1   29   16   25 o   70.803   22.893   4.1312   2.8288   2.0508   3.6643   7.1994   4.4501   62.485   25.091   90.532   28.655 -28.04684 38.08806 
1 1 1   29   16   26 o  153.847   14.942   18.945   3.4743   22.294   4.2169   11.868   6.1302  166.062   16.822  112.492   33.273 53.57071 37.28366 
1 1 1   29   16   27 o   64.450   25.710   2.3815   3.8203  -3.4092   7.0834   4.7568   4.5367   64.661   29.987   77.846   28.772 -13.18443 41.55750 
1 1 1   29   16   28 o  107.652   19.611   9.7304   3.1123   4.4461   4.1809   16.298   4.6611   75.176   27.649  138.128   22.845 -62.95168 35.86566 
1 1 1   29   16   29 o   54.039   22.353   1.1392   3.0137   1.7275   4.0430   0.4036   4.5209   62.320   25.844   60.150   26.197 2.170300 36.79914 
1 1 1   29   16   30 o  156.886   18.067   20.342   4.2592   20.342   4.2592   0.0000   0.0000  156.886   18.067  ?   ?  0.000000 18.06694 
1 1 1   29   16   31 o   62.559   23.628   2.8397   3.0933  -2.2628   3.9420   11.017   4.9902   48.438   22.431  107.809   29.420 -59.37103 36.99563 
1 1 1   29   16   32 o   92.444   21.842   7.5291   3.0416   9.5255   3.9291   4.5436   4.8048  102.233   25.256   75.499   29.213 26.73442 38.61724 
1 1 1   29   16   33 o   75.603   24.748   5.0872   3.3009   4.4101   4.3670   5.9895   5.0416   73.524   28.001   81.651   30.300 -8.127586 41.25721 
1 1 1   29   16   34 o   54.260   23.274   0.7691   3.4625   0.0204   3.9457   3.2771   7.2213   54.450   24.067   76.600   33.235 -22.14989 41.03418 
1 1 1   29   17    0 o   60.806   29.129   4.3133   3.1209   4.3133   3.1209   4.3133   3.1209   60.806   29.129   60.806   29.129 0.000000 0.000000 
1 1 1   29   17    1 o  145.177   11.248   16.428   2.4800   18.503   3.3440   13.892   3.6968  153.270   14.424  131.190   18.960 22.08072 23.82312 
1 1 1   29   17    2 o  175.534   8.3626   23.746   2.2468   25.549   2.6854   19.538   4.1023  181.608   9.6958  156.548   17.416 25.06047 19.93267 
1 1 1   29   17    3 o  157.923   10.293   19.369   2.4745   19.369   2.4745   0.0000   0.0000  157.923   10.293  ?   ?  0.000000 10.29328 
1 1 1   29   17    4 o  111.217   11.099   9.6753   1.8641   9.3133   2.1015   11.012   4.0378  108.688   12.883  114.872   23.749 -6.184555 27.01856 
1 1 1   29   17    5 f  130.354   8.6903   13.161   1.7240   14.619   1.8862   5.7627   4.2487  137.355   9.0220   84.562   28.096 52.79235 29.50916 
1 1 1   29   17    6 f  167.235   13.793   21.959   3.4991   25.167   5.1745   19.256   4.7497  177.026   19.415  154.113   20.655 22.91273 28.34751 
1 1 1   29   17    7 o  161.790   14.360   20.608   3.5191   20.705   5.2130   20.527   4.7700  159.306   21.963  159.437   19.985 -0.1305847 29.69460 
1 1 1   29   17    8 o  125.235   18.972   12.698   3.5228   21.562   5.5130   6.5806   4.5798  162.182   22.841   89.358   29.146 72.82397 37.02949 
1 1 1   29   17    9 o   84.827   25.482   5.9884   3.5749   5.7335   5.5748   6.1665   4.6588   87.397   31.959   87.309   29.426 0.8798218E-01 43.44258 
1 1 1   29   17   10 o  151.769   22.245   18.880   5.0141   0.0000   0.0000   18.880   5.0141  ?   ?   151.769   22.245 0.000000 22.24477 
1 1 1   29   17   11 o   56.592   24.533  -0.0996   3.9279  -3.2781   6.8802   1.4372   4.7842   65.992   30.221   67.194   28.009 -1.202103 41.20483 
1 1 1   29   17   12 o  155.330   18.712   19.414   4.3593   19.858   7.5372   19.190   5.3438  149.643   33.715  152.266   23.700 -2.623947 41.21155 
1 1 1   29   17   13 o   55.547   24.447  -0.5969   4.0297 -12.7433   7.2601   4.8112   4.8444   53.253   26.117   81.007   29.766 -27.75455 39.59985 
1 1 1   29   17   14 o  131.353   24.054   14.435   4.6579   18.635   7.8577   12.160   5.7837  143.245   35.907  117.397   31.522 25.84833 47.78044 
1 1 1   29   17   15 o   99.520   37.402   7.8079   7.7299   7.8079   7.7299   0.0000   0.0000   99.520   37.402  ?   ?  0.000000 37.40218 
1 1 1   29   17   16 o  235.429   15.412   43.803   5.5232   55.820   9.5040   37.675   6.7869  260.201   24.138  215.456   20.840 44.74496 31.88984 
1 1 1   29   17   17 o  156.834   19.083   19.918   4.4865   18.160   6.3048   21.722   6.3856  144.427   29.517  159.734   27.085 -15.30724 40.06077 
1 1 1   29   17   18 o   80.884   29.874   4.8785   4.8895  -0.7307   8.3068   7.8521   6.0482   77.217   34.477   96.344   33.496 -19.12634 48.06964 
1 1 1   29   17   19 o  125.369   28.060   13.704   5.2503   18.240   9.0179   11.379   6.4576  137.515   40.265  111.929   34.380 25.58681 52.94618 
1 1 1   29   17   20 o  115.175   29.960   11.808   5.3318   17.571   9.8794   9.4398   6.3333  133.122   42.755  102.962   34.308 30.15984 54.81811 
1 1 1   29   17   21 o   75.533   31.727   2.2927   6.2089   0.0000   0.0000   2.2927   6.2089  ?   ?    75.533   31.727 0.000000 31.72654 
1 1 1   29   17   22 o   95.163   24.420   7.8201   3.5748   17.270   7.2696   4.8063   4.1054  135.939   34.792   77.765   27.554 58.17379 44.38113 
1 1 1   29   17   23 o  141.582   17.940   16.322   3.8006   15.017   7.1058   16.846   4.4981  125.866   35.400  142.178   21.327 -16.31213 41.32836 
1 1 1   29   17   24 o  135.848   9.5723   14.400   1.9777   15.419   2.2172   10.436   4.3745  140.355   10.394  108.816   26.509 31.53951 28.47404 
1 1 1   29   17   25 o   55.944   21.823   1.8221   2.6980   2.5648   3.4914   0.7212   4.2508   63.912   24.854   60.337   25.831 3.574509 35.84647 
1 1 1   29   17   26 o  200.693   11.283   31.603   3.4519   32.546   4.0832   29.242   6.4627  202.748   13.230  185.882   23.221 16.86577 26.72577 
1 1 1   29   17   27 o   63.808   25.512   2.3372   3.7704  -2.2214   7.1316   4.1058   4.4420   66.871   30.677   74.305   28.254 -7.434097 41.70590 
1 1 1   29   17   28 o   43.945   19.841  -1.0509   2.8375  -4.0934   3.5721   4.1520   4.6712   41.712   19.926   74.788   28.842 -33.07613 35.05577 
1 1 1   29   17   29 o   42.819   19.529  -1.3424   2.8346  -0.8112   3.5453  -2.2837   4.7194   50.012   22.413   53.615   24.727 -3.603012 33.37335 
1 1 1   29   17   30 o  115.215   17.528   11.050   2.9936   8.2888   3.8685   15.170   4.7262   95.377   25.852  130.841   24.500 -35.46395 35.61696 
1 1 1   29   17   31 o   61.440   23.048   2.7838   2.9325   5.1964   3.7748  -0.8885   4.6572   76.905   26.478   56.313   25.423 20.59210 36.70716 
1 1 1   29   17   32 o  110.457   21.358   10.649   3.4804   9.5615   3.9133   14.767   7.6131  102.168   25.185  116.300   37.551 -14.13194 45.21468 
1 1 1   29   17   33 o   54.125   23.576   0.4028   3.6627   7.5135   4.2871 -18.8138   7.0477   88.903   28.124   44.105   22.247 44.79866 35.85940 
1 1 1   29   18    0 o  106.124   27.582   10.437   3.8716   10.437   3.8716   10.437   3.8716  106.124   27.582  106.124   27.582 0.000000 0.000000 
1 1 1   29   18    1 o  120.210   15.571   11.509   2.7977   9.8728   3.7987   13.449   4.1357  108.641   23.526  127.882   21.917 -19.24131 32.15318 
1 1 1   29   18    2 o  211.755   8.1968   34.556   2.6567   35.092   3.1053   33.091   5.1316  213.135   9.5187  204.446   16.540 8.688721 19.08348 
1 1 1   29   18    3 o   68.811   21.150   3.8185   2.4434   3.8185   2.4434   0.0000   0.0000   68.811   21.150  ?   ?  0.000000 21.15027 
1 1 1   29   18    4 o  169.800   9.3578   22.333   2.4227   24.045   2.7992   17.223   4.8367  175.953   10.440  144.773   22.562 31.18013 24.86057 
1 1 1   29   18    5 o  195.968   8.2671   29.602   2.4797   31.220   2.8172   24.037   5.2252  201.089   9.1529  172.555   20.164 28.53398 22.14396 
1 1 1   29   18    6 o   49.248   18.110   1.5686   1.7937   1.8703   1.9387  -0.2246   4.7263   52.397   18.894   61.377   26.757 -8.979557 32.75561 
1 1 1   29   18    7 f  110.375   21.995   10.104   3.5854   8.0940   5.1402   12.009   5.0037   97.600   30.787  118.256   28.065 -20.65558 41.65900 
1 1 1   29   18    8 f  177.150   14.762   24.738   3.9663   28.207   5.8254   21.741   5.4153  186.719   20.733  162.980   22.292 23.73885 30.44370 
1 1 1   29   18    9 o  114.758   29.595   11.435   5.2322   0.0000   0.0000   11.435   5.2322  ?   ?   114.758   29.595 0.000000 29.59493 
1 1 1   29   18   10 o  209.421   19.311   35.209   6.1205   0.0000   0.0000   35.209   6.1205  ?   ?   209.421   19.311 0.000000 19.31137 
1 1 1   29   18   11 o   81.384   28.290   5.1990   4.3142  -0.0493   6.7848   8.7612   5.5898   72.733   31.873  100.860   32.136 -28.12640 45.26193 
1 1 1   29   18   12 o  111.379   26.595   10.631   4.4713   11.106   7.1424   10.325   5.7339  111.737   36.395  108.342   32.210 3.394333 48.60142 
1 1 1   29   18   13 o   95.228   28.304   7.7744   4.4279   7.8041   7.2807   7.7570   5.5780   98.667   36.452   95.867   32.198 2.800423 48.63615 
1 1 1   29   18   14 o   86.878   35.498   4.1590   7.4816   4.1590   7.4816   0.0000   0.0000   86.878   35.498  ?   ?  0.000000 35.49823 
1 1 1   29   18   15 o  121.854   24.526   12.559   4.4161   4.9747   5.8315   22.757   6.7619   84.264   32.294  163.000   28.119 -78.73641 42.82000 
1 1 1   29   18   16 o  288.605   11.675   64.848   5.1573   65.096   6.7061   64.488   8.0686  287.031   15.319  283.525   18.698 3.506836 24.17190 
1 1 1   29   18   17 o  110.338   26.113   10.502   4.3415   5.4468   5.8448   16.724   6.4846   85.808   32.462  136.907   31.588 -51.09982 45.29417 
1 1 1   29   18   18 o   76.938   28.263   4.4114   4.3671   3.5438   5.9344   5.4361   6.4497   78.851   31.837   87.189   33.815 -8.337929 46.44398 
1 1 1   29   18   19 o   80.657   29.007   5.1042   4.5662  -0.1519   6.2770   11.012   6.6546   69.069   30.450  109.722   35.074 -40.65259 46.44830 
1 1 1   29   18   20 o  103.119   28.642   9.4201   4.6822   20.014   6.6371  -1.0748   6.6061  150.337   29.896   68.198   30.577 82.13863 42.76323 
1 1 1   29   18   21 o   93.470   32.360   7.5735   5.6419   36.658   9.7825  -6.9222   6.9062  201.553   32.841   58.331   27.822 143.2217 43.04137 
1 1 1   29   18   22 o   98.158   30.010   8.6217   4.9267   5.0895   6.7874   12.555   7.1626   85.810   34.257  114.907   36.352 -29.09617 49.95055 
1 1 1   29   18   23 o  108.278   11.302   9.2514   1.8455   10.474   2.0234   3.2000   4.5013  115.179   11.637   71.196   28.063 43.98318 30.37988 
1 1 1   29   18   24 o   87.771   14.870   6.2638   1.9264   5.7578   2.1295   8.5435   4.5201   83.300   17.269   97.623   28.485 -14.32323 33.31098 
1 1 1   29   18   25 o   44.029   19.341  -0.3379   2.5118  -2.7074   3.0503   4.6541   4.4273   40.928   19.208   77.031   28.432 -36.10315 34.31247 
1 1 1   29   18   26 o   61.805   26.427   0.9632   4.4391  -4.4858   7.1354   4.4037   5.6699   62.598   29.379   79.055   31.389 -16.45681 42.99260 
1 1 1   29   18   27 o   52.293   21.271   1.2397   2.6713   2.3887   3.2988  -0.9490   4.5528   61.559   24.098   56.273   25.295 5.285931 34.93638 
1 1 1   29   18   28 f   54.460   21.819   1.5807   2.7638   0.7583   3.4462   3.0632   4.6271   54.922   23.379   69.754   28.130 -14.83245 36.57692 
1 1 1   29   18   29 o   45.121   19.815  -0.2182   2.6342   0.9931   3.2246  -2.6481   4.5672   54.333   22.845   51.601   23.981 2.731850 33.12105 
1 1 1   29   18   30 o   80.310   21.532   5.6699   2.7010   5.7981   3.2518   5.3847   4.8505   80.462   24.333   79.296   29.662 1.166367 38.36568 
1 1 1   29   18   31 o  155.680   13.987   19.584   3.2974   18.412   3.5988   25.712   8.2309  149.751   15.946  159.352   34.727 -9.600372 38.21293 
1 1 1   29   18   32 o   68.379   24.525   3.9042   3.2619   1.2235   3.5888   16.640   7.8224   56.815   24.006  122.569   37.871 -65.75352 44.83852 
1 1 1   29   19    0 o   93.780   33.821   9.2685   4.4487   9.2685   4.4487   9.2685   4.4487   93.780   33.821   93.780   33.821 0.000000 0.000000 
1 1 1   29   19    1 o   85.581   23.320   6.1302   3.1380   7.7457   4.3700   4.4103   4.5089   95.432   28.055   78.244   28.722 17.18811 40.15007 
1 1 1   29   19    2 o   67.873   26.884   2.4508   4.1497   2.4508   4.1497   0.0000   0.0000   67.873   26.884  ?   ?  0.000000 26.88352 
1 1 1   29   19    3 o   73.482   20.667   4.4492   2.4218   4.2525   2.8205   5.0013   4.7248   72.545   22.795   81.669   29.489 -9.124039 37.27215 
1 1 1   29   19    4 o   98.652   17.124   7.8848   2.4919   8.7914   2.9119   5.4041   4.8167  103.692   19.049   83.801   29.829 19.89133 35.39236 
1 1 1   29   19    5 o   82.308   19.497   5.6040   2.4185   4.7808   2.7708   8.2380   4.9562   76.127   22.328   98.131   30.116 -22.00446 37.48968 
1 1 1   29   19    6 o  145.759   11.420   16.590   2.5274   17.960   2.8765   11.953   5.2929  151.393   12.526  117.287   29.508 34.10519 32.05692 
1 1 1   29   19    7 o   63.704   19.667   3.2545   2.1101   2.7601   2.3119   5.7222   5.1652   60.610   20.727   86.029   30.861 -25.41954 37.17509 
1 1 1   29   19    8 o   42.823   17.900   0.3641   1.9617   0.0237   2.1135   2.4818   5.2711   42.502   18.206   73.182   29.837 -30.67981 34.95274 
1 1 1   29   19    9 o   71.941   27.913   3.1676   4.3961   3.8465   7.5190   2.8150   5.4188   86.359   35.471   74.976   30.369 11.38255 46.69570 
1 1 1   29   19   10 o   99.335   24.886   8.3930   3.7759   9.9905   5.0105   6.2935   5.7441  107.052   29.591   89.678   32.494 17.37336 43.94896 
1 1 1   29   19   11 o  164.977   16.335   21.678   4.0707   20.364   5.4670   23.313   6.0984  156.667   23.525  167.260   24.551 -10.59306 34.00286 
1 1 1   29   19   12 o   95.178   26.008   7.7528   3.8966   9.3387   5.3339   5.9378   5.7063  103.284   31.148   87.897   32.305 15.38715 44.87568 
1 1 1   29   19   13 o  310.167   14.161   75.456   6.7227   75.456   6.7227   0.0000   0.0000  310.167   14.161  ?   ?  0.000000 14.16053 
1 1 1   29   19   14 o  111.269   31.014   10.991   5.4798   10.991   5.4798   0.0000   0.0000  111.269   31.014  ?   ?  0.000000 31.01428 
1 1 1   29   19   15 o  109.280   26.693   10.344   4.4265   9.5164   5.7505   11.548   6.9343  103.607   32.546  112.567   35.785 -8.959969 48.37181 
1 1 1   29   19   16 o   93.057   28.466   7.4919   4.4322   4.5110   5.8126   11.633   6.8508   81.952   32.013  112.714   35.541 -30.76189 47.83316 
1 1 1   29   19   17 o  105.341   27.318   9.7049   4.4417   6.1723   5.7833   14.786   6.9357   88.247   32.509  126.405   34.763 -38.15761 47.59492 
1 1 1   29   19   18 o  147.738   21.632   18.120   4.7467   26.625   6.4642   8.1683   6.9927  177.835   24.390   97.943   35.797 79.89204 43.31637 
1 1 1   29   19   19 o   87.599   29.036   6.5624   4.5388   4.0463   6.2926   9.2911   6.5529   81.210   32.785  101.706   34.894 -20.49670 47.87944 
1 1 1   29   19   20 o  137.707   24.577   16.208   4.9903   13.403   6.9047   19.275   7.2205  119.151   35.329  144.604   33.309 -25.45271 48.55518 
1 1 1   29   19   21 o  249.314   9.3568   48.233   3.5706   48.729   3.9412   45.957   8.4343  250.236   10.290  233.769   23.908 16.46719 26.02848 
1 1 1   29   19   22 o   56.870   19.092   2.5162   1.9612   2.4187   2.0276   3.9331   7.7322   56.375   19.406   84.610   35.465 -28.23534 40.42736 
1 1 1   29   19   23 o  131.430   11.231   13.596   2.2377   13.248   2.3262   17.901   8.1909  129.523   11.865  134.383   38.082 -4.859558 39.88723 
1 1 1   29   19   24 o  172.201   8.8458   23.069   2.3237   23.235   2.6047   22.422   5.1431  172.465   9.9085  163.829   20.993 8.635574 23.21365 
1 1 1   29   19   25 o  102.587   28.186   9.5918   4.5622   5.3387   7.3292   12.282   5.8291   86.267   35.179  113.837   32.079 -27.56992 47.60881 
1 1 1   29   19   26 o  161.407   12.143   20.635   2.9779   17.127   3.6531   27.584   5.1413  144.733   16.803  182.811   18.634 -38.07838 25.09151 
1 1 1   29   19   27 o   59.537   22.247   2.5361   2.7272   5.3001   3.4021  -2.4332   4.5617   77.826   25.100   52.246   24.171 25.58049 34.84584 
1 1 1   29   19   28 o   47.722   20.378   0.3973   2.6334   0.6430   3.2256  -0.0938   4.5602   52.879   22.566   58.261   25.806 -5.382351 34.28091 
1 1 1   29   19   29 o   73.951   21.923   4.7865   2.6591   3.6735   3.2349   7.1055   4.6694   67.445   24.393   87.315   29.459 -19.86964 38.24728 
1 1 1   29   19   30 o  186.564   12.020   27.696   3.4141   26.065   3.7269   36.206   8.5133  179.991   13.629  196.895   29.127 -16.90486 32.15811 
1 1 1   29   19   31 o   54.472   21.971   1.6355   2.8231   0.6460   3.4093   3.7942   5.0354   53.558   23.037   72.504   29.308 -18.94541 37.27777 
1 1 1   29   20    1 f  110.734   29.850   10.692   5.1742   10.692   5.1742   0.0000   0.0000  110.734   29.850  ?   ?  0.000000 29.84952 
1 1 1   29   20    2 o   48.844   22.020  -1.4189   3.4798  -1.1313   4.8606  -1.7214   4.9840   59.363   26.449   58.539   26.376 0.8241730 37.35290 
1 1 1   29   20    3 o   69.731   22.385   3.8911   2.7084   1.9653   3.1858   8.9118   5.1439   60.309   23.661  101.449   30.587 -41.14039 38.67039 
1 1 1   29   20    4 o   40.751   18.735  -1.7913   2.6798  -4.1256   3.1594   4.1938   5.0591   38.886   18.621   78.927   30.119 -40.04128 35.41055 
1 1 1   29   20    5 o  206.971   10.153   33.175   3.2166   35.605   3.8557   27.614   5.8333  213.655   11.837  184.275   21.059 29.38023 24.15784 
1 1 1   29   20    6 o  109.317   17.215   9.6650   2.7853   11.337   3.2892   5.4277   5.2364  118.007   18.844   84.708   30.974 33.29817 36.25617 
1 1 1   29   20    7 o  115.339   15.419   10.634   2.6540   8.5372   3.0499   17.176   5.3868  101.571   20.327  142.682   25.607 -41.11015 32.69375 
1 1 1   29   20    8 o  265.415   9.1643   54.454   3.7230   58.609   4.5075   45.533   6.6041  274.856   10.714  238.619   18.219 36.23688 21.13622 
1 1 1   29   20    9 o   91.304   19.156   6.8877   2.5917   6.8458   2.8899   7.0596   5.8578   90.451   21.237   92.972   32.916 -2.520737 39.17249 
1 1 1   29   20   10 o  237.344   12.167   44.008   4.4053   56.008   5.9028   28.922   6.6186  266.711   14.514  186.875   23.670 79.83643 27.76522 
1 1 1   29   20   11 o  100.225   16.984   8.1616   2.5124   8.1587   2.7571   8.1758   6.0996   99.618   18.770   97.913   33.661 1.705521 38.54078 
1 1 1   29   20   12 o  254.458   12.077   50.485   4.7038   58.059   6.3637   41.364   6.9837  270.916   15.410  225.710   20.436 45.20604 25.59524 
1 1 1   29   20   13 o  148.142   25.953   18.676   5.6704   18.676   5.6704   0.0000   0.0000  148.142   25.953  ?   ?  0.000000 25.95330 
1 1 1   29   20   14 o   93.933   28.244   7.6528   4.3903   6.5165   5.6210   9.4304   7.0304   89.545   32.186  103.464   36.106 -13.91899 48.36879 
1 1 1   29   20   15 o  241.577   13.666   45.958   5.0323   50.189   6.5266   39.755   7.9029  250.508   17.124  218.298   24.051 32.21001 29.52423 
1 1 1   29   20   16 o   61.923   26.236   0.9408   4.3057   0.8458   5.6696   1.0701   6.6183   68.763   29.642   73.723   31.902 -4.959709 43.54738 
1 1 1   29   20   17 o   85.503   28.770   6.1714   4.4536  -2.5209   5.8262   18.390   6.9077   60.771   27.823  142.083   32.472 -81.31189 42.76154 
1 1 1   29   20   18 o   38.984   18.207  -2.2918   2.6849  -4.6753   2.9210   10.692   6.8174   35.336   17.161  107.490   35.584 -72.15395 39.50585 
1 1 1   29   20   19 o  116.382   12.077   10.708   2.1201   9.8538   2.2142   20.131   7.3528  111.225   13.268  147.688   33.319 -36.46289 35.86349 
1 1 1   29   20   20 o   98.372   15.935   7.8797   2.3172   7.1262   2.4377   14.946   7.4646   92.790   17.811  124.374   36.696 -31.58360 40.78980 
1 1 1   29   20   21 f  143.065   11.227   16.085   2.4387   15.950   2.5572   17.440   8.1040  142.250   11.853  133.027   37.942 9.223022 39.75061 
1 1 1   29   20   22 o   61.535   20.424   3.0242   2.2453   3.0383   2.3531   2.8809   7.5041   61.953   20.912   80.571   34.403 -18.61826 40.25987 
1 1 1   29   20   23 o  168.430   12.553   22.449   3.2130   22.090   3.4823   24.508   8.3314  166.507   13.788  159.969   34.999 6.538742 37.61718 
1 1 1   29   20   24 o  103.184   15.702   8.7008   2.4017   10.745   2.5358  -9.1132   7.4850  115.288   14.705   57.082   27.663 58.20586 31.32878 
1 1 1   29   20   25 o  128.439   15.474   13.404   2.9808   10.968   3.4085   21.327   6.1466  113.665   20.338  154.452   26.982 -40.78720 33.78860 
1 1 1   29   20   26 o   45.493   19.866  -0.1081   2.6154   1.1500   3.1951  -2.6628   4.5531   54.944   22.895   51.604   23.970 3.340103 33.14720 
1 1 1   29   20   27 o   67.182   22.159   3.8028   2.6445   2.4356   3.1954   6.7749   4.7113   60.833   23.743   86.015   29.582 -25.18193 37.93250 
1 1 1   29   20   28 o   56.022   22.482   1.7631   2.9400   4.0808   3.2113 -10.2398   7.3081   69.727   24.398   53.858   26.370 15.86958 35.92556 
1 1 1   29   20   29 o  129.567   16.435   13.881   3.1861   14.150   3.4828   12.499   7.8886  129.908   17.999  106.993   38.164 22.91414 42.19547 
1 1 1   29   21    0 o  182.555   25.304   27.811   6.6826   27.811   6.6826   27.811   6.6826  182.555   25.304  182.555   25.304 0.000000 0.000000 
1 1 1   29   21    1 o   72.044   30.076   1.8701   5.5279   0.0000   0.0000   1.8701   5.5279  ?   ?    72.044   30.076 0.000000 30.07584 
1 1 1   29   21    2 o   81.664   27.293   5.4192   4.0078   5.5886   5.5782   5.2385   5.7619   86.148   31.891   85.221   32.233 0.9270248 45.34336 
1 1 1   29   21    3 o  104.190   25.516   9.2846   4.0368   9.6375   5.6290   8.9109   5.7925  104.720   32.088  101.264   32.761 3.455414 45.85720 
1 1 1   29   21    4 o  108.533   18.752   9.6325   3.0025   7.7777   3.4963   14.842   5.8597   95.740   23.926  130.104   30.034 -34.36375 38.39864 
1 1 1   29   21    5 o  128.607   16.025   13.237   3.0861   16.508   3.6569   5.1425   5.7524  143.460   16.984   84.714   32.167 58.74570 36.37541 
1 1 1   29   21    6 o   68.603   23.357   3.6537   2.9356   6.6911   3.4206  -4.8376   5.7193   88.778   24.412   55.883   26.251 32.89472 35.84820 
1 1 1   29   21    7 o  226.778   10.820   39.938   3.7558   41.213   4.5581   37.242   6.6286  229.272   13.042  214.207   20.466 15.06514 24.26862 
1 1 1   29   21    8 o  162.321   15.938   20.996   3.9088   24.735   4.9676   14.917   6.3337  174.987   18.844  129.032   32.179 45.95502 37.29031 
1 1 1   29   21    9 o   98.591   19.150   8.0238   2.7857   7.1359   3.0683   12.188   6.6448   91.990   22.074  115.681   34.739 -23.69164 41.15868 
1 1 1   29   21   10 o  118.865   15.593   11.329   2.7686   11.809   3.0542   9.1198   6.5573  120.904   16.971  102.046   34.907 18.85725 38.81422 
1 1 1   29   21   11 o  154.553   12.238   18.757   2.8714   19.230   3.1808   16.677   6.6740  156.094   13.444  135.979   32.507 20.11542 35.17751 
1 1 1   29   21   12 o  126.821   15.974   12.917   3.0320   12.917   3.0320   0.0000   0.0000  126.821   15.974  ?   ?  0.000000 15.97379 
1 1 1   29   21   13 o   34.583   15.509  -0.6832   1.7006  -0.7736   1.7533   0.7505   6.9857   34.786   15.662   74.551   32.514 -39.76405 36.08943 
1 1 1   29   21   14 o  177.534   9.3102   24.489   2.5211   24.072   2.6654   28.037   7.7683  175.823   9.9448  179.026   29.368 -3.203003 31.00598 
1 1 1   29   21   15 o   73.686   17.732   4.5128   1.9757   4.7050   2.0541   2.1374   7.2199   75.178   18.074   78.795   33.697 -3.616127 38.23813 
1 1 1   29   21   16 o  220.620   7.4800   37.568   2.5259   38.629   2.6699   28.517   7.7966  223.633   7.8000  180.201   29.271 43.43135 30.29265 
1 1 1   29   21   17 o  117.352   11.749   10.866   2.0820   11.980   2.1751  -1.3176   7.1951  123.296   11.664   70.033   31.610 53.26295 33.69366 
1 1 1   29   21   18 o  121.704   11.996   11.701   2.2056   11.112   2.3167   17.402   7.2075  118.246   13.016  135.913   34.566 -17.66693 36.93562 
1 1 1   29   21   19 o  106.600   14.733   9.1572   2.3397   10.141   2.4651   0.2164   7.4319  112.280   14.696   74.122   32.882 38.15833 36.01689 
1 1 1   29   21   20 o  171.742   9.7582   23.012   2.5546   24.438   2.6935   10.240   8.0599  176.922   9.9870  104.583   38.400 72.33886 39.67749 
1 1 1   29   21   21 o  110.571   19.841   10.256   3.2346   11.902   3.5382   1.8851   7.9805  119.164   20.115   79.371   34.681 39.79311 40.09170 
1 1 1   29   21   22 o  223.645   8.3987   38.790   2.8750   40.692   3.0782   25.797   8.0468  228.919   8.7851  165.838   32.862 63.08124 34.01637 
1 1 1   29   21   23 o   41.270   18.401  -0.6303   2.3573  -0.4619   2.4928  -2.0545   7.2497   43.164   19.101   67.213   30.869 -24.04895 36.30129 
1 1 1   29   21   24 o  214.145   9.3312   35.738   3.0585   35.738   3.0585   0.0000   0.0000  214.145   9.3312  ?   ?  0.000000 9.331160 
1 1 1   29   21   25 f  150.968   14.344   18.372   3.2748   18.140   3.6001   19.482   7.8835  149.088   16.028  137.672   36.731 11.41620 40.07598 
1 1 1   29   21   26 o   92.956   22.261   7.6163   3.1255   10.847   3.4466  -7.3354   7.4150  112.235   20.830   58.265   28.062 53.97070 34.94777 
1 1 1   29   21   27 o   59.577   23.357   2.3143   3.1028   2.2247   3.4220   2.7284   7.3577   60.605   24.279   76.634   33.397 -16.02897 41.28956 
1 1 1   29   21   28 o   45.277   20.077  -0.3902   2.7675  -0.2928   3.3902  -0.5847   4.7912   50.157   22.232   57.615   25.919 -7.458260 34.14775 
1 1 1   29   22    0 o  148.340   27.902   19.200   5.6801   19.200   5.6801   19.200   5.6801  148.340   27.902  148.340   27.902 0.000000 0.000000 
1 1 1   29   22    1 o   47.429   21.864  -2.3894   3.6836   2.1364   5.1943  -6.9683   5.2248   71.118   29.376   48.865   23.540 22.25337 37.64423 
1 1 1   29   22    2 f  187.096   20.679   28.545   5.8229   0.0000   0.0000   28.545   5.8229  ?   ?   187.096   20.679 0.000000 20.67902 
1 1 1   29   22    3 f  128.317   20.128   13.525   3.8231   13.459   5.2448   13.600   5.5846  124.279   28.216  124.191   29.766 0.8810425E-01 41.01442 
1 1 1   29   22    4 o   53.134   21.900   0.9498   2.8784   1.6502   3.4444  -0.6716   5.2408   60.039   24.250   62.536   27.684 -2.497173 36.80298 
1 1 1   29   22    5 o   97.211   20.399   7.8765   2.9385   8.3293   3.4996   6.7942   5.4108   98.995   23.455   90.588   31.671 8.407356 39.41101 
1 1 1   29   22    6 o   60.886   24.379   1.8391   3.4485   1.7656   4.4097   1.9548   5.5330   65.798   27.111   71.929   30.064 -6.130859 40.48286 
1 1 1   29   22    7 o   70.094   22.586   3.9787   2.7552   1.6753   3.1159   12.235   5.8992   58.130   23.210  116.513   32.068 -58.38309 39.58576 
1 1 1   29   22    8 o  119.424   16.308   11.494   2.9031   11.128   3.2476   12.950   6.4770  116.523   18.853  118.923   33.921 -2.400055 38.80777 
1 1 1   29   22    9 o   52.743   21.514   1.0891   2.7422  -0.2222   3.0250   7.1340   6.4950   49.105   21.407   93.477   34.449 -44.37211 40.55797 
1 1 1   29   22   10 o  120.485   16.608   11.732   2.9814   15.388   3.3388  -2.6522   6.6228  138.468   16.051   64.910   29.698 73.55775 33.75848 
1 1 1   29   22   11 o  138.063   16.463   15.347   3.4105   15.347   3.4105   0.0000   0.0000  138.063   16.463  ?   ?  0.000000 16.46319 
1 1 1   29   22   12 o   48.278   21.300  -0.5251   3.0767  -3.6089   3.4007   13.383   7.2221   41.875   19.844  119.107   36.318 -77.23135 41.38548 
1 1 1   29   22   13 o  230.675   11.996   41.707   4.2209   44.437   4.8960   33.806   8.3296  237.368   13.532  197.292   28.402 40.07649 31.46054 
1 1 1   29   22   14 o  117.849   20.066   11.537   3.4898   13.273   3.8910   4.3971   7.8914  126.206   20.872   86.974   36.090 39.23215 41.69059 
1 1 1   29   22   15 o   92.549   24.285   7.4144   3.4833   5.6129   3.8862   14.776   7.8560   81.533   26.860  123.365   37.925 -41.83180 46.47357 
1 1 1   29   22   16 o   68.782   24.976   3.5480   3.3961   3.8686   3.8568   2.4414   7.1650   71.995   26.544   78.896   33.650 -6.900833 42.85918 
1 1 1   29   22   17 o   84.214   24.676   6.1334   3.3857   6.5742   3.8682   4.6898   7.0006   86.839   26.598   84.705   34.443 2.133499 43.51772 
1 1 1   29   22   18 o   82.416   24.824   5.8733   3.3893   8.7265   3.8572  -3.7948   7.1003   99.658   25.255   64.133   29.837 35.52483 39.09054 
1 1 1   29   22   19 o  152.545   11.058   18.286   2.5645   18.144   2.7315   19.341   7.4473  151.653   11.862  142.249   34.548 9.403793 36.52768 
1 1 1   29   22   20 o   56.597   20.292   2.3620   2.2329   3.9577   2.3463 -12.9598   7.2703   68.564   20.654   51.615   25.473 16.94939 32.79446 
1 1 1   29   22   21 o  153.704   10.872   18.586   2.5413   18.185   2.6885   21.948   7.7883  151.721   11.666  150.595   34.525 1.125702 36.44312 
1 1 1   29   22   22 o  137.103   12.270   14.938   2.5476   16.256   2.7020   4.3811   7.6465  142.980   12.471   83.392   35.127 59.58842 37.27546 
1 1 1   29   22   23 o  126.840   13.202   12.895   2.5255   13.853   2.6601   4.1373   8.0413  131.418   13.412   83.228   35.577 48.19009 38.02113 
1 1 1   29   22   24 o  100.793   17.516   8.4990   2.6043   8.4990   2.6043   0.0000   0.0000  100.793   17.516  ?   ?  0.000000 17.51635 
1 1 1   29   22   25 o  148.680   14.684   17.916   3.2981   17.819   3.6134   18.400   8.0737  147.346   16.294  131.112   38.016 16.23456 41.36108 
1 1 1   29   22   26 o   67.190   24.062   3.6896   3.1388   4.7179   3.4208  -1.7882   7.8952   73.684   25.212   68.708   31.791 4.975235 40.57535 
1 1 1   29   22   27 o   41.535   19.466  -2.4459   3.1138  -0.6878   3.4336 -10.5880   7.3890   49.120   22.032   53.570   26.288 -4.450245 34.29983 
1 1 1   29   23    0 o  114.471   34.467   13.035   5.2648   13.035   5.2648   13.035   5.2648  114.471   34.467  114.471   34.467 0.000000 0.000000 
1 1 1   29   23    1 o  120.447   20.728   12.034   3.6836   9.3636   5.0692   15.021   5.3619  102.743   30.219  131.431   27.535 -28.68758 40.88239 
1 1 1   29   23    2 o  170.969   15.042   23.233   3.8962   28.385   5.4355   17.788   5.5876  186.990   19.267  144.002   26.320 42.98779 32.61887 
1 1 1   29   23    3 o   97.442   24.183   8.1430   3.5898   2.7171   4.8784   14.550   5.3013   71.488   28.865  129.204   27.642 -57.71583 39.96571 
1 1 1   29   23    4 f   99.626   30.592   8.7838   5.1134   0.0000   0.0000   8.7838   5.1134  ?   ?    99.626   30.592 0.000000 30.59227 
1 1 1   29   23    5 o   66.861   25.154   3.0455   3.4979  -1.3082   4.6889   8.5081   5.2523   57.211   25.698   98.161   31.137 -40.94983 40.37237 
1 1 1   29   23    6 o   65.801   23.504   3.2229   2.9932   3.3006   3.5273   3.0230   5.6576   68.281   25.343   75.692   30.892 -7.410728 39.95707 
1 1 1   29   23    7 o  100.597   20.395   8.4620   3.0329   14.148   3.4977  -8.7678   6.0886  131.967   17.767   51.173   24.834 80.79429 30.53557 
1 1 1   29   23    8 o   64.936   23.620   3.0544   3.0393   4.0916   3.4515  -0.5266   6.4134   72.289   25.294   68.575   30.478 3.713867 39.60672 
1 1 1   29   23    9 o   52.808   22.217   0.6558   3.0528  -1.4751   3.4637   8.0723   6.4618   48.119   21.806   96.676   34.535 -48.55779 40.84270 
1 1 1   29   23   10 f  119.225   21.724   11.936   3.8184   11.936   3.8184   0.0000   0.0000  119.225   21.724  ?   ?  0.000000 21.72440 
1 1 1   29   23   11 o  129.935   18.388   13.810   3.5549   13.053   4.0032   16.630   7.7312  124.720   21.762  131.729   36.882 -7.008797 42.82323 
1 1 1   29   23   12 o   66.606   24.852   3.1244   3.4007   1.8827   3.8234   7.8276   7.4408   62.689   25.468   96.625   36.610 -33.93631 44.59724 
1 1 1   29   23   13 o  202.664   12.454   32.316   3.8444   35.416   4.3890   22.098   7.9683  211.636   13.621  153.754   34.684 57.88232 37.26328 
1 1 1   29   23   14 o   82.431   25.446   5.8380   3.5325   6.5507   3.9798   3.1915   7.6691   86.795   27.045   82.509   34.990 4.285950 44.22361 
1 1 1   29   23   15 o  164.692   9.8628   21.167   2.4748   21.786   2.6228   16.141   7.4736  166.941   10.315  129.098   36.303 37.84311 37.74025 
1 1 1   29   23   16 o  123.162   13.042   12.070   2.4212   14.140   2.5867  -2.5703   6.8785  133.488   12.818   65.396   30.047 68.09155 32.66717 
1 1 1   29   23   17 o  118.179   13.140   11.142   2.3366   9.7243   2.4798   22.362   6.9773  109.563   15.197  156.997   30.131 -47.43399 33.74634 
1 1 1   29   23   18 o   89.337   18.662   6.7121   2.4695   7.1735   2.6522   3.7053   6.7706   92.124   19.421   79.946   33.322 12.17820 38.56881 
1 1 1   29   23   19 o   91.902   18.241   7.0850   2.4754   7.2326   2.6535   6.0949   6.8721   92.406   19.380   87.401   34.603 5.004402 39.66048 
1 1 1   29   23   20 o   31.565   15.365  -3.9166   2.3782  -3.9801   2.5329  -3.4437   6.9127   32.936   15.991   62.905   29.324 -29.96906 33.40086 
1 1 1   29   23   21 o   58.794   21.006   2.6340   2.3908   3.2391   2.5653  -1.3647   6.5944   63.415   21.828   65.367   29.802 -1.952396 36.94090 
1 1 1   29   23   22 o  111.188   14.953   10.077   2.4803   10.409   2.6466   7.6799   7.1089  112.655   15.782   91.757   35.525 20.89803 38.87319 
1 1 1   29   23   23 o   44.093   19.393  -0.2523   2.5321  -0.2523   2.5321   0.0000   0.0000   44.093   19.393  ?   ?  0.000000 19.39347 
1 1 1   29   23   24 o  106.481   15.643   9.3396   2.4735   10.108   2.6412   3.8569   7.0544  110.641   16.066   78.887   33.511 31.75385 37.16352 
1 1 1   29   23   25 o   47.992   20.986  -0.0096   2.9271   1.7951   3.2024  -9.1725   7.2160   57.449   23.320   54.577   26.610 2.871391 35.38209 
1 1 1   29   24    0 o  117.999   35.842   13.995   5.6509   13.995   5.6509   13.995   5.6509  117.999   35.842  117.999   35.842 0.000000 0.000000 
1 1 1   29   24    1 o  141.492   18.708   16.343   3.9522   16.461   5.5919   16.226   5.5866  137.328   27.561  136.214   27.737 1.113800 39.10223 
1 1 1   29   24    2 f   58.376   24.359   1.0864   3.6238  -5.2761   5.0198   8.0111   5.2368   50.213   23.886   95.438   31.168 -45.22494 39.26782 
1 1 1   29   24    3 o  100.601   24.284   8.7209   3.6967   7.5340   5.3481   9.8069   5.1155   93.190   31.526  104.576   30.243 -11.38599 43.68682 
1 1 1   29   24    4 o  143.340   18.104   16.711   3.8835   25.957   5.6806   8.5984   5.3212  177.207   21.375   98.279   31.359 78.92800 37.95061 
1 1 1   29   24    5 o   71.193   24.308   4.0428   3.1796   7.3287   3.9336  -2.1505   5.4004   91.725   26.518   59.175   26.975 32.54976 37.82707 
1 1 1   29   24    6 o  160.464   18.157   20.910   4.3811   21.073   6.1565   20.743   6.2358  156.175   26.715  154.501   27.371 1.673859 38.24693 
1 1 1   29   24    7 f   60.667   25.301   1.2645   3.9062  -4.6017   5.1108   9.5057   6.0576   52.023   24.554  102.363   33.526 -50.34072 41.55577 
1 1 1   29   24    8 o   90.128   23.716   6.9972   3.3161   8.1493   3.9815   4.3886   5.9912   96.448   26.263   81.227   32.261 15.22024 41.59957 
1 1 1   29   24    9 o  150.687   18.534   18.537   4.1846   18.537   4.1846   0.0000   0.0000  150.687   18.534  ?   ?  0.000000 18.53355 
1 1 1   29   24   10 o  213.732   11.773   35.834   3.8367   33.283   4.4076   43.811   7.7942  204.857   14.143  229.352   22.492 -24.49498 26.56902 
1 1 1   29   24   11 o  100.469   23.110   8.6807   3.4799   12.680   4.0652  -2.2851   6.7313  122.239   22.558   65.574   29.979 56.66409 37.51848 
1 1 1   29   24   12 o   40.720   19.468  -4.1275   3.4238   0.4293   3.9747 -17.2326   6.7406   57.696   24.845   45.068   22.601 12.62767 33.58715 
1 1 1   29   24   13 o  118.432   19.657   11.684   3.4383   12.494   4.0202   9.4775   6.6353  121.113   22.515  101.229   35.090 19.88390 41.69251 
1 1 1   29   24   14 o  159.046   15.024   20.289   3.6140   23.447   4.2539   12.094   6.8517  170.276   16.530  111.874   35.572 58.40145 39.22505 
1 1 1   29   24   15 o  109.376   21.907   10.237   3.5396   6.4679   4.1456   20.376   6.7997   85.704   27.714  148.888   30.851 -63.18392 41.47122 
1 1 1   29   24   16 o  224.636   8.3838   39.136   2.8826   43.515   3.1558   17.073   7.0835  236.747   8.7087  132.575   34.555 104.1720 35.63580 
1 1 1   29   24   17 o   62.306   21.205   3.1054   2.4197   3.2267   2.6170   2.3905   6.3523   63.696   22.040   74.283   31.683 -10.58701 38.59514 
1 1 1   29   24   18 o   97.192   17.052   7.8431   2.4442   8.6350   2.6351   2.9628   6.5416  101.877   17.531   76.294   32.333 25.58317 36.77957 
1 1 1   29   24   19 o   42.584   18.613  -0.1727   2.3005   0.3821   2.4587  -4.0724   6.5188   46.430   19.755   59.669   28.029 -13.23937 34.29095 
1 1 1   29   24   20 o   66.767   20.966   3.7748   2.3865   3.0806   2.5565   8.4808   6.6559   62.229   21.769   94.437   34.860 -32.20740 41.09907 
1 1 1   29   24   21 o   80.714   19.689   5.6186   2.4108   4.4792   2.5955   12.781   6.5075   71.913   21.737  112.303   34.516 -40.38991 40.79029 
1 1 1   29   24   22 o  131.084   14.595   13.951   2.8786   13.951   2.8786   0.0000   0.0000  131.084   14.595  ?   ?  0.000000 14.59470 
1 1 1   29   24   23 o   66.161   23.704   3.5493   3.0466   6.7157   3.4128  -8.8723   6.7596   86.050   24.649   52.854   25.766 33.19538 35.65797 
1 1 1   29   25    0 o   33.660   23.958  -6.9053   5.3710  -6.9053   5.3710  -6.9053   5.3710   33.660   23.958   33.660   23.958 0.000000 0.000000 
1 1 1   29   25    1 f  114.404   23.945   11.239   4.0585   12.960   5.8270   9.6186   5.6559  118.978   31.501  102.798   32.275 16.18005 45.10006 
1 1 1   29   25    2 o   42.569   20.466  -5.1048   3.9033  -0.0397   5.9139  -9.0144   5.1958   67.056   29.560   45.185   22.147 21.87096 36.93639 
1 1 1   29   25    3 f  165.647   17.365   22.202   4.3373   24.207   6.6214   20.696   5.7402  167.231   26.771  155.588   24.946 11.64294 36.59259 
1 1 1   29   25    4 o  110.489   24.710   10.579   4.0742   6.5778   6.0349   13.929   5.5228   89.446   33.159  124.496   29.444 -35.04963 44.34492 
1 1 1   29   25    5 o   58.026   25.047   0.3432   4.0594  -6.9090   5.9911   6.4987   5.5196   53.129   25.494   88.172   31.868 -35.04327 40.81057 
1 1 1   29   25    6 o  111.872   21.559   10.577   3.5578   15.545   4.6229   3.3590   5.5719  135.321   23.152   75.852   30.771 59.46877 38.50742 
1 1 1   29   25    7 o   90.422   23.765   7.0813   3.3322   8.3807   4.1501   4.7237   5.5903   97.271   26.947   80.889   31.451 16.38122 41.41649 
1 1 1   29   25    8 o  204.131   14.499   33.159   4.5006   33.159   4.5006   0.0000   0.0000  204.131   14.499  ?   ?  0.000000 14.49860 
1 1 1   29   25    9 f   56.795   24.501   0.3617   3.8795  -0.7974   5.3112   1.6875   5.6803   61.586   27.528   70.485   30.010 -8.898735 40.72322 
1 1 1   29   25   10 o  167.904   17.116   22.876   4.3374   19.766   5.6496   27.341   6.7690  151.058   25.331  177.900   25.596 -26.84204 36.01132 
1 1 1   29   25   11 o  100.024   26.981   8.9612   4.2258   11.673   5.5904   5.3458   6.4549  111.873   31.376   84.751   33.542 27.12142 45.92967 
1 1 1   29   25   12 o   81.675   24.766   5.8076   3.3652   2.5461   3.9232   14.889   6.5465   65.429   26.069  124.711   33.558 -59.28238 42.49346 
1 1 1   29   25   13 o   72.000   24.974   4.2449   3.3611   5.5550   4.0031   1.1143   6.1882   80.406   27.275   70.346   30.643 10.06006 41.02385 
1 1 1   29   25   14 o  163.097   14.763   21.376   3.6456   25.856   4.3541   10.870   6.6671  178.718   16.090  105.588   35.201 73.13039 38.70374 
1 1 1   29   25   15 o   77.807   25.351   5.2440   3.4652   5.1478   4.2705   5.4295   5.9287   78.328   28.065   82.869   32.343 -4.541252 42.82146 
1 1 1   29   25   16 o  190.346   14.500   29.084   4.1929   32.334   5.5928   24.912   6.3357  197.799   18.695  168.387   25.369 29.41252 31.51346 
1 1 1   29   25   17 o   43.993   20.459  -2.3042   3.3325  -0.1695   4.0882  -6.5316   5.7532   55.540   24.525   51.416   24.752 4.123817 34.84465 
1 1 1   29   25   18 o  178.906   10.349   25.152   2.8219   28.499   3.1134   9.7504   6.6786  190.288   10.733   99.406   35.152 90.88210 36.75376 
1 1 1   29   25   19 o   60.843   22.952   2.6615   2.9164   5.8727   3.2822  -9.3815   6.3563   81.136   24.427   50.413   24.664 30.72322 34.71262 
1 1 1   29   25   20 o   92.279   21.337   7.4467   2.9536   7.5113   3.2941   7.1820   6.6709   91.693   23.395   88.891   34.414 2.802116 41.61326 
1 1 1   29   25   21 o   33.164   16.425  -6.5904   3.1198  -6.5904   3.1198   0.0000   0.0000   33.164   16.425  ?   ?  0.000000 16.42519 
1 1 1   29   26    0 o  106.250   39.723   12.649   6.0227   12.649   6.0227   12.649   6.0227  106.250   39.723  106.250   39.723 0.000000 0.000000 
1 1 1   29   26    1 o   56.167   24.581  -0.0744   4.0233   1.7618   6.1341  -1.4607   5.3298   72.548   31.044   59.939   27.116 12.60867 41.21889 
1 1 1   29   26    2 o   77.877   27.593   4.9537   4.1170   12.461   6.3047  -0.6274   5.4361  114.623   33.698   62.636   27.934 51.98677 43.77065 
1 1 1   29   26    3 o   55.316   24.522  -0.5328   4.1258   9.8163   6.4716  -7.6196   5.3553  102.468   34.680   47.990   23.290 54.47841 41.77480 
1 1 1   29   26    4 o  164.266   17.971   22.035   4.4447   15.755   6.5491   27.397   6.0517  129.298   32.986  180.395   22.399 -51.09776 39.87197 
1 1 1   29   26    5 o   54.031   24.184  -0.9096   4.1138  -5.4295   6.2624   2.5214   5.4561   56.754   26.904   71.996   29.953 -15.24160 40.26151 
1 1 1   29   26    6 o   69.991   27.133   3.3394   4.1511   3.2479   6.2924   3.4098   5.5236   77.331   32.169   75.224   30.592 2.106934 44.39272 
1 1 1   29   26    7 o   71.399   28.537   3.1921   4.7155   3.1921   4.7155   0.0000   0.0000   71.399   28.537  ?   ?  0.000000 28.53675 
1 1 1   29   26    8 o  169.145   15.138   22.987   3.8777   27.611   5.1413   16.884   5.9058  183.385   18.572  136.277   29.192 47.10764 34.59929 
1 1 1   29   26    9 o   48.947   22.219  -1.4080   3.6156  -0.3649   4.6167  -3.0625   5.8144   58.501   25.936   58.553   27.159 -0.5166245E-01 37.55413 
1 1 1   29   26   10 o  178.252   14.839   25.506   4.0119   34.144   5.2442   13.317   6.2295  205.064   16.857  117.589   33.171 87.47482 37.20892 
1 1 1   29   26   11 o   60.204   24.936   1.5699   3.7577   3.7663   4.7886  -1.9501   6.0622   73.522   28.956   62.011   28.387 11.51116 40.54954 
1 1 1   29   26   12 o   97.338   25.354   8.4832   3.8150   13.031   4.8351   0.9816   6.2097  120.121   26.960   69.659   30.510 50.46151 40.71498 
1 1 1   29   26   13 o   70.788   26.385   3.8703   3.8315   6.3297   4.9801   0.3032   5.9977   84.816   30.316   66.834   29.600 17.98193 42.36938 
1 1 1   29   26   14 o  104.872   24.295   9.7719   3.8234   14.432   5.0010   3.2159   5.9316  126.413   26.684   74.796   31.184 51.61672 41.04209 
1 1 1   29   26   15 o  105.558   32.993   10.927   5.9179   0.0000   0.0000   10.927   5.9179  ?   ?   105.558   32.993 0.000000 32.99346 
1 1 1   29   26   16 o   73.169   25.214   4.5527   3.4234   4.9196   4.2217   3.8484   5.8501   76.479   27.835   76.209   31.293 0.2701340 41.88160 
1 1 1   29   26   17 o   71.257   25.079   4.2500   3.3955   5.3765   4.0943   1.7684   6.0769   78.444   27.543   70.400   30.517 8.043800 41.10843 
1 1 1   29   26   18 o   42.351   19.987  -3.0316   3.3851  -6.9336   4.0011   6.7961   6.3498   39.423   19.345   87.137   33.620 -47.71455 38.78873 
1 1 1   29   27    0 o   71.198   39.346   6.5486   6.2607   6.5486   6.2607   6.5486   6.2607   71.198   39.346   71.198   39.346 0.000000 0.000000 
1 1 1   29   27    1 o   91.165   28.732   7.5206   4.4777   16.197   6.5626  -0.0371   6.1248  130.261   32.905   66.984   29.777 63.27686 44.37757 
1 1 1   29   27    2 o   60.800   26.062   0.8701   4.3371   7.5029   6.1382  -5.7430   6.1290   91.680   33.534   55.182   26.289 36.49852 42.61042 
1 1 1   29   27    3 o   38.100   18.876  -8.7115   4.1331  -5.2583   5.8633 -12.1221   5.8270   54.535   25.905   44.717   22.199 9.818920 34.11522 
1 1 1   29   27    4 o   78.878   28.034   5.2238   4.2528   1.0485   6.0249   9.3702   6.0039   69.313   30.213   99.506   33.405 -30.19353 45.04161 
1 1 1   29   27    5 o   58.693   27.415  -3.6376   6.0897  -3.6376   6.0897   0.0000   0.0000   58.693   27.415  ?   ?  0.000000 27.41504 
1 1 1   29   27    6 o  104.872   30.504   10.323   5.1907   10.323   5.1907   0.0000   0.0000  104.872   30.504  ?   ?  0.000000 30.50363 
1 1 1   29   27    7 o  186.628   16.075   28.214   4.5470   43.638   6.4325   12.809   6.4285  230.486   18.386  114.270   34.136 116.2155 38.77252 
1 1 1   29   27    8 o   65.107   24.774   3.0097   3.4164   3.2203   4.1652   2.5769   5.9724   68.913   27.048   73.244   30.959 -4.331779 41.11045 
1 1 1   29   27    9 o  122.481   19.246   12.585   3.4890   17.366   4.3394   3.8409   5.8681  143.578   20.313   76.851   31.424 66.72688 37.41753 
1 1 1   29   27   10 o   46.258   21.239  -1.7678   3.4279  -0.8104   4.2580  -3.5312   5.7787   54.680   24.530   56.941   26.632 -2.260960 36.20747 
1 1 1   29   27   11 o   78.092   25.755   5.3311   3.5725   6.9291   4.4517   2.4404   5.9875   87.233   28.749   72.503   30.838 14.72995 42.16016 
1 1 1   29   27   12 o  130.491   18.693   14.238   3.6270   17.057   4.6981   10.080   5.7065  140.446   22.623  101.837   32.472 38.60877 39.57558 
1 1 1   29   27   13 o  170.344   14.195   23.341   3.6674   29.256   4.6854   13.986   5.8927  189.398   16.322  120.191   31.609 69.20634 35.57464 
1 1 1   29   27   14 o  181.700   15.231   26.752   4.1970   36.395   5.8477   16.508   6.0273  209.522   18.421  131.706   30.499 77.81657 35.63030 
1 1 1   29   27   15 f   46.959   21.548  -1.6852   3.5216  -0.6985   4.3795  -3.4908   5.9240   55.369   24.855   57.337   26.864 -1.968311 36.59898 
1 1 1   29   28    0 o  236.205   20.707   45.524   7.3542   45.524   7.3542   45.524   7.3542  236.205   20.707  236.205   20.707 0.000000 0.000000 
1 1 1   29   28    1 o   75.208   28.538   4.4187   4.5259   16.150   6.5273  -6.4441   6.2809  129.051   32.935   54.518   26.146 74.53223 42.05099 
1 1 1   29   28    2 o   83.939   28.873   6.2605   4.4882   8.7114   6.4255   3.9256   6.2718   95.845   34.416   78.195   32.288 17.65000 47.19093 
1 1 1   29   28    3 o  126.031   24.232   13.967   4.5048   13.590   6.4519   14.324   6.2926  117.242   33.981  121.177   33.024 -3.935211 47.38470 
1 1 1   29   28    4 o   71.841   30.737   2.1534   6.0118   2.1534   6.0118   0.0000   0.0000   71.841   30.737  ?   ?  0.000000 30.73675 
1 1 1   29   28    5 o  118.552   25.503   12.579   4.4905   14.597   6.3059   10.503   6.3961  122.261   32.951  103.204   34.480 19.05721 47.69283 
1 1 1   29   28    6 o   59.675   25.302   1.1756   4.0093   2.0321   5.1473  -0.1455   6.3930   67.982   28.738   67.169   30.100 0.8133163 41.61616 
1 1 1   29   28    7 o   88.913   27.654   7.2319   4.1633   12.292   5.3616  -0.4529   6.6074  113.742   30.266   67.287   30.338 46.45522 42.85354 
1 1 1   29   28    8 o   53.763   23.379   0.2458   3.5894  -2.6146   4.2766   7.0634   6.6023   49.894   23.194   89.102   34.309 -39.20832 41.41341 
1 1 1   29   28    9 o   66.956   25.646   3.2667   3.6762   4.4045   4.3699   0.5118   6.7999   74.363   28.084   70.120   31.259 4.243721 42.02245 
1 1 1   29   28   10 o   48.313   22.049  -1.4870   3.6214  -2.2532   4.3755   0.1788   6.4521   51.331   23.721   67.870   30.339 -16.53984 38.51166 
1 1 1   29   28   11 o   46.718   21.544  -1.9377   3.5812  -1.5692   4.5241  -2.5562   5.8608   53.918   24.622   58.962   27.320 -5.044537 36.77805 
1 1 1   29   29    0 o  182.791   26.998   29.016   7.0697   29.016   7.0697   29.016   7.0697  182.791   26.998  182.791   26.998 0.000000 0.000000 
1 1 1   29   29    1 o   72.444   28.216   3.8946   4.5054   12.376   6.3201  -4.8686   6.4242  111.162   33.990   57.532   27.266 53.63036 43.57495 
1 1 1   29   29    2 o   93.664   34.627   8.3434   6.5723   8.3434   6.5723   0.0000   0.0000   93.664   34.627  ?   ?  0.000000 34.62749 
1 1 1   29   29    3 o   58.517   25.893  -0.0508   4.5798   6.6126   6.6126  -6.1938   6.3491   87.281   34.131   54.956   26.337 32.32518 43.11154 
1 1 1   29   29    4 o   58.638   25.989  -0.1000   4.6325   3.7562   6.5158  -4.0413   6.5874   77.719   32.566   59.721   28.092 17.99796 43.00792 
1 1 1   30    0    0 o  178.304   15.167   24.969   4.0704   24.969   4.0704   24.969   4.0704  178.304   15.167  178.304   15.167 0.000000 0.000000 
1 1 1   30    0    1 o  164.534   10.925   21.093   2.7235   21.093   2.7235   21.093   2.7235  164.534   10.925  164.534   10.925 0.000000 0.000000 
1 1 1   30    0    2 o   30.698   20.017  -0.1859   2.2903  -0.1859   2.2903  -0.1859   2.2903   30.698   20.017   30.698   20.017 0.000000 0.000000 
1 1 1   30    0    3 o   25.046   17.372  -1.9390   2.3159  -1.9390   2.3159  -1.9390   2.3159   25.046   17.372   25.046   17.372 0.000000 0.000000 
1 1 1   30    0    4 o  223.060   9.5033   38.431   3.2312   38.431   3.2312   38.431   3.2312  223.060   9.5033  223.060   9.5033 0.000000 0.000000 
1 1 1   30    0    5 o   39.918   21.984   1.7343   1.9470   1.7343   1.9470   1.7343   1.9470   39.918   21.984   39.918   21.984 0.000000 0.000000 
1 1 1   30    0    6 o  206.179   9.2206   32.847   2.8966   32.847   2.8966   32.847   2.8966  206.179   9.2206  206.179   9.2206 0.000000 0.000000 
1 1 1   30    0    7 o   58.637   24.324   3.7648   2.1729   3.7648   2.1729   3.7648   2.1729   58.637   24.324   58.637   24.324 0.000000 0.000000 
1 1 1   30    0    8 o  196.032   9.5225   29.734   2.8419   29.734   2.8419   29.734   2.8419  196.032   9.5225  196.032   9.5225 0.000000 0.000000 
1 1 1   30    0    9 o  215.336   7.7552   35.720   2.5486   35.720   2.5486   35.720   2.5486  215.336   7.7552  215.336   7.7552 0.000000 0.000000 
1 1 1   30    0   10 o  248.572   10.624   47.784   4.0252   47.784   4.0252   47.784   4.0252  248.572   10.624  248.572   10.624 0.000000 0.000000 
1 1 1   30    0   11 o  324.102   9.9497   80.980   4.9253   80.980   4.9253   80.980   4.9253  324.102   9.9497  324.102   9.9497 0.000000 0.000000 
1 1 1   30    0   12 o  346.781   10.086   92.702   5.3433   92.702   5.3433   92.702   5.3433  346.781   10.086  346.781   10.086 0.000000 0.000000 
1 1 1   30    0   13 o   40.663   26.267   0.1046   3.8189   0.1046   3.8189   0.1046   3.8189   40.663   26.267   40.663   26.267 0.000000 0.000000 
1 1 1   30    0   14 o   50.244   29.994   2.2737   4.0784   2.2737   4.0784   2.2737   4.0784   50.244   29.994   50.244   29.994 0.000000 0.000000 
1 1 1   30    0   15 o  124.151   27.053   13.670   4.5040   13.670   4.5040   13.670   4.5040  124.151   27.053  124.151   27.053 0.000000 0.000000 
1 1 1   30    0   16 o   62.810   33.820   4.6138   4.5036   4.6138   4.5036   4.6138   4.5036   62.810   33.820   62.810   33.820 0.000000 0.000000 
1 1 1   30    0   17 o   54.892   32.451   2.9193   4.6914   2.9193   4.6914   2.9193   4.6914   54.892   32.451   54.892   32.451 0.000000 0.000000 
1 1 1   30    0   18 o  109.222   33.984   11.855   4.9788   11.855   4.9788   11.855   4.9788  109.222   33.984  109.222   33.984 0.000000 0.000000 
1 1 1   30    0   19 o   42.020   28.154  -1.5046   5.0519  -1.5046   5.0519  -1.5046   5.0519   42.020   28.154   42.020   28.154 0.000000 0.000000 
1 1 1   30    0   20 o  143.408   40.366   20.113   7.6708   20.113   7.6708   20.113   7.6708  143.408   40.366  143.408   40.366 0.000000 0.000000 
1 1 1   30    0   21 o  185.088   19.158   27.574   5.2943   27.574   5.2943   27.574   5.2943  185.088   19.158  185.088   19.158 0.000000 0.000000 
1 1 1   30    0   22 o   40.902   28.747  -6.8705   6.9567  -6.8705   6.9567  -6.8705   6.9567   40.902   28.747   40.902   28.747 0.000000 0.000000 
1 1 1   30    0   23 o   45.051   31.081  -4.5834   7.1714  -4.5834   7.1714  -4.5834   7.1714   45.051   31.081   45.051   31.081 0.000000 0.000000 
1 1 1   30    0   24 o   38.807   26.714  -3.3406   5.2288  -3.3406   5.2288  -3.3406   5.2288   38.807   26.714   38.807   26.714 0.000000 0.000000 
1 1 1   30    0   25 o  304.057   14.210   72.145   6.5805   72.145   6.5805   72.145   6.5805  304.057   14.210  304.057   14.210 0.000000 0.000000 
1 1 1   30    0   26 o  136.455   29.659   16.772   5.4292   16.772   5.4292   16.772   5.4292  136.455   29.659  136.455   29.659 0.000000 0.000000 
1 1 1   30    0   27 o   74.301   37.844   6.8762   5.4083   6.8762   5.4083   6.8762   5.4083   74.301   37.844   74.301   37.844 0.000000 0.000000 
1 1 1   30    0   28 o   63.288   35.866   4.7059   5.3661   4.7059   5.3661   4.7059   5.3661   63.288   35.866   63.288   35.866 0.000000 0.000000 
1 1 1   30    0   29 o  102.500   26.089   9.7744   3.5388   9.7744   3.5388   9.7744   3.5388  102.500   26.089  102.500   26.089 0.000000 0.000000 
1 1 1   30    0   30 o   49.789   31.519   1.3949   5.1684   1.3949   5.1684   1.3949   5.1684   49.789   31.519   49.789   31.519 0.000000 0.000000 
1 1 1   30    0   31 o   55.665   30.684   3.6839   3.7967   3.6839   3.7967   3.6839   3.7967   55.665   30.684   55.665   30.684 0.000000 0.000000 
1 1 1   30    0   32 o  104.251   31.667   10.916   4.4110   10.916   4.4110   10.916   4.4110  104.251   31.667  104.251   31.667 0.000000 0.000000 
1 1 1   30    0   33 o   88.587   32.088   8.4927   3.9945   8.4927   3.9945   8.4927   3.9945   88.587   32.088   88.587   32.088 0.000000 0.000000 
1 1 1   30    0   34 o  172.903   13.202   23.694   3.4470   23.694   3.4470   23.694   3.4470  172.903   13.202  172.903   13.202 0.000000 0.000000 
1 1 1   30    0   35 o  231.021   15.794   42.578   5.5248   42.578   5.5248   42.578   5.5248  231.021   15.794  231.021   15.794 0.000000 0.000000 
1 1 1   30    0   36 o   63.236   29.430   4.8806   3.1645   4.8806   3.1645   4.8806   3.1645   63.236   29.430   63.236   29.430 0.000000 0.000000 
1 1 1   30    0   37 o   50.074   31.328   2.1075   4.9423   2.1075   4.9423   2.1075   4.9423   50.074   31.328   50.074   31.328 0.000000 0.000000 
1 1 1   30    0   38 o   55.710   30.734   3.9387   3.8128   3.9387   3.8128   3.9387   3.8128   55.710   30.734   55.710   30.734 0.000000 0.000000 
1 1 1   30    1    0 o   35.850   22.103   0.8034   2.3718   0.8034   2.3718   0.8034   2.3718   35.850   22.103   35.850   22.103 0.000000 0.000000 
1 1 1   30    1    1 o  226.027   6.5341   39.239   2.2605   39.537   3.1717   38.931   3.2227  226.495   9.1488  224.714   9.3696 1.781494 13.09542 
1 1 1   30    1    2 o  168.410   7.6465   21.813   1.9710   23.384   2.7352   20.116   2.8429  173.718   10.333  160.803   11.629 12.91435 15.55654 
1 1 1   30    1    3 o  214.034   6.6881   35.193   2.1911   32.288   2.9933   38.546   3.2160  204.608   9.5578  223.588   9.3971 -18.97955 13.40361 
1 1 1   30    1    4 o   69.829   16.375   3.9652   1.7198   5.4275   2.4208   2.4752   2.4437   81.313   19.666   59.591   21.243 21.72242 28.94825 
1 1 1   30    1    5 o  272.001   5.9076   56.792   2.4595   56.069   3.5843   57.435   3.3812  269.797   8.6795  273.181   8.0864 -3.383972 11.86265 
1 1 1   30    1    6 o   92.239   10.958   6.6684   1.5168   6.1364   2.4286   7.0087   1.9423   86.641   18.849   93.946   13.929 -7.305443 23.43720 
1 1 1   30    1    7 o  247.687   7.0648   47.156   2.6784   0.0000   0.0000   47.156   2.6784  ?   ?   247.687   7.0648 0.000000 7.064766 
1 1 1   30    1    8 o  109.626   14.709   9.5293   2.4058   12.122   4.4442   8.4545   2.8613  120.650   24.892  101.984   19.030 18.66650 31.33257 
1 1 1   30    1    9 o  125.569   11.911   12.325   2.2619   14.431   3.4826   10.788   2.9748  134.518   17.316  116.033   17.277 18.48499 24.46078 
1 1 1   30    1   10 o  262.008   7.3205   52.791   2.9358   60.982   4.4225   46.338   3.9254  280.944   10.284  244.857   10.474 36.08713 14.67885 
1 1 1   30    1   11 o  212.616   6.5469   34.732   2.1306   37.837   4.1686   33.634   2.4788  220.469   12.403  209.064   7.7463 11.40471 14.62353 
1 1 1   30    1   12 o  237.748   8.3191   43.538   3.0274   46.198   4.4490   41.244   4.1313  244.085   11.908  230.378   11.755 13.70708 16.73289 
1 1 1   30    1   13 o  248.108   8.4732   47.432   3.2178   54.418   4.8117   41.780   4.3279  264.892   11.868  231.696   12.247 33.19571 17.05376 
1 1 1   30    1   14 o   58.252   22.404   1.9411   2.8129   2.1098   4.2729   1.8120   3.7368   67.335   27.075   63.102   25.338 4.232964 37.08225 
1 1 1   30    1   15 o  130.525   15.759   13.535   3.0848   13.471   4.5492   13.590   4.1972  127.232   24.245  128.627   22.116 -1.394501 32.81638 
1 1 1   30    1   16 o  139.658   15.376   15.452   3.2325   16.163   4.8231   14.872   4.3554  139.965   23.335  134.717   21.872 5.247864 31.98288 
1 1 1   30    1   17 o   69.747   24.664   3.5804   3.2879  -0.6893   4.7747   7.4306   4.5341   60.325   26.579   93.887   28.804 -33.56139 39.19265 
1 1 1   30    1   18 o  176.591   12.861   24.405   3.4525   24.341   5.2256   24.455   4.5992  173.692   20.022  175.201   17.380 -1.509293 26.51319 
1 1 1   30    1   19 o   89.646   29.052   6.6728   4.5538   7.0634   6.7430   6.3453   6.1745   95.378   35.108   91.277   33.595 4.101425 48.59217 
1 1 1   30    1   20 o  119.384   26.227   12.127   4.6616   0.0000   0.0000   12.127   4.6616  ?   ?   119.384   26.227 0.000000 26.22707 
1 1 1   30    1   21 f   55.525   23.542   0.4895   3.4704  -2.7051   5.6293   2.4480   4.4077   60.057   27.441   68.957   27.579 -8.900234 38.90519 
1 1 1   30    1   22 o   66.748   25.242   2.8945   3.5330   6.6953   5.7303   0.5636   4.4875   91.337   32.532   62.240   26.590 29.09615 42.01674 
1 1 1   30    1   23 o   61.253   24.668   1.7418   3.5530   4.1981   5.8374   0.2963   4.4781   81.424   32.001   61.201   26.363 20.22355 41.46161 
1 1 1   30    1   24 o  110.150   22.293   10.167   3.6296   6.3069   5.9738   12.425   4.5698   89.800   33.046  120.641   25.543 -30.84109 41.76708 
1 1 1   30    1   25 o   88.970   29.186   6.6919   4.5902   9.3367   6.1378   3.3355   6.9143  102.792   33.751   81.887   33.864 20.90522 47.81116 
1 1 1   30    1   26 o  279.466   10.403   60.660   4.4498   56.213   6.8424   63.919   5.8577  265.369   16.934  285.499   13.405 -20.12988 21.59734 
1 1 1   30    1   27 o  163.295   15.547   21.288   3.8389   22.522   5.8928   20.379   5.0599  163.402   24.301  156.785   21.663 6.617508 32.55511 
1 1 1   30    1   28 o  129.702   19.200   13.834   3.6965   7.1908   5.3955   19.710   5.0745   91.477   31.647  153.591   22.232 -62.11466 38.67531 
1 1 1   30    1   29 o  127.981   15.501   13.185   2.9746   15.969   3.6381   7.5710   5.1665  140.198   17.322   92.694   30.989 47.50346 35.50129 
1 1 1   30    1   30 o  181.990   10.058   25.859   2.7908   25.477   3.9627   26.234   3.9312  178.699   14.616  181.523   14.264 -2.823578 20.42231 
1 1 1   30    1   31 o   93.370   20.335   7.3978   2.8239   9.9061   5.7368   6.5957   3.2442  103.031   32.527   87.028   23.710 16.00266 40.25132 
1 1 1   30    1   32 o   50.328   21.270   0.5819   2.8182  -2.8216   7.5216   1.1377   3.0397   67.342   31.114   54.343   22.462 12.99917 38.37438 
1 1 1   30    1   33 o  183.711   9.6132   26.372   2.6938   23.638   4.2490   28.208   3.4833  170.535   16.484  188.896   12.111 -18.36105 20.45478 
1 1 1   30    1   34 o  123.166   13.786   12.215   2.5543   8.3204   3.9977   14.901   3.3205   95.553   26.439  134.855   16.426 -39.30205 31.12640 
1 1 1   30    1   35 o   63.256   21.244   3.3064   2.4283   4.4824   3.8481   2.5282   3.1302   73.297   26.591   60.925   23.578 12.37244 35.53817 
1 1 1   30    1   36 o  117.437   15.683   11.363   2.7486   13.253   5.1271   10.600   3.2560  118.060   28.661  111.076   19.881 6.983414 34.88138 
1 1 1   30    1   37 o   71.334   25.213   4.4008   3.4355   9.0087   4.9097  -0.0198   4.8090   95.625   30.078   58.887   26.267 36.73885 39.93339 
1 1 1   30    1   38 o   55.503   21.209   2.1725   2.5108   4.7128   3.2565  -1.5507   3.9425   72.640   24.601   49.535   22.755 23.10518 33.51141 
1 1 1   30    2    0 o   23.277   16.486  -3.0711   2.4339  -3.0711   2.4339  -3.0711   2.4339   23.277   16.486   23.277   16.486 0.000000 0.000000 
1 1 1   30    2    1 o   45.965   17.806   1.0953   1.7866   1.6796   2.5238   0.5083   2.5294   55.097   21.213   48.853   20.365 6.244843 29.40645 
1 1 1   30    2    2 o  133.571   9.4498   13.825   1.9195   11.372   2.6728   16.437   2.7584  119.911   14.883  145.069   12.546 -25.15816 19.46540 
1 1 1   30    2    3 o   33.330   15.077  -0.8702   1.6473   1.2895   2.3290  -3.0323   2.3303   51.442   20.215   33.756   16.117 17.68609 25.85346 
1 1 1   30    2    4 o  200.773   7.8591   31.013   2.4152   31.541   3.0570   30.136   3.9397  202.167   9.8790  196.559   13.171 5.607544 16.46410 
1 1 1   30    2    5 o   91.938   14.923   6.7516   2.0280   4.0395   3.4718   8.1562   2.4986   73.403   25.386  100.765   16.791 -27.36172 30.43660 
1 1 1   30    2    6 f  205.386   7.7791   32.453   2.4455   34.525   4.0164   31.232   3.0829  210.613   12.515  201.141   10.013 9.471954 16.02812 
1 1 1   30    2    7 o   43.337   16.750   0.9794   1.5783   0.9584   3.3782   0.9853   1.7851   57.265   23.675   45.179   17.715 12.08647 29.56931 
1 1 1   30    2    8 o   27.502   13.148  -2.0999   1.5609  -3.5736   4.5365  -1.9020   1.6624   51.389   23.889   29.461   13.935 21.92744 27.65608 
1 1 1   30    2    9 o  223.321   6.2315   38.300   2.1301   34.809   4.2570   39.466   2.4602  211.230   13.234  226.578   7.0938 -15.34862 15.01509 
1 1 1   30    2   10 o  119.794   9.7935   11.150   1.7800   17.374   6.0055   10.550   1.8638  143.468   28.353  116.360   10.580 27.10794 30.26283 
1 1 1   30    2   11 o  165.780   7.9667   21.156   2.0215   15.586   6.3378   21.787   2.1329  134.383   31.381  168.193   8.2851 -33.81009 32.45645 
1 1 1   30    2   12 o  278.835   6.1857   59.715   2.6400   64.413   7.5333   59.058   2.8188  285.656   17.311  277.219   6.6430 8.436615 18.54204 
1 1 1   30    2   13 o  134.375   8.8456   13.981   1.8092   13.543   6.5914   14.016   1.8814  124.223   33.777  134.485   9.1951 -10.26185 35.00579 
1 1 1   30    2   14 o   77.263   24.243   4.8313   3.1916   3.6442   6.6905   5.1811   3.6314   83.684   33.798   80.226   25.938 3.457809 42.60404 
1 1 1   30    2   15 o   64.825   23.746   2.8595   3.0796   3.7646   6.7691   2.6232   3.4582   84.281   34.011   65.393   24.915 18.88816 42.16053 
1 1 1   30    2   16 o   41.176   19.006  -2.0372   2.7965   3.1522   4.8757  -4.5813   3.4139   74.365   29.240   40.201   19.278 34.16396 35.02343 
1 1 1   30    2   17 o  361.297   7.3620  100.462   4.0713  107.392   6.6649   96.337   5.1421  371.966   11.706  353.141   9.5132 18.82462 15.08437 
1 1 1   30    2   18 o  229.494   10.966   40.822   3.8522   42.089   5.8115   39.830   5.1449  230.626   16.574  224.982   15.027 5.643921 22.37150 
1 1 1   30    2   19 o  325.270   8.1086   81.550   4.0370   91.445   7.0420   76.707   4.9270  342.318   13.440  314.802   10.225 27.51538 16.88754 
1 1 1   30    2   20 o  111.643   19.113   10.170   3.1487   9.3223   5.9711   10.497   3.7057  103.757   33.230  112.310   22.343 -8.552269 40.04332 
1 1 1   30    2   21 o  169.316   14.264   22.599   3.6622   24.423   9.9999   22.316   3.9357  161.235   40.557  167.811   15.498 -6.576157 43.41721 
1 1 1   30    2   22 o  116.678   18.968   11.101   3.2712   5.1532   6.1978   13.398   3.8513   86.266   33.235  127.873   20.360 -41.60678 38.97528 
1 1 1   30    2   23 o  128.564   17.810   13.354   3.4105   18.996   6.6062   11.304   3.9822  147.477   30.280  116.035   23.232 31.44178 38.16554 
1 1 1   30    2   24 o   88.729   24.462   6.6950   3.4293   10.263   6.6794   5.4180   3.9963  107.299   35.208   81.450   27.254 25.84847 44.52367 
1 1 1   30    2   25 o   71.906   25.450   3.9406   3.5017  -5.9351   6.6674   7.7023   4.1149   59.166   27.962   94.400   27.073 -35.23409 38.92083 
1 1 1   30    2   26 o   68.433   25.204   3.3457   3.4761   2.9741   6.3870   3.5021   4.1435   78.555   32.521   71.802   27.292 6.752304 42.45577 
1 1 1   30    2   27 o  201.925   16.147   32.567   4.9488   34.830   6.3326   29.016   7.9315  206.428   20.305  182.109   29.461 24.31897 35.78017 
1 1 1   30    2   28 o  173.263   10.424   23.436   2.7515   25.731   4.2936   21.837   3.5842  179.357   15.801  165.805   14.262 13.55145 21.28563 
1 1 1   30    2   29 o   62.334   22.968   2.7618   2.8872   3.0681   5.2552   2.6293   3.4554   73.641   29.880   64.169   24.789 9.472290 38.82411 
1 1 1   30    2   30 o   64.786   20.617   3.4374   2.3013   2.9769   3.6948   3.7294   2.9417   66.727   25.674   68.258   23.380 -1.530708 34.72426 
1 1 1   30    2   31 o  166.639   10.342   21.737   2.6248   22.185   3.9895   21.394   3.4853  165.888   15.907  163.796   14.037 2.092712 21.21534 
1 1 1   30    2   32 o  117.588   13.556   11.074   2.3952   8.0951   3.7444   13.137   3.1161   95.543   25.231  126.961   16.420 -31.41865 30.10320 
1 1 1   30    2   33 o   53.280   21.417   1.4306   2.6726  -1.9651   6.4961   2.1225   2.9323   64.022   29.336   58.396   22.758 5.626232 37.12896 
1 1 1   30    2   34 o   88.023   18.290   6.5544   2.3837   10.344   3.8409   4.1801   3.0401  108.115   23.850   70.458   23.770 37.65687 33.67236 
1 1 1   30    2   35 o   68.882   21.855   4.0726   2.5874   5.2789   4.9244   3.6125   3.0410   79.025   29.821   66.653   23.704 12.37221 38.09390 
1 1 1   30    2   36 o   96.148   18.862   7.9129   2.6766   10.670   5.1564   6.8959   3.1316  104.333   30.419   87.614   23.044 16.71861 38.16162 
1 1 1   30    2   37 o  135.930   13.440   14.949   2.7597   14.715   3.9855   15.165   3.8250  130.311   20.672  133.277   19.313 -2.965469 28.28995 
1 1 1   30    2   38 o   50.952   20.516   1.4232   2.4571   0.3690   3.8934   2.1209   3.1675   54.971   24.116   58.218   23.346 -3.247189 33.56487 
1 1 1   30    3    0 o  111.095   16.898   10.178   2.6763   10.178   2.6763   10.178   2.6763  111.095   16.898  111.095   16.898 0.000000 0.000000 
1 1 1   30    3    1 o  112.364   11.182   9.8586   1.8976   8.2488   2.7004   11.429   2.6670  100.998   18.135  120.232   14.805 -19.23433 23.41069 
1 1 1   30    3    2 o  117.427   13.326   10.844   2.3527   12.340   2.8446   7.6027   4.1859  124.894   15.193   95.337   27.296 29.55611 31.23906 
1 1 1   30    3    3 o  237.588   9.8618   43.561   3.5863   55.698   5.9798   36.743   4.4819  266.931   14.692  217.004   13.561 49.92723 19.99443 
1 1 1   30    3    4 o   82.926   14.598   5.5087   1.7852   3.4512   4.8816   5.8264   1.9180   76.099   29.446   85.182   15.272 -9.082993 33.17030 
1 1 1   30    3    5 o  213.126   6.9166   34.907   2.2563   42.625   6.1170   33.691   2.4275  232.406   17.320  209.295   7.5775 23.11053 18.90502 
1 1 1   30    3    6 o   97.580   11.883   7.4816   1.7382   1.2685   3.6926   9.2503   1.9702   60.666   24.881  108.613   12.054 -47.94628 27.64710 
1 1 1   30    3    7 o  251.653   5.8859   48.615   2.2672   53.312   4.7159   47.202   2.5856  262.347   11.744  247.843   6.8157 14.50351 13.57864 
1 1 1   30    3    8 o  237.429   6.0738   43.284   2.2073   44.413   4.5783   42.942   2.5195  238.914   12.564  236.369   6.9639 2.545029 14.36466 
1 1 1   30    3    9 o  268.614   6.0764   55.403   2.4983   53.232   6.6329   55.762   2.6969  259.980   16.758  269.412   6.5401 -9.432434 17.98864 
1 1 1   30    3   10 o   97.246   11.002   7.4072   1.6088   2.9655   4.0568   8.2361   1.7525   70.130   26.922  102.534   11.357 -32.40337 29.21929 
1 1 1   30    3   11 o   50.509   21.659   0.0446   2.9975   2.1225   4.0127  -2.5788   4.5087   66.089   26.354   53.547   24.501 12.54196 35.98392 
1 1 1   30    3   12 o   86.109   22.969   6.1642   3.0832   9.1684   4.2277   2.7510   4.5062  104.129   26.468   71.238   28.079 32.89066 38.58741 
1 1 1   30    3   13 o   82.037   23.830   5.5614   3.1698   5.0599   4.3456   6.1316   4.6340   81.294   28.385   87.429   29.347 -6.135345 40.82887 
1 1 1   30    3   14 o  171.650   13.759   23.103   3.5845   23.889   4.8809   22.183   5.2813  172.834   18.751  165.437   21.355 7.396698 28.41876 
1 1 1   30    3   15 o  228.839   11.969   40.753   4.1778   51.044   5.7916   29.590   6.0322  255.053   14.900  191.529   20.917 63.52397 25.68119 
1 1 1   30    3   16 o  134.003   27.805   15.267   5.5161   15.267   5.5161   0.0000   0.0000  134.003   27.805  ?   ?  0.000000 27.80464 
1 1 1   30    3   17 o   53.210   18.744   2.0085   1.8972   3.1765   5.3298   1.8390   2.0301   76.303   30.390   52.742   19.286 23.56100 35.99310 
1 1 1   30    3   18 o   79.298   18.988   5.1874   2.2742   3.7961   5.6799   5.4531   2.4818   79.940   31.519   81.133   20.091 -1.193596 37.37744 
1 1 1   30    3   19 o  232.893   8.2167   41.817   2.9290   48.028   6.6497   40.321   3.2626  245.710   17.802  228.449   9.3304 17.26088 20.09879 
1 1 1   30    3   20 o  107.540   15.225   9.2447   2.4360  -4.2284   6.1748   11.728   2.6510   60.046   27.899  121.558   14.536 -61.51223 31.45861 
1 1 1   30    3   21 o  214.751   33.453   40.404   10.638   40.404   10.638   0.0000   0.0000  214.751   33.453  ?   ?  0.000000 33.45313 
1 1 1   30    3   22 o  153.369   12.155   18.425   2.8301   27.510   6.7113   16.460   3.1212  181.809   24.761  144.254   14.325 37.55472 28.60646 
1 1 1   30    3   23 o   86.674   21.356   6.2963   2.8148   0.5898   6.6066   7.5619   3.1114   73.192   31.773   94.925   21.865 -21.73275 38.56942 
1 1 1   30    3   24 f  197.760   10.863   30.469   3.2757   34.439   6.9348   29.329   3.7164  204.623   22.514  193.416   12.623 11.20650 25.81125 
1 1 1   30    3   25 o   69.122   21.436   3.9039   2.5035   0.2257   6.7317   4.4942   2.6970   72.426   31.743   73.624   22.137 -1.197334 38.69991 
1 1 1   30    3   26 o  278.531   9.3943   60.102   4.0051   67.069   7.5467   57.370   4.7254  289.762   17.091  271.361   11.377 18.40103 20.53152 
1 1 1   30    3   27 o   85.886   20.903   6.2267   2.7219   10.920   6.1384   5.0780   3.0367  109.227   33.515   77.669   23.520 31.55807 40.94432 
1 1 1   30    3   28 o   61.414   21.744   2.8155   2.5562   0.0765   3.3372   6.7038   3.9762   52.405   22.666   87.927   26.973 -35.52193 35.23149 
1 1 1   30    3   29 o  113.912   13.954   10.383   2.3821   7.5215   3.5713   12.676   3.1973   92.924   24.689  124.722   17.206 -31.79772 30.09319 
1 1 1   30    3   30 o   61.986   20.816   3.0487   2.3314   2.0548   3.7309   3.6855   2.9863   62.627   25.258   68.087   23.545 -5.460030 34.53008 
1 1 1   30    3   31 o   86.827   17.420   6.2711   2.2346   2.2567   3.7065   8.5637   2.8010   63.234   25.290  101.275   18.760 -38.04093 31.48885 
1 1 1   30    3   32 o   84.166   18.112   5.9479   2.2642   9.7042   3.8489   3.9602   2.7999  105.066   24.401   69.131   22.800 35.93438 33.39550 
1 1 1   30    3   33 o   68.108   20.668   3.9241   2.3431   6.9733   4.0990   2.4442   2.8556   87.993   27.452   59.758   22.670 28.23513 35.60259 
1 1 1   30    3   34 o   86.065   21.011   6.4358   2.7437   18.635   8.6330   5.0651   2.8938  131.406   39.627   76.139   22.939 55.26772 45.78715 
1 1 1   30    3   35 o   68.611   20.754   4.0537   2.3653   4.4984   3.9106   3.7972   2.9701   73.409   26.779   67.570   23.474 5.838730 35.61108 
1 1 1   30    3   36 o   60.723   20.857   3.0140   2.3416  -0.1413   3.7642   5.0057   2.9907   53.014   23.466   75.047   23.454 -22.03296 33.17740 
1 1 1   30    3   37 o   67.609   21.039   3.9820   2.4093   6.8781   3.8689   2.1475   3.0792   85.580   26.665   58.158   23.119 27.42176 35.29222 
1 1 1   30    3   38 o   72.920   22.311   4.7619   2.7226   3.8500   4.1274   5.4643   3.6225   69.555   27.030   77.126   25.947 -7.571686 37.46854 
1 1 1   30    4    0 f  226.480   17.393   40.442   5.9477   40.442   5.9477   40.442   5.9477  226.480   17.393  226.480   17.393 0.000000 0.000000 
1 1 1   30    4    1 o  140.796   12.009   15.466   2.5633   13.760   5.5455   15.930   2.8906  127.279   29.099  142.578   13.403 -15.29887 32.03733 
1 1 1   30    4    2 o  202.457   11.135   31.797   3.4374   34.691   6.1094   30.456   4.1581  208.769   19.339  197.404   13.849 11.36447 23.78611 
1 1 1   30    4    3 o  203.270   9.2763   31.857   2.8862   29.891   5.8792   32.481   3.3128  193.331   20.164  204.753   10.607 -11.42302 22.78403 
1 1 1   30    4    4 o  264.504   6.2817   53.726   2.5432   60.507   6.7457   52.603   2.7458  277.710   15.936  261.638   6.8564 16.07095 17.34862 
1 1 1   30    4    5 o  234.733   6.5907   42.328   2.3680   43.472   6.5081   42.154   2.5422  234.290   18.293  234.179   7.0924 0.1103668 19.61998 
1 1 1   30    4    6 o  199.463   6.6448   30.566   2.0287   31.319   4.3559   30.358   2.2925  200.017   14.323  198.671   7.5387 1.346146 16.18549 
1 1 1   30    4    7 o  140.658   10.155   15.357   2.1715   15.058   4.1440   15.470   2.5496  136.422   20.478  140.803   11.943 -4.381531 23.70608 
1 1 1   30    4    8 o  186.968   11.486   27.166   3.2710   23.694   4.3985   31.463   4.8927  173.027   16.821  199.844   16.133 -26.81664 23.30672 
1 1 1   30    4    9 o  111.549   18.081   10.031   2.9815   6.5190   4.1249   13.873   4.3145   88.911   27.506  130.081   22.483 -41.17094 35.52501 
1 1 1   30    4   10 o  141.583   16.507   15.920   3.5100   11.284   5.6116   18.898   4.4987  114.422   31.188  153.349   19.616 -38.92731 36.84345 
1 1 1   30    4   11 o  148.964   14.303   17.456   3.2211   15.137   4.5153   19.858   4.5964  135.918   22.490  157.245   19.517 -21.32697 29.77789 
1 1 1   30    4   12 o   96.925   22.076   7.7961   3.2019   12.931   4.5423   2.7247   4.5143  124.547   24.700   71.148   28.084 53.39901 37.40062 
1 1 1   30    4   13 o  131.224   16.993   13.749   3.3329   13.945   4.7056   13.553   4.7213  129.414   24.656  127.361   25.111 2.053101 35.19231 
1 1 1   30    4   14 o  108.890   21.738   9.7903   3.4962   6.7188   4.7791   13.327   5.1281   90.590   29.784  125.277   27.497 -34.68680 40.53627 
1 1 1   30    4   15 o   69.057   25.541   3.2320   3.5764   4.0764   5.0508   2.3830   5.0647   78.921   30.100   72.276   29.331 6.645508 42.02739 
1 1 1   30    4   16 o   65.610   28.448   0.0599   5.2841   0.0599   5.2841   0.0000   0.0000   65.610   28.448  ?   ?  0.000000 28.44849 
1 1 1   30    4   17 o  200.367   19.869   32.269   6.0132   32.269   6.0132   0.0000   0.0000  200.367   19.869  ?   ?  0.000000 19.86892 
1 1 1   30    4   18 o  155.382   17.567   19.306   4.1047   14.434   5.8938   23.896   5.7199  128.810   30.386  170.936   22.401 -42.12596 37.75038 
1 1 1   30    4   19 o  213.521   13.891   35.773   4.5153   35.384   6.4764   36.140   6.2985  209.390   20.469  212.070   19.626 -2.679932 28.35799 
1 1 1   30    4   20 o   74.609   27.367   3.9875   4.0924   3.2778   6.2087   4.5326   5.4418   79.895   32.456   81.702   31.224 -1.807533 45.03704 
1 1 1   30    4   21 o  109.862   11.287   9.4675   1.8710  -0.5639   6.6544   10.329   1.9496   70.697   31.251  114.808   11.239 -44.11144 33.21017 
1 1 1   30    4   22 o  157.904   9.4924   19.354   2.2836   20.941   9.9022   19.265   2.3469  147.731   41.874  157.470   9.7853 -9.739334 43.00179 
1 1 1   30    4   23 o  120.401   11.537   11.375   2.1002   15.807   6.8409   10.914   2.2067  132.307   33.690  117.677   12.440 14.63017 35.91341 
1 1 1   30    4   24 o  158.702   9.7916   19.585   2.3669   29.718   7.2349   18.371   2.5047  187.841   25.849  153.439   10.732 34.40208 27.98806 
1 1 1   30    4   25 o   93.421   16.238   7.0930   2.2376  -0.6730   7.0379   7.9664   2.3601   71.580   31.864   99.178   16.099 -27.59808 35.70008 
1 1 1   30    4   26 o   86.465   21.042   6.3011   2.7584   8.6360   6.9450   5.8638   3.0056   99.907   35.790   83.125   22.894 16.78285 42.48663 
1 1 1   30    4   27 o  191.397   9.9145   28.516   2.8946   28.785   6.8568   28.458   3.1930  184.453   24.925  190.839   10.977 -6.386490 27.23533 
1 1 1   30    4   28 o  131.112   13.608   13.667   2.6911   0.1107   6.2914   16.702   2.9773   69.294   30.521  145.088   13.564 -75.79356 33.39909 
1 1 1   30    4   29 o   93.260   20.051   7.3304   2.7771   11.147   3.6903   2.3461   4.2170  114.736   21.810   66.364   26.823 48.37154 34.57067 
1 1 1   30    4   30 o   72.384   19.622   4.4225   2.2284   2.1824   3.6965   5.7014   2.7930   62.990   25.234   81.529   21.911 -18.53904 33.41958 
1 1 1   30    4   31 o   36.159   16.588  -1.2883   2.0852  -1.6766   3.6582  -1.1014   2.5379   48.579   22.167   41.273   18.688 7.305317 28.99331 
1 1 1   30    4   32 o  142.308   11.351   15.973   2.4520   22.271   4.7205   13.646   2.8694  164.057   19.160  130.168   14.657 33.88861 24.12301 
1 1 1   30    4   33 o   41.122   18.201  -0.4485   2.2643  -1.5406   4.0648   0.0429   2.7264   51.481   23.443   47.119   20.433 4.362228 31.09761 
1 1 1   30    4   34 o  117.440   13.496   11.107   2.3819   15.392   4.0140   8.7780   2.9592  134.845   20.059  101.400   19.776 33.44502 28.16845 
1 1 1   30    4   35 o  100.154   17.281   8.4088   2.5534   2.5012   5.0972   10.388   2.9503   68.637   28.784  111.198   17.945 -42.56126 33.91949 
1 1 1   30    4   36 o   63.970   21.018   3.4626   2.3801   10.851   4.0560  -0.4178   2.9394  109.068   24.850   46.425   20.633 62.64288 32.29972 
1 1 1   30    4   37 o   88.405   18.827   6.7558   2.4696   4.2162   4.0358   8.2760   3.1224   71.351   26.979   96.457   21.677 -25.10657 34.60863 
1 1 1   30    4   38 o  108.622   17.111   9.9621   2.7507   11.437   4.2510   8.8997   3.6079  110.587   25.617   98.202   24.167 12.38493 35.21748 
1 1 1   30    5    0 o  171.096   24.748   24.291   6.0867   24.291   6.0867   24.291   6.0867  171.096   24.748  171.096   24.748 0.000000 0.000000 
1 1 1   30    5    1 o  148.626   28.890   18.626   6.3354   18.626   6.3354   0.0000   0.0000  148.626   28.890  ?   ?  0.000000 28.88957 
1 1 1   30    5    2 o  232.913   9.0161   41.810   3.2143   54.343   7.1445   38.630   3.5991  262.287   17.903  223.597   10.516 38.69003 20.76318 
1 1 1   30    5    3 o   99.041   17.892   7.9336   2.6125   14.720   6.3855   6.5693   2.8631  130.531   32.168   89.203   21.269 41.32722 38.56329 
1 1 1   30    5    4 o  109.204   11.048   9.3152   1.8213   5.6460   6.3608   9.6429   1.9009   90.103   33.916  111.068   11.341 -20.96571 35.76151 
1 1 1   30    5    5 o  140.024   8.0724   15.141   1.7228   16.753   6.4350   15.016   1.7880  139.864   30.884  139.390   8.4201 0.4738770 32.01121 
1 1 1   30    5    6 o  104.791   17.660   8.8517   2.7318   10.162   4.0923   7.7984   3.6690  110.268   24.842   96.563   24.719 13.70453 35.04528 
1 1 1   30    5    7 o  241.367   9.4628   44.942   3.4960   48.528   4.9307   41.317   4.9575  249.630   12.949  229.890   14.158 19.73976 19.18637 
1 1 1   30    5    8 o   43.767   19.622  -1.0812   2.7204  -0.6981   4.1073  -1.3807   3.6311   56.141   24.696   50.452   22.641 5.688629 33.50406 
1 1 1   30    5    9 o  168.386   12.350   22.115   3.1609   26.817   4.6340   18.023   4.3226  184.189   16.616  149.827   19.297 34.36229 25.46513 
1 1 1   30    5   10 o   93.934   23.202   7.3553   3.3163   6.3133   5.4798   7.9575   4.1658   90.237   31.848   97.156   27.027 -6.919159 41.77062 
1 1 1   30    5   11 o   70.226   23.825   3.7652   3.0544   5.4346   4.4437   2.2701   4.2052   83.504   28.730   67.704   26.985 15.79983 39.41554 
1 1 1   30    5   12 o  127.266   17.061   12.946   3.2399   19.173   4.6380   7.0116   4.5277  154.171   20.135   91.888   28.882 62.28226 35.20763 
1 1 1   30    5   13 o  147.094   15.624   17.127   3.4638   15.047   4.8446   19.303   4.9544  134.617   24.411  154.072   21.602 -19.45483 32.59691 
1 1 1   30    5   14 o   43.049   20.038  -2.6769   3.2087  -4.6217   4.6858  -0.9600   4.4028   49.988   23.568   57.196   25.344 -7.208054 34.60938 
1 1 1   30    5   15 o   96.992   30.563   7.9376   5.0668   7.9376   5.0668   0.0000   0.0000   96.992   30.563  ?   ?  0.000000 30.56326 
1 1 1   30    5   16 o  127.182   27.936   13.814   5.2896   13.814   5.2896   0.0000   0.0000  127.182   27.936  ?   ?  0.000000 27.93633 
1 1 1   30    5   17 o   72.582   26.246   3.8015   3.7446   0.4948   5.3259   7.0342   5.2660   67.060   28.817   92.575   31.284 -25.51536 42.53342 
1 1 1   30    5   18 f   73.833   26.320   4.0429   3.7516   4.2222   5.6155   3.8983   5.0418   81.255   31.542   77.848   29.980 3.407143 43.51683 
1 1 1   30    5   19 o   45.821   21.437  -3.2894   3.7484  -2.1871   5.6810  -4.1392   4.9884   61.659   27.936   52.887   24.739 8.771694 37.31503 
1 1 1   30    5   20 o   84.440   21.416   5.9547   2.7721   5.8315   5.9132   5.9894   3.1384   88.300   32.805   84.488   23.443 3.811699 40.32090 
1 1 1   30    5   21 o  119.248   17.557   11.487   3.1087   3.0825   6.4603   14.020   3.5462   80.066   32.882  131.774   18.057 -51.70828 37.51355 
1 1 1   30    5   22 o   77.668   24.606   4.9529   3.2807   5.4597   9.0434   4.8761   3.5205   95.164   38.972   77.619   25.565 17.54448 46.60939 
1 1 1   30    5   23 o  202.515   7.0143   31.581   2.1742   38.330   7.3111   30.926   2.2773  216.145   22.425  200.330   7.4268 15.81528 23.62281 
1 1 1   30    5   24 o  310.893   6.4114   74.368   3.0509   78.702   8.3740   73.704   3.2761  314.045   17.490  309.367   6.9186 4.677368 18.80901 
1 1 1   30    5   25 o  113.852   12.068   10.222   2.0710   12.656   7.4395   10.018   2.1562  116.665   37.063  112.505   12.746 4.159904 39.19386 
1 1 1   30    5   26 o  186.320   8.8608   26.866   2.5270   29.183   7.4615   26.565   2.6857  184.401   27.257  184.883   9.5228 -0.4815826 28.87277 
1 1 1   30    5   27 o  191.949   10.212   28.716   2.9896   23.805   7.1316   29.763   3.2929  164.388   29.424  195.121   11.071 -30.73314 31.43758 
1 1 1   30    5   28 o  124.609   11.364   12.220   2.1435   13.191   3.6156   11.693   2.6618  126.430   19.295  120.764   14.704 5.666687 24.25875 
1 1 1   30    5   29 o  100.869   15.637   8.2706   2.3360   4.5712   3.6226   10.904   3.0564   74.928   25.931  115.160   17.922 -40.23232 31.52152 
1 1 1   30    5   30 o  134.892   15.536   14.679   3.1492   16.765   4.3165   12.304   4.6047  141.751   20.489  118.063   26.169 23.68824 33.23541 
1 1 1   30    5   31 o  117.526   13.137   11.026   2.3227   12.653   4.5017   10.436   2.7115  119.995   25.307  113.147   16.112 6.847931 30.00025 
1 1 1   30    5   32 o  133.262   11.304   14.020   2.2840   12.410   3.8596   14.887   2.8334  120.557   21.715  136.372   13.762 -15.81419 25.70854 
1 1 1   30    5   33 o  133.415   12.306   14.160   2.4847   6.6363   4.6206   17.220   2.9470   85.956   29.303  146.800   13.259 -60.84423 32.16274 
1 1 1   30    5   34 o   48.697   19.762   1.0917   2.2992   2.1812   3.8950   0.5090   2.8485   62.849   25.639   49.770   21.222 13.07894 33.28250 
1 1 1   30    5   35 o  112.661   15.775   10.461   2.6457   4.2277   5.3496   12.480   3.0440   75.444   30.309  122.742   16.631 -47.29794 34.57226 
1 1 1   30    5   36 o  128.399   13.020   13.289   2.5234   9.1823   4.1278   15.739   3.1885   98.877   26.664  138.568   15.288 -39.69193 30.73598 
1 1 1   30    5   37 o   44.757   19.232   0.2918   2.3719  -2.1748   3.9298   1.7052   2.9748   47.929   22.265   55.387   22.478 -7.457920 31.63859 
1 1 1   30    5   38 o   41.957   19.278  -1.3959   2.8313  -1.1624   3.9709  -1.6373   4.0382   50.683   23.115   49.820   22.939 0.8626404 32.56528 
1 1 1   30    6    1 o  272.483   11.265   57.454   4.6981   58.380   7.0020   56.695   6.3362  272.331   16.881  268.963   15.456 3.368256 22.88785 
1 1 1   30    6    2 o  200.441   13.381   31.363   4.0817   31.124   6.7421   31.501   5.1283  196.065   22.897  199.721   16.935 -3.656143 28.47944 
1 1 1   30    6    3 f  171.583   8.7770   22.742   2.2974   27.915   6.9599   22.110   2.4338  184.436   25.322  169.050   9.4436 15.38678 27.02601 
1 1 1   30    6    4 o   70.586   24.011   3.7799   3.1025   0.6236   6.6873   4.6456   3.5022   74.993   32.260   76.980   25.505 -1.987411 41.12465 
1 1 1   30    6    5 o   64.683   24.000   2.7316   3.1628  -1.8437   6.6877   4.0498   3.5896   68.746   30.798   73.795   25.797 -5.048973 40.17417 
1 1 1   30    6    6 f  169.859   12.061   22.476   3.1154   27.693   4.7129   18.428   4.1519  187.241   16.617  151.947   18.215 35.29478 24.65575 
1 1 1   30    6    7 o  135.288   14.724   14.440   2.9997   14.430   4.5571   14.447   3.9847  132.407   23.338  133.656   20.100 -1.248322 30.80098 
1 1 1   30    6    8 o  342.390   8.4723   90.307   4.4401  112.558   6.4974   70.813   6.0817  381.348   11.131  301.800   13.165 79.54733 17.24054 
1 1 1   30    6    9 o  101.671   20.183   8.4695   3.0301   7.3466   4.5262   9.3815   4.0789   93.812   28.778  105.596   25.520 -11.78384 38.46344 
1 1 1   30    6   10 o  126.071   16.724   12.682   3.1476   11.007   4.6585   14.089   4.2697  113.958   27.103  131.172   22.048 -17.21385 34.93820 
1 1 1   30    6   11 o  110.318   20.157   9.9420   3.2782   8.7678   5.5832   10.560   4.0498  101.754   32.085  112.429   24.246 -10.67541 40.21593 
1 1 1   30    6   12 o  192.090   12.218   28.757   3.5737   31.132   5.2526   26.710   4.8763  198.072   17.506  183.327   17.594 14.74513 24.81912 
1 1 1   30    6   13 o  117.232   19.448   11.164   3.3674   12.939   4.8815   9.5528   4.6514  123.751   26.565  105.759   28.213 17.99222 38.75151 
1 1 1   30    6   14 o  166.695   21.587   22.572   5.3785   22.572   5.3785   0.0000   0.0000  166.695   21.587  ?   ?  0.000000 21.58688 
1 1 1   30    6   15 o   83.006   30.460   5.0273   5.0704   5.0273   5.0704   0.0000   0.0000   83.006   30.460  ?   ?  0.000000 30.46026 
1 1 1   30    6   16 f   99.097   22.870   8.2145   3.3986   15.110   5.3860   3.6526   4.3808  133.375   27.302   74.329   28.108 59.04593 39.18484 
1 1 1   30    6   17 o   35.501   16.953  -3.2980   2.5800  -2.9647   5.5576  -3.3896   2.9129   59.198   27.129   38.456   18.265 20.74153 32.70433 
1 1 1   30    6   18 o  136.928   14.265   14.816   2.9459   19.599   6.0400   13.323   3.3745  152.352   26.884  128.712   17.589 23.64015 32.12663 
1 1 1   30    6   19 o  232.213   9.7278   41.707   3.4576   46.005   6.6959   40.144   4.0375  240.049   18.363  227.016   11.659 13.03255 21.75158 
1 1 1   30    6   20 o   60.413   22.673   2.3458   2.8387  -5.4951   6.1679   4.4529   3.1974   57.513   27.093   74.486   24.355 -16.97309 36.43093 
1 1 1   30    6   21 o  213.031   10.795   35.297   3.5085   48.251   7.2225   31.296   4.0139  245.020   19.417  199.760   13.202 45.26050 23.48024 
1 1 1   30    6   22 o   53.215   22.681   0.3301   3.2511  -5.2046   9.7599   1.0209   3.4480   75.296   35.014   57.431   23.845 17.86570 42.36284 
1 1 1   30    6   23 o   82.281   23.787   5.7026   3.1652   18.331   7.3477   2.8253   3.5073  142.122   34.193   66.079   25.111 76.04311 42.42315 
1 1 1   30    6   24 o   89.132   23.494   6.7560   3.2506  -7.7377   7.4967   10.112   3.6074   60.654   28.945  109.721   22.242 -49.06722 36.50378 
1 1 1   30    6   25 o  119.710   18.910   11.744   3.3499   13.652   7.8642   11.321   3.7026  120.258   38.096  116.391   21.578 3.867767 43.78275 
1 1 1   30    6   26 o   48.517   17.786   1.5688   1.7282   7.2547   7.1791   1.2191   1.7806   94.796   35.950   46.332   17.824 48.46416 40.12584 
1 1 1   30    6   27 o  172.060   10.035   23.079   2.6313   25.615   6.9631   22.657   2.8421  171.980   27.369  170.171   10.970 1.808716 29.48559 
1 1 1   30    6   28 o   46.318   18.625   0.9411   2.0219   1.1503   3.5527   0.8409   2.4590   57.975   24.149   49.172   20.251 8.802589 31.51629 
1 1 1   30    6   29 o  149.074   10.739   17.425   2.4340   16.190   4.2475   18.029   2.9699  139.383   20.524  150.826   12.991 -11.44298 24.28989 
1 1 1   30    6   30 o  162.283   9.5153   20.546   2.3532   18.226   3.9666   21.806   2.9232  149.360   17.695  166.468   11.544 -17.10799 21.12738 
1 1 1   30    6   31 o  126.626   13.655   12.826   2.6047   11.370   3.7373   14.201   3.6322  115.337   21.972  131.012   18.639 -15.67422 28.81267 
1 1 1   30    6   32 o  113.108   13.042   10.239   2.2165   13.807   3.9491   8.5976   2.6781  127.657   20.937  101.601   17.874 26.05637 27.52890 
1 1 1   30    6   33 f   57.118   20.552   2.4458   2.2925   3.7125   4.4006   1.9739   2.6857   71.609   27.887   56.110   21.804 15.49876 35.39970 
1 1 1   30    6   34 o  125.037   12.838   12.535   2.4220   13.181   4.2638   12.226   2.9430  122.131   23.663  121.898   16.172 0.2321701 28.66179 
1 1 1   30    6   35 o   81.314   19.058   5.7056   2.3306   2.3417   3.9769   7.4652   2.8763   63.415   25.893   92.392   20.836 -28.97697 33.23502 
1 1 1   30    6   36 o  105.041   17.186   9.2805   2.6675   7.4934   5.3016   9.8863   3.0867   88.016   31.298  107.147   19.541 -19.13103 36.89735 
1 1 1   30    6   37 o  136.459   12.921   15.029   2.6666   13.420   4.1082   16.200   3.5055  122.619   22.726  139.352   16.772 -16.73292 28.24438 
1 1 1   30    7    0 o  197.591   19.662   31.246   5.8114   31.246   5.8114   31.246   5.8114  197.591   19.662  197.591   19.662 0.000000 0.000000 
1 1 1   30    7    1 o  158.193   20.664   20.169   4.8840   0.0000   0.0000   20.169   4.8840  ?   ?   158.193   20.664 0.000000 20.66417 
1 1 1   30    7    2 o  225.893   10.734   39.452   3.7115   34.804   6.8984   41.345   4.4030  207.814   22.023  230.502   12.527 -22.68872 25.33635 
1 1 1   30    7    3 o  149.914   31.631   19.294   7.0300   19.294   7.0300   0.0000   0.0000  149.914   31.631  ?   ?  0.000000 31.63104 
1 1 1   30    7    4 f  189.718   26.676   29.750   7.5325   29.750   7.5325   0.0000   0.0000  189.718   26.676  ?   ?  0.000000 26.67625 
1 1 1   30    7    5 o  137.820   33.680   16.583   7.0447   16.583   7.0447   0.0000   0.0000  137.820   33.680  ?   ?  0.000000 33.68037 
1 1 1   30    7    6 o  277.754   9.0237   59.479   3.8363   64.418   5.4734   54.710   5.3786  288.113   12.412  265.260   13.247 22.85251 18.15313 
1 1 1   30    7    7 o  276.754   9.1576   59.069   3.8792   62.929   5.4958   55.237   5.4764  284.677   12.613  266.113   13.489 18.56418 18.46709 
1 1 1   30    7    8 o  289.773   9.0710   64.754   4.0233   76.460   6.0097   55.246   5.4161  313.805   12.512  266.503   13.278 47.30234 18.24396 
1 1 1   30    7    9 o  197.706   11.674   30.399   3.5172   29.073   5.1631   31.548   4.8043  191.308   17.838  200.112   15.814 -8.803589 23.83864 
1 1 1   30    7   10 o  215.827   11.239   36.172   3.7000   42.881   5.4575   30.465   5.0334  233.632   15.347  196.191   16.927 37.44107 22.84820 
1 1 1   30    7   11 o  144.082   16.981   16.534   3.6730   12.075   6.0730   19.106   4.6121  117.683   32.596  153.903   20.055 -36.21947 38.27116 
1 1 1   30    7   12 o  238.913   10.747   44.179   3.9300   42.447   5.6288   45.825   5.4896  232.128   15.939  241.647   14.915 -9.518829 21.82885 
1 1 1   30    7   13 o   87.301   30.091   6.0373   4.8760   6.0373   4.8760   0.0000   0.0000   87.301   30.091  ?   ?  0.000000 30.09126 
1 1 1   30    7   14 o   86.494   24.410   6.2525   3.3725   9.6635   5.1433   3.6799   4.4668  105.894   30.235   74.882   28.367 31.01208 41.45886 
1 1 1   30    7   15 o   58.681   21.272   2.3594   2.4620   5.0359   5.0602   1.5293   2.8180   82.958   30.431   55.962   22.158 26.99554 37.64349 
1 1 1   30    7   16 o  143.746   17.406   16.535   3.7515   18.586   5.7163   14.983   4.9722  148.828   26.042  133.654   25.230 15.17360 36.25917 
1 1 1   30    7   17 o  113.298   16.041   10.279   2.7041   11.930   5.7114   9.8021   3.0700  116.676   31.323  109.656   18.978 7.019974 36.62335 
1 1 1   30    7   18 o  295.349   8.4428   67.288   3.8167   67.383   7.0009   67.248   4.5528  292.359   15.702  294.765   10.091 -2.405121 18.66506 
1 1 1   30    7   19 o   66.045   22.618   3.3220   2.7529   9.4242   6.1884   1.8164   3.0739  104.188   33.874   58.906   23.199 45.28212 41.05703 
1 1 1   30    7   20 o  177.320   11.993   24.573   3.2360   33.866   7.0322   22.077   3.6448  203.110   23.027  167.264   14.376 35.84579 27.14610 
1 1 1   30    7   21 o  134.025   15.861   14.340   3.1906   9.7787   6.8893   15.585   3.5999  105.756   35.782  139.289   17.254 -33.53351 39.72493 
1 1 1   30    7   22 o  102.883   21.108   8.8207   3.2125   3.1472   9.0016   9.6487   3.4389   88.790   37.790  107.516   21.646 -18.72628 43.55000 
1 1 1   30    7   23 o   73.006   24.029   4.2939   3.1103  -4.3571   7.1570   6.3082   3.4535   64.636   30.033   86.177   24.828 -21.54119 38.96653 
1 1 1   30    7   24 f   72.291   23.934   4.2060   3.0842   4.5112   7.0167   4.1329   3.4336   85.732   34.617   72.738   25.241 12.99405 42.84211 
1 1 1   30    7   25 o  159.442   14.932   20.225   3.6016   18.833   9.5436   20.456   3.8892  137.913   41.681  159.867   16.114 -21.95419 44.68768 
1 1 1   30    7   26 o   52.528   22.686   0.0946   3.3337   2.0084   8.5377  -0.2496   3.6211   83.148   36.107   53.305   23.324 29.84380 42.98550 
1 1 1   30    7   27 o  100.007   28.255   8.8898   4.5162   5.9463   6.5684   11.529   6.2197   88.295   34.158  111.441   33.642 -23.14594 47.94346 
1 1 1   30    7   28 o   45.495   20.094  -0.4972   2.7456  -1.6099   3.3276   1.8757   4.8594   46.453   21.176   67.586   28.205 -21.13254 35.26954 
1 1 1   30    7   29 o   62.692   18.398   3.2547   1.8808   3.2259   3.5067   3.2664   2.2284   67.198   25.204   63.327   20.302 3.871170 32.36401 
1 1 1   30    7   30 o   87.090   15.688   6.2226   2.0143   6.6730   3.6286   6.0220   2.4217   87.094   25.553   84.444   19.174 2.649597 31.94679 
1 1 1   30    7   31 o   35.168   16.016  -1.0143   1.8979  -5.1397   3.7066   0.4515   2.2095   40.701   19.662   44.931   18.902 -4.229843 27.27415 
1 1 1   30    7   32 o  115.636   15.943   10.927   2.7468   9.1099   4.0001   12.549   3.7785  100.656   25.834  121.377   21.104 -20.72092 33.35828 
1 1 1   30    7   33 o   49.518   19.277   1.4482   2.1021   7.6119   4.0288  -0.8577   2.4642   91.177   26.975   41.213   18.560 49.96355 32.74337 
1 1 1   30    7   34 o   65.723   20.841   3.6699   2.3532   0.3703   4.7434   4.7471   2.7103   60.357   26.545   73.658   22.201 -13.30090 34.60539 
1 1 1   30    7   35 o   40.538   18.252  -0.7765   2.3820  -4.3019   3.9085   1.3064   3.0043   43.255   20.712   53.994   22.325 -10.73871 30.45334 
1 1 1   30    7   36 o   67.252   21.600   3.9228   2.5215   5.0693   4.2138   3.2832   3.1472   75.897   27.781   64.429   23.934 11.46815 36.66872 
1 1 1   30    7   37 o   80.653   20.787   5.7841   2.5823   2.8082   5.2428   6.7373   2.9672   68.914   29.061   86.353   22.295 -17.43951 36.62817 
1 1 1   30    8    0 o   85.476   34.645   8.0733   4.4375   8.0733   4.4375   8.0733   4.4375   85.476   34.645   85.476   34.645 0.000000 0.000000 
1 1 1   30    8    1 o  185.592   14.257   26.992   4.0191   0.0000   0.0000   26.992   4.0191  ?   ?   185.592   14.257 0.000000 14.25723 
1 1 1   30    8    2 o  192.905   8.7830   28.678   2.5933   39.651   6.2123   26.362   2.8539  223.574   18.314  184.467   10.146 39.10645 20.93704 
1 1 1   30    8    3 o  158.862   28.474   21.223   6.6693   21.223   6.6693   0.0000   0.0000  158.862   28.474  ?   ?  0.000000 28.47358 
1 1 1   30    8    4 o  184.652   26.372   28.188   7.2419   28.188   7.2419   0.0000   0.0000  184.652   26.372  ?   ?  0.000000 26.37208 
1 1 1   30    8    5 o   78.321   33.125   1.6047   6.8439   1.6047   6.8439   0.0000   0.0000   78.321   33.125  ?   ?  0.000000 33.12496 
1 1 1   30    8    6 o  140.738   22.138   16.172   4.6114   16.172   4.6114   0.0000   0.0000  140.738   22.138  ?   ?  0.000000 22.13767 
1 1 1   30    8    7 o  123.747   16.716   12.224   3.0851   6.3291   4.7375   16.564   4.0653   88.710   29.674  143.614   18.957 -54.90453 35.21230 
1 1 1   30    8    8 o   57.631   22.655   1.6888   2.9263  -1.2930   4.6921   3.5868   3.7435   58.235   25.963   71.736   26.196 -13.50153 36.88253 
1 1 1   30    8    9 o   68.264   23.638   3.4767   3.0107   2.5727   4.7241   4.0950   3.9068   71.509   28.569   74.968   26.845 -3.458961 39.20261 
1 1 1   30    8   10 o  120.192   17.884   11.620   3.1898   14.980   5.0027   9.3184   4.1407  133.958   25.326  105.017   25.918 28.94070 36.23738 
1 1 1   30    8   11 o  210.366   13.213   34.576   4.2328   39.839   7.0038   31.548   5.3128  222.640   20.793  199.323   17.594 23.31738 27.23796 
1 1 1   30    8   12 o  166.053   12.723   21.563   3.2092   26.329   5.4354   19.011   3.9763  180.955   19.956  154.513   17.100 26.44214 26.28016 
1 1 1   30    8   13 o  158.221   10.719   19.468   2.5805   22.027   5.3287   18.684   2.9494  164.554   21.684  154.523   12.579 10.03116 25.06905 
1 1 1   30    8   14 o   83.089   19.056   5.6871   2.3719   17.008   5.1762   2.6781   2.6686  143.026   24.527   61.736   22.178 81.29037 33.06738 
1 1 1   30    8   15 o  154.828   11.426   18.696   2.6887   16.004   5.4174   19.576   3.0970  137.604   26.684  158.045   12.915 -20.44069 29.64542 
1 1 1   30    8   16 o   80.757   25.308   5.3558   3.4794   2.5658   5.4053   7.3297   4.5466   74.270   30.240   93.182   28.885 -18.91193 41.81905 
1 1 1   30    8   17 o  233.843   9.4436   42.261   3.3801   46.612   6.2817   40.488   4.0102  242.399   17.039  228.064   11.525 14.33516 20.57084 
1 1 1   30    8   18 o   54.929   21.938   1.3971   2.7848   6.2202   5.8636  -0.0077   3.1645   89.829   32.787   51.349   22.140 38.48005 39.56262 
1 1 1   30    8   19 o  197.984   10.892   30.498   3.2881   32.158   6.5699   29.943   3.7980  198.502   21.993  195.577   12.757 2.925308 25.42527 
1 1 1   30    8   20 o   60.090   22.700   2.2823   2.8553   7.7621   6.3443   0.8904   3.1974   96.881   34.260   55.257   22.954 41.62416 41.23915 
1 1 1   30    8   21 o   51.748   21.808   0.5108   2.9491 -16.2632   10.477   1.9544   3.0734   64.469   31.567   59.468   23.265 5.001312 39.21411 
1 1 1   30    8   22 o   79.071   25.097   5.1729   3.4117   0.0000   0.0000   5.1729   3.4117  ?   ?    79.071   25.097 0.000000 25.09681 
1 1 1   30    8   23 o   53.516   22.527   0.6251   3.1409  -7.4427   10.743   1.3791   3.2844   75.411   35.595   57.802   23.558 17.60897 42.68470 
1 1 1   30    8   24 o  168.521   13.331   22.395   3.4105   35.504   7.4799   18.954   3.8321  206.184   24.159  153.712   16.548 52.47177 29.28331 
1 1 1   30    8   25 o   58.369   23.321   1.7177   3.1483 -11.8107   6.7726   5.4470   3.5559   51.087   25.089   80.500   25.629 -29.41306 35.86544 
1 1 1   30    8   26 o  190.115   13.121   28.506   3.7948   30.172   7.1700   27.858   4.4725  188.270   25.540  186.700   15.799 1.570786 30.03201 
1 1 1   30    8   27 o  106.372   20.123   9.4687   3.1563   9.4687   3.1563   0.0000   0.0000  106.372   20.123  ?   ?  0.000000 20.12279 
1 1 1   30    8   28 o   76.575   21.232   4.9839   2.5753   4.2371   3.2733   6.1970   4.1719   72.219   24.663   84.715   27.826 -12.49587 37.18322 
1 1 1   30    8   29 o  147.237   12.875   17.192   2.8724   18.754   3.7531   14.983   4.4629  152.251   16.362  132.595   22.812 19.65608 28.07344 
1 1 1   30    8   30 o   38.076   17.948  -2.6376   2.7148  -0.9870   3.5966  -4.8236   4.1390   50.181   22.526   44.596   21.344 5.585361 31.03166 
1 1 1   30    8   31 o   44.914   20.167  -0.8936   2.8852  -0.8829   3.8491  -0.9073   4.3590   52.104   23.352   55.306   24.814 -3.202465 34.07424 
1 1 1   30    8   32 o   52.225   21.188   1.2877   2.6422  -2.5595   4.0102   4.2387   3.5123   48.373   22.478   71.860   25.483 -23.48689 33.97990 
1 1 1   30    8   33 o   54.767   22.425   1.4066   2.9937   6.6303   4.0998  -4.5601   4.3816   85.294   27.558   46.299   22.104 38.99588 35.32771 
1 1 1   30    8   34 o   93.287   17.742   7.3559   2.4408   6.3914   4.9437   7.6668   2.8067   83.734   30.175   94.128   20.092 -10.39417 36.25258 
1 1 1   30    8   35 o   35.568   16.531  -1.5892   2.1706  -2.1099   4.1598  -1.3944   2.5445   49.821   23.061   39.758   18.270 10.06287 29.42125 
1 1 1   30    8   36 o   47.494   19.478   0.9983   2.2631   6.1478   4.2694  -1.0140   2.6689   81.218   28.148   42.005   19.077 39.21240 34.00338 
1 1 1   30    8   37 o   91.850   19.223   7.3419   2.6158   1.8104   5.7099   8.8111   2.9427   67.345   29.383  100.480   19.838 -33.13508 35.45261 
1 1 1   30    9    0 o  111.089   24.293   10.889   3.6174   10.889   3.6174   10.889   3.6174  111.089   24.293  111.089   24.293 0.000000 0.000000 
1 1 1   30    9    1 o  108.592   13.570   9.3124   2.2064   10.306   4.3676   8.9721   2.5566  110.550   26.210  105.848   16.303 4.701889 30.86677 
1 1 1   30    9    3 o  166.635   23.351   22.682   5.7924   22.682   5.7924   0.0000   0.0000  166.635   23.351  ?   ?  0.000000 23.35139 
1 1 1   30    9    4 o  219.605   21.301   38.776   7.0698   38.776   7.0698   0.0000   0.0000  219.605   21.301  ?   ?  0.000000 21.30061 
1 1 1   30    9    5 o  139.981   32.387   17.016   6.8014   17.016   6.8014   0.0000   0.0000  139.981   32.387  ?   ?  0.000000 32.38677 
1 1 1   30    9    6 o  120.369   35.911   12.762   7.1178   12.762   7.1178   0.0000   0.0000  120.369   35.911  ?   ?  0.000000 35.91068 
1 1 1   30    9    7 o  135.305   36.008   16.291   7.5885   16.291   7.5885   0.0000   0.0000  135.305   36.008  ?   ?  0.000000 36.00784 
1 1 1   30    9    8 o  139.833   36.037   17.421   7.7616   17.421   7.7616   0.0000   0.0000  139.833   36.037  ?   ?  0.000000 36.03743 
1 1 1   30    9    9 o  126.705   20.359   13.059   3.8148   15.642   8.2104   12.348   4.3080  131.665   38.383  121.839   23.954 9.826546 45.24436 
1 1 1   30    9   10 f  132.012   14.041   13.740   2.7936   12.800   5.5966   14.052   3.2240  121.733   30.185  132.894   16.184 -11.16072 34.24990 
1 1 1   30    9   11 o   55.564   20.043   2.1112   2.1818   3.4343   6.3061   1.9312   2.3254   81.360   32.829   55.202   20.560 26.15799 38.73583 
1 1 1   30    9   12 o  181.926   9.5987   25.636   2.6634   27.783   5.6316   25.018   3.0228  185.788   20.125  179.359   11.065 6.428101 22.96648 
1 1 1   30    9   13 f   96.723   17.029   7.5722   2.4290   11.550   5.3145   6.5219   2.7309  115.497   29.847   88.736   20.516 26.76073 36.21853 
1 1 1   30    9   14 o   50.062   20.454   0.8645   2.4835  -1.6216   9.1850   1.0606   2.5796   80.128   35.981   51.817   20.966 28.31073 41.64368 
1 1 1   30    9   15 o  106.836   18.139   9.2666   2.8602  -2.8395   9.2634   10.542   3.0071   78.039   35.480  114.232   17.777 -36.19300 39.68398 
1 1 1   30    9   16 o  147.962   20.416   17.799   4.5006   9.5716   9.6218   20.103   5.0920  109.161   41.566  156.775   21.811 -47.61374 46.94055 
1 1 1   30    9   17 o   75.971   23.495   4.7252   3.0100   0.0600   9.7486   5.2168   3.1646   85.293   37.758   79.404   24.003 5.889236 44.74117 
1 1 1   30    9   18 o   46.196   20.405  -0.6343   2.8320  -5.4935   9.2216  -0.1282   2.9758   72.929   33.954   49.369   21.378 23.55976 40.12346 
1 1 1   30    9   19 o   34.909   16.998  -4.9681   2.9175   3.3439   9.6460  -5.8050   3.0608   91.775   39.091   34.616   16.973 57.15880 42.61666 
1 1 1   30    9   20 o   38.234   18.029  -2.8308   2.7440   5.9552   6.3400  -4.8561   3.0439   89.516   33.823   36.255   17.586 53.26166 38.12167 
1 1 1   30    9   21 o  109.981   18.511   9.8835   3.0055   15.652   6.8756   8.5209   3.3417  131.380   33.948  100.661   22.278 30.71886 40.60492 
1 1 1   30    9   22 o  126.064   17.064   12.824   3.2079   13.584   7.5292   12.655   3.5459  120.913   37.120  124.379   19.247 -3.465660 41.81372 
1 1 1   30    9   23 o  126.567   18.210   13.032   3.4262   41.919   10.505   9.5942   3.6244  217.568   32.546  106.474   22.918 111.0937 39.80587 
1 1 1   30    9   24 o   92.824   22.464   7.3221   3.1572   2.4976   6.7827   8.6566   3.5672   78.456   33.068  100.649   23.570 -22.19323 40.60841 
1 1 1   30    9   25 o  111.355   21.275   10.402   3.4940   10.887   6.7351   10.223   4.0871  108.612   35.340  108.729   25.071 -0.1170044 43.32985 
1 1 1   30    9   26 o  161.513   17.908   21.177   4.3526   29.806   7.0407   15.840   5.5377  187.092   25.229  134.081   27.891 53.01164 37.60925 
1 1 1   30    9   27 o  211.138   9.6773   34.644   3.1275   33.065   3.4194   42.729   7.7356  205.576   10.906  226.060   22.661 -20.48376 25.14911 
1 1 1   30    9   28 o  122.482   20.323   12.548   3.6764   9.9846   6.5731   13.714   4.4350  103.335   34.951  126.291   23.816 -22.95651 42.29433 
1 1 1   30    9   29 o   76.615   21.560   5.0178   2.6350   6.2167   3.3186   2.9726   4.3346   84.445   24.341   69.132   27.446 15.31359 36.68470 
1 1 1   30    9   30 o  151.895   13.033   18.342   3.0007   20.396   3.9485   15.534   4.6168  158.503   16.518  134.391   23.288 24.11249 28.55100 
1 1 1   30    9   31 o   99.571   20.344   8.4562   2.9958   4.9177   4.0234   12.859   4.4880   76.738   27.268  120.528   25.141 -43.79018 37.08922 
1 1 1   30    9   32 o   58.478   22.910   2.1402   2.9833   0.9177   3.9914   3.6876   4.4907   58.604   25.058   71.684   28.101 -13.07998 37.65066 
1 1 1   30    9   33 o   45.335   20.051  -0.3645   2.7431  -0.4069   4.0548  -0.3287   3.7248   54.258   24.167   52.455   23.274 1.803173 33.55198 
1 1 1   30    9   34 o   56.325   22.785   1.7410   3.0459  -1.7548   4.9206   3.9125   3.8781   55.357   25.427   70.108   26.462 -14.75136 36.69817 
1 1 1   30    9   35 o   71.877   22.882   4.5618   2.8346   3.9334   4.1015   5.1364   3.9219   70.391   27.058   76.013   26.931 -5.622040 38.17604 
1 1 1   30    9   36 o   97.055   20.632   8.2899   2.9705   6.8503   4.2418   9.6754   4.1614   84.784   28.069  101.040   26.558 -16.25651 38.64165 
1 1 1   30   10    0 o   46.994   25.932   2.4357   2.7151   2.4357   2.7151   2.4357   2.7151   46.994   25.932   46.994   25.932 0.000000 0.000000 
1 1 1   30   10    1 o  240.387   7.4517   44.455   2.7418   47.350   4.7320   42.992   3.3641  246.603   12.578  236.055   9.3106 10.54788 15.64930 
1 1 1   30   10    3 o  133.179   26.109   14.861   5.1321   14.861   5.1321   0.0000   0.0000  133.179   26.109  ?   ?  0.000000 26.10944 
1 1 1   30   10    4 o   83.869   32.037   4.6493   5.7271   4.6493   5.7271   0.0000   0.0000   83.869   32.037  ?   ?  0.000000 32.03652 
1 1 1   30   10    5 o  166.788   26.296   23.124   6.4907   23.124   6.4907   0.0000   0.0000  166.788   26.296  ?   ?  0.000000 26.29589 
1 1 1   30   10    6 o  150.347   30.091   19.322   6.6830   19.322   6.6830   0.0000   0.0000  150.347   30.091  ?   ?  0.000000 30.09092 
1 1 1   30   10    7 o  252.966   13.835   50.023   5.3365   50.023   5.3365   0.0000   0.0000  252.966   13.835  ?   ?  0.000000 13.83478 
1 1 1   30   10    8 o  167.670   11.030   21.863   2.8149   21.641   4.8436   21.976   3.4589  164.032   19.685  167.416   13.616 -3.383926 23.93523 
1 1 1   30   10    9 o  143.979   12.912   16.250   2.8152   22.625   5.0319   13.346   3.3965  167.592   20.012  128.984   17.668 38.60805 26.69543 
1 1 1   30   10   10 o  283.826   11.234   62.436   4.8803   0.0000   0.0000   62.436   4.8803  ?   ?   283.826   11.234 0.000000 11.23364 
1 1 1   30   10   11 o   82.253   18.438   5.5557   2.2639   6.6399   5.2410   5.3070   2.5102   90.818   31.203   80.076   20.418 10.74150 37.28955 
1 1 1   30   10   12 o   68.232   20.229   3.7817   2.2639   4.9270   4.9762   3.4828   2.5422   82.221   30.175   66.620   21.714 15.60023 37.17579 
1 1 1   30   10   13 o   78.705   18.846   5.1056   2.2403   16.952   5.1771   2.3764   2.4850  142.679   24.594   58.889   21.367 83.78981 32.57977 
1 1 1   30   10   14 o  119.404   13.869   11.276   2.4875   11.096   5.2093   11.329   2.8312  113.092   29.709  119.090   15.931 -5.998207 33.71115 
1 1 1   30   10   15 o   99.740   17.227   8.0623   2.5349   17.427   5.4467   5.4731   2.8640  144.070   25.639   81.051   22.359 63.01842 34.01904 
1 1 1   30   10   16 f  253.847   10.806   49.960   4.1987   55.004   6.0904   45.392   5.7963  264.329   15.116  239.695   15.889 24.63451 21.93055 
1 1 1   30   10   17 f  144.660   13.149   16.458   2.8796   16.341   5.7681   16.496   3.3234  137.934   28.271  144.158   15.296 -6.223480 32.14312 
1 1 1   30   10   18 o  153.259   13.081   18.460   3.0392   20.550   5.9874   17.735   3.5274  156.232   25.948  149.354   15.663 6.877686 30.30935 
1 1 1   30   10   19 o  158.024   13.099   19.631   3.1398   14.898   6.3745   21.147   3.6079  129.288   32.304  163.553   14.564 -34.26529 35.43533 
1 1 1   30   10   20 o  124.825   15.928   12.479   2.9739   13.649   6.4413   12.163   3.3526  123.001   33.367  122.292   18.488 0.7088623 38.14643 
1 1 1   30   10   21 o   86.127   22.457   6.2640   2.9910   9.4081   6.7937   5.5080   3.3312  103.587   35.530   81.051   24.655 22.53576 43.24602 
1 1 1   30   10   22 o  148.350   14.723   17.485   3.2989   22.103   7.6395   16.427   3.6575  156.891   32.865  142.856   17.065 14.03505 37.03139 
1 1 1   30   10   23 o   57.429   23.558   1.2850   3.3115  -1.8089   9.2701   1.7376   3.5454   78.295   35.556   60.845   24.593 17.45041 43.23277 
1 1 1   30   10   24 o   74.153   24.110   4.5206   3.1349   8.3523   6.5950   3.4021   3.5632   98.077   34.904   68.891   25.491 29.18527 43.22157 
1 1 1   30   10   25 o   72.481   26.539   3.9362   3.8460  -1.0798   5.9766   7.4813   5.0245   64.841   29.077   92.509   30.545 -27.66740 42.17184 
1 1 1   30   10   26 o   45.002   20.762  -2.1271   3.3315  -1.1908   6.6149  -2.4453   3.8562   67.463   30.393   48.183   22.268 19.27978 37.67692 
1 1 1   30   10   27 o   40.460   18.179  -0.8697   2.3485  -1.0656   2.5748   0.1002   5.7287   41.841   18.895   66.191   29.140 -24.34952 34.73003 
1 1 1   30   10   28 f  205.009   9.1548   32.639   2.8727   34.317   3.5514   29.464   4.8861  209.211   11.130  190.843   16.902 18.36830 20.23740 
1 1 1   30   10   29 o  110.290   23.093   10.514   3.7735   4.7299   6.5629   13.371   4.6120   82.763   33.458  123.467   25.256 -40.70322 41.92002 
1 1 1   30   10   30 o   65.791   23.066   3.4314   2.8708   6.5667   3.8509  -0.4907   4.3071   85.952   26.574   56.213   24.980 29.73859 36.47206 
1 1 1   30   10   31 o  182.124   12.079   26.265   3.3482   27.541   4.3625   24.434   5.2230  184.500   15.594  170.495   20.420 14.00459 25.69357 
1 1 1   30   10   32 o   92.659   22.593   7.5781   3.1754   5.3400   4.1129   10.881   4.9962   78.369   27.599  107.080   29.528 -28.71085 40.41793 
1 1 1   30   10   33 o   70.679   23.193   4.3134   2.8985   2.0839   4.1589   6.4191   4.0418   63.313   26.230   83.683   27.384 -20.37070 37.91959 
1 1 1   30   10   34 o   52.170   22.231   0.7333   3.1222  -1.6459   4.9839   2.2702   4.0056   55.822   25.622   63.063   25.895 -7.241451 36.42813 
1 1 1   30   10   35 o  162.270   12.614   21.131   3.1085   17.690   4.3694   24.657   4.4233  143.120   20.534  172.226   17.001 -29.10631 26.65888 
1 1 1   30   10   36 o   85.726   22.353   6.6461   2.9633   3.9897   4.1201   9.4928   4.2651   70.223   27.085   99.447   27.224 -29.22437 38.40281 
1 1 1   30   11    0 o  281.254   10.052   61.062   4.3149   61.062   4.3149   61.062   4.3149  281.254   10.052  281.254   10.052 0.000000 0.000000 
1 1 1   30   11    1 o   57.864   16.592   2.6944   1.5456   1.1887   3.1482   3.1726   1.7742   56.604   23.066   62.593   17.718 -5.988113 29.08597 
1 1 1   30   11    3 o  175.367   18.162   24.517   4.8045   24.517   4.8045   0.0000   0.0000  175.367   18.162  ?   ?  0.000000 18.16247 
1 1 1   30   11    4 o  159.697   22.829   20.847   5.4214   20.847   5.4214   0.0000   0.0000  159.697   22.829  ?   ?  0.000000 22.82866 
1 1 1   30   11    5 o   96.629   32.141   7.7231   5.5594   7.7231   5.5594   0.0000   0.0000   96.629   32.141  ?   ?  0.000000 32.14057 
1 1 1   30   11    6 o  107.473   15.407   9.2158   2.4619   16.828   5.9930   7.6704   2.7003  140.527   28.829   96.904   18.884 43.62267 34.46342 
1 1 1   30   11    7 o  216.822   8.9876   36.268   2.9827   47.239   5.0012   30.211   3.7160  245.935   13.336  196.812   12.399 49.12347 18.20890 
1 1 1   30   11    8 o  150.836   12.185   17.782   2.7892   18.614   4.8260   17.364   3.4178  151.207   21.453  148.166   15.290 3.041061 26.34466 
1 1 1   30   11    9 o   68.482   21.593   3.7448   2.5288   3.5042   4.7333   3.8409   2.9915   75.196   29.023   70.361   23.580 4.835022 37.39465 
1 1 1   30   11   10 o  112.096   15.803   10.041   2.6363   9.8977   4.9379   10.099   3.1178  107.208   29.270  111.441   18.957 -4.233162 34.87250 
1 1 1   30   11   11 o  130.012   14.583   13.377   2.8519   8.1151   5.1404   15.717   3.4279   97.799   30.779  140.528   16.236 -42.72837 34.79887 
1 1 1   30   11   12 o   76.681   20.016   4.8613   2.3744   4.7369   6.6029   4.8798   2.5446   86.606   34.036   76.799   21.030 9.806953 40.00844 
1 1 1   30   11   13 o  137.415   12.237   14.795   2.5470   19.108   5.3097   13.506   2.9027  152.056   23.577  130.538   14.789 21.51843 27.83141 
1 1 1   30   11   14 o  104.551   16.056   8.7828   2.4873   7.4374   5.2902   9.1646   2.8182   94.370   31.351  106.250   17.970 -11.88018 36.13611 
1 1 1   30   11   15 o  133.044   13.313   13.944   2.6747   20.390   5.4331   11.883   3.0728  157.136   23.295  121.603   16.972 35.53260 28.82155 
1 1 1   30   11   16 o  123.639   19.006   12.425   3.4816   20.266   5.5645   7.3806   4.4632  156.201   24.046   93.179   28.576 63.02216 37.34650 
1 1 1   30   11   17 o   64.150   28.531  -1.0170   5.6294  -1.0170   5.6294   0.0000   0.0000   64.150   28.531  ?   ?  0.000000 28.53053 
1 1 1   30   11   18 o  171.094   11.751   22.877   3.0587   24.427   5.9755   22.327   3.5606  171.870   23.316  168.305   13.947 3.564758 27.16937 
1 1 1   30   11   19 o  109.191   18.207   9.7214   2.9358   4.9291   6.1724   11.123   3.3374   85.075   33.057  116.517   19.395 -31.44245 38.32656 
1 1 1   30   11   20 o  104.880   19.388   9.0649   2.9978   14.703   6.4976   7.5401   3.3789  127.623   33.013   94.214   23.508 33.40985 40.52734 
1 1 1   30   11   21 o  130.683   15.818   13.679   3.0997   16.166   7.0500   13.083   3.4511  132.827   34.402  126.828   18.308 5.998482 38.97003 
1 1 1   30   11   22 o   59.519   23.162   2.0544   3.0338   7.3614   6.9245   0.7937   3.3750   95.142   35.470   55.740   23.401 39.40151 42.49372 
1 1 1   30   11   23 o  106.765   21.993   9.6168   3.4744   18.626   9.5387   8.2387   3.7307  136.766   41.746   97.668   24.885 39.09795 48.60014 
1 1 1   30   11   24 o  103.915   26.144   9.4395   4.1547   7.2013   6.3000   11.162   5.5269   92.797   33.968  110.874   31.234 -18.07682 46.14524 
1 1 1   30   11   25 o  155.908   15.358   19.463   3.6174   26.073   6.3475   16.284   4.4022  175.343   24.304  139.695   21.259 35.64867 32.29004 
1 1 1   30   11   26 o  141.691   17.442   16.342   3.7028   23.889   6.7059   13.032   4.4413  165.193   27.487  122.846   24.480 42.34696 36.80775 
1 1 1   30   11   27 f  178.106   10.041   24.774   2.7262   24.811   3.0013   24.602   6.5189  177.852   11.080  168.332   26.150 9.520889 28.40030 
1 1 1   30   11   28 o   47.175   19.698   0.6163   2.3717  -0.1306   2.8628   2.2507   4.2349   47.735   20.817   65.711   26.762 -17.97546 33.90506 
1 1 1   30   11   29 o  144.582   17.876   17.173   3.8716   10.698   6.5227   20.695   4.8107  105.334   34.803  157.308   20.464 -51.97444 40.37410 
1 1 1   30   11   30 o   96.296   20.943   7.9718   2.9989   6.5310   3.8809   10.107   4.7248   85.478   26.719  104.540   28.668 -19.06162 39.18879 
1 1 1   30   11   31 o   64.818   23.849   3.2124   3.1114   1.8830   4.0806   5.0588   4.8089   62.660   25.972   78.388   29.493 -15.72884 39.29847 
1 1 1   30   11   32 o   44.820   20.548  -1.5592   3.1924  -6.1586   4.1328   5.2450   5.0267   41.602   20.251   79.078   30.060 -37.47660 36.24498 
1 1 1   30   11   33 o   60.093   22.672   2.6380   2.8461   3.8951   4.1580   1.5297   3.9041   70.762   27.233   59.820   25.144 10.94193 37.06563 
1 1 1   30   11   34 o  155.605   14.327   19.670   3.3740   15.883   5.0964   22.625   4.5018  131.177   26.298  164.150   18.225 -32.97304 31.99609 
1 1 1   30   11   35 o   68.900   23.530   4.1244   2.9794   2.0579   4.1494   6.3236   4.2806   62.394   26.053   82.029   28.199 -19.63518 38.39190 
1 1 1   30   12    0 o  160.545   12.908   20.263   3.1248   20.263   3.1248   20.263   3.1248  160.545   12.908  160.545   12.908 0.000000 0.000000 
1 1 1   30   12    1 o   60.567   23.127   2.1854   2.9838   2.1854   2.9838   0.0000   0.0000   60.567   23.127  ?   ?  0.000000 23.12657 
1 1 1   30   12    3 o  206.820   14.983   33.628   4.7110   33.628   4.7110   0.0000   0.0000  206.820   14.983  ?   ?  0.000000 14.98334 
1 1 1   30   12    4 o  147.989   11.425   17.076   2.5680   17.534   4.9031   16.903   3.0145  146.222   22.639  146.680   13.581 -0.4579926 26.40029 
1 1 1   30   12    5 o   75.269   29.571   3.2574   4.9830   3.2574   4.9830   0.0000   0.0000   75.269   29.571  ?   ?  0.000000 29.57148 
1 1 1   30   12    6 o   76.736   19.913   4.8587   2.3591   14.588   5.4623   2.6277   2.6157  130.806   28.119   61.204   21.960 69.60147 35.67811 
1 1 1   30   12    7 o  146.513   12.075   16.780   2.6839   17.604   4.4526   16.310   3.3636  147.408   20.271  143.443   15.570 3.965591 25.56020 
1 1 1   30   12    8 o   67.627   21.173   3.6583   2.4360  -0.4138   4.4656   5.3834   2.9065   59.210   25.905   80.552   22.635 -21.34243 34.40087 
1 1 1   30   12    9 o  171.043   11.520   22.798   2.9985   27.060   5.1066   20.555   3.7044  184.007   18.377  161.295   15.183 22.71194 23.83809 
1 1 1   30   12   10 o   85.693   20.258   6.0832   2.6152   7.8248   4.8754   5.3797   3.0987   96.110   29.931   80.569   23.606 15.54128 38.12013 
1 1 1   30   12   11 o   94.621   21.634   7.4559   3.0650   10.494   6.8365   6.6916   3.4289  109.615   35.603   89.200   24.406 20.41451 43.16494 
1 1 1   30   12   12 o  125.415   16.338   12.574   3.0619   18.227   5.4839   10.014   3.6908  147.677   25.163  109.562   22.752 38.11502 33.92437 
1 1 1   30   12   13 o  158.377   13.284   19.699   3.1904   28.880   5.6026   15.294   3.8812  189.392   19.611  137.535   18.939 51.85690 27.26304 
1 1 1   30   12   14 o  306.650   7.7415   72.451   3.6336   86.412   6.8476   66.979   4.2869  332.656   13.448  294.340   9.5154 38.31653 16.47435 
1 1 1   30   12   15 o   56.299   21.337   1.9396   2.5281   4.7503   5.3760   1.1415   2.8646   82.315   31.135   54.167   22.030 28.14793 38.14057 
1 1 1   30   12   16 o  159.305   15.417   20.132   3.7122   19.475   5.7173   20.611   4.8811  152.257   25.430  159.117   20.520 -6.859863 32.67616 
1 1 1   30   12   17 o  131.322   14.983   13.715   2.9577   11.303   5.7452   14.585   3.4500  112.870   31.861  134.729   17.116 -21.85911 36.16781 
1 1 1   30   12   18 o  158.282   12.898   19.691   3.0975   19.788   6.1493   19.658   3.5857  152.103   27.422  157.404   15.067 -5.301239 31.28838 
1 1 1   30   12   19 o  123.693   16.436   12.302   3.0348   14.548   6.1086   11.565   3.4968  127.732   31.453  118.555   19.980 9.176781 37.26281 
1 1 1   30   12   20 o  118.056   17.578   11.312   3.0795   13.484   6.3781   10.651   3.5165  121.841   33.266  113.146   21.081 8.695427 39.38270 
1 1 1   30   12   21 o  115.944   18.471   10.997   3.1679   11.697   6.3931   10.769   3.6472  113.131   34.097  113.364   21.811 -0.2329941 40.47660 
1 1 1   30   12   22 o  116.161   20.814   11.238   3.5647   2.0423   8.8395   13.024   3.8956   84.491   36.715  125.123   21.091 -40.63230 42.34155 
1 1 1   30   12   23 f  170.311   17.799   23.464   4.5713   26.627   6.8140   20.875   6.1642  176.501   26.002  155.404   26.888 21.09633 37.40374 
1 1 1   30   12   24 f   51.600   22.373   0.0076   3.2682  -8.6969   5.9335   3.7984   3.9156   50.154   24.380   71.911   26.699 -21.75681 36.15603 
1 1 1   30   12   25 o  107.583   22.235   9.8604   3.5405   10.446   6.3536   9.5968   4.2638  105.866   34.318  104.156   26.639 1.709999 43.44333 
1 1 1   30   12   26 o  186.167   13.632   27.497   3.8576   23.983   6.5642   29.351   4.7678  165.811   26.777  190.848   16.483 -25.03685 31.44352 
1 1 1   30   12   27 o  135.053   11.961   14.416   2.4470   13.900   2.6691   17.139   6.1274  132.068   13.389  137.143   30.023 -5.074554 32.87257 
1 1 1   30   12   28 o   87.892   19.184   6.5274   2.5083   6.8029   3.0479   5.9492   4.4154   88.570   22.452   83.058   28.634 5.511757 36.38718 
1 1 1   30   12   29 o  126.424   20.407   13.488   3.8144   14.122   6.5354   13.161   4.6976  120.259   33.994  121.475   26.047 -1.215691 42.82563 
1 1 1   30   12   30 o  116.080   18.021   11.227   3.0981   11.915   4.0862   10.297   4.7513  116.402   23.739  105.103   28.718 11.29930 37.25966 
1 1 1   30   12   31 o   48.193   21.204  -0.2004   3.0291  -1.2023   3.9635   1.2063   4.6966   51.402   23.307   62.929   27.052 -11.52677 35.70746 
1 1 1   30   12   32 o   59.869   23.438   2.3632   3.1208   2.1919   4.0763   2.6057   4.8510   63.334   26.078   68.007   28.264 -4.672924 38.45637 
1 1 1   30   12   33 o  167.820   13.667   22.717   3.4801   19.824   4.4320   27.370   5.6200  152.860   19.378  178.461   20.974 -25.60103 28.55559 
1 1 1   30   12   34 o   90.967   24.094   7.5874   3.4081   8.9109   5.5952   6.8067   4.2972   93.964   32.243   84.756   28.261 9.208237 42.87509 
1 1 1   30   13    0 o  314.198   10.045   76.168   4.8197   76.168   4.8197   76.168   4.8197  314.198   10.045  314.198   10.045 0.000000 0.000000 
1 1 1   30   13    1 o  156.847   15.317   19.444   3.6304   19.444   3.6304   0.0000   0.0000  156.847   15.317  ?   ?  0.000000 15.31745 
1 1 1   30   13    3 o   49.571   18.705   1.4703   1.9375   4.8225   3.7389   0.2396   2.2654   78.256   26.361   45.075   19.061 33.18099 32.52982 
1 1 1   30   13    4 o  124.648   12.389   12.191   2.3324   16.706   4.3442   10.362   2.7646  143.495   20.349  113.750   16.348 29.74440 26.10298 
1 1 1   30   13    5 o   97.045   28.988   8.0017   4.6359   8.0017   4.6359   0.0000   0.0000   97.045   28.988  ?   ?  0.000000 28.98787 
1 1 1   30   13    6 f  129.356   13.471   13.179   2.6280   12.216   5.3425   13.487   3.0185  118.894   29.498  130.308   15.434 -11.41351 33.29185 
1 1 1   30   13    7 f  163.775   10.796   20.864   2.6910   27.462   4.4650   17.101   3.3723  186.394   15.799  146.986   15.210 39.40810 21.93025 
1 1 1   30   13    8 o  221.938   9.6720   38.069   3.2856   37.662   5.0834   38.362   4.3059  218.658   15.285  221.645   12.746 -2.986969 19.90181 
1 1 1   30   13    9 o   60.610   22.078   2.5138   2.6568   4.8695   4.5866   1.3242   3.2592   80.677   29.066   57.794   23.501 22.88300 37.37805 
1 1 1   30   13   10 o  291.295   8.8614   65.491   3.9510   79.022   6.1916   56.197   5.1315  318.564   12.698  268.724   12.476 49.84021 17.80137 
1 1 1   30   13   11 o  235.052   11.370   42.884   4.0906   44.611   8.2166   42.314   4.7166  233.628   23.288  232.530   13.307 1.098267 26.82153 
1 1 1   30   13   12 o  105.226   20.101   9.1133   3.1195   11.242   5.3518   8.0177   3.8391  113.485   30.257   97.121   25.500 16.36431 39.56950 
1 1 1   30   13   13 o  100.507   21.163   8.3924   3.1528   6.1703   5.2114   9.6751   3.9596   88.124   31.063  106.880   24.699 -18.75624 39.68605 
1 1 1   30   13   14 o   79.655   24.233   5.2579   3.2181   1.9481   5.2768   7.2177   4.0606   71.269   29.537   92.118   27.033 -20.84866 40.04005 
1 1 1   30   13   15 o  125.548   14.862   12.535   2.8006   7.7070   5.5415   14.192   3.2455   95.566   32.093  133.219   16.254 -37.65268 35.97384 
1 1 1   30   13   16 o  115.886   21.150   11.120   3.6133   6.6924   5.6347   14.212   4.7090   90.963   32.275  129.839   24.595 -38.87627 40.57807 
1 1 1   30   13   17 o  271.924   8.9953   57.161   3.7440   55.961   6.7035   57.706   4.5135  265.425   16.583  272.608   10.817 -7.183411 19.79944 
1 1 1   30   13   18 f  135.706   14.639   14.635   2.9926   21.653   6.1666   12.472   3.4226  159.811   26.112  123.736   18.651 36.07535 32.08853 
1 1 1   30   13   19 o  135.577   15.170   14.659   3.0942   16.968   6.1384   13.873   3.5826  138.887   29.770  130.614   18.432 8.273178 35.01396 
1 1 1   30   13   20 o   60.866   23.071   2.3805   2.9557  -1.5278   6.1602   3.5494   3.3688   65.150   29.342   69.145   24.910 -3.995392 38.48981 
1 1 1   30   13   21 o  104.023   25.784   9.3922   4.0847   16.615   6.3991   4.4253   5.3064  135.861   31.401   79.671   30.736 56.18987 43.94014 
1 1 1   30   13   22 o   99.291   29.437   8.7609   4.7940   23.821   9.5061   3.6244   5.5517  156.260   39.674   77.213   30.927 79.04645 50.30398 
1 1 1   30   13   23 o   80.447   25.278   5.4994   3.4687   0.7337   6.6278   7.2971   4.0707   72.387   31.618   91.278   27.140 -18.89148 41.66844 
1 1 1   30   13   24 o   61.560   24.137   2.2464   3.3139   11.720   6.4530  -1.1469   3.8620  111.605   34.382   51.848   23.303 59.75695 41.53522 
1 1 1   30   13   25 o   59.998   24.075   1.8795   3.3710  -3.0914   6.5673   3.6578   3.9279   62.927   29.074   70.960   26.663 -8.033169 39.44859 
1 1 1   30   13   26 o   97.246   23.726   8.2321   3.5003   5.8075   6.6652   9.1554   4.1132   87.013   34.196  101.519   26.269 -14.50614 43.12091 
1 1 1   30   13   27 o   82.518   28.909   5.8033   4.5092   4.6339   7.0056   6.6305   5.8920   83.594   34.276   88.257   32.755 -4.663467 47.40998 
1 1 1   30   13   28 o   67.582   22.030   3.7946   2.6166   0.4820   3.2417   9.9885   4.4327   52.754   22.570  104.911   27.331 -52.15671 35.44582 
1 1 1   30   13   29 o   56.255   24.077   0.7088   3.6913  -1.1884   6.4540   1.6311   4.5000   65.218   29.637   63.910   26.936 1.307247 40.04840 
1 1 1   30   13   30 o  114.640   17.897   10.976   3.0378   13.178   3.9659   7.8484   4.7255  123.529   21.770   91.588   29.586 31.94180 36.73246 
1 1 1   30   13   31 o  134.617   15.497   14.819   3.1349   13.591   4.0656   16.620   4.9234  124.936   22.067  136.674   24.432 -11.73721 32.92205 
1 1 1   30   13   32 o   69.771   24.537   4.1242   3.2499  -2.2091   4.2603   12.939   5.0260   50.303   23.303  116.766   28.395 -66.46320 36.73302 
1 1 1   30   13   33 o  154.992   16.476   19.880   3.8488   13.421   5.4453   26.329   5.4408  116.858   30.219  174.961   20.719 -58.10283 36.63962 
1 1 1   30   13   34 o  175.066   11.819   24.461   3.1484   19.943   4.3254   29.553   4.5915  153.253   18.836  189.370   15.990 -36.11725 24.70814 
1 1 1   30   14    1 o   98.565   13.152   7.6946   1.9347   9.3598   3.3769   6.8808   2.3606  106.361   21.482   91.988   17.403 14.37232 27.64699 
1 1 1   30   14    2 o   70.651   21.158   4.0611   2.4674   0.0000   0.0000   4.0611   2.4674  ?   ?    70.651   21.158 0.000000 21.15816 
1 1 1   30   14    3 o   69.431   18.965   3.9532   2.0725   2.6032   3.7178   4.5618   2.4963   66.472   25.704   74.423   21.000 -7.951202 33.19139 
1 1 1   30   14    4 o   73.199   19.343   4.4135   2.1998   4.1844   4.0395   4.5100   2.6228   75.622   27.273   74.127   21.718 1.495041 34.86386 
1 1 1   30   14    5 o   59.518   25.585   0.2146   4.2008   0.2146   4.2008   0.0000   0.0000   59.518   25.585  ?   ?  0.000000 25.58485 
1 1 1   30   14    6 o   51.099   20.530   1.1028   2.4545   2.1449   4.5787   0.6825   2.9076   68.794   27.898   52.408   21.840 16.38591 35.43026 
1 1 1   30   14    7 o   68.054   21.277   3.7177   2.4610   7.2099   4.0780   1.7176   3.0863   92.317   27.090   58.585   23.191 33.73275 35.66101 
1 1 1   30   14    8 o   88.143   19.612   6.4177   2.5778   6.9394   4.1811   6.0978   3.2740   90.763   27.624   85.321   24.041 5.441162 36.62039 
1 1 1   30   14    9 o  149.945   13.171   17.661   2.9922   15.615   4.5440   19.228   3.9759  137.645   22.333  155.218   17.014 -17.57309 28.07562 
1 1 1   30   14   10 o   68.481   23.242   3.6130   2.9068   7.5266   4.6865   1.1661   3.7057   94.199   29.347   59.868   24.777 34.33063 38.40818 
1 1 1   30   14   11 o  125.519   19.398   12.821   3.6067   12.084   7.0478   13.082   4.1980  116.114   35.959  125.529   22.684 -9.414742 42.51567 
1 1 1   30   14   12 o   48.787   21.467  -0.5512   3.1056   1.6844   5.0269  -1.9313   3.9495   69.149   28.758   50.902   23.152 18.24659 36.91895 
1 1 1   30   14   13 o   71.035   24.470   3.8841   3.2242   13.892   5.1877  -2.4141   4.1155  127.194   27.452   50.772   23.296 76.42210 36.00417 
1 1 1   30   14   14 o  108.147   21.296   9.7181   3.3998   13.732   5.5486   7.3053   4.3019  125.421   29.413   92.509   27.990 32.91145 40.60228 
1 1 1   30   14   15 o  209.318   12.736   34.318   4.0610   40.256   6.0566   29.468   5.4737  224.412   17.778  191.240   18.949 33.17128 25.98298 
1 1 1   30   14   16 o  153.797   26.079   20.050   5.9198   20.050   5.9198   0.0000   0.0000  153.797   26.079  ?   ?  0.000000 26.07876 
1 1 1   30   14   17 o  156.248   13.422   19.250   3.1789   17.582   5.9243   19.924   3.7671  142.535   28.154  158.113   15.776 -15.57828 32.27260 
1 1 1   30   14   18 o   47.964   21.003  -0.3592   2.9409  -2.3545   5.9911   0.2742   3.3756   62.445   28.445   53.723   23.010 8.722263 36.58660 
1 1 1   30   14   19 o   79.052   23.682   5.2574   3.0908   4.4959   6.2193   5.5072   3.5618   83.001   32.900   81.014   25.635 1.987373 41.70850 
1 1 1   30   14   20 o  166.204   17.382   22.265   4.3566   31.407   6.6756   15.482   5.7498  194.363   22.877  132.314   29.175 62.04875 37.07530 
1 1 1   30   14   21 o  105.971   21.529   9.4653   3.3729   7.0302   6.7601   10.272   3.8919   92.963   34.970  109.468   23.898 -16.50539 42.35543 
1 1 1   30   14   22 o   73.172   26.055   4.1810   3.6752   6.6822   10.002   3.7906   3.9517   97.760   40.603   72.009   26.805 25.75080 48.65313 
1 1 1   30   14   23 o   50.069   22.202  -0.6330   3.3842   1.0983   6.5274  -1.2695   3.9577   72.691   31.569   52.158   23.502 20.53282 39.35638 
1 1 1   30   14   24 o   49.649   22.315  -1.0904   3.5416   3.9356   6.8022  -2.9595   4.1482   81.605   33.654   48.908   22.771 32.69647 40.63379 
1 1 1   30   14   25 o   83.772   25.824   6.1070   3.6396  -0.8265   6.9310   8.7468   4.2767   69.272   31.168   98.861   27.343 -29.58880 41.46165 
1 1 1   30   14   26 o  130.389   19.433   14.143   3.7600   11.524   7.3172   15.082   4.3829  108.668   36.876  133.132   22.297 -24.46426 43.09269 
1 1 1   30   14   27 o   68.116   27.438   2.7528   4.3967   2.7145   6.6758   2.7821   5.8429   76.507   32.552   73.793   30.873 2.714378 44.86432 
1 1 1   30   14   28 o   58.867   22.008   2.4498   2.6694  -0.1518   3.4450   6.3586   4.2227   51.586   22.657   84.404   28.008 -32.81750 36.02494 
1 1 1   30   14   29 o   46.298   21.465  -2.2448   3.6255   4.7330   6.8025  -5.0132   4.2848   81.618   33.656   44.835   21.526 36.78358 39.95152 
1 1 1   30   14   30 o   45.591   20.571  -0.9524   3.0445  -2.2225   4.0318   0.7325   4.6439   49.031   22.698   61.015   26.563 -11.98411 34.93962 
1 1 1   30   14   31 o   49.965   21.699   0.2210   3.0837  -7.2048   4.0447   10.529   4.7654   39.199   19.278  104.916   28.799 -65.71795 34.65636 
1 1 1   30   14   32 o   46.767   20.734  -0.3341   2.9505   1.1911   3.7016  -2.9918   4.8862   57.256   24.296   52.144   24.421 5.112255 34.44833 
1 1 1   30   14   33 o  135.458   19.051   15.637   3.8408   13.283   4.4933   22.023   7.4010  120.222   25.223  146.694   33.674 -26.47211 42.07261 
1 1 1   30   15    0 o   68.642   24.134   4.8234   2.3003   4.8234   2.3003   4.8234   2.3003   68.642   24.134   68.642   24.134 0.000000 0.000000 
1 1 1   30   15    1 o  323.233   6.6651   80.341   3.2975   84.761   4.6137   75.726   4.7147  331.327   9.0976  312.935   9.8431 18.39145 13.40347 
1 1 1   30   15    2 o   60.363   19.761   2.8242   2.1045   7.2752   3.5830   0.4798   2.6004   92.828   24.761   49.056   20.565 43.77144 32.18718 
1 1 1   30   15    3 o  229.271   8.6158   40.551   3.0235   46.324   4.8978   36.997   3.8432  243.412   13.195  218.009   11.559 25.40312 17.54189 
1 1 1   30   15    4 o  129.170   12.982   13.125   2.5319   10.174   4.2917   14.701   3.1357  109.349   26.019  136.083   15.321 -26.73390 30.19458 
1 1 1   30   15    5 o   63.718   26.341   1.4080   4.1812   1.4080   4.1812   0.0000   0.0000   63.718   26.341  ?   ?  0.000000 26.34074 
1 1 1   30   15    6 o   64.600   22.264   3.1369   2.6693   5.9152   4.5170   1.6461   3.3088   85.604   28.973   59.561   23.869 26.04287 37.53926 
1 1 1   30   15    7 o   57.920   21.713   2.1301   2.6020  -2.6714   3.9636   5.7665   3.4493   49.054   22.637   83.212   25.038 -34.15726 33.75402 
1 1 1   30   15    8 o   90.766   20.497   6.8397   2.7802   3.5620   4.1082   9.6092   3.7763   72.631   27.273  106.878   23.705 -34.24696 36.13470 
1 1 1   30   15    9 o   77.228   22.685   4.9369   2.8583   9.8965   4.5987   1.8146   3.6488  107.155   27.800   62.283   25.028 44.87164 37.40677 
1 1 1   30   15   10 o  124.003   17.107   12.366   3.1606   20.049   4.8824   6.8243   4.1466  156.822   20.858   89.885   27.540 66.93636 34.54695 
1 1 1   30   15   11 o   37.223   18.131  -5.6509   3.3283  -5.3439   6.6785  -5.7524   3.8390   60.654   28.452   41.216   19.935 19.43815 34.74070 
1 1 1   30   15   12 o   88.314   24.573   6.6026   3.4432   1.0813   5.4427   10.287   4.4460   69.105   29.398  109.337   26.779 -40.23221 39.76593 
1 1 1   30   15   13 o   53.011   22.857   0.0510   3.3729   2.1695   5.3584  -1.3393   4.3408   72.199   29.831   55.237   24.774 16.96170 38.77681 
1 1 1   30   15   14 o   66.726   24.988   2.9950   3.4442   4.1654   5.2996   2.1393   4.5318   79.300   30.681   68.062   27.698 11.23836 41.33437 
1 1 1   30   15   15 o  171.628   22.639   24.339   5.8020   24.339   5.8020   0.0000   0.0000  171.628   22.639  ?   ?  0.000000 22.63857 
1 1 1   30   15   16 o  104.880   25.504   9.4631   4.0546   5.4068   5.7627   13.440   5.7059   85.412   32.252  123.013   30.464 -37.60174 44.36507 
1 1 1   30   15   17 o  114.189   24.275   11.112   4.1121   3.2385   5.6540   19.953   5.9914   76.710   31.039  152.674   26.606 -75.96432 40.88143 
1 1 1   30   15   18 o  131.957   21.936   14.522   4.2750   10.903   6.1432   17.920   5.9528  109.498   33.516  143.436   28.119 -33.93845 43.74949 
1 1 1   30   15   19 o  139.201   20.889   16.042   4.3134   14.675   6.5970   17.063   5.7007  126.177   33.571  139.977   27.589 -13.79953 43.45248 
1 1 1   30   15   20 o  152.968   15.151   18.689   3.5007   18.202   6.6642   18.875   4.1140  141.839   31.515  152.469   17.974 -10.63089 36.28016 
1 1 1   30   15   21 o   61.185   24.092   2.1490   3.3145  -5.7205   6.6420   4.7584   3.8248   58.757   27.811   76.651   26.638 -17.89398 38.51018 
1 1 1   30   15   22 o  133.371   19.302   14.676   3.8257   25.854   10.432   12.939   4.1122  159.116   42.160  123.489   22.588 35.62700 47.82949 
1 1 1   30   15   23 o  190.439   13.427   28.726   3.8887   31.211   7.5123   27.817   4.5450  189.779   26.592  186.012   16.123 3.767319 31.09747 
1 1 1   30   15   24 o   88.075   25.617   6.8092   3.6610   13.337   7.1246   4.4672   4.2676  117.086   36.137   75.782   27.924 41.30385 45.66860 
1 1 1   30   15   25 o  141.584   17.435   16.390   3.6986   16.103   7.2051   16.492   4.3098  128.460   35.474  140.277   20.694 -11.81659 41.06906 
1 1 1   30   15   26 o  145.519   23.577   18.243   5.0718   15.915   9.4332   19.190   6.0152  121.881   41.863  146.212   27.896 -24.33163 50.30590 
1 1 1   30   15   27 o  123.088   14.695   12.256   2.7138   11.344   3.3346   14.045   4.6701  116.090   19.455  125.970   25.102 -9.879944 31.75843 
1 1 1   30   15   28 o   53.138   21.459   1.4204   2.6967   1.0735   3.4912   1.9333   4.2461   56.337   23.734   63.618   26.442 -7.280415 35.53108 
1 1 1   30   15   29 o  103.045   23.663   9.4683   3.6535   9.7804   6.2585   9.3070   4.4999   99.120   34.096   99.523   28.234 -0.4025803 44.26812 
1 1 1   30   15   30 o   62.017   22.689   2.9789   2.8103   0.0457   3.4843   8.4388   4.7538   52.013   22.816   93.820   29.608 -41.80700 37.37949 
1 1 1   30   15   31 o   93.254   22.841   7.8052   3.2343   4.0579   3.6505   21.487   6.9752   70.083   25.826  147.862   31.767 -77.77889 40.94041 
1 1 1   30   15   32 o  168.424   14.141   23.013   3.6117   20.501   4.0703   32.310   7.8319  156.788   17.246  185.338   28.522 -28.55023 33.33082 
1 1 1   30   16    0 o   46.216   24.810   2.4301   2.4167   2.4301   2.4167   2.4301   2.4167   46.216   24.810   46.216   24.810 0.000000 0.000000 
1 1 1   30   16    1 o   85.722   14.017   5.8848   1.7756   7.2761   2.2831   3.7552   2.8246   94.893   16.306   69.170   22.905 25.72362 28.11634 
1 1 1   30   16    2 o   74.593   14.108   4.4870   1.5518   3.9569   1.7949   6.0564   3.0883   69.458   17.017   85.020   23.121 -15.56198 28.70771 
1 1 1   30   16    3 o  122.752   13.901   11.919   2.5659   13.223   4.0969   11.077   3.2913  126.562   21.944  116.634   19.097 9.928345 29.09031 
1 1 1   30   16    4 o   46.845   21.816  -3.0748   3.8115  -3.0748   3.8115   0.0000   0.0000   46.845   21.816  ?   ?  0.000000 21.81639 
1 1 1   30   16    5 o   91.181   20.157   6.8901   2.7384   11.012   4.5266   4.5110   3.4392  113.502   26.532   75.460   25.283 38.04234 36.64888 
1 1 1   30   16    6 o  117.764   17.435   11.189   3.0477   6.3359   4.8346   14.390   3.9261   88.167   29.974  132.900   19.914 -44.73294 35.98615 
1 1 1   30   16    7 o  130.195   16.306   13.556   3.1782   15.266   5.1708   12.517   4.0291  134.211   26.111  122.843   22.247 11.36812 34.30324 
1 1 1   30   16    8 o  164.708   12.756   21.274   3.1907   27.804   4.6263   15.350   4.4065  187.080   16.319  136.473   21.831 50.60774 27.25621 
1 1 1   30   16    9 o   43.133   19.613  -1.4855   2.8323   0.0611   4.1579  -2.8244   3.8686   58.482   25.297   47.841   22.178 10.64080 33.64181 
1 1 1   30   16   10 o   68.959   24.033   3.6065   3.1145   12.145   4.7315  -2.9223   4.1373  118.986   26.643   49.587   22.968 69.39917 35.17638 
1 1 1   30   16   11 o  104.654   24.099   9.2906   3.7806   8.6878   7.1494   9.5245   4.4544  101.511   36.319  104.910   27.430 -3.399635 45.51332 
1 1 1   30   16   12 o   71.359   24.815   3.9150   3.3194   2.7546   5.1098   4.7623   4.3662   73.103   29.533   78.967   28.369 -5.863365 40.95079 
1 1 1   30   16   13 o  281.088   10.398   61.299   4.4738   69.213   6.6243   54.662   6.0662  296.742   14.585  263.056   15.130 33.68588 21.01483 
1 1 1   30   16   14 o   75.306   25.785   4.4985   3.5779   9.7056   5.7314   1.1736   4.5798  104.546   32.435   64.586   27.195 39.95906 42.32738 
1 1 1   30   16   15 o   91.003   32.314   6.8279   5.6496   6.8279   5.6496   0.0000   0.0000   91.003   32.314  ?   ?  0.000000 32.31441 
1 1 1   30   16   16 o  100.216   26.205   8.7141   4.0651   7.7855   5.7140   9.6657   5.7844   95.163   32.585  103.940   32.641 -8.777061 46.12175 
1 1 1   30   16   17 o  146.446   19.941   17.599   4.3536   16.692   6.1962   18.484   6.1185  136.870   30.370  145.387   28.513 -8.517441 41.65764 
1 1 1   30   16   18 o   66.853   26.505   2.5598   4.0373  -0.8697   5.7672   5.8559   5.6538   64.438   28.753   86.280   32.073 -21.84184 43.07439 
1 1 1   30   16   19 o   53.221   23.962  -1.2999   4.1044   3.4023   6.0236  -5.3750   5.6076   77.980   31.856   53.625   25.432 24.35545 40.76257 
1 1 1   30   16   20 o  227.419   11.290   40.382   3.9300   34.418   7.0465   43.075   4.7347  202.667   23.130  233.641   13.295 -30.97339 26.67814 
1 1 1   30   16   21 o  108.083   21.840   9.9155   3.4887   10.540   6.7780   9.6906   4.0691  106.145   35.494  105.168   25.534 0.9767075 43.72417 
1 1 1   30   16   22 o   59.553   25.351   0.8302   4.0524   0.0000   0.0000   0.8302   4.0524  ?   ?    59.553   25.351 0.000000 25.35103 
1 1 1   30   16   23 o   70.646   26.099   3.7514   3.7321  -0.9071   9.8437   4.5335   4.0332   80.058   36.466   75.496   27.248 4.561127 45.52126 
1 1 1   30   16   24 o   53.116   23.395  -0.3012   3.6967   13.534   9.6736  -2.6671   4.0003  114.619   42.071   48.380   22.471 66.23849 47.69624 
1 1 1   30   16   25 o   41.342   19.743  -4.0182   3.4999 -13.1256   7.2082  -1.2088   4.0035   51.010   25.210   52.179   23.563 -1.169319 34.50716 
1 1 1   30   16   26 o   89.791   28.160   7.3402   4.3070   11.149   6.5557   4.4479   5.7130  106.284   34.881   78.569   31.407 27.71496 46.93699 
1 1 1   30   16   27 o   86.358   19.794   6.4064   2.5605   2.6467   3.1084   14.342   4.5159   61.700   23.594  127.661   23.992 -65.96059 33.64933 
1 1 1   30   16   28 o   67.539   22.152   3.8639   2.6443   3.9088   3.2852   3.7812   4.4563   69.028   24.628   71.585   28.012 -2.556236 37.29865 
1 1 1   30   16   29 o  122.959   25.929   13.791   4.7263   11.531   6.6326   16.122   6.7365  105.495   35.107  125.792   34.122 -20.29717 48.95744 
1 1 1   30   16   30 o   62.276   23.551   2.8937   3.0754   3.4693   3.4809   0.8456   6.5657   66.644   25.089   68.882   30.711 -2.237999 39.65634 
1 1 1   30   16   31 o   68.245   24.292   3.9278   3.1944   3.3656   3.6530   5.7552   6.5855   66.408   25.534   82.296   33.429 -15.88874 42.06474 
1 1 1   30   17    0 o  193.050   12.570   29.138   3.6781   29.138   3.6781   29.138   3.6781  193.050   12.570  193.050   12.570 0.000000 0.000000 
1 1 1   30   17    1 o  112.030   13.172   9.9234   2.2156   10.936   2.9181   8.5448   3.4044  116.565   16.844  100.933   22.599 15.63267 28.18571 
1 1 1   30   17    2 o   77.523   14.910   4.8657   1.7049   5.2876   1.9658   3.5849   3.4250   80.492   16.510   70.015   25.128 10.47620 30.06680 
1 1 1   30   17    3 o  143.879   8.5602   16.033   1.8766   16.138   2.1446   15.689   3.8773  144.092   9.7817  139.307   18.652 4.784943 21.06127 
1 1 1   30   17    4 f  183.449   7.9132   25.944   2.2220   25.944   2.2220   0.0000   0.0000  183.449   7.9132  ?   ?  0.000000 7.913240 
1 1 1   30   17    5 o  160.951   13.129   20.354   3.2062   22.673   5.0747   18.814   4.1363  167.083   20.257  152.960   18.012 14.12401 27.10684 
1 1 1   30   17    6 o  158.048   13.598   19.671   3.2575   25.223   5.3470   16.395   4.1078  176.345   20.173  142.089   19.394 34.25516 27.98339 
1 1 1   30   17    7 o   77.970   23.953   5.0294   3.1343   2.2597   5.2291   6.5825   3.9157   71.973   29.573   88.200   26.708 -16.22722 39.84871 
1 1 1   30   17    8 o   42.627   19.720  -2.2194   3.0361   4.6380   5.2831  -5.6008   3.7098   81.278   30.835   40.432   19.565 40.84578 36.51878 
1 1 1   30   17    9 o   46.557   20.654  -0.7431   2.9325   0.1115   4.2661  -1.5087   4.0378   59.234   25.623   52.620   23.722 6.613846 34.91780 
1 1 1   30   17   10 o   51.827   22.948  -0.7406   3.6028   1.3666   7.1671  -1.4531   4.1676   77.574   33.384   53.663   24.155 23.91135 41.20592 
1 1 1   30   17   11 o  143.021   16.662   16.403   3.5791   17.042   4.9586   15.708   5.1712  142.777   23.508  135.817   25.819 6.959396 34.91791 
1 1 1   30   17   12 o  156.503   16.239   19.575   3.8333   19.546   5.4680   19.604   5.3755  152.619   24.216  153.127   23.701 -0.5083466 33.88398 
1 1 1   30   17   13 o   46.623   21.528  -2.4006   3.5927  -5.3023   5.3835  -0.0707   4.8240   52.727   24.981   61.789   26.982 -9.061398 36.77012 
1 1 1   30   17   14 o   58.207   24.776   0.6023   3.8701  -1.1069   5.8027   1.9717   5.1940   64.305   28.756   70.276   29.230 -5.971169 41.00382 
1 1 1   30   17   15 o  176.565   32.592   27.943   8.4837   27.943   8.4837   0.0000   0.0000  176.565   32.592  ?   ?  0.000000 32.59188 
1 1 1   30   17   16 o   64.526   27.504   0.9489   4.7815  -7.1603   8.4342   4.7896   5.8044   65.627   31.143   82.522   32.059 -16.89435 44.69497 
1 1 1   30   17   17 f  119.119   28.006   12.541   5.0203   10.889   8.9911   13.289   6.0516  108.948   40.457  120.441   32.204 -11.49292 51.70911 
1 1 1   30   17   18 o  131.278   26.229   14.980   5.0861   23.105   9.0970   11.284   6.1345  154.097   38.640  110.390   33.430 43.70720 51.09369 
1 1 1   30   17   19 o  116.732   27.775   12.103   4.8906   20.357   8.8079   8.4234   5.8804  143.614   39.043   97.066   33.057 46.54829 51.15773 
1 1 1   30   17   20 o   88.447   30.213   6.7712   4.9121   10.419   9.0344   5.2404   5.8528  106.237   40.319   83.548   32.266 22.68862 51.64006 
1 1 1   30   17   21 o   61.526   25.108   1.7844   3.7367   10.899   9.2181  -0.0078   4.0876  107.429   40.737   56.838   24.828 50.59131 47.70705 
1 1 1   30   17   22 o  137.376   17.948   15.472   3.6838   16.903   6.7716   14.871   4.3903  133.864   33.209  132.242   22.496 1.622025 40.11068 
1 1 1   30   17   23 o  160.733   16.020   20.881   3.8888   21.963   7.0802   20.413   4.6535  154.558   31.007  156.760   19.838 -2.201675 36.81040 
1 1 1   30   17   24 o   69.707   25.731   3.7267   3.6262   8.9305   6.9142   1.7523   4.2589   97.676   35.611   63.521   26.448 34.15482 44.35845 
1 1 1   30   17   25 o   72.775   25.878   4.3521   3.6244   2.2190   6.9655   5.1441   4.2443   75.549   32.710   78.094   27.979 -2.544571 43.04387 
1 1 1   30   17   26 o   72.921   21.420   4.5991   2.5484   6.4644   2.8082  -4.1053   6.0662   86.097   21.402   57.156   26.908 28.94082 34.38089 
1 1 1   30   17   27 o  130.549   15.430   13.917   3.0237   14.936   3.3233   9.0191   7.2872  134.734   16.457   95.937   36.258 38.79723 39.81823 
1 1 1   30   17   28 o   56.813   25.453  -0.4886   4.5682  -6.3299   6.3434   5.8041   6.5840   54.327   26.112   83.567   33.606 -29.23984 42.55880 
1 1 1   30   17   29 o  116.703   18.450   11.525   3.1861   11.981   3.5924   9.8445   6.8968  117.643   20.707   97.646   35.571 19.99739 41.15929 
1 1 1   30   17   30 o   69.058   22.880   4.1420   2.8184   3.3946   3.5412   5.4337   4.6553   66.261   25.220   78.306   29.105 -12.04506 38.51109 
1 1 1   30   18    0 f   54.376   29.164   3.4409   3.3367   3.4409   3.3367   3.4409   3.3367   54.376   29.164   54.376   29.164 0.000000 0.000000 
1 1 1   30   18    1 o  160.286   10.812   20.027   2.6372   21.788   3.5150   17.760   3.9888  166.237   13.943  148.532   17.906 17.70502 22.69425 
1 1 1   30   18    2 o   85.025   15.719   5.8642   1.9704   5.9910   2.3276   5.5434   3.7013   85.236   18.382   81.847   26.158 3.389000 31.97051 
1 1 1   30   18    3 o  205.308   8.9835   32.577   2.8231   32.577   2.8231   0.0000   0.0000  205.308   8.9835  ?   ?  0.000000 8.983493 
1 1 1   30   18    4 o  162.081   8.6121   20.344   2.1289   20.421   2.4165   20.075   4.4989  162.116   9.7845  157.504   19.049 4.612000 21.41458 
1 1 1   30   18    5 o   55.743   16.519   2.5002   1.5099   2.5604   1.6270   2.1261   4.0545   56.570   17.235   65.622   26.378 -9.052250 31.50972 
1 1 1   30   18    6 o  188.973   12.682   27.996   3.6469   45.006   5.7958   16.847   4.6922  238.247   15.986  142.667   22.210 95.57915 27.36487 
1 1 1   30   18    7 o   75.865   23.202   4.7634   2.9447   6.2930   4.1921   3.2734   4.1373   86.577   27.856   71.015   27.205 15.56230 38.93629 
1 1 1   30   18    8 o  122.155   17.167   12.053   3.1213   10.415   4.4441   13.647   4.3848  109.746   26.709  127.539   23.320 -17.79343 35.45714 
1 1 1   30   18    9 o  138.236   15.662   15.264   3.2554   17.766   4.7272   13.007   4.4896  146.638   21.718  123.819   24.556 22.81892 32.78265 
1 1 1   30   18   10 o   43.347   20.613  -4.2047   3.7330 -10.8139   7.3789  -1.9313   4.3277   55.787   27.135   53.315   24.244 2.472401 36.38746 
1 1 1   30   18   11 o   51.680   22.734  -0.4782   3.4808  -0.5306   5.0111  -0.4293   4.8385   61.488   27.153   60.766   26.765 0.7221031 38.12656 
1 1 1   30   18   12 o  171.066   15.282   23.283   3.9594   29.781   5.6357   16.950   5.5638  191.458   19.504  140.194   26.907 51.26379 33.23186 
1 1 1   30   18   13 o  108.984   23.441   10.108   3.7942   13.212   5.4510   7.1905   5.2845  121.936   29.522   91.807   31.337 30.12901 43.05302 
1 1 1   30   18   14 o   62.093   27.872  -1.2529   5.5057  -1.2529   5.5057   0.0000   0.0000   62.093   27.872  ?   ?  0.000000 27.87161 
1 1 1   30   18   15 o   96.758   27.299   8.2235   4.2189   10.870   5.8587   5.3731   6.0803  109.045   32.591   85.288   32.901 23.75694 46.31041 
1 1 1   30   18   16 o  161.092   18.552   21.143   4.4909   27.595   6.1889   13.967   6.5267  181.690   22.753  122.414   33.746 59.27626 40.70004 
1 1 1   30   18   17 o  130.441   23.182   14.442   4.4589   23.020   6.4147   6.4225   6.2023  163.113   26.611   89.187   33.506 73.92587 42.78792 
1 1 1   30   18   18 o  139.929   21.653   16.409   4.4878   18.639   6.6299   14.522   6.0970  143.189   31.137  125.618   31.707 17.57157 44.43954 
1 1 1   30   18   19 o  148.100   20.097   18.170   4.4381   28.429   6.5861   9.6375   6.0067  182.949   24.107  102.210   33.381 80.73945 41.17508 
1 1 1   30   18   20 o   73.408   28.344   3.7703   4.5158   2.0257   6.5845   5.3194   6.2049   75.095   32.149   84.393   33.046 -9.297623 46.10411 
1 1 1   30   18   21 o   65.794   28.502   0.8051   5.2944  -3.2875   9.4415   2.6823   6.3944   74.392   34.542   76.003   32.075 -1.611031 47.13754 
1 1 1   30   18   22 o  112.662   21.966   10.871   3.6518   7.6236   6.6227   12.290   4.3774   92.890   34.677  118.261   24.966 -25.37074 42.72923 
1 1 1   30   18   23 o   88.612   25.406   6.9981   3.6241   15.931   6.7985   3.4518   4.2835  127.754   34.122   70.480   27.496 57.27465 43.82142 
1 1 1   30   18   24 o  244.704   11.743   47.156   4.3982   52.623   7.2935   44.031   5.5135  252.236   19.031  233.590   15.509 18.64601 24.55030 
1 1 1   30   18   25 o  203.404   10.230   32.474   3.1747   32.474   3.1747   0.0000   0.0000  203.404   10.230  ?   ?  0.000000 10.22955 
1 1 1   30   18   26 o  201.870   11.086   32.166   3.4124   32.166   3.4124   0.0000   0.0000  201.870   11.086  ?   ?  0.000000 11.08632 
1 1 1   30   18   27 o   91.815   20.481   7.3350   2.8051   5.3996   3.0568   17.656   7.0590   77.843   23.604  131.383   34.617 -53.53966 41.89844 
1 1 1   30   18   28 o   54.342   23.736   0.3073   3.7353  -3.2194   6.4245   2.1083   4.5909   59.728   27.982   64.928   27.277 -5.199848 39.07753 
1 1 1   30   18   29 o   49.397   20.917   0.7005   2.7343  -1.6289   3.3599   5.2686   4.7051   45.576   20.963   77.662   29.182 -32.08656 35.93073 
1 1 1   30   19    0 o   44.312   27.620   1.1943   3.8063   1.1943   3.8063   1.1943   3.8063   44.312   27.620   44.312   27.620 0.000000 0.000000 
1 1 1   30   19    1 f  116.514   16.463   10.937   2.8542   4.9703   3.7685   18.964   4.3712   78.482   26.465  152.874   19.097 -74.39130 32.63583 
1 1 1   30   19    2 o   60.568   23.971   1.9369   3.2968   1.9369   3.2968   0.0000   0.0000   60.568   23.971  ?   ?  0.000000 23.97086 
1 1 1   30   19    3 o  137.484   11.224   14.794   2.3413   13.079   2.7062   19.896   4.6690  128.416   13.994  156.193   19.988 -27.77769 24.40005 
1 1 1   30   19    4 o  100.525   14.664   8.1009   2.1899   9.5462   2.5133   3.5435   4.4629  109.013   15.499   73.438   28.226 35.57584 32.20135 
1 1 1   30   19    5 o   52.043   19.025   1.8225   1.9752   1.3909   2.2134   3.5105   4.3772   50.751   19.774   72.928   27.972 -22.17626 34.25572 
1 1 1   30   19    6 o  103.033   12.738   8.4158   1.9661   8.2644   2.1736   9.0972   4.6109  101.615   14.376  101.944   28.461 -0.3282700 31.88603 
1 1 1   30   19    7 o   36.716   17.697  -4.2503   2.9620  -3.0373   4.1007  -5.5735   4.2830   48.842   22.707   44.748   21.494 4.094116 31.26713 
1 1 1   30   19    8 o   69.922   24.237   3.7909   3.1654   6.6794   4.4415   0.8093   4.5124   88.599   28.690   62.808   26.744 25.79131 39.22182 
1 1 1   30   19    9 o   62.153   25.705   1.4524   3.9842   14.164   7.6674  -3.2498   4.6633  122.589   37.430   52.222   24.257 70.36679 44.60266 
1 1 1   30   19   10 f   51.312   22.714  -0.6648   3.5273   2.5162   4.9317  -3.9962   5.0469   70.932   28.883   53.061   24.840 17.87064 38.09575 
1 1 1   30   19   11 o  210.247   13.535   34.852   4.3325   44.866   6.0524   24.329   6.2046  236.838   16.805  169.776   24.593 67.06209 29.78592 
1 1 1   30   19   12 o   56.825   24.458   0.3112   3.8481  -2.6970   5.3211   3.6093   5.5716   57.498   26.422   77.307   30.976 -19.80862 40.71402 
1 1 1   30   19   13 o   58.417   25.041   0.5005   4.0040   7.9089   5.4840  -7.9575   5.8596   94.931   31.926   50.901   24.621 44.03091 40.31659 
1 1 1   30   19   14 o  123.980   29.864   13.819   5.5998   13.819   5.5998   0.0000   0.0000  123.980   29.864  ?   ?  0.000000 29.86363 
1 1 1   30   19   15 o   85.504   28.273   6.2596   4.3043   2.9867   5.6331   10.852   6.6723   74.960   30.735  107.897   35.179 -32.93719 46.71408 
1 1 1   30   19   16 o   72.588   28.233   3.5161   4.5058   4.2963   5.9012   2.4254   6.9775   80.339   31.984   78.114   33.259 2.224876 46.14240 
1 1 1   30   19   17 o   61.555   26.428   0.7015   4.4726   5.0608   6.1702  -4.1251   6.4925   83.680   32.896   60.635   28.317 23.04556 43.40536 
1 1 1   30   19   18 o   95.813   28.732   8.2319   4.5479   9.5847   6.2162   6.6738   6.6712  101.764   33.991   90.412   34.567 11.35212 48.47950 
1 1 1   30   19   19 o   47.697   22.628  -4.3987   4.4464  -5.5639   6.1612  -3.1322   6.4234   56.012   26.591   61.928   28.662 -5.916302 39.09694 
1 1 1   30   19   20 o  119.185   30.583   13.173   5.6070   14.880   9.3861   12.226   6.9915  119.259   41.713  111.835   35.973 7.423904 55.08164 
1 1 1   30   19   21 o  191.663   18.155   30.116   5.2625   32.533   7.1533   27.265   7.7694  194.108   24.631  172.483   30.547 21.62491 39.23987 
1 1 1   30   19   22 o  155.773   21.679   20.612   5.0287   26.257   6.8303   13.929   7.4311  171.884   26.839  116.879   37.033 55.00486 45.73563 
1 1 1   30   19   23 o  132.992   26.135   15.854   5.1305   22.262   6.7796   7.2648   7.8483  155.157   29.628   91.666   36.752 63.49088 47.20719 
1 1 1   30   19   24 o   35.043   15.769  -0.6851   1.7747  -0.9590   1.8263   3.9510   7.5138   34.447   15.697   80.966   34.494 -46.51912 37.89783 
1 1 1   30   19   25 o   96.385   15.111   7.6385   2.1560   7.6385   2.1560   0.0000   0.0000   96.385   15.111  ?   ?  0.000000 15.11080 
1 1 1   30   19   26 o  152.304   9.5790   18.218   2.2217   19.488   2.4711   12.863   5.0748  157.220   10.326  116.488   28.659 40.73112 30.46230 
1 1 1   30   19   27 o  110.038   23.703   10.877   3.8743   8.9669   6.4373   11.961   4.8513   94.428   34.371  112.140   28.271 -17.71214 44.50453 
1 1 1   30   20    0 o  116.255   31.140   12.837   4.7884   12.837   4.7884   12.837   4.7884  116.255   31.140  116.255   31.140 0.000000 0.000000 
1 1 1   30   20    1 o   84.907   28.752   5.9764   4.4483   5.9764   4.4483   0.0000   0.0000   84.907   28.752  ?   ?  0.000000 28.75221 
1 1 1   30   20    2 o   95.258   22.001   7.6655   3.1431   9.6563   4.1503   4.9881   4.8130  105.667   25.869   80.875   29.677 24.79186 39.36916 
1 1 1   30   20    3 o   59.459   21.135   2.5742   2.4173   0.7213   2.7833   8.2624   4.8766   51.290   21.370   97.114   29.885 -45.82459 36.73931 
1 1 1   30   20    4 o   52.386   20.528   1.4669   2.3959   0.6864   2.7537   3.8983   4.8603   50.894   21.235   76.198   29.410 -25.30419 36.27508 
1 1 1   30   20    5 o   37.437   17.332  -1.7747   2.3515  -1.4205   2.6563  -3.0578   5.0562   41.573   18.939   55.203   25.507 -13.63029 31.76897 
1 1 1   30   20    6 o   58.414   20.752   2.4847   2.3301   4.3763   2.6480  -4.0056   4.9049   72.599   21.959   52.114   24.426 20.48543 32.84519 
1 1 1   30   20    7 o  238.297   7.6027   43.818   2.7730   45.654   3.1626   37.712   5.7670  242.989   8.5034  216.652   17.541 26.33728 19.49382 
1 1 1   30   20    8 o   48.342   19.284   1.0913   2.1493   1.6570   2.4027  -1.1746   4.8082   53.474   20.667   58.256   26.105 -4.782578 33.29574 
1 1 1   30   20    9 o   73.320   25.512   4.2509   3.5089   6.1850   4.7209   1.8635   5.2451   85.975   29.610   69.826   29.236 16.14921 41.61110 
1 1 1   30   20   10 o   81.858   26.341   5.6676   3.7485   8.3291   4.9203   1.9858   5.7870   96.908   30.051   72.555   30.561 24.35346 42.86018 
1 1 1   30   20   11 o  122.642   23.055   12.758   4.1689   17.107   5.6284   7.4719   6.2052  140.030   27.241   93.657   33.798 46.37299 43.40956 
1 1 1   30   20   12 o  129.246   22.217   14.060   4.2367   31.860   5.8390  -5.7307   6.1569  197.442   19.579   56.146   26.634 141.2954 33.05589 
1 1 1   30   20   13 o   86.011   31.987   5.9190   5.6245   5.9190   5.6245   0.0000   0.0000   86.011   31.987  ?   ?  0.000000 31.98665 
1 1 1   30   20   14 o  277.342   12.470   60.347   5.2938   67.920   7.0459   50.531   8.0218  291.668   15.842  247.235   21.409 44.43265 26.63306 
1 1 1   30   20   15 o   76.661   28.514   4.4774   4.4698   5.8606   5.8146   2.4790   6.9888   85.875   32.404   78.142   33.279 7.732948 46.44918 
1 1 1   30   20   16 o  133.876   23.375   15.299   4.6157   15.768   6.2118   14.720   6.8970  130.841   31.414  124.021   34.874 6.819557 46.93694 
1 1 1   30   20   17 o   66.811   27.558   2.1162   4.5622  -5.0752   6.0593   11.529   6.9324   56.331   26.633  109.505   35.865 -53.17338 44.67223 
1 1 1   30   20   18 o   40.585   20.017  -8.6578   4.4645  -9.8173   6.1731  -7.3862   6.4646   49.610   24.279   54.607   26.275 -4.996628 35.77506 
1 1 1   30   20   19 o   58.432   25.845  -0.2709   4.5582   2.3957   6.2984  -3.2037   6.6052   74.376   31.631   62.294   28.913 12.08194 42.85464 
1 1 1   30   20   20 o   79.594   31.213   4.7769   5.5422   5.6714   8.9252   4.2154   7.0706   89.986   37.931   81.759   34.063 8.227036 50.98057 
1 1 1   30   20   21 o  161.412   21.137   22.057   5.0967   24.132   6.6872   19.181   7.8729  163.690   27.677  137.385   36.730 26.30464 45.99042 
1 1 1   30   20   22 o   60.839   21.652   2.8752   2.5378   3.0164   2.6930   1.7553   7.5864   62.263   22.289   75.945   33.479 -13.68191 40.21998 
1 1 1   30   20   23 o  104.420   11.905   8.7136   1.8687   8.6363   1.9255   9.9669   7.7518  103.780   12.365   99.519   37.445 4.260757 39.43340 
1 1 1   30   20   24 o   48.151   18.257   1.5078   1.8514   1.0622   1.9084   8.6455   7.6384   45.583   18.175   94.388   36.746 -48.80577 40.99532 
1 1 1   30   20   25 o   94.432   13.939   7.2810   1.9542   7.1522   2.0569   8.4761   6.2634   93.166   14.928   92.900   33.890 0.2660141 37.03227 
1 1 1   30   20   26 o  134.761   13.386   14.657   2.7246   12.975   3.2473   18.657   5.0076  124.478   17.529  145.277   23.308 -20.79917 29.16378 
1 1 1   30   21    1 o  102.907   23.311   9.0442   3.5867   10.353   5.1000   7.7636   5.0451  107.564   29.899   94.208   30.584 13.35621 42.77016 
1 1 1   30   21    2 o  136.604   18.079   15.183   3.6872   17.882   5.0654   12.141   5.3776  145.661   23.521  116.368   30.000 29.29317 38.12147 
1 1 1   30   21    3 o   39.928   19.132  -4.2717   3.3469  -6.1900   4.3914  -1.6131   5.1698   44.266   21.388   59.218   26.756 -14.95229 34.25358 
1 1 1   30   21    4 o  141.640   13.730   15.917   2.9393   16.826   3.4312   13.412   5.6974  144.885   15.725  121.991   30.573 22.89429 34.37990 
1 1 1   30   21    5 o   46.553   20.243  -0.1559   2.6908   1.3235   3.1308  -4.3378   5.2638   56.318   22.982   53.574   25.172 2.744053 34.08541 
1 1 1   30   21    6 o  214.556   19.041   37.392   6.1883   0.0000   0.0000   37.392   6.1883  ?   ?   214.556   19.041 0.000000 19.04122 
1 1 1   30   21    7 o  177.925   10.526   24.717   2.8538   27.253   3.3218   17.571   5.5761  186.433   11.700  142.413   26.558 44.01924 29.02069 
1 1 1   30   21    8 o   64.410   22.839   3.1270   2.8213   2.8763   3.3348   3.7580   5.2914   65.048   24.542   76.636   30.357 -11.58858 39.03612 
1 1 1   30   21    9 o   91.956   19.057   7.0554   2.5942   8.6544   2.8961   0.5628   5.8357  102.010   19.254   68.371   29.771 33.63942 35.45460 
1 1 1   30   21   10 o   45.956   19.692   0.1431   2.4744   0.0885   2.7217   0.4035   5.9406   47.748   20.560   68.363   29.895 -20.61536 36.28259 
1 1 1   30   21   11 o   55.274   16.364   2.4838   1.4822   3.1219   1.5328  -6.7105   5.8181   61.482   16.098   52.446   25.155 9.036415 29.86479 
1 1 1   30   21   12 o   60.606   21.446   2.7542   2.4863   2.7542   2.4863   0.0000   0.0000   60.606   21.446  ?   ?  0.000000 21.44600 
1 1 1   30   21   13 o   77.657   28.272   4.7602   4.3559   7.7843   5.6345   0.2686   6.8669   93.741   32.345   71.860   31.756 21.88129 45.32849 
1 1 1   30   21   14 o  110.215   27.071   10.817   4.5336   16.771   5.8103   1.5491   7.2489  136.900   28.648   76.370   33.217 60.53078 43.86443 
1 1 1   30   21   15 o   61.872   26.485   0.8710   4.4679   3.3484   5.8331  -2.6456   6.9497   76.252   31.272   65.464   30.124 10.78722 43.42134 
1 1 1   30   21   16 o   86.600   29.344   6.5796   4.6334   10.269   6.0976   1.5388   7.1275  104.185   33.603   75.393   32.863 28.79144 47.00151 
1 1 1   30   21   17 o  147.720   21.199   18.392   4.6558   20.941   6.3442   15.416   6.8540  152.788   28.166  125.829   34.538 26.95844 44.56699 
1 1 1   30   21   18 o   78.485   28.958   5.0318   4.5917   5.7040   6.2150   4.2239   6.8134   84.613   33.089   81.140   33.591 3.472351 47.15089 
1 1 1   30   21   19 o  119.040   15.629   11.554   2.7788   11.490   3.0556   11.859   6.6819  117.838   17.470  109.149   35.173 8.689072 39.27297 
1 1 1   30   21   20 f   83.323   14.547   5.6942   1.7878   5.2348   1.8491   12.282   7.0024   79.383   15.774  109.891   36.048 -30.50792 39.34855 
1 1 1   30   21   21 o   41.959   17.479   0.5062   1.8615   0.9523   1.9307  -5.3806   7.0137   45.181   18.188   59.507   28.285 -14.32572 33.62852 
1 1 1   30   21   22 o   49.138   18.692   1.5605   1.9447   2.1670   2.0163  -6.5203   7.3604   53.783   19.283   59.121   28.340 -5.338074 34.27780 
1 1 1   30   21   23 f  110.669   12.663   9.8466   2.1065   10.315   2.1995   4.6616   7.3216  113.185   12.928   81.608   34.374 31.57774 36.72491 
1 1 1   30   21   24 o   92.168   22.572   7.5768   3.1589   7.5768   3.1589   0.0000   0.0000   92.168   22.572  ?   ?  0.000000 22.57158 
1 1 1   30   22    0 o   96.238   38.519   10.579   5.5055   10.579   5.5055   10.579   5.5055   96.238   38.519   96.238   38.519 0.000000 0.000000 
1 1 1   30   22    1 o   89.843   32.459   6.7443   5.7256   0.0000   0.0000   6.7443   5.7256  ?   ?    89.843   32.459 0.000000 32.45929 
1 1 1   30   22    2 o   47.921   22.071  -2.2532   3.7414  -2.0018   4.9864  -2.5769   5.6596   56.987   25.956   59.571   27.328 -2.584400 37.68987 
1 1 1   30   22    3 o   58.878   24.701   1.0447   3.7563  -2.3002   4.7967   6.3481   6.0399   55.059   25.222   88.730   33.117 -33.67075 41.62804 
1 1 1   30   22    4 o  189.744   14.198   28.563   4.0936   37.110   5.2773   15.651   6.4864  215.342   16.128  130.296   32.603 85.04630 36.37438 
1 1 1   30   22    5 o  245.476   18.703   48.884   6.9743   0.0000   0.0000   48.884   6.9743  ?   ?   245.476   18.703 0.000000 18.70264 
1 1 1   30   22    6 o  142.877   14.091   16.254   3.0415   13.614   3.4933   24.527   6.1833  128.968   18.202  169.896   24.485 -40.92757 30.50929 
1 1 1   30   22    7 o  237.338   19.297   45.919   6.9493   0.0000   0.0000   45.919   6.9493  ?   ?   237.338   19.297 0.000000 19.29656 
1 1 1   30   22    8 o  134.226   13.634   14.334   2.7622   14.843   3.0887   12.301   6.1729  136.044   15.087  114.814   33.227 21.23003 36.49168 
1 1 1   30   22    9 o  170.102   11.207   22.692   2.9017   26.578   3.2305   6.4629   6.6011  184.024   11.527   89.822   34.374 94.20183 36.25555 
1 1 1   30   22   10 o  106.773   16.778   9.3210   2.6516   9.5424   2.9130   8.2511   6.4045  107.410   18.379   96.311   34.383 11.09884 38.98743 
1 1 1   30   22   11 o   55.224   21.866   1.6457   2.7444   1.6457   2.7444   0.0000   0.0000   55.224   21.866  ?   ?  0.000000 21.86597 
1 1 1   30   22   12 o   75.879   15.247   4.7318   1.7094   4.6406   1.7643   6.1288   6.9052   74.948   15.874   88.690   34.821 -13.74215 38.26884 
1 1 1   30   22   13 o   72.698   15.925   4.3784   1.7231   3.6111   1.7835   15.134   6.6771   65.735   17.438  125.766   33.912 -60.03094 38.13267 
1 1 1   30   22   14 o   71.885   16.689   4.3119   1.8010   4.0895   1.8725   7.0596   6.5819   69.812   17.544   90.829   34.428 -21.01680 38.64016 
1 1 1   30   22   15 o  121.979   10.891   11.733   2.0120   12.572   2.1134   3.6150   6.5741  126.242   11.048   78.847   32.847 47.39561 34.65537 
1 1 1   30   22   16 o  119.280   10.895   11.232   1.9671   10.321   2.0596   20.705   6.6391  113.928   11.991  149.962   29.972 -36.03400 32.28148 
1 1 1   30   22   17 o  101.058   12.702   8.1898   1.9214   8.7080   2.0183   3.1755   6.2788  104.163   12.937   75.981   31.909 28.18242 34.43209 
1 1 1   30   22   18 o  137.926   10.015   14.945   2.0999   15.015   2.2139   14.324   6.6301  138.049   10.558  119.858   34.363 18.19135 35.94808 
1 1 1   30   22   19 o   72.913   18.325   4.5312   2.0427   3.9092   2.1547   10.052   6.4190   67.679   19.644  100.726   34.537 -33.04773 39.73231 
1 1 1   30   22   20 o   75.230   18.798   4.8527   2.1584   4.6996   2.2692   6.3076   6.9943   73.797   19.715   86.526   34.694 -12.72897 39.90388 
1 1 1   30   22   21 o   59.562   23.201   2.3515   3.0465   4.6134   3.3890  -7.1726   6.9543   73.146   25.094   56.182   27.088 16.96484 36.92531 
1 1 1   30   22   22 o   98.266   21.190   8.4450   3.0934   9.1142   3.4574   5.7599   6.9257  101.217   22.857   83.886   34.201 17.33083 41.13573 
1 1 1   30   22   23 o   71.155   20.328   4.4105   2.3243   4.4105   2.3243   0.0000   0.0000   71.155   20.328  ?   ?  0.000000 20.32822 
1 1 1   30   23    0 o   44.343   29.322  -0.5640   5.1831  -0.5640   5.1831  -0.5640   5.1831   44.343   29.322   44.343   29.322 0.000000 0.000000 
1 1 1   30   23    1 o   73.539   26.451   4.2175   3.7968   3.2884   5.1456   5.3279   5.6254   74.001   29.727   83.405   31.777 -9.403816 43.51380 
1 1 1   30   23    2 o   94.632   25.323   7.8379   3.7401   10.419   4.9357   4.3576   5.7318  107.418   29.237   79.955   31.619 27.46356 43.06417 
1 1 1   30   23    3 o  174.661   23.843   25.854   6.2076   0.0000   0.0000   25.854   6.2076  ?   ?   174.661   23.843 0.000000 23.84268 
1 1 1   30   23    4 o  127.439   19.777   13.479   3.7327   12.819   4.7298   14.569   6.0777  120.810   26.322  125.713   31.616 -4.903168 41.13955 
1 1 1   30   23    5 o  125.421   16.114   12.737   3.0218   13.020   3.5379   11.972   5.8107  125.547   19.005  113.565   32.037 11.98158 37.25010 
1 1 1   30   23    6 f  156.889   15.404   19.756   3.6515   17.929   4.4709   23.416   6.3281  146.858   20.444  164.439   26.007 -17.58102 33.08058 
1 1 1   30   23    7 o   96.072   19.509   7.7513   2.7708   7.9115   3.1062   7.1274   6.1304   96.240   21.615   91.223   33.490 5.017403 39.85989 
1 1 1   30   23    8 o   47.797   20.433   0.2632   2.6528  -0.4614   2.9571   3.2508   6.0042   47.269   20.867   76.586   31.605 -29.31666 37.87188 
1 1 1   30   23    9 o   90.174   20.112   6.8960   2.7053   8.3547   3.0505   1.5228   5.8547   99.187   20.759   70.506   30.253 28.68063 36.69091 
1 1 1   30   23   10 o   62.261   23.202   2.7495   2.9624   2.7495   2.9624   0.0000   0.0000   62.261   23.202  ?   ?  0.000000 23.20210 
1 1 1   30   23   11 o  121.538   18.644   12.257   3.3576   12.257   3.3576   0.0000   0.0000  121.538   18.644  ?   ?  0.000000 18.64388 
1 1 1   30   23   12 o   98.430   20.194   8.2312   2.9404   8.0820   3.3550   8.7255   6.1062   96.244   23.074   96.817   33.657 -0.5727768 40.80672 
1 1 1   30   23   13 o   90.347   21.848   7.0758   2.9883   7.4346   3.3991   5.8549   6.2702   91.803   23.942   85.307   33.270 6.496155 40.98897 
1 1 1   30   23   14 o  136.362   14.926   15.027   3.0645   17.430   3.5425   7.8831   6.1086  146.365   16.078   92.654   33.519 53.71143 37.17571 
1 1 1   30   23   15 o   52.857   21.962   1.0370   2.9278   2.7236   3.3321  -4.6757   6.1323   63.192   24.362   56.683   26.797 6.508408 36.21592 
1 1 1   30   23   16 o   74.845   23.461   4.8647   2.9899   8.0642   3.3973  -6.1279   6.2971   95.431   23.430   54.961   26.311 40.46988 35.23094 
1 1 1   30   23   17 o   77.650   23.226   5.3010   2.9745   4.8469   3.4380   6.6531   5.9319   74.927   25.278   86.636   32.721 -11.70810 41.34732 
1 1 1   30   23   18 o   70.635   24.872   4.1632   3.3402   2.0890   4.0022   8.9241   6.0633   62.884   25.860   95.715   33.523 -32.83135 42.33815 
1 1 1   30   23   19 o   41.032   19.352  -2.8440   3.1640  -5.0929   3.6252   4.3472   6.4825   39.775   19.270   78.970   32.734 -39.19537 37.98518 
1 1 1   30   23   20 o  119.385   12.952   11.468   2.3289   12.244   2.4699   5.2460   6.9926  123.237   13.305   82.538   34.088 40.69897 36.59241 
1 1 1   30   23   21 o   62.127   20.280   3.2347   2.2172   2.2852   2.3371   11.783   7.0127   55.834   20.647  105.544   36.099 -49.70993 41.58678 
1 1 1   30   24    0 o   35.992   24.973  -3.5331   4.7985  -3.5331   4.7985  -3.5331   4.7985   35.992   24.973   35.992   24.973 0.000000 0.000000 
1 1 1   30   24    1 o  154.790   15.972   19.344   3.7299   15.661   5.0750   23.670   5.5004  133.766   25.721  167.757   21.947 -33.99089 33.81197 
1 1 1   30   24    2 o   94.669   24.416   7.8601   3.5611   5.6564   4.7807   10.607   5.3373   82.410   29.676  106.986   30.877 -24.57599 42.82643 
1 1 1   30   24    3 o  118.329   20.404   11.770   3.5621   7.3561   4.7251   17.581   5.4218   90.706   29.605  141.688   25.956 -50.98246 39.37242 
1 1 1   30   24    4 o   90.243   31.834   7.1895   5.4744   0.0000   0.0000   7.1895   5.4744  ?   ?    90.243   31.834 0.000000 31.83450 
1 1 1   30   24    5 o   98.559   32.377   9.0078   5.6479   0.0000   0.0000   9.0078   5.6479  ?   ?    98.559   32.377 0.000000 32.37704 
1 1 1   30   24    6 o   40.930   19.049  -2.2012   2.8982  -2.8827   3.4154  -0.4485   5.4776   43.406   20.357   62.990   28.070 -19.58453 34.67476 
1 1 1   30   24    7 o  186.677   11.097   27.380   3.1565   30.533   3.6904   18.786   6.0926  196.582   12.327  144.266   28.602 52.31630 31.14517 
1 1 1   30   24    8 o   55.714   22.451   1.5646   2.9449   1.3190   3.4455   2.2305   5.6731   57.527   23.857   71.441   30.184 -13.91354 38.47364 
1 1 1   30   24    9 o   79.257   25.989   5.4428   3.6397   5.4428   3.6397   0.0000   0.0000   79.257   25.989  ?   ?  0.000000 25.98891 
1 1 1   30   24   10 o   94.543   24.751   7.9512   3.6238   7.9512   3.6238   0.0000   0.0000   94.543   24.751  ?   ?  0.000000 24.75132 
1 1 1   30   24   11 o   58.705   22.800   2.1919   2.9352   7.4068   3.4943 -10.3057   5.4094   91.251   24.501   44.254   21.865 46.99663 32.83903 
1 1 1   30   24   12 o   46.610   20.652  -0.4674   2.9231  -1.4336   3.3962   2.2945   5.7419   47.019   21.418   71.334   30.265 -24.31478 37.07664 
1 1 1   30   24   13 o  126.037   16.761   13.069   3.1534   15.732   3.6965   5.9509   6.0433  137.780   17.955   84.485   32.742 53.29476 37.34203 
1 1 1   30   24   14 o   40.845   19.117  -2.4057   2.9861   0.3625   3.4520 -10.6351   5.9520   53.325   23.058   46.793   23.085 6.532036 32.62785 
1 1 1   30   24   15 o  134.106   11.317   14.252   2.3012   16.888   2.4858  -1.5416   6.0852  146.103   11.201   62.291   28.488 83.81136 30.61112 
1 1 1   30   24   16 o  144.993   10.847   16.611   2.3897   19.994   2.6113  -0.8252   5.9284  159.170   10.782   63.044   28.552 96.12608 30.52035 
1 1 1   30   24   17 o   69.001   19.950   4.1008   2.2262   4.5845   2.3938   1.0052   6.0557   72.653   20.587   67.976   29.942 4.676811 36.33607 
1 1 1   30   24   18 o  141.285   11.467   15.857   2.4584   16.896   2.6708   10.089   6.2907  145.576   12.096   99.865   34.190 45.71074 36.26671 
1 1 1   30   25    0 o   55.712   32.873   3.3938   4.7979   3.3938   4.7979   3.3938   4.7979   55.712   32.873   55.712   32.873 0.000000 0.000000 
1 1 1   30   25    1 o   65.383   24.944   2.9970   3.4692   6.3876   4.9609  -0.2482   4.8534   85.443   30.287   60.005   26.598 25.43766 40.30866 
1 1 1   30   25    2 o   94.636   24.252   7.9211   3.5290   9.6939   4.9644   6.1100   5.0176  102.044   29.874   84.197   30.391 17.84695 42.61576 
1 1 1   30   25    3 o   85.594   25.445   6.5038   3.5784  -0.0507   5.0436   13.148   5.0780   61.539   27.204  120.027   28.131 -58.48823 39.13323 
1 1 1   30   25    4 o  127.121   19.463   13.534   3.6665   7.1961   5.0512   20.593   5.3304   89.213   30.634  154.733   23.223 -65.52036 38.44165 
1 1 1   30   25    5 o   82.703   25.678   6.0476   3.5913   4.8978   4.9046   7.3768   5.2732   78.457   29.723   90.091   31.279 -11.63339 43.14946 
1 1 1   30   25    6 o  113.950   18.096   10.805   3.0506   12.501   3.6849   7.1105   5.4387  121.408   20.563   88.887   31.690 32.52136 37.77734 
1 1 1   30   25    7 o   63.600   25.381   2.4409   3.7243   1.5653   5.3584   3.2592   5.1802   67.623   28.978   72.610   29.588 -4.986816 41.41459 
1 1 1   30   25    8 o   63.487   28.071   0.1540   5.3726   0.1540   5.3726   0.0000   0.0000   63.487   28.071  ?   ?  0.000000 28.07097 
1 1 1   30   25    9 o   55.418   23.866   0.5369   3.6681   0.5369   3.6681   0.0000   0.0000   55.418   23.866  ?   ?  0.000000 23.86579 
1 1 1   30   25   10 o  103.185   20.082   9.0924   3.0576   13.995   3.8318   0.4992   5.0730  128.562   20.133   62.843   27.550 65.71927 34.12215 
1 1 1   30   25   11 o   89.321   22.651   7.0372   3.1014   4.8475   3.7265   11.972   5.5940   75.348   26.287  111.244   31.452 -35.89602 40.99102 
1 1 1   30   25   12 o   95.260   21.705   7.9287   3.0943   10.763   3.6759   1.0372   5.7317  110.985   22.411   67.117   29.357 43.86876 36.93316 
1 1 1   30   25   13 o   34.386   16.887  -5.6249   3.0680  -6.3582   3.6184  -3.7496   5.7864   37.550   18.420   56.156   26.387 -18.60591 32.18069 
1 1 1   30   25   14 o  126.783   19.158   13.573   3.6017   15.662   4.4298   9.4963   6.1868  134.226   22.347   97.867   33.886 36.35927 40.59139 
1 1 1   30   25   15 o   70.336   25.304   4.0951   3.4749   3.5804   4.3100   5.0512   5.8738   70.081   27.512   79.829   31.869 -9.748405 42.10155 
1 1 1   30   25   16 f  147.353   12.029   17.303   2.6895   17.773   2.9876   15.294   6.1762  148.729   13.263  124.281   32.205 24.44772 34.82911 
1 1 1   30   26    0 o   43.306   29.196  -1.4870   5.5927  -1.4870   5.5927  -1.4870   5.5927   43.306   29.196   43.306   29.196 0.000000 0.000000 
1 1 1   30   26    1 o   51.223   22.988  -0.8459   3.7435  -3.2414   5.2618   1.6094   5.3271   54.614   25.501   67.422   28.892 -12.80805 38.53623 
1 1 1   30   26    2 o   97.112   25.380   8.5030   3.8146   8.5118   5.5039   8.4949   5.2917   94.829   31.983   94.852   31.348 -0.2312469E-01 44.78385 
1 1 1   30   26    3 o   84.802   25.976   6.4588   3.6894   6.8394   5.4307   6.1326   5.0277   87.208   31.596   83.655   30.387 3.552795 43.83716 
1 1 1   30   26    4 f   41.044   19.648  -4.1023   3.5109  -6.5495   5.2003  -2.0527   4.7592   48.113   23.254   54.312   24.969 -6.198910 34.12012 
1 1 1   30   26    5 o   62.992   24.992   2.4866   3.5917  -3.5265   5.4008   7.2545   4.8092   54.725   25.644   88.744   29.897 -34.01836 39.38808 
1 1 1   30   26    6 o   55.053   23.080   1.0770   3.2757   1.9263   4.5253   0.1422   4.7477   64.816   27.148   60.062   26.481 4.754490 37.92430 
1 1 1   30   26    7 o   61.265   25.213   1.8822   3.8080   1.8822   3.8080   0.0000   0.0000   61.265   25.213  ?   ?  0.000000 25.21278 
1 1 1   30   26    8 o   84.307   23.136   6.3059   3.0758   2.4819   3.7569   14.080   5.3567   63.546   25.445  122.574   29.004 -59.02805 38.58346 
1 1 1   30   26    9 o   95.716   21.830   8.0239   3.1274   6.7664   3.9095   10.259   5.2118   86.108   26.801  103.144   30.719 -17.03561 40.76683 
1 1 1   30   26   10 o  130.267   21.887   14.684   4.2093   24.027   6.1751   6.5749   5.7530  164.282   25.375   85.726   32.257 78.55676 41.04163 
1 1 1   30   26   11 o   49.881   22.955  -1.9038   4.0363   3.6222   5.8484  -6.9298   5.5775   75.034   31.097   49.464   23.949 25.57065 39.24983 
1 1 1   30   26   12 o   54.052   24.157  -0.5206   4.0885   5.9450   5.7480  -7.1415   5.8167   82.960   31.994   50.427   24.425 32.53383 40.25148 
1 1 1   30   27    0 o  106.282   39.932   13.035   6.0712   13.035   6.0712   13.035   6.0712  106.282   39.932  106.282   39.932 0.000000 0.000000 
1 1 1   30   27    1 o  117.771   24.773   12.417   4.3241   11.021   6.1008   13.826   6.1296  105.059   33.583  118.235   32.747 -13.17563 46.90628 
1 1 1   30   27    2 o   91.935   27.655   7.8418   4.2085   4.6710   5.8884   11.153   6.0171   78.900   31.763  105.797   33.302 -26.89680 46.02071 
1 1 1   30   27    3 o  109.178   25.503   10.808   4.1849   13.656   5.8501   7.8239   5.9890  118.321   31.674   91.065   33.152 27.25613 45.85079 
1 1 1   30   27    4 o   51.853   23.348  -0.8921   3.8978  -1.5162   5.6402  -0.3216   5.3928   60.062   27.452   61.773   27.666 -1.711365 38.97496 
1 1 1   30   27    5 o  105.266   24.768   9.9934   3.9241   18.042   5.7430   2.9449   5.3744  140.023   27.777   71.367   29.712 68.65684 40.67392 
1 1 1   30   27    6 o   84.018   29.984   6.3919   4.8700   6.3919   4.8700   0.0000   0.0000   84.018   29.984  ?   ?  0.000000 29.98402 
1 1 1   30   27    7 o   60.740   24.296   2.2356   3.4210  -0.1922   4.6290   5.1575   5.0783   58.135   25.863   78.767   30.148 -20.63185 39.72160 
1 1 1   31    0    1 o  119.262   15.117   11.511   2.6389   11.511   2.6389   11.511   2.6389  119.262   15.117  119.262   15.117 0.000000 0.000000 
1 1 1   31    0    2 o  121.942   14.757   11.983   2.6472   11.983   2.6472   11.983   2.6472  121.942   14.757  121.942   14.757 0.000000 0.000000 
1 1 1   31    0    3 o   93.549   20.427   7.6855   2.5619   7.6855   2.5619   7.6855   2.5619   93.549   20.427   93.549   20.427 0.000000 0.000000 
1 1 1   31    0    4 o   41.313   23.773   1.7205   2.4085   1.7205   2.4085   1.7205   2.4085   41.313   23.773   41.313   23.773 0.000000 0.000000 
1 1 1   31    0    5 o  301.839   7.1740   70.021   3.3102   70.021   3.3102   70.021   3.3102  301.839   7.1740  301.839   7.1740 0.000000 0.000000 
1 1 1   31    0    6 o   48.687   24.476   2.7467   2.2451   2.7467   2.2451   2.7467   2.2451   48.687   24.476   48.687   24.476 0.000000 0.000000 
1 1 1   31    0    7 o   42.726   22.672   2.0731   1.9967   2.0731   1.9967   2.0731   1.9967   42.726   22.672   42.726   22.672 0.000000 0.000000 
1 1 1   31    0    8 o   30.985   19.490   0.3970   1.9411   0.3970   1.9411   0.3970   1.9411   30.985   19.490   30.985   19.490 0.000000 0.000000 
1 1 1   31    0    9 o   27.656   18.014  -0.1309   1.8470  -0.1309   1.8470  -0.1309   1.8470   27.656   18.014   27.656   18.014 0.000000 0.000000 
1 1 1   31    0   10 o  157.239   9.5695   19.221   2.2836   19.221   2.2836   19.221   2.2836  157.239   9.5695  157.239   9.5695 0.000000 0.000000 
1 1 1   31    0   11 o  235.165   12.204   42.997   4.3658   42.997   4.3658   42.997   4.3658  235.165   12.204  235.165   12.204 0.000000 0.000000 
1 1 1   31    0   12 o   87.213   31.259   7.9541   3.8142   7.9541   3.8142   7.9541   3.8142   87.213   31.259   87.213   31.259 0.000000 0.000000 
1 1 1   31    0   13 o   28.520   20.329  -5.4598   3.9199  -5.4598   3.9199  -5.4598   3.9199   28.520   20.329   28.520   20.329 0.000000 0.000000 
1 1 1   31    0   14 o  267.535   12.358   55.591   5.0361   55.591   5.0361   55.591   5.0361  267.535   12.358  267.535   12.358 0.000000 0.000000 
1 1 1   31    0   15 o   31.904   22.417  -4.3751   4.2213  -4.3751   4.2213  -4.3751   4.2213   31.904   22.417   31.904   22.417 0.000000 0.000000 
1 1 1   31    0   16 o   77.828   34.946   7.0819   4.4472   7.0819   4.4472   7.0819   4.4472   77.828   34.946   77.828   34.946 0.000000 0.000000 
1 1 1   31    0   17 o  162.739   20.872   21.727   4.9646   21.727   4.9646   21.727   4.9646  162.739   20.872  162.739   20.872 0.000000 0.000000 
1 1 1   31    0   18 o  195.617   18.075   30.588   5.3059   30.588   5.3059   30.588   5.3059  195.617   18.075  195.617   18.075 0.000000 0.000000 
1 1 1   31    0   19 o  133.871   43.289   18.673   7.8387   18.673   7.8387   18.673   7.8387  133.871   43.289  133.871   43.289 0.000000 0.000000 
1 1 1   31    0   20 o   87.911   37.599   8.9772   5.1648   8.9772   5.1648   8.9772   5.1648   87.911   37.599   87.911   37.599 0.000000 0.000000 
1 1 1   31    0   21 o   48.142   31.019   0.5602   5.2798   0.5602   5.2798   0.5602   5.2798   48.142   31.019   48.142   31.019 0.000000 0.000000 
1 1 1   31    0   22 o   89.550   38.313   9.3835   5.3626   9.3835   5.3626   9.3835   5.3626   89.550   38.313   89.550   38.313 0.000000 0.000000 
1 1 1   31    0   23 o   55.456   36.172   0.4659   7.4877   0.4659   7.4877   0.4659   7.4877   55.456   36.172   55.456   36.172 0.000000 0.000000 
1 1 1   31    0   24 o   94.248   45.826   11.492   7.7578   11.492   7.7578   11.492   7.7578   94.248   45.826   94.248   45.826 0.000000 0.000000 
1 1 1   31    0   25 o  133.712   26.621   15.812   4.8378   15.812   4.8378   15.812   4.8378  133.712   26.621  133.712   26.621 0.000000 0.000000 
1 1 1   31    0   26 o   97.911   36.495   10.572   5.0915   10.572   5.0915   10.572   5.0915   97.911   36.495   97.911   36.495 0.000000 0.000000 
1 1 1   31    0   27 o   77.504   37.584   7.5384   5.2126   7.5384   5.2126   7.5384   5.2126   77.504   37.584   77.504   37.584 0.000000 0.000000 
1 1 1   31    0   28 o  138.098   29.750   17.380   5.5180   17.380   5.5180   17.380   5.5180  138.098   29.750  138.098   29.750 0.000000 0.000000 
1 1 1   31    0   29 o   53.273   32.587   2.5902   5.0653   2.5902   5.0653   2.5902   5.0653   53.273   32.587   53.273   32.587 0.000000 0.000000 
1 1 1   31    0   31 o   95.052   40.389   11.077   5.9662   11.077   5.9662   11.077   5.9662   95.052   40.389   95.052   40.389 0.000000 0.000000 
1 1 1   31    0   32 o   26.830   19.098  -4.4235   3.4162  -4.4235   3.4162  -4.4235   3.4162   26.830   19.098   26.830   19.098 0.000000 0.000000 
1 1 1   31    0   33 o   83.896   31.106   7.7882   3.7088   7.7882   3.7088   7.7882   3.7088   83.896   31.106   83.896   31.106 0.000000 0.000000 
1 1 1   31    0   34 o  118.316   24.066   12.599   3.8568   12.599   3.8568   12.599   3.8568  118.316   24.066  118.316   24.066 0.000000 0.000000 
1 1 1   31    0   35 o   70.557   32.257   6.2042   3.7946   6.2042   3.7946   6.2042   3.7946   70.557   32.257   70.557   32.257 0.000000 0.000000 
1 1 1   31    0   36 o   87.023   30.945   8.3194   3.7560   8.3194   3.7560   8.3194   3.7560   87.023   30.945   87.023   30.945 0.000000 0.000000 
1 1 1   31    1    0 o  116.026   15.738   10.969   2.6499   10.969   2.6499   10.969   2.6499  116.026   15.738  116.026   15.738 0.000000 0.000000 
1 1 1   31    1    1 o  176.086   7.6301   23.865   2.0565   24.799   2.8665   22.874   2.9520  178.745   10.524  171.451   11.312 7.293900 15.45047 
1 1 1   31    1    2 f   65.466   17.511   3.4956   1.7889   2.3536   2.4392   4.8246   2.6314   58.602   21.184   76.547   21.547 -17.94560 30.21660 
1 1 1   31    1    3 o   29.309   13.911  -2.0219   1.6846  -0.3461   2.2880  -4.0057   2.4895   42.566   18.585   32.939   15.961 9.627331 24.49788 
1 1 1   31    1    4 o  121.309   11.190   11.494   2.0543   9.5573   2.5906   14.776   3.3719  109.327   15.951  136.216   16.510 -26.88902 22.95677 
1 1 1   31    1    5 o  129.780   8.7321   13.045   1.7245   13.869   2.3669   12.113   2.5177  133.216   11.727  124.000   13.483 9.216339 17.86922 
1 1 1   31    1    6 o  181.513   6.6609   25.327   1.8506   26.520   2.9652   24.566   2.3685  184.839   10.524  178.491   8.6693 6.347397 13.63502 
1 1 1   31    1    7 o  145.321   8.1416   16.320   1.8037   18.136   3.1134   15.403   2.2128  151.974   13.526  140.740   10.345 11.23375 17.02797 
1 1 1   31    1    8 o   51.255   20.762   1.0133   2.5328  -2.7745   5.2489   2.1630   2.8917   57.827   26.451   59.870   22.789 -2.043442 34.91410 
1 1 1   31    1    9 o  115.849   20.794   11.013   3.5517   11.013   3.5517   0.0000   0.0000  115.849   20.794  ?   ?  0.000000 20.79360 
1 1 1   31    1   10 o  168.994   10.149   22.170   2.6130   21.951   3.8144   22.364   3.5867  166.735   15.110  168.664   14.020 -1.929092 20.61310 
1 1 1   31    1   11 o  110.294   10.653   9.5067   1.7761   9.9197   3.7194   9.3847   2.0214  108.992   23.017  109.200   12.309 -0.2088394 26.10147 
1 1 1   31    1   12 o  105.979   11.132   8.8026   1.7788   6.3517   3.8960   9.4481   1.9994   87.180   26.692  109.605   12.120 -22.42524 29.31501 
1 1 1   31    1   13 o  182.304   10.732   25.843   2.9815   22.659   4.3553   28.652   4.0902  168.588   17.115  190.924   14.096 -22.33659 22.17261 
1 1 1   31    1   14 o   43.577   19.713  -1.3272   2.8161  -2.0612   4.1129  -0.6794   3.8640   51.777   23.579   54.123   23.875 -2.345982 33.55538 
1 1 1   31    1   15 o  116.423   17.649   10.955   3.0464   9.5232   4.5101   12.157   4.1313  105.129   27.656  120.656   23.213 -15.52746 36.10682 
1 1 1   31    1   16 o  115.170   19.192   10.831   3.2642   9.6657   4.7691   11.859   4.4772  105.543   28.744  118.130   25.508 -12.58698 38.43034 
1 1 1   31    1   17 o   64.527   24.395   2.6835   3.2993   4.0999   4.9286   1.5333   4.4412   77.922   29.730   65.415   27.103 12.50655 40.23023 
1 1 1   31    1   18 o  170.904   15.959   23.226   4.1265   29.370   5.4090   14.673   6.3824  191.059   18.737  128.130   32.495 62.92813 37.51038 
1 1 1   31    1   19 o  189.349   18.116   28.796   5.1863   15.623   8.0903   37.985   6.7574  129.161   38.229  216.227   20.669 -87.06615 43.45876 
1 1 1   31    1   20 o  156.507   20.399   20.031   4.7704   0.0000   0.0000   20.031   4.7704  ?   ?   156.507   20.399 0.000000 20.39871 
1 1 1   31    1   21 o  110.720   24.131   10.443   3.9739   11.125   7.3915   10.167   4.7131  110.477   37.065  107.643   28.250 2.834084 46.60283 
1 1 1   31    1   22 o   60.460   24.482   1.6829   3.5205   5.2847   5.6206  -0.6424   4.5161   84.199   31.838   58.093   25.709 26.10526 40.92212 
1 1 1   31    1   23 o   71.709   25.504   3.9496   3.5204   5.9121   5.4695   2.5615   4.6000   86.187   31.635   69.481   28.038 16.70673 42.27151 
1 1 1   31    1   24 o   70.273   25.279   3.7466   3.4680   4.5280   5.2503   3.1417   4.6191   79.581   30.608   71.713   28.377 7.867973 41.73852 
1 1 1   31    1   25 o   74.675   27.633   4.1991   4.1874  -0.3978   5.0530   14.277   7.4818   61.532   27.214  121.624   36.938 -60.09186 45.88076 
1 1 1   31    1   26 o   71.948   27.590   3.6184   4.2580   1.6982   5.1020   8.0253   7.7291   68.016   28.674   96.870   37.166 -28.85387 46.94172 
1 1 1   31    1   27 o  114.451   21.056   11.068   3.5526   8.8273   5.2805   12.922   4.8019   98.226   31.228  120.741   26.693 -22.51504 41.08114 
1 1 1   31    1   28 o   67.710   25.112   3.3966   3.4620   2.4997   5.2445   4.0894   4.6089   70.913   29.423   74.771   28.697 -3.858421 41.10006 
1 1 1   31    1   29 o   76.540   25.667   4.9747   3.5445   5.7543   5.2859   4.3378   4.7778   83.314   31.004   76.085   29.214 7.228508 42.59941 
1 1 1   31    1   30 o   58.252   22.369   2.2257   2.8012   3.3019   3.4999   0.3074   4.6725   66.938   25.165   60.557   26.496 6.380775 36.54222 
1 1 1   31    1   31 o   61.909   22.011   2.9968   2.6221  -0.2427   3.4902   7.1940   3.9728   51.418   22.685   88.838   26.902 -37.42010 35.19041 
1 1 1   31    1   32 o   46.870   20.884  -0.5491   3.0310   3.5632   5.7456  -2.1349   3.5679   74.518   30.848   46.009   21.318 28.50900 37.49690 
1 1 1   31    1   33 o   42.420   18.518  -0.0829   2.2706   1.6121   3.4538  -1.3732   3.0134   57.839   23.928   43.819   20.043 14.01981 31.21289 
1 1 1   31    1   34 o   49.746   20.102   1.2710   2.3681   1.7462   3.5760   0.8998   3.1603   58.749   24.329   52.947   22.458 5.801731 33.10983 
1 1 1   31    1   35 o  164.856   10.139   21.477   2.5460   15.349   3.7978   26.479   3.4313  133.993   19.054  181.723   12.410 -47.72954 22.73938 
1 1 1   31    1   36 f   58.070   21.703   2.5674   2.5956   1.0261   3.6463   4.1506   3.6956   55.776   23.902   69.814   25.935 -14.03779 35.26974 
1 1 1   31    2    0 f  101.197   20.425   8.8556   2.8030   8.8556   2.8030   8.8556   2.8030  101.197   20.425  101.197   20.425 0.000000 0.000000 
1 1 1   31    2    1 o  220.662   7.0919   37.449   2.3953   36.478   3.3126   38.512   3.4676  217.265   9.9612  223.200   10.150 -5.935471 14.22136 
1 1 1   31    2    2 o   59.547   18.581   2.7995   1.8779   4.6341   2.6475   0.9418   2.6641   75.164   21.762   51.924   21.196 23.23959 30.37869 
1 1 1   31    2    3 o   62.284   19.648   3.0619   2.0935   6.4452   2.5365  -4.1684   3.7081   88.566   19.260   43.572   20.669 44.99443 28.25124 
1 1 1   31    2    4 o  107.322   10.100   8.9801   1.6397   9.8677   2.5862   8.3835   2.1203  111.208   15.624  102.827   13.822 8.381058 20.86047 
1 1 1   31    2    5 o  102.694   11.487   8.2747   1.7747   10.880   2.3553   4.8531   2.6994  117.479   13.335   76.764   21.900 40.71590 25.63987 
1 1 1   31    2    6 o  110.408   13.396   9.6281   2.2175   7.7218   3.7736   10.634   2.7406   95.679   25.359  115.409   15.940 -19.72974 29.95240 
1 1 1   31    2    7 o  140.192   8.8254   15.219   1.8841   16.725   3.8821   14.755   2.1549  144.494   17.939  137.739   10.296 6.755890 20.68321 
1 1 1   31    2    8 o  131.183   9.6596   13.366   1.9259   12.772   5.1805   13.462   2.0746  122.106   28.275  131.502   10.392 -9.396095 30.12434 
1 1 1   31    2    9 o   37.532   16.011   0.0317   1.6228   0.9973   3.6966  -0.1989   1.8061   59.255   24.654   38.306   16.621 20.94967 29.73300 
1 1 1   31    2   10 o   63.304   16.927   3.2690   1.6718   6.5727   3.7534   2.4514   1.8673   88.502   25.995   56.562   18.618 31.94036 31.97497 
1 1 1   31    2   11 o   68.803   16.000   3.8649   1.6531   5.1173   3.8655   3.5845   1.8288   80.075   26.804   66.182   17.707 13.89327 32.12448 
1 1 1   31    2   12 o  109.531   11.052   9.3938   1.8276   6.6154   6.2959   9.6494   1.9098   92.639   33.950  110.945   11.409 -18.30589 35.81590 
1 1 1   31    2   13 o   41.502   16.550   0.7355   1.5825  -1.1652   6.3517   0.8613   1.6340   67.873   30.238   42.854   16.903 25.01921 34.64171 
1 1 1   31    2   14 o   93.386   12.098   6.8909   1.6887   11.774   6.6651   6.5559   1.7456  114.917   34.856   90.853   12.917 24.06394 37.17207 
1 1 1   31    2   15 o   61.807   23.494   2.3739   3.0706   5.6178   6.6479   1.4942   3.4620   89.433   34.430   59.712   24.244 29.72153 42.10935 
1 1 1   31    2   16 o   55.489   22.126   1.4596   2.8284   5.2217   4.8146  -0.5229   3.4950   82.637   29.779   51.886   22.803 30.75066 37.50701 
1 1 1   31    2   17 o   69.054   23.058   3.7462   2.8604   0.7100   5.1488   5.1015   3.4400   66.403   28.428   78.861   25.219 -12.45856 38.00232 
1 1 1   31    2   18 o  110.959   21.127   10.216   3.4571   16.671   5.5400   6.0987   4.4243  139.705   26.883   85.969   28.676 53.73616 39.30678 
1 1 1   31    2   19 o   51.667   21.894   0.4166   2.9992   1.4299   5.7740   0.0422   3.5098   71.586   30.359   53.901   23.278 17.68539 38.25668 
1 1 1   31    2   20 o   92.476   23.664   7.2780   3.3634   0.9553   8.8387   8.3486   3.6370   82.791   36.328   98.890   24.220 -16.09926 43.66144 
1 1 1   31    2   21 o   48.365   21.338  -0.5634   3.0878  -0.7469   6.1243  -0.5009   3.5755   66.959   29.770   52.296   23.022 14.66334 37.63350 
1 1 1   31    2   22 o   62.923   23.922   2.5575   3.1838   3.9554   6.0568   2.0237   3.7426   80.517   32.285   63.189   25.363 17.32805 41.05606 
1 1 1   31    2   23 o   53.667   22.624   0.6488   3.1761  -5.5222   5.8886   3.1805   3.7717   55.158   26.130   68.584   26.046 -13.42611 36.89428 
1 1 1   31    2   24 o   85.125   23.831   6.2193   3.2280   12.333   5.7724   3.4375   3.8937  116.199   31.614   70.159   26.507 46.04041 41.25624 
1 1 1   31    2   25 o   50.926   22.034   0.0555   3.1562  -2.0949   5.3858   1.1802   3.8951   58.993   26.910   60.121   25.185 -1.127850 36.85694 
1 1 1   31    2   26 o  133.922   16.333   14.525   3.2787   11.915   5.2618   16.182   4.1921  114.375   29.768  139.526   20.218 -25.15068 35.98505 
1 1 1   31    2   27 o   60.454   25.726   0.9341   4.1707   1.1150   5.1456   0.5878   7.1207   66.110   28.365   73.295   32.367 -7.184387 43.03667 
1 1 1   31    2   28 o   49.113   22.898  -2.9905   4.2178  -1.2085   5.1312  -6.7029   7.4060   59.226   26.717   60.361   28.796 -1.135101 39.28095 
1 1 1   31    2   29 o   40.265   19.176  -3.6208   3.2554  -5.3683   5.3154  -2.5719   4.1181   51.193   24.415   49.321   22.870 1.872433 33.45305 
1 1 1   31    2   30 o   86.041   20.071   6.3434   2.5949   2.4207   3.5774   10.699   3.7697   62.912   24.948  110.836   22.975 -47.92397 33.91494 
1 1 1   31    2   31 o   92.364   16.822   7.1111   2.2906   2.7639   3.5436   10.231   3.0022   64.071   25.005  110.419   18.412 -46.34804 31.05190 
1 1 1   31    2   32 o  113.115   14.390   10.409   2.4351   10.453   3.9966   10.383   3.0710  107.600   24.778  110.781   18.782 -3.181290 31.09199 
1 1 1   31    2   33 o   48.637   20.194   0.8965   2.4727   8.9142   4.5914  -2.3791   2.9347   96.384   28.861   40.226   18.867 56.15794 34.48100 
1 1 1   31    2   34 f   55.513   20.342   2.3191   2.2603   0.1956   3.4812   3.8667   2.9719   52.200   22.854   67.442   23.478 -15.24215 32.76488 
1 1 1   31    2   35 o  128.543   13.560   13.426   2.6276   12.174   4.7160   13.990   3.1643  112.713   27.565  129.622   16.310 -16.90919 32.02851 
1 1 1   31    3    0 o  243.073   10.013   45.670   3.7109   45.670   3.7109   45.670   3.7109  243.073   10.013  243.073   10.013 0.000000 0.000000 
1 1 1   31    3    1 o   79.905   19.452   5.2618   2.3568   5.9103   2.7862   3.6310   4.4185   84.389   21.507   74.564   28.221 9.825607 35.48212 
1 1 1   31    3    2 o  165.100   10.168   21.151   2.5570   20.270   3.0644   23.171   4.6392  161.035   12.531  170.417   18.061 -9.381424 21.98210 
1 1 1   31    3    3 o   73.681   17.190   4.4402   1.9031   5.3685   2.7421   3.5773   2.6436   80.504   21.742   67.646   22.147 12.85836 31.03562 
1 1 1   31    3    4 o  230.447   8.1499   40.911   2.8747   39.482   6.1281   41.315   3.2551  222.850   18.123  231.373   9.1913 -8.523300 20.32018 
1 1 1   31    3    5 o  158.630   8.2529   19.441   1.9969   17.703   4.1691   19.958   2.2749  148.447   18.768  160.532   9.2979 -12.08559 20.94470 
1 1 1   31    3    6 o  178.769   7.4464   24.595   2.0375   27.355   4.3469   23.818   2.3066  186.253   15.386  175.763   8.5740 10.49036 17.61338 
1 1 1   31    3    7 o  105.098   12.648   8.7083   1.9938   0.0000   0.0000   8.7083   1.9938  ?   ?   105.098   12.648 0.000000 12.64836 
1 1 1   31    3    8 o  125.729   9.9456   12.295   1.8984   11.567   4.4245   12.460   2.1016  117.116   25.412  126.352   10.976 -9.235901 27.68109 
1 1 1   31    3    9 o   61.055   18.144   2.9993   1.8197   8.3951   5.4408   2.3196   1.9309   99.400   31.708   55.785   18.943 43.61546 36.93600 
1 1 1   31    3   10 o   36.187   17.524  -4.6975   2.9898  -7.1789   4.1806  -2.0997   4.2775   41.464   20.224   52.948   24.087 -11.48393 31.45142 
1 1 1   31    3   11 o  124.918   18.178   12.594   3.3738   17.271   4.6150   7.2243   4.9446  145.380   21.378   93.003   30.281 52.37721 37.06710 
1 1 1   31    3   12 o   79.971   24.166   5.2873   3.2082   7.0034   4.3891   3.3185   4.7012   91.242   28.397   74.054   28.829 17.18761 40.46550 
1 1 1   31    3   13 o  121.665   19.131   12.035   3.4450   16.590   4.8790   7.5048   4.8650  141.488   23.343   94.225   29.976 47.26352 37.99266 
1 1 1   31    3   14 o  111.349   21.846   10.296   3.5903   8.1948   4.9586   12.612   5.2053   97.770   30.143  120.757   28.602 -22.98689 41.55336 
1 1 1   31    3   15 o  160.624   15.987   20.507   3.8782   24.154   5.2043   15.953   5.8157  172.704   20.061  135.923   28.846 36.78078 35.13631 
1 1 1   31    3   16 o   54.944   24.010  -0.3285   3.8264  -3.7923   5.1259   4.0310   5.7506   54.426   25.331   80.647   31.741 -26.22087 40.60985 
1 1 1   31    3   17 o   85.777   31.455   5.6025   5.4059   5.6025   5.4059   0.0000   0.0000   85.777   31.455  ?   ?  0.000000 31.45549 
1 1 1   31    3   18 o   67.808   26.957   2.4824   4.1866   3.4418   5.8168   1.4513   6.0304   78.539   31.587   72.948   30.986 5.591164 44.24757 
1 1 1   31    3   19 o  159.146   9.8333   19.694   2.3836   13.147   6.2754   20.797   2.5767  120.751   33.009  163.423   10.355 -42.67155 34.59459 
1 1 1   31    3   20 o  129.311   12.604   13.180   2.4630   10.411   6.4620   13.650   2.6641  107.647   34.579  131.365   13.439 -23.71802 37.09871 
1 1 1   31    3   21 o  115.408   15.348   10.684   2.6440   11.172   9.8545   10.646   2.7446  111.846   42.190  114.966   16.034 -3.120041 45.13400 
1 1 1   31    3   22 o   35.601   16.830  -2.5896   2.4184  -0.1219   6.1306  -3.0444   2.6318   68.396   30.127   36.466   17.331 31.92986 34.75613 
1 1 1   31    3   23 o   58.569   21.640   2.3487   2.5661   8.5548   6.1929   1.0623   2.8195   98.479   33.914   53.044   21.746 45.43504 40.28715 
1 1 1   31    3   24 o   76.709   22.076   4.9752   2.7317  -1.1624   5.7438   6.7692   3.1053   63.391   28.460   88.922   22.729 -25.53032 36.42251 
1 1 1   31    3   25 o  111.832   17.081   10.217   2.8310   12.698   5.5642   9.3500   3.2885  118.016   30.561  105.214   21.154 12.80239 37.16777 
1 1 1   31    3   26 o  161.928   12.540   20.718   3.0839   19.669   5.6718   21.158   3.6745  150.755   25.488  162.603   14.931 -11.84796 29.53952 
1 1 1   31    3   27 o   81.366   20.257   5.6334   2.5131   11.005   5.4609   4.1900   2.8307  108.873   31.178   70.914   22.897 37.95876 38.68298 
1 1 1   31    3   28 o  140.926   12.852   15.780   2.7418   19.465   5.6839   14.662   3.1300  149.138   25.835  134.708   15.461 14.42979 30.10805 
1 1 1   31    3   29 o  103.980   26.818   9.7557   4.2961   0.0000   0.0000   9.7557   4.2961  ?   ?   103.980   26.818 0.000000 26.81832 
1 1 1   31    3   30 o   53.404   20.482   1.8138   2.3467   0.9146   3.3777   2.6530   3.2628   55.220   23.308   62.607   24.116 -7.386784 33.53867 
1 1 1   31    3   31 o   49.971   19.399   1.5019   2.1240  -0.0557   3.4426   2.4592   2.6989   51.702   22.679   58.837   22.103 -7.135201 31.66837 
1 1 1   31    3   32 o   36.113   16.753  -1.5863   2.2137  -2.0393   3.8832  -1.3682   2.6943   48.444   22.373   41.306   18.915 7.138218 29.29711 
1 1 1   31    3   33 o   44.031   18.555   0.4969   2.1351   0.0964   3.3590   0.7683   2.7657   51.257   22.445   50.020   21.101 1.237099 30.80675 
1 1 1   31    3   34 o  129.736   18.097   14.212   3.4958   16.291   8.2878   13.761   3.8555  118.668   39.232  125.876   20.733 -7.207787 44.37331 
1 1 1   31    3   35 o   48.882   19.609   1.2989   2.2357   0.8393   3.5120   1.6120   2.8989   54.502   23.410   54.416   22.150 0.8586121E-01 32.22794 
1 1 1   31    4    0 o  166.669   24.186   23.105   5.7917   23.105   5.7917   23.105   5.7917  166.669   24.186  166.669   24.186 0.000000 0.000000 
1 1 1   31    4    1 o   75.886   20.515   4.7465   2.4399   13.054   5.5950   2.7958   2.7113  122.970   29.994   62.741   22.374 60.22944 37.41967 
1 1 1   31    4    2 o   60.406   22.525   2.3450   2.7929   3.6893   5.4742   1.8720   3.2474   79.011   31.010   60.457   23.834 18.55455 39.11077 
1 1 1   31    4    3 o  227.672   8.8735   39.982   3.0922   42.107   6.4130   39.338   3.5297  230.061   18.365  225.543   10.224 4.518845 21.01888 
1 1 1   31    4    4 o  157.362   8.8355   19.159   2.1195   22.936   6.0628   18.633   2.2623  166.730   24.486  155.032   9.5805 11.69823 26.29397 
1 1 1   31    4    5 o  108.378   11.920   9.2231   1.9447   11.463   6.1860   8.9774   2.0486  114.412   33.306  106.702   12.799 7.709976 35.68049 
1 1 1   31    4    6 o   94.377   12.320   7.0332   1.7372   7.5765   4.0061   6.9074   1.9279   94.654   26.566   93.117   13.957 1.537140 30.00872 
1 1 1   31    4    7 o   42.818   19.501  -1.5713   2.8144  -3.3008   4.0525   0.0401   3.9116   48.253   22.480   57.058   24.608 -8.804329 33.33049 
1 1 1   31    4    8 o  233.806   10.039   42.275   3.5926   46.266   5.0578   38.211   5.1038  243.167   13.644  220.315   15.228 22.85207 20.44668 
1 1 1   31    4    9 o   60.477   24.137   1.7485   3.3687   2.3792   5.7627   1.4211   4.1520   75.316   31.008   63.679   26.280 11.63710 40.64671 
1 1 1   31    4   10 o  142.109   15.202   16.002   3.2554   17.935   4.7071   14.230   4.5070  148.222   21.365  130.954   23.341 17.26785 31.64285 
1 1 1   31    4   11 o   58.024   23.198   1.5688   3.1173   1.8339   4.4601   1.3157   4.3587   66.932   27.385   64.399   26.780 2.532875 38.30312 
1 1 1   31    4   12 o   51.814   22.295   0.0412   3.1957   1.3339   4.5625  -1.2037   4.4774   65.567   27.344   56.766   25.332 8.800697 37.27422 
1 1 1   31    4   13 o   58.419   23.800   1.3492   3.3506   6.8660   4.6647  -4.5307   4.8158   90.681   29.406   50.887   23.962 39.79333 37.93262 
1 1 1   31    4   14 o   88.962   25.420   6.6878   3.6341   6.4797   5.1054   6.9015   5.1741   89.342   30.791   91.472   31.009 -2.130074 43.69957 
1 1 1   31    4   15 o   53.132   23.302  -0.4608   3.6325  -2.0114   5.1178   1.1134   5.1566   58.578   26.529   67.838   28.726 -9.260246 39.10218 
1 1 1   31    4   16 o  198.232   20.537   31.856   6.1409   31.856   6.1409   0.0000   0.0000  198.232   20.537  ?   ?  0.000000 20.53690 
1 1 1   31    4   17 o   41.427   19.986  -5.4542   3.7989  -1.7764   5.6035  -8.5824   5.1679   61.968   27.940   46.081   22.479 15.88667 35.85964 
1 1 1   31    4   18 o  179.802   16.083   25.719   4.3795   24.190   6.0959   27.350   6.2961  170.470   24.029  181.927   23.133 -11.45682 33.35483 
1 1 1   31    4   19 o  145.626   20.948   17.427   4.5349   13.724   6.4950   20.950   6.3347  123.032   33.560  156.367   27.470 -33.33501 43.36917 
1 1 1   31    4   20 o  187.743   17.000   28.209   4.8322   36.293   7.0743   21.138   6.6163  209.969   22.356  156.089   28.752 53.87993 36.42084 
1 1 1   31    4   21 o  105.107   30.988   9.8467   5.3248   0.3854   9.3033   14.456   6.4937   82.852   36.771  125.901   33.216 -43.04928 49.55202 
1 1 1   31    4   22 o  127.601   10.514   12.739   2.0351   21.457   6.7217   11.859   2.1354  156.486   29.135  122.822   11.492 33.66366 31.31990 
1 1 1   31    4   23 o  117.871   12.282   10.981   2.1833   4.4571   6.1865   11.909   2.3334   82.303   32.753  122.700   12.604 -40.39617 35.09461 
1 1 1   31    4   24 o   37.582   16.786  -0.6682   1.9711  -0.6372   5.7525  -0.6723   2.0981   64.724   28.810   38.880   17.346 25.84383 33.62893 
1 1 1   31    4   25 o  122.100   12.470   11.812   2.2978   8.7378   5.9076   12.360   2.4942   98.295   33.135  124.650   13.277 -26.35464 35.69644 
1 1 1   31    4   26 o  112.053   15.813   10.190   2.6367   8.1050   5.7889   10.736   2.9618   95.020   32.785  114.380   17.472 -19.35930 37.15036 
1 1 1   31    4   27 o  115.307   14.352   10.692   2.4781   13.488   5.8941   10.091   2.7312  120.203   31.613  111.105   16.567 9.098343 35.69109 
1 1 1   31    4   28 o   65.595   21.197   3.5437   2.4255   2.2507   5.5728   3.8459   2.6940   71.308   30.010   68.215   22.359 3.093193 37.42363 
1 1 1   31    4   29 o   94.340   16.190   7.3303   2.2536   9.3684   3.3545   5.6537   3.0424  104.359   21.707   80.536   23.333 23.82372 31.86869 
1 1 1   31    4   30 o   88.156   19.997   6.6618   2.6362   4.3138   3.3465   10.502   4.2797   71.955   24.922  107.785   26.197 -35.82989 36.15768 
1 1 1   31    4   31 o  127.845   13.013   13.103   2.5110   16.057   4.2473   11.516   3.1133  137.158   20.891  117.464   17.880 19.69363 27.49813 
1 1 1   31    4   32 o  166.425   11.847   22.016   2.9981   0.0000   0.0000   22.016   2.9981  ?   ?   166.425   11.847 0.000000 11.84706 
1 1 1   31    4   33 o   40.930   18.378  -0.6973   2.3956  -5.1011   5.0428   0.5863   2.7224   49.026   23.489   48.874   20.791 0.1525650 31.36906 
1 1 1   31    4   34 o   77.205   18.961   5.1857   2.2244   3.6676   3.4761   6.2384   2.8946   67.320   25.124   83.280   22.274 -15.96029 33.57636 
1 1 1   31    4   35 o   48.284   20.183   0.8652   2.4940   0.4338   4.6958   1.0347   2.9434   59.238   26.215   51.962   21.836 7.275322 34.11829 
1 1 1   31    5    0 o   65.193   37.228   4.7105   5.8397   4.7105   5.8397   4.7105   5.8397   65.193   37.228   65.193   37.228 0.000000 0.000000 
1 1 1   31    5    1 o   89.675   22.150   6.6991   3.0223   0.5535   6.0472   8.7452   3.4894   71.194   30.651  102.414   22.841 -31.21976 38.22604 
1 1 1   31    5    2 o  236.678   9.1347   43.230   3.3092   43.670   7.0586   43.106   3.7464  233.502   19.941  236.055   10.369 -2.552887 22.47543 
1 1 1   31    5    3 o  198.081   10.025   30.408   3.0295   25.882   6.7867   31.534   3.3855  176.548   25.883  201.466   11.021 -24.91826 28.13187 
1 1 1   31    5    4 o  113.660   11.068   10.101   1.9011   18.757   6.2994   9.2333   1.9941  148.433   28.765  108.362   12.237 40.07149 31.26015 
1 1 1   31    5    5 o  204.707   6.5435   32.211   2.0503   39.275   6.9469   31.537   2.1459  220.860   20.795  202.501   6.9232 18.35812 21.91671 
1 1 1   31    5    6 o  272.753   9.0143   57.412   3.7633   63.279   5.2266   51.096   5.4231  285.450   11.963  255.490   13.920 29.95943 18.35408 
1 1 1   31    5    7 o  180.562   11.767   25.413   3.2344   25.967   4.6258   24.884   4.5242  180.809   16.911  176.972   16.908 3.836975 23.91352 
1 1 1   31    5    8 o  211.480   10.785   34.733   3.4795   37.848   4.9606   31.717   4.8819  219.377   14.861  200.284   16.060 19.09340 21.88047 
1 1 1   31    5    9 o   78.907   23.405   5.1431   3.0301   8.7685   4.6510   2.4696   3.9940  101.110   28.711   67.198   26.451 33.91203 39.03818 
1 1 1   31    5   10 f   99.618   22.819   8.3090   3.4047   6.7603   5.5454   9.2459   4.3134   91.714   32.063  104.010   26.895 -12.29659 41.84935 
1 1 1   31    5   11 o   72.606   24.027   4.1674   3.1083   2.5431   4.4691   5.6893   4.3260   69.777   27.816   84.072   28.355 -14.29518 39.72062 
1 1 1   31    5   12 o  176.981   13.473   24.586   3.6224   27.463   5.0797   21.609   5.1672  185.294   18.143  162.854   21.235 22.43933 27.92998 
1 1 1   31    5   13 o   46.462   21.000  -1.4265   3.1880  -1.0101   4.6891  -1.7844   4.3472   58.646   26.063   54.187   24.504 4.459476 35.77310 
1 1 1   31    5   14 o  203.949   12.765   32.548   3.9648   27.323   5.2704   39.359   6.0178  184.339   18.949  222.115   17.851 -37.77580 26.03331 
1 1 1   31    5   15 o   57.218   26.102  -2.4248   5.0683  -2.4248   5.0683   0.0000   0.0000   57.218   26.102  ?   ?  0.000000 26.10242 
1 1 1   31    5   16 o  200.205   13.973   31.531   4.2550   30.270   5.7615   33.044   6.3110  193.574   19.721  201.786   20.728 -8.211716 28.61035 
1 1 1   31    5   17 o  138.372   19.513   15.588   4.0181   13.991   5.6263   17.251   5.7403  126.421   29.598  141.890   27.423 -15.46939 40.34943 
1 1 1   31    5   18 o  151.551   18.330   18.549   4.1657   27.120   6.0463   10.804   5.7474  181.595   22.216  110.124   32.117 71.47009 39.05161 
1 1 1   31    5   19 o  172.572   17.132   23.864   4.4655   19.564   6.3243   28.141   6.3062  150.294   28.535  184.505   22.816 -34.21085 36.53558 
1 1 1   31    5   20 o   82.754   28.089   5.6177   4.2454   7.3367   6.2781   4.1693   5.7628   94.176   33.995   80.532   31.750 13.64409 46.51528 
1 1 1   31    5   21 o  112.386   20.701   10.510   3.4298   16.884   9.3889   9.5280   3.6844  131.073   41.637  105.832   23.369 25.24034 47.74659 
1 1 1   31    5   22 o  103.320   21.355   8.9792   3.2655   8.3682   6.5856   9.1784   3.7604   98.191   34.886  103.367   24.195 -5.176041 42.45531 
1 1 1   31    5   23 f   83.771   23.638   6.0044   3.1628   6.0896   6.0994   5.9731   3.6990   88.013   33.194   83.604   26.077 4.408203 42.21211 
1 1 1   31    5   24 o  172.085   7.6559   22.874   2.0166   23.585   6.5983   22.800   2.1179  164.794   27.101  171.724   8.0576 -6.929443 28.27362 
1 1 1   31    5   25 o   65.114   18.021   3.5288   1.8570  -2.0914   6.2568   4.0716   1.9446   63.537   28.992   69.776   18.066 -6.238689 34.15952 
1 1 1   31    5   26 o  169.738   9.9909   22.506   2.5843   21.901   6.4102   22.623   2.8239  157.601   27.578  169.850   10.920 -12.24887 29.66094 
1 1 1   31    5   27 f  110.491   13.840   9.7997   2.2893  -1.1921   6.0280   11.652   2.4747   64.045   28.918  120.690   13.635 -56.64546 31.97118 
1 1 1   31    5   28 o   66.147   21.000   3.6313   2.3886   3.3385   5.9189   3.6883   2.6106   76.045   31.381   66.946   22.013 9.099136 38.33157 
1 1 1   31    5   29 o  166.616   9.8419   21.726   2.4988   25.704   4.2122   19.566   3.1040  178.424   15.580  156.770   13.054 21.65411 20.32609 
1 1 1   31    5   30 f   92.952   16.737   7.1830   2.2937   6.4341   3.9964   7.5509   2.8009   84.603   27.195   93.871   20.100 -9.267654 33.81696 
1 1 1   31    5   31 o   66.931   23.641   3.6522   3.0200   5.4638   4.0338   1.3419   4.5554   78.824   27.358   62.705   26.790 16.11903 38.29056 
1 1 1   31    5   32 o   68.768   19.416   4.0780   2.1332   7.6899   3.4361   1.8127   2.7212   92.178   24.087   55.004   21.775 37.17324 32.47075 
1 1 1   31    5   33 o   50.872   19.864   1.5959   2.2371   3.2457   3.8926   0.7822   2.7337   66.732   26.162   49.798   20.991 16.93387 33.54213 
1 1 1   31    5   34 o   57.162   20.172   2.6049   2.1983   0.8499   3.4919   3.7572   2.8293   54.567   23.388   66.385   22.920 -11.81844 32.74579 
1 1 1   31    5   35 o   55.403   20.438   2.3220   2.2870  -0.0271   3.6090   3.8984   2.9564   51.922   22.980   67.243   23.417 -15.32049 32.80874 
1 1 1   31    6    1 o  126.159   23.588   13.218   4.3875   8.9721   6.4818   16.809   5.9605  103.137   34.709  140.342   28.715 -37.20417 45.04731 
1 1 1   31    6    2 o  265.719   11.160   54.722   4.5390   52.131   7.1079   56.507   5.8984  256.095   18.252  268.539   14.403 -12.44391 23.25046 
1 1 1   31    6    3 o  163.111   7.9647   20.494   1.9885   10.108   6.6483   21.514   2.0839  108.151   35.108  167.097   8.1477 -58.94596 36.04124 
1 1 1   31    6    4 o   90.880   23.250   6.9175   3.2473   12.470   6.6573   5.1839   3.7198  118.705   34.550   80.263   26.271 38.44209 43.40371 
1 1 1   31    6    5 o  107.062   21.128   9.4584   3.3394   5.3260   6.6337   10.861   3.8647   88.918   34.348  114.291   22.890 -25.37345 41.27640 
1 1 1   31    6    6 o  203.374   10.948   32.139   3.3955   28.913   4.8149   35.331   4.7892  190.968   16.639  211.948   14.857 -20.98050 22.30618 
1 1 1   31    6    7 o   71.079   23.298   3.9905   2.9250   2.5080   4.3408   5.2234   3.9587   69.116   27.458   80.915   27.125 -11.79863 38.59687 
1 1 1   31    6    8 f  144.522   14.736   16.511   3.2142   12.732   4.6655   19.924   4.4344  122.796   25.650  157.441   18.771 -34.64535 31.78493 
1 1 1   31    6    9 o  111.032   19.397   10.067   3.1766   8.6814   4.7248   11.209   4.2912  100.562   29.060  115.243   25.043 -14.68059 38.36149 
1 1 1   31    6   10 o  166.144   15.386   21.840   3.8684   23.265   6.4874   21.054   4.8188  166.610   26.312  161.343   19.937 5.266190 33.01253 
1 1 1   31    6   11 o   83.814   23.612   5.8770   3.1585   5.2327   4.7576   6.3848   4.2236   82.773   29.626   87.632   27.936 -4.858421 40.71966 
1 1 1   31    6   12 o  172.611   14.360   23.478   3.7595   20.891   5.2953   26.108   5.3383  159.558   22.291  179.890   19.710 -20.33243 29.75543 
1 1 1   31    6   13 o  116.756   20.790   11.225   3.5792   12.022   5.1072   10.456   5.0174  117.811   28.608  109.647   29.325 8.163979 40.96813 
1 1 1   31    6   14 o  168.297   21.202   23.103   5.3405   23.103   5.3405   0.0000   0.0000  168.297   21.202  ?   ?  0.000000 21.20243 
1 1 1   31    6   15 o  181.029   14.291   25.833   3.9278   30.623   5.7307   21.590   5.3939  194.872   19.474  161.998   22.348 32.87349 29.64226 
1 1 1   31    6   16 o   84.419   26.011   5.9724   3.6931   4.0098   5.4413   7.6488   5.0288   79.336   30.979   94.689   30.514 -15.35305 43.48298 
1 1 1   31    6   17 o   90.630   26.487   7.0117   3.9055  -0.3777   5.8586   12.922   5.2396   66.875   29.454  121.776   28.598 -54.90076 41.05352 
1 1 1   31    6   18 o  224.353   13.596   39.566   4.6467   38.199   6.6322   40.884   6.5124  217.028   20.197  225.255   19.068 -8.226425 27.77557 
1 1 1   31    6   19 o   77.835   23.240   5.0653   2.9802  -6.9957   6.2032   8.6846   3.3981   54.777   26.193  101.439   22.477 -46.66204 34.51531 
1 1 1   31    6   20 o  136.095   15.123   14.777   3.0971   14.469   6.7233   14.860   3.4893  125.559   34.102  135.699   17.185 -10.14024 38.18669 
1 1 1   31    6   21 o  138.589   15.874   15.398   3.3067   10.954   6.9196   16.713   3.7643  109.307   35.834  143.794   17.461 -34.48679 39.86162 
1 1 1   31    6   22 o  141.927   17.071   16.276   3.6340   34.456   10.658   13.885   3.8656  191.236   37.753  129.618   20.138 61.61789 42.78790 
1 1 1   31    6   23 o  149.299   15.126   17.819   3.4089   15.558   6.2906   18.759   4.0562  130.552   31.779  152.034   17.765 -21.48181 36.40779 
1 1 1   31    6   24 o  104.890   21.182   9.2945   3.2836   17.252   6.1837   6.1697   3.8751  138.407   30.051   84.570   26.737 53.83679 40.22314 
1 1 1   31    6   25 o   61.710   23.901   2.3913   3.2187   2.8826   6.1965   2.2097   3.7667   76.283   31.844   63.535   25.465 12.74712 40.77392 
1 1 1   31    6   26 o  116.710   25.856   12.001   4.4974   4.6706   6.3379   19.435   6.3827   82.295   33.016  146.827   29.426 -64.53170 44.22572 
1 1 1   31    6   27 o  172.815   8.7172   23.230   2.2984   12.784   6.2755   24.849   2.4700  115.610   33.515  178.632   9.0635 -63.02176 34.71877 
1 1 1   31    6   28 o   65.576   19.997   3.5958   2.1895  -8.4497   8.4518   4.4623   2.2669   62.416   30.035   72.435   19.855 -10.01893 36.00485 
1 1 1   31    6   29 o  140.229   10.244   15.446   2.1835   24.700   4.0008   11.521   2.6058  175.096   15.075  119.382   14.562 55.71366 20.95968 
1 1 1   31    6   30 o   40.738   17.570   0.0419   1.9940  -1.9172   3.4755   1.0032   2.4346   46.102   21.247   49.257   20.202 -3.155838 29.31866 
1 1 1   31    6   31 o   69.133   18.657   4.0924   2.0200   8.6137   3.4232   1.6770   2.5021   98.435   23.115   53.175   20.934 45.26061 31.18556 
1 1 1   31    6   32 o   42.199   19.214  -1.1639   2.7295  -3.6057   3.4469   2.9417   4.4695   41.347   19.703   67.686   27.522 -26.33830 33.84758 
1 1 1   31    6   33 o   45.207   18.929   0.6426   2.1991   0.5715   4.1693   0.6700   2.5885   57.466   25.089   48.232   20.384 9.233837 32.32607 
1 1 1   31    6   34 o  128.856   12.020   13.320   2.3434   9.6948   3.9151   15.344   2.9253  102.082   25.207  137.212   14.131 -35.12939 28.89776 
1 1 1   31    6   35 o   97.398   15.920   7.9512   2.2914   7.3130   3.7266   8.3391   2.9056   87.838   25.931   97.414   20.152 -9.576637 32.84073 
1 1 1   31    7    0 o  524.408   12.492  212.514   10.014  212.514   10.014  212.514   10.014  524.408   12.492  524.408   12.492 0.000000 0.000000 
1 1 1   31    7    1 o   99.544   29.152   8.4620   4.7267   0.0000   0.0000   8.4620   4.7267  ?   ?    99.544   29.152 0.000000 29.15243 
1 1 1   31    7    2 o   58.920   23.009   1.8716   3.0020   4.7623   6.2435   1.0023   3.4237   85.648   33.256   57.502   23.809 28.14632 40.89977 
1 1 1   31    7    3 o  153.444   32.432   20.555   7.3788   20.555   7.3788   0.0000   0.0000  153.444   32.432  ?   ?  0.000000 32.43192 
1 1 1   31    7    4 o  118.193   36.886   12.452   7.3999   12.452   7.3999   0.0000   0.0000  118.193   36.886  ?   ?  0.000000 36.88617 
1 1 1   31    7    5 o  190.531   13.806   28.478   3.9989   14.870   7.4094   34.070   4.7501  128.557   36.146  208.037   15.018 -79.48096 39.14149 
1 1 1   31    7    6 o  146.204   14.082   16.846   3.1124   19.393   4.6258   14.739   4.2072  154.834   19.985  134.225   21.181 20.60921 29.12078 
1 1 1   31    7    7 o   54.701   21.950   1.3136   2.8022  -0.9610   4.3419   2.9374   3.6684   56.635   25.129   67.818   25.703 -11.18340 35.94567 
1 1 1   31    7    8 o   72.558   23.269   4.2216   2.9270   12.542   4.6157  -1.3750   3.7855  121.840   25.566   51.403   23.089 70.43672 34.44882 
1 1 1   31    7    9 o  119.986   18.503   11.662   3.2889   17.075   4.8706   7.1255   4.4591  143.844   22.888   91.969   28.622 51.87553 36.64845 
1 1 1   31    7   10 o  248.368   10.587   47.794   4.0246   54.731   5.8716   41.646   5.5272  263.965   14.589  229.625   15.823 34.33960 21.52202 
1 1 1   31    7   11 o   51.058   22.586  -0.7543   3.4817  -6.6568   5.9954   2.2494   4.2768   54.513   25.979   67.553   27.114 -13.04028 37.55102 
1 1 1   31    7   12 o  168.093   21.454   23.057   5.3940   23.057   5.3940   0.0000   0.0000  168.093   21.454  ?   ?  0.000000 21.45405 
1 1 1   31    7   13 o   82.675   31.040   4.8881   5.3214   4.8881   5.3214   0.0000   0.0000   82.675   31.040  ?   ?  0.000000 31.04035 
1 1 1   31    7   14 o   77.059   25.442   4.7820   3.4859   3.8705   5.3088   5.4728   4.6219   78.419   30.605   83.333   29.264 -4.914795 42.34443 
1 1 1   31    7   15 o  120.068   20.922   11.892   3.7053   11.634   5.5243   12.103   4.9955  114.850   30.794  118.210   28.034 -3.359581 41.64372 
1 1 1   31    7   16 o  120.635   21.602   12.070   3.8422   16.183   5.8558   8.9608   5.0914  136.508   28.925  101.322   30.404 35.18560 41.96516 
1 1 1   31    7   17 o  153.944   12.944   18.643   3.0217   14.887   6.0645   19.883   3.4851  129.565   30.996  158.471   14.530 -28.90590 34.23259 
1 1 1   31    7   18 o   54.071   21.732   1.3171   2.7514   5.3984   6.2403   0.3323   3.0655   86.721   33.366   51.755   22.041 34.96556 39.98844 
1 1 1   31    7   19 o  143.493   14.132   16.323   3.0635   23.045   6.7155   14.556   3.4426  163.635   27.807  134.339   17.132 29.29602 32.66120 
1 1 1   31    7   20 o   59.902   22.837   2.2551   2.9067 -12.6778   6.6427   5.7915   3.2326   49.462   24.399   82.619   24.084 -33.15700 34.28341 
1 1 1   31    7   21 o   52.713   21.951   0.8126   2.9344   2.1690   6.7558   0.4972   3.2577   77.279   32.810   53.623   22.776 23.65541 39.94054 
1 1 1   31    7   22 o   64.211   24.812   2.5870   3.4624   9.8633   9.8463   1.5603   3.6986  106.568   41.656   60.739   24.905 45.82890 48.53291 
1 1 1   31    7   23 o   40.368   19.072  -3.1381   3.0971  -3.7023   5.9326  -2.9268   3.6312   58.645   27.280   45.288   21.159 13.35649 34.52422 
1 1 1   31    7   24 o  118.260   19.406   11.606   3.3909   14.640   6.3265   10.383   4.0165  125.392   32.644  109.320   24.599 16.07145 40.87451 
1 1 1   31    7   25 o   63.591   25.031   2.4343   3.5765   0.3335   7.8945   2.9768   4.0118   75.855   33.759   68.012   26.588 7.842690 42.97186 
1 1 1   31    7   26 o  104.826   24.220   9.5963   3.8079   2.1553   8.0320   11.754   4.3248   80.201   34.924  115.787   25.125 -35.58605 43.02277 
1 1 1   31    7   27 o  109.823   33.961   11.583   6.2891   11.583   6.2891   0.0000   0.0000  109.823   33.961  ?   ?  0.000000 33.96127 
1 1 1   31    7   28 o  114.231   21.127   11.117   3.5579   10.161   6.0759   11.615   4.3891  102.992   33.569  114.213   25.725 -11.22105 42.29246 
1 1 1   31    7   29 o   65.340   21.790   3.5180   2.5546   8.2285   3.2415  -4.2037   4.1501   97.129   22.277   45.634   21.711 51.49500 31.10686 
1 1 1   31    7   30 o   93.505   19.778   7.4981   2.7422   2.0318   3.4453   16.947   4.5297   60.120   24.263  140.391   21.785 -80.27068 32.60857 
1 1 1   31    7   31 o   80.879   16.618   5.5019   1.9885   7.7067   3.5055   4.4560   2.4145   92.233   24.439   71.607   20.797 20.62585 32.09074 
1 1 1   31    7   32 o   36.796   16.556  -0.6879   1.9554   1.7963   3.4745  -1.8394   2.3656   58.681   24.108   36.688   17.120 21.99290 29.56871 
1 1 1   31    7   33 o   56.521   22.264   2.0538   2.8314   0.0946   4.2746   3.5854   3.7793   56.428   24.990   67.778   25.993 -11.35009 36.05707 
1 1 1   31    7   34 o   49.562   19.462   1.4950   2.1572  -2.2660   3.7168   3.4055   2.6491   46.180   21.519   63.671   22.166 -17.49026 30.89378 
1 1 1   31    8    0 o  135.394   25.365   15.802   4.7165   15.802   4.7165   15.802   4.7165  135.394   25.365  135.394   25.365 0.000000 0.000000 
1 1 1   31    8    1 o  229.784   12.559   41.195   4.4004   0.0000   0.0000   41.195   4.4004  ?   ?   229.784   12.559 0.000000 12.55899 
1 1 1   31    8    2 o  161.724   24.924   21.713   5.9715   21.713   5.9715   0.0000   0.0000  161.724   24.924  ?   ?  0.000000 24.92426 
1 1 1   31    8    3 f  179.206   23.926   26.428   6.3990   26.428   6.3990   0.0000   0.0000  179.206   23.926  ?   ?  0.000000 23.92612 
1 1 1   31    8    4 o  231.273   20.609   43.067   7.2190   43.067   7.2190   0.0000   0.0000  231.273   20.609  ?   ?  0.000000 20.60892 
1 1 1   31    8    5 o   83.704   33.666   3.8842   6.6086   3.8842   6.6086   0.0000   0.0000   83.704   33.666  ?   ?  0.000000 33.66635 
1 1 1   31    8    6 o  158.556   13.669   19.762   3.2849   21.657   4.7551   18.033   4.5432  163.972   19.317  148.987   20.463 14.98479 28.14000 
1 1 1   31    8    7 o  104.061   20.653   8.9377   3.1734   1.5210   4.6386   15.463   4.3510   66.705   27.674  137.400   21.384 -70.69431 34.97299 
1 1 1   31    8    8 o  156.484   14.328   19.309   3.3936   21.126   5.1062   17.873   4.5418  161.044   21.233  148.215   20.575 12.82886 29.56620 
1 1 1   31    8    9 o  183.936   12.926   26.493   3.6159   19.459   5.1583   33.289   5.0703  153.830   22.580  204.980   16.295 -51.15038 27.84538 
1 1 1   31    8   10 o  161.876   14.924   20.714   3.6562   18.197   5.3645   22.898   4.9964  147.688   24.596  168.330   19.768 -20.64288 31.55565 
1 1 1   31    8   11 o  216.377   21.757   38.070   7.1081   38.070   7.1081   0.0000   0.0000  216.377   21.757  ?   ?  0.000000 21.75717 
1 1 1   31    8   12 o  105.807   22.448   9.3637   3.5229   7.3587   5.2129   11.049   4.7796   93.653   31.121  113.136   27.800 -19.48226 41.72963 
1 1 1   31    8   13 o  161.536   15.310   20.686   3.7403   27.497   5.7527   15.699   4.9228  183.949   20.797  136.866   24.393 47.08350 32.05529 
1 1 1   31    8   14 o  157.412   11.330   19.348   2.7117   16.935   5.7207   20.048   3.0796  140.611   27.565  159.847   12.691 -19.23517 30.34671 
1 1 1   31    8   15 o  162.790   15.704   21.067   3.8644   23.807   5.6895   18.720   5.2654  170.046   22.405  149.860   23.747 20.18657 32.64783 
1 1 1   31    8   16 o   57.097   21.936   1.9322   2.6948  -0.6569   5.5318   2.7378   3.0857   64.333   28.462   63.697   23.692 0.6352119 37.03246 
1 1 1   31    8   17 o  102.989   18.441   8.6959   2.8002   6.8082   5.9276   9.2382   3.1770   91.640   33.039  105.513   20.410 -13.87259 38.83506 
1 1 1   31    8   18 o  158.476   12.879   19.764   3.0970   9.9455   6.2766   22.924   3.5606  105.480   34.100  170.424   13.767 -64.94403 36.77441 
1 1 1   31    8   19 o  145.395   14.070   16.759   3.0921   18.403   6.3607   16.250   3.5383  144.574   29.736  142.215   16.565 2.359207 34.03891 
1 1 1   31    8   20 o  171.694   12.493   23.175   3.2607   15.549   6.5433   25.695   3.7609  130.554   32.789  180.346   13.728 -49.79291 35.54692 
1 1 1   31    8   21 o   42.596   19.796  -2.3772   3.1116 -10.4469   8.8522  -1.2395   3.3237   62.984   30.416   47.772   21.530 15.21238 37.26553 
1 1 1   31    8   22 o   99.291   24.398   8.5294   3.6815   0.0000   0.0000   8.5294   3.6815  ?   ?    99.291   24.398 0.000000 24.39841 
1 1 1   31    8   23 o  135.834   17.735   15.045   3.5993   21.204   7.7487   13.351   4.0643  150.509   34.388  125.874   21.890 24.63580 40.76371 
1 1 1   31    8   24 o  117.371   19.191   11.430   3.3285   9.5214   5.9216   12.312   4.0245  101.607   33.141  120.166   22.713 -18.55905 40.17713 
1 1 1   31    8   25 o  143.612   16.345   16.702   3.5289   11.603   6.3008   19.032   4.2596  110.537   33.961  152.190   18.678 -41.65375 38.75869 
1 1 1   31    8   26 o   81.766   27.331   5.7594   4.0188   2.2851   6.0627   8.4827   5.3675   73.481   31.133   96.224   31.561 -22.74286 44.33218 
1 1 1   31    8   27 o   87.668   28.829   6.8511   4.4774   5.2707   6.0628   8.7471   6.6407   83.082   32.626   97.162   34.977 -14.07986 47.83146 
1 1 1   31    8   28 o   91.164   24.827   7.3965   3.5579   0.4220   6.0356   11.111   4.4046   67.495   29.802  111.142   26.301 -43.64625 39.74855 
1 1 1   31    8   29 o  114.692   15.599   10.755   2.6674   11.528   3.3144   9.3336   4.4938  117.011   19.170  100.305   28.131 16.70661 34.04171 
1 1 1   31    8   30 o   66.417   22.371   3.6860   2.6929   2.2250   3.3363   6.4173   4.5615   60.377   24.045   84.058   29.097 -23.68056 37.74657 
1 1 1   31    8   31 o   55.794   21.954   1.9328   2.7506  -0.8900   3.3864   7.4066   4.7156   48.203   21.728   88.501   29.605 -40.29817 36.72279 
1 1 1   31    8   32 o  150.973   12.817   18.303   2.9338   15.485   3.6332   23.586   4.9739  135.801   17.916  166.326   19.934 -30.52522 26.80257 
1 1 1   31    8   33 o  144.933   14.939   17.207   3.2665   16.713   4.4593   17.778   4.7986  137.956   21.846  141.450   22.950 -3.494614 31.68504 
1 1 1   31    8   34 o   84.251   22.648   6.4531   2.9836   7.4858   3.8065   4.8081   4.8044   88.826   26.204   75.085   29.167 13.74086 39.20927 
1 1 1   31    9    0 o   27.900   19.715  -4.0357   3.4149  -4.0357   3.4149  -4.0357   3.4149   27.900   19.715   27.900   19.715 0.000000 0.000000 
1 1 1   31    9    1 o  181.605   9.5323   25.553   2.6404   24.978   4.9800   25.778   3.1142  176.507   18.719  181.973   11.236 -5.466141 21.83195 
1 1 1   31    9    3 o   82.972   31.015   4.8978   5.3011   4.8978   5.3011   0.0000   0.0000   82.972   31.015  ?   ?  0.000000 31.01462 
1 1 1   31    9    4 o  282.433   16.751   63.095   7.2090   63.095   7.2090   0.0000   0.0000  282.433   16.751  ?   ?  0.000000 16.75066 
1 1 1   31    9    5 o   85.346   33.187   4.7594   6.2247   4.7594   6.2247   0.0000   0.0000   85.346   33.187  ?   ?  0.000000 33.18701 
1 1 1   31    9    6 o   62.056   28.672  -3.8729   6.3875  -3.8729   6.3875   0.0000   0.0000   62.056   28.672  ?   ?  0.000000 28.67173 
1 1 1   31    9    7 o   70.965   31.472  -0.8390   6.8025  -0.8390   6.8025   0.0000   0.0000   70.965   31.472  ?   ?  0.000000 31.47158 
1 1 1   31    9    8 o  123.941   20.747   12.601   3.7967   13.449   7.6085   12.320   4.3811  121.780   37.304  121.048   24.487 0.7327194 44.62284 
1 1 1   31    9    9 o   71.909   32.390  -1.8842   7.5094  -1.8842   7.5094   0.0000   0.0000   71.909   32.390  ?   ?  0.000000 32.39024 
1 1 1   31    9   10 o  113.412   39.433   11.379   8.3824   11.379   8.3824   0.0000   0.0000  113.412   39.433  ?   ?  0.000000 39.43333 
1 1 1   31    9   11 o   65.277   26.684   1.7713   4.2299   0.0000   0.0000   1.7713   4.2299  ?   ?    65.277   26.684 0.000000 26.68411 
1 1 1   31    9   12 o  238.066   9.4437   43.829   3.4412   40.517   10.365   44.239   3.6481  215.689   32.398  239.036   9.9709 -23.34709 33.89717 
1 1 1   31    9   13 f  106.640   17.404   9.2232   2.7427   0.5957   9.5917   9.9914   2.8623   85.383   37.642  111.085   17.406 -25.70219 41.47139 
1 1 1   31    9   14 o  168.687   11.770   22.247   3.0200   38.211   10.233   20.724   3.1608  208.295   33.211  162.463   12.815 45.83235 35.59755 
1 1 1   31    9   15 o  134.165   14.683   14.301   2.9660   24.809   10.010   13.290   3.1054  161.361   40.573  128.801   16.104 32.55997 43.65190 
1 1 1   31    9   16 o   65.597   26.317   2.1801   4.0271   3.6762   9.4864   1.8513   4.4478   91.293   38.823   66.427   27.282 24.86519 47.45053 
1 1 1   31    9   17 o   72.119   23.497   4.2078   2.9769   13.289   9.3793   3.1905   3.1392  118.895   41.691   66.375   24.026 52.52069 48.11886 
1 1 1   31    9   18 o  119.371   17.978   11.601   3.1828   12.630   9.7233   11.477   3.3684  116.364   42.260  118.208   19.282 -1.844673 46.45073 
1 1 1   31    9   19 o  141.849   14.416   15.997   3.0866   16.724   6.1150   15.749   3.5755  137.343   29.934  139.702   17.076 -2.359100 34.46191 
1 1 1   31    9   20 o   93.382   21.517   7.3768   3.0122   4.0334   5.9842   8.5114   3.4861   80.288   32.127   99.796   23.253 -19.50839 39.65904 
1 1 1   31    9   21 o  100.626   20.246   8.4790   3.0103   15.113   6.1104   6.3529   3.4591  129.052   31.264   85.905   24.877 43.14636 39.95327 
1 1 1   31    9   22 o  142.165   16.285   16.299   3.4797   18.946   9.7310   15.911   3.7261  135.953   42.278  139.753   17.825 -3.800232 45.88161 
1 1 1   31    9   23 o   82.233   23.878   5.8240   3.1831   12.107   5.9550   3.3107   3.7663  113.995   32.528   68.745   26.046 45.25073 41.67136 
1 1 1   31    9   24 o  141.930   15.827   16.252   3.3797   11.676   5.8171   18.583   4.1525  111.826   32.224  150.580   18.399 -38.75488 37.10697 
1 1 1   31    9   25 f   87.318   26.666   6.7248   3.8914   6.7295   6.1704   6.7218   5.0143   89.329   33.447   87.779   30.500 1.550217 45.26565 
1 1 1   31    9   26 o   99.000   23.627   8.5601   3.5305   5.2308   6.1282   10.214   4.3193   83.291   32.771  106.840   26.533 -23.54951 42.16587 
1 1 1   31    9   27 o  120.880   25.846   12.987   4.6372   10.441   6.0607   16.583   7.2021  104.305   33.486  129.615   35.333 -25.31004 48.68009 
1 1 1   31    9   28 o   60.692   24.451   2.0453   3.4920  -5.7362   5.8292   6.4007   4.3611   53.235   25.438   84.633   28.470 -31.39821 38.17889 
1 1 1   31    9   29 o   77.175   25.802   5.2111   3.5817   3.8477   5.8620   6.0233   4.5245   76.237   31.317   82.322   28.951 -6.084984 42.64923 
1 1 1   31    9   30 o   82.824   20.841   5.9992   2.6399   7.5161   3.2025   2.7833   4.6630   91.876   22.864   68.082   27.945 23.79403 36.10702 
1 1 1   31    9   31 o   54.589   21.612   1.7925   2.6808   3.5805   3.2411  -2.0802   4.7700   66.646   24.369   53.672   24.791 12.97398 34.76227 
1 1 1   31    9   32 o   41.660   19.123  -1.4075   2.7772  -2.7798   3.4131   1.2812   4.7774   42.873   20.184   62.640   27.105 -19.76709 33.79464 
1 1 1   31    9   33 o   68.630   24.176   4.0499   3.1563   8.2713   4.1928  -1.4704   4.7947   92.738   27.538   54.777   25.138 37.96044 37.28599 
1 1 1   31   10    0 o   33.391   21.971  -0.4169   2.8530  -0.4169   2.8530  -0.4169   2.8530   33.391   21.971   33.391   21.971 0.000000 0.000000 
1 1 1   31   10    1 o  355.947   6.9753   97.477   3.8003   97.128   6.1572   97.692   4.8300  353.767   11.371  355.761   8.8699 -1.994751 14.42139 
1 1 1   31   10    3 o  246.897   15.792   48.103   5.9366   48.103   5.9366   0.0000   0.0000  246.897   15.792  ?   ?  0.000000 15.79187 
1 1 1   31   10    4 o   87.815   31.649   5.9575   5.4383   5.9575   5.4383   0.0000   0.0000   87.815   31.649  ?   ?  0.000000 31.64861 
1 1 1   31   10    5 o  176.403   23.545   25.628   6.1987   25.628   6.1987   0.0000   0.0000  176.403   23.545  ?   ?  0.000000 23.54521 
1 1 1   31   10    6 o   55.272   24.480  -0.8472   4.1028  -0.8472   4.1028   0.0000   0.0000   55.272   24.480  ?   ?  0.000000 24.48010 
1 1 1   31   10    7 o   89.201   28.575   6.6443   4.4150   6.6443   4.4150   0.0000   0.0000   89.201   28.575  ?   ?  0.000000 28.57469 
1 1 1   31   10    8 f  109.733   27.016   10.337   4.5072   10.337   4.5072   0.0000   0.0000  109.733   27.016  ?   ?  0.000000 27.01568 
1 1 1   31   10    9 o  129.796   24.976   14.190   4.7819   14.190   4.7819   0.0000   0.0000  129.796   24.976  ?   ?  0.000000 24.97634 
1 1 1   31   10   10 o   73.488   19.559   4.4682   2.2389   6.3784   4.8481   3.9504   2.5241   88.302   30.016   69.747   21.506 18.55530 36.92522 
1 1 1   31   10   11 o  108.063   15.701   9.3691   2.5210   13.637   6.3996   8.5851   2.7428  123.464   33.161  102.593   18.130 20.87136 37.79337 
1 1 1   31   10   12 o  185.691   9.8122   26.765   2.7790   26.655   5.4096   26.805   3.2390  181.488   19.795  185.353   11.473 -3.864944 22.87937 
1 1 1   31   10   13 o   52.860   20.368   1.5941   2.3283  -3.8573   4.8347   3.2401   2.6566   52.270   24.419   65.041   22.219 -12.77070 33.01445 
1 1 1   31   10   14 o   57.832   21.150   2.2859   2.4417   6.5027   5.4024   1.2034   2.7372   89.506   31.619   53.451   21.608 36.05456 38.29689 
1 1 1   31   10   15 o   86.455   20.348   6.2464   2.6479   7.4308   5.5324   5.8944   3.0157   93.795   32.064   83.574   22.897 10.22137 39.40004 
1 1 1   31   10   16 o  113.844   22.617   10.893   3.8021   10.940   5.9186   10.861   4.9612  110.320   32.708  111.118   28.898 -0.7979202 43.64531 
1 1 1   31   10   17 o  165.120   12.250   21.400   3.0740   23.268   6.3106   20.819   3.5198  165.660   25.722  162.109   14.333 3.550049 29.44582 
1 1 1   31   10   18 o   97.418   19.867   7.9049   2.8620   9.1315   6.0003   7.5437   3.2563  101.345   33.376   94.153   22.831 7.191620 40.43740 
1 1 1   31   10   19 o  112.115   18.303   10.308   3.0326   13.491   5.9086   9.1692   3.5335  122.050   31.436  103.831   22.853 18.21960 38.86511 
1 1 1   31   10   20 o   44.915   20.090  -0.8897   2.8336   1.7111   5.6614  -1.7589   3.2731   71.134   30.109   45.716   20.902 25.41818 36.65309 
1 1 1   31   10   21 o  177.972   12.209   24.916   3.3057   22.766   6.0724   25.822   3.9407  163.250   25.106  180.249   14.404 -16.99924 28.94452 
1 1 1   31   10   22 o   69.178   24.839   3.6645   3.3468   16.470   9.9530   2.0319   3.5537  126.142   43.007   61.762   24.742 64.38007 49.61610 
1 1 1   31   10   23 o   96.164   22.412   7.9464   3.2378   7.7792   6.0016   8.0150   3.8453   93.837   33.307   95.369   25.743 -1.532166 42.09621 
1 1 1   31   10   24 o  112.329   23.315   10.884   3.8774   21.082   6.1002   3.9707   5.0224  155.116   26.654   75.787   29.716 79.32813 39.91787 
1 1 1   31   10   25 o   51.257   22.338  -0.0376   3.2914   10.769   5.8450  -5.0553   3.9829  106.813   32.692   43.012   20.678 63.80082 38.68284 
1 1 1   31   10   26 o  157.799   15.402   20.083   3.6726   8.1997   6.3298   26.114   4.5092   94.715   34.143  179.393   16.610 -84.67804 37.96889 
1 1 1   31   10   27 o   82.207   28.329   5.9059   4.3214   2.9642   5.8084   9.5528   6.4672   73.913   30.840   99.701   34.638 -25.78842 46.37834 
1 1 1   31   10   28 o  176.837   9.5946   24.479   2.5873   23.349   3.0405   27.441   4.9254  171.802   11.631  182.442   17.867 -10.63992 21.31956 
1 1 1   31   10   29 o   75.489   20.791   4.9597   2.4788   3.4131   2.8910   9.2520   4.8163   65.110   23.116   98.558   29.571 -33.44753 37.53402 
1 1 1   31   10   30 o   90.053   19.297   6.9810   2.5799   8.2107   3.1023   4.2237   4.6453   96.677   21.518   73.565   28.652 23.11127 35.83241 
1 1 1   31   10   31 o  105.265   18.020   9.3862   2.7990   12.377   3.5209   4.2507   4.6140  120.046   19.856   73.188   28.541 46.85799 34.76838 
1 1 1   31   10   32 o  108.057   18.186   9.9344   2.9010   10.617   3.5765   8.6206   4.9604  109.290   22.139   93.328   30.327 15.96177 37.54800 
1 1 1   31   10   33 o   94.024   23.355   8.0781   3.3461   8.2194   4.4683   7.8977   5.0490   91.669   28.672   89.183   30.627 2.486069 41.95362 
1 1 1   31   11    0 o  379.061   9.8162  110.774   5.6867  110.774   5.6867  110.774   5.6867  379.061   9.8162  379.061   9.8162 0.000000 0.000000 
1 1 1   31   11    1 o   92.230   24.318   7.1848   3.4818   7.1848   3.4818   0.0000   0.0000   92.230   24.318  ?   ?  0.000000 24.31754 
1 1 1   31   11    3 o   90.979   28.979   6.9467   4.5459   6.9467   4.5459   0.0000   0.0000   90.979   28.979  ?   ?  0.000000 28.97950 
1 1 1   31   11    4 o  232.396   16.525   42.794   5.8397   42.794   5.8397   0.0000   0.0000  232.396   16.525  ?   ?  0.000000 16.52462 
1 1 1   31   11    5 o  124.311   29.870   13.468   5.6127   13.468   5.6127   0.0000   0.0000  124.311   29.870  ?   ?  0.000000 29.86990 
1 1 1   31   11    6 o  337.553   15.411   89.561   7.9623   89.561   7.9623   0.0000   0.0000  337.553   15.411  ?   ?  0.000000 15.41091 
1 1 1   31   11    7 o  145.737   21.204   17.388   4.5912   17.388   4.5912   0.0000   0.0000  145.737   21.204  ?   ?  0.000000 21.20376 
1 1 1   31   11    8 o  187.611   10.452   27.360   2.9896   35.912   4.9286   22.381   3.7605  213.289   15.196  168.305   14.746 44.98318 21.17467 
1 1 1   31   11    9 o  282.765   8.6350   61.726   3.7373   68.486   5.8850   57.157   4.8382  296.237   12.979  271.134   11.658 25.10309 17.44601 
1 1 1   31   11   10 o  106.539   17.285   9.1987   2.7221   11.397   5.0215   8.2841   3.2394  114.439   28.714   99.506   21.866 14.93340 36.09175 
1 1 1   31   11   11 o  160.066   11.477   20.018   2.7933   20.950   6.6971   19.822   3.0734  155.761   29.162  158.899   12.744 -3.138092 31.82518 
1 1 1   31   11   12 o  110.821   14.863   9.8116   2.4576   8.6214   5.0555   10.180   2.8122   99.539   30.393  112.259   16.890 -12.71995 34.77114 
1 1 1   31   11   13 o  111.185   15.076   9.8924   2.4995   9.5207   5.4127   9.9931   2.8179  103.933   31.385  111.085   17.123 -7.152496 35.75257 
1 1 1   31   11   14 o   72.959   21.025   4.4177   2.4763   2.8169   5.5143   4.8220   2.7715   74.904   30.526   76.074   22.336 -1.169815 37.82490 
1 1 1   31   11   15 o  103.433   17.715   8.7353   2.7037   9.8061   5.5493   8.4019   3.0961  105.009   31.794  100.303   20.847 4.705704 38.01933 
1 1 1   31   11   16 o  102.766   23.657   8.9982   3.6442   6.9610   5.5134   10.579   4.8562   91.296   31.967  109.598   28.633 -18.30261 42.91588 
1 1 1   31   11   17 o   72.239   23.160   4.2716   2.8999   0.0520   5.7592   5.7048   3.3565   67.052   29.375   82.059   24.700 -15.00633 38.38001 
1 1 1   31   11   18 o   73.052   23.445   4.3894   2.9711  -3.7491   5.4730   7.7898   3.5377   56.151   26.148   95.154   24.226 -39.00334 35.64561 
1 1 1   31   11   19 o  102.180   19.821   8.7035   2.9882   12.346   5.6501   7.2892   3.5209  116.664   31.082   91.863   24.565 24.80068 39.61667 
1 1 1   31   11   20 o  156.523   13.566   19.420   3.2181   15.442   5.9656   21.052   3.8218  130.811   30.377  162.143   15.592 -31.33182 34.14482 
1 1 1   31   11   21 o  174.531   12.562   24.025   3.3334   23.263   6.1599   24.341   3.9639  164.699   25.240  174.604   14.977 -9.905228 29.34892 
1 1 1   31   11   22 o  115.157   20.566   11.129   3.4920   33.966   10.669   8.3893   3.6956  186.774   38.597   97.990   24.659 88.78433 45.80173 
1 1 1   31   11   23 o  137.340   20.116   15.703   4.1034   18.260   6.2798   13.797   5.4207  141.978   29.845  123.382   29.164 18.59629 41.72835 
1 1 1   31   11   24 o   77.819   24.556   5.1896   3.2698   4.0316   6.1202   5.6521   3.8682   79.299   32.220   81.066   26.802 -1.767418 41.91080 
1 1 1   31   11   25 o   85.422   24.302   6.4022   3.3290  -0.7316   5.6994   10.096   4.1013   63.321   28.395  106.665   25.471 -43.34465 38.14516 
1 1 1   31   11   26 o  116.463   19.949   11.438   3.4282   11.989   5.8410   11.149   4.2343  111.861   32.306  111.996   25.298 -0.1352158 41.03268 
1 1 1   31   11   27 o   52.412   23.931  -1.6490   4.2721  -5.0671   5.8238   2.3331   6.2860   54.285   25.795   73.328   31.403 -19.04339 40.63868 
1 1 1   31   11   28 o   70.676   25.407   4.0972   3.5027   8.1128   5.6829   1.6371   4.4480   92.415   32.450   63.295   26.734 29.11940 42.04370 
1 1 1   31   11   29 o   48.039   19.717   0.9654   2.3212   2.2456   2.6988  -2.6741   4.5504   57.349   21.971   51.190   23.839 6.159031 32.41987 
1 1 1   31   11   30 o   83.348   26.321   6.3976   3.7562   4.6478   6.0871   7.4737   4.7734   78.295   32.009   88.525   29.785 -10.23069 43.72319 
1 1 1   31   11   31 o   97.575   19.880   8.2729   2.8684   7.2685   3.4933   10.351   5.0255   88.778   24.769  102.371   30.083 -13.59323 38.96724 
1 1 1   31   11   32 o   91.995   21.544   7.5506   2.9802   5.3740   3.6893   11.638   5.0556   76.777   26.184  108.534   29.610 -31.75649 39.52675 
1 1 1   31   12    0 o  144.553   13.600   16.574   2.9479   16.574   2.9479   16.574   2.9479  144.553   13.600  144.553   13.600 0.000000 0.000000 
1 1 1   31   12    1 o  184.614   13.687   26.776   3.8401   26.776   3.8401   0.0000   0.0000  184.614   13.687  ?   ?  0.000000 13.68705 
1 1 1   31   12    3 o  249.539   14.039   48.874   5.3405   48.874   5.3405   0.0000   0.0000  249.539   14.039  ?   ?  0.000000 14.03926 
1 1 1   31   12    4 o  104.997   28.118   9.5245   4.6091   9.5245   4.6091   0.0000   0.0000  104.997   28.118  ?   ?  0.000000 28.11775 
1 1 1   31   12    5 o   92.633   31.157   7.1453   5.2233   7.1453   5.2233   0.0000   0.0000   92.633   31.157  ?   ?  0.000000 31.15729 
1 1 1   31   12    6 o  191.497   10.684   28.523   3.1191   21.995   6.0296   30.908   3.6447  162.210   25.095  198.949   12.025 -36.73889 27.82772 
1 1 1   31   12    7 o  143.316   11.985   16.090   2.6048   24.693   4.6750   12.216   3.1369  175.665   17.625  123.195   17.096 52.47029 24.55426 
1 1 1   31   12    8 o   97.863   17.397   7.7957   2.5105   7.2900   4.5658   8.0149   3.0056   92.565   28.988   98.220   20.648 -5.655479 35.58978 
1 1 1   31   12    9 o  183.907   11.041   26.356   3.0935   34.600   5.3854   22.296   3.7791  208.380   17.034  167.853   14.863 40.52705 22.60646 
1 1 1   31   12   10 o   80.392   20.876   5.4003   2.5917   11.928   4.8074   2.7256   3.0772  117.538   27.252   63.634   23.660 53.90416 36.08974 
1 1 1   31   12   11 o   62.137   22.924   2.6360   2.8775   7.6883   6.4368   1.3741   3.2169   96.355   34.463   57.463   23.355 38.89257 41.63086 
1 1 1   31   12   12 o  123.731   16.088   12.283   2.9747   23.019   5.5324   7.9170   3.5281  167.090   22.180   96.431   23.999 70.65954 32.67855 
1 1 1   31   12   13 o  131.766   13.386   13.727   2.6623   18.058   5.5582   12.437   3.0329  145.738   25.864  124.391   16.323 21.34713 30.58434 
1 1 1   31   12   14 o   69.821   21.127   4.0097   2.4508   9.8794   5.3924   2.4815   2.7514  105.412   31.213   60.497   22.397 44.91518 38.41689 
1 1 1   31   12   15 o   51.007   20.628   1.0896   2.4959  -1.4314   5.3894   1.7779   2.8161   61.198   27.514   56.813   22.258 4.384361 35.38998 
1 1 1   31   12   16 o   48.151   21.858  -1.5833   3.4991  -7.9657   5.3059   3.3289   4.6548   47.626   23.129   72.945   28.606 -25.31954 36.78627 
1 1 1   31   12   17 o   40.532   18.817  -2.1443   2.7998  -1.2512   5.5159  -2.4542   3.2495   62.157   27.899   43.571   20.242 18.58570 34.46896 
1 1 1   31   12   18 o   50.989   21.346   0.6716   2.7956   0.4855   5.4864   0.7368   3.2491   66.609   28.935   54.483   22.921 12.12603 36.91339 
1 1 1   31   12   19 o  107.957   18.592   9.6224   2.9614   7.2221   5.4945   10.605   3.5157   91.542   31.920  112.310   21.229 -20.76842 38.33522 
1 1 1   31   12   20 o  117.925   18.224   11.432   3.1834   11.041   5.9806   11.587   3.7603  109.035   33.005  117.106   21.780 -8.071709 39.54387 
1 1 1   31   12   21 o   56.667   22.915   1.5227   3.0797  -8.2975   5.7105   5.5505   3.6571   49.239   23.931   80.625   26.026 -31.38663 35.35601 
1 1 1   31   12   22 o  144.641   22.480   17.706   4.8152   17.713   9.5299   17.703   5.5799  130.210   42.010  142.003   26.651 -11.79283 49.75082 
1 1 1   31   12   23 o   80.580   24.693   5.6158   3.3334   10.465   6.2290   3.6699   3.9459  105.172   33.967   70.832   26.703 34.33945 43.20662 
1 1 1   31   12   24 o   58.120   23.870   1.4887   3.4045  -5.5543   6.1093   4.6608   4.1001   55.522   26.393   75.973   27.465 -20.45140 38.09100 
1 1 1   31   12   25 o  118.149   20.829   11.846   3.6292   13.912   6.2014   10.769   4.4756  120.373   32.776  109.171   26.947 11.20272 42.43099 
1 1 1   31   12   26 o   73.054   25.475   4.4542   3.4997   5.0793   5.8587   4.1074   4.3639   81.110   32.001   73.380   27.980 7.730606 42.50872 
1 1 1   31   12   27 o  186.179   17.141   28.450   4.8299   29.378   6.2269   27.049   7.6525  184.922   22.461  169.971   30.537 14.95068 37.90760 
1 1 1   31   12   28 o   87.638   25.662   7.0106   3.6627   7.6068   5.8890   6.6344   4.6775   89.835   32.848   85.002   29.462 4.832375 44.12516 
1 1 1   31   12   29 o   40.086   17.899  -0.5678   2.2391  -1.6842   2.5818   2.8197   4.4974   39.220   18.159   67.339   27.520 -28.11863 32.97073 
1 1 1   31   12   30 o  186.707   14.620   28.316   4.1447   10.399   6.3216   41.823   5.4890  100.046   34.274  225.867   15.980 -125.8211 37.81628 
1 1 1   31   12   31 o  162.174   12.417   21.086   3.0589   26.154   3.8114   11.914   5.1277  179.652   13.970  109.930   29.750 69.72240 32.86692 
1 1 1   31   13    0 o  115.728   16.839   11.030   2.7986   11.030   2.7986   11.030   2.7986  115.728   16.839  115.728   16.839 0.000000 0.000000 
1 1 1   31   13    1 o  224.253   12.488   39.303   4.2695   39.303   4.2695   0.0000   0.0000  224.253   12.488  ?   ?  0.000000 12.48821 
1 1 1   31   13    3 o   94.413   26.799   7.6215   4.0529   7.6215   4.0529   0.0000   0.0000   94.413   26.799  ?   ?  0.000000 26.79886 
1 1 1   31   13    4 o   86.502   17.512   6.1289   2.2390   7.4841   4.2588   5.6112   2.6322   93.561   27.747   81.993   20.909 11.56792 34.74284 
1 1 1   31   13    5 o   90.086   29.414   6.8055   4.6640   6.8055   4.6640   0.0000   0.0000   90.086   29.414  ?   ?  0.000000 29.41371 
1 1 1   31   13    6 o  121.895   14.513   11.810   2.6545   10.767   5.3537   12.150   3.0567  110.593   30.595  122.956   16.672 -12.36213 34.84224 
1 1 1   31   13    7 o   95.524   17.490   7.4457   2.4630   3.3226   4.3596   9.3786   2.9850   72.277   27.866  106.999   18.918 -34.72273 33.68086 
1 1 1   31   13    8 o  173.652   13.473   23.727   3.5530   0.0000   0.0000   23.727   3.5530  ?   ?   173.652   13.473 0.000000 13.47293 
1 1 1   31   13    9 o  162.307   11.667   20.604   2.8792   19.833   5.0833   20.969   3.4936  155.081   22.035  162.930   14.149 -7.848740 26.18634 
1 1 1   31   13   10 o   59.883   21.600   2.5382   2.5338   3.6428   4.7426   2.0969   2.9975   75.037   29.027   59.717   23.083 15.31966 37.08585 
1 1 1   31   13   11 o  133.899   15.850   14.343   3.1853   14.127   6.9790   14.400   3.5800  124.033   35.152  133.356   17.999 -9.322815 39.49233 
1 1 1   31   13   12 o  119.354   17.383   11.541   3.0823   16.136   5.3441   9.2506   3.7732  137.244   26.398  104.152   24.140 33.09257 35.77136 
1 1 1   31   13   13 o  246.417   10.359   47.145   3.9071   56.286   6.2165   41.176   5.0233  266.614   15.297  228.338   14.447 38.27646 21.04123 
1 1 1   31   13   14 o   59.449   23.386   1.9481   3.1200   0.4257   5.3661   2.7256   3.8348   66.149   28.675   66.863   26.035 -0.7140961 38.73103 
1 1 1   31   13   15 o  132.705   14.341   14.018   2.8666   23.095   5.8895   11.200   3.2815  165.826   23.893  116.727   19.022 49.09917 30.54059 
1 1 1   31   13   16 o  208.586   13.490   34.316   4.2838   40.860   6.2390   28.479   5.8924  224.982   18.275  185.992   21.070 38.98996 27.89114 
1 1 1   31   13   17 o   48.771   21.138  -0.0528   2.9149  -9.0594   5.6338   3.2396   3.4062   47.937   23.403   67.317   24.920 -19.38094 34.18653 
1 1 1   31   13   18 o  157.693   13.579   19.713   3.2455   27.808   6.2845   16.769   3.7900  182.083   23.066  143.658   17.604 38.42497 29.01681 
1 1 1   31   13   19 o   76.564   23.651   4.9605   3.0511   10.741   5.7404   2.6843   3.6020  107.866   32.265   65.087   25.263 42.77853 40.97864 
1 1 1   31   13   20 o   98.250   26.030   8.5163   3.9770  -0.0971   5.9908   15.303   5.3178   66.968   29.625  131.623   27.291 -64.65506 40.27939 
1 1 1   31   13   21 o   63.578   26.121   1.8674   4.0789   5.6057   6.0037  -1.3374   5.5589   84.946   32.715   61.491   27.767 23.45523 42.90993 
1 1 1   31   13   22 o  100.328   24.591   8.8310   3.7470   15.529   9.2878   7.5289   4.0950  122.175   41.545   91.913   27.197 30.26211 49.65551 
1 1 1   31   13   23 o   62.890   24.568   2.4921   3.4234   6.2904   6.3738   0.9520   4.0586   87.655   33.722   59.701   25.391 27.95398 42.21234 
1 1 1   31   13   24 o  144.529   17.281   17.110   3.7471   4.2298   6.4414   23.697   4.6067   80.291   32.888  169.922   17.986 -89.63023 37.48433 
1 1 1   31   13   25 o  102.305   23.990   9.2573   3.6915   5.0563   6.5969   11.172   4.4541   82.809   33.520  111.101   26.554 -28.29232 42.76350 
1 1 1   31   13   26 o   60.432   24.772   1.8461   3.6581  -1.7458   6.3914   3.5959   4.4610   63.420   29.075   71.125   27.968 -7.704842 40.34287 
1 1 1   31   13   27 o   71.998   28.220   3.8417   4.5283   2.2394   6.0450   5.8907   6.8357   71.463   30.705   84.758   34.187 -13.29489 45.95161 
1 1 1   31   13   28 o   84.871   26.211   6.6142   3.7475   7.2488   6.0365   6.2162   4.7802   88.024   33.058   82.707   29.686 5.316673 44.43077 
1 1 1   31   13   29 o  135.052   12.745   14.656   2.6034   16.900   3.0753   8.9787   4.8911  144.358   14.098   95.901   29.998 48.45719 33.14569 
1 1 1   31   13   30 o  180.219   10.745   25.715   2.9506   26.842   3.6080   23.439   5.1269  182.758   12.982  164.799   20.787 17.95976 24.50839 
1 1 1   31   13   31 o   91.147   21.263   7.3938   2.9121   7.8316   3.6205   6.5916   4.9010   91.636   25.082   83.251   30.038 8.384995 39.13288 
1 1 1   31   14    1 o  157.167   15.470   19.623   3.6734   19.623   3.6734   0.0000   0.0000  157.167   15.470  ?   ?  0.000000 15.47025 
1 1 1   31   14    2 o  286.915   10.091   63.782   4.4315   0.0000   0.0000   63.782   4.4315  ?   ?   286.915   10.091 0.000000 10.09082 
1 1 1   31   14    3 o   44.206   18.379   0.4742   2.0522   4.5364   3.9356  -1.0428   2.4051   76.666   26.998   40.674   18.325 35.99209 32.62944 
1 1 1   31   14    4 o  139.850   11.993   15.338   2.5424   11.962   4.5364   16.884   3.0698  118.324   25.777  146.197   13.885 -27.87319 29.27888 
1 1 1   31   14    5 o   65.160   27.027   1.5219   4.4230   1.5219   4.4230   0.0000   0.0000   65.160   27.027  ?   ?  0.000000 27.02675 
1 1 1   31   14    6 o   39.713   18.040  -1.2527   2.3887   3.6696   4.8489  -2.8301   2.7449   75.622   29.323   38.220   18.026 37.40229 34.42012 
1 1 1   31   14    7 o   51.219   20.358   1.2514   2.3872  -2.8768   4.2590   3.1425   2.8826   50.492   23.358   65.186   23.089 -14.69359 32.84392 
1 1 1   31   14    8 o   87.693   19.274   6.3820   2.5166   5.6438   4.3521   6.7528   3.0845   83.282   28.439   89.395   22.546 -6.113472 36.29141 
1 1 1   31   14    9 o   82.644   20.472   5.7164   2.5763   11.385   4.7814   3.3976   3.0582  114.376   27.623   67.327   23.789 47.04861 36.45496 
1 1 1   31   14   10 o   92.180   19.679   7.0659   2.6921   12.239   4.9812   4.9317   3.1996  118.425   27.933   77.165   24.283 41.26007 37.01259 
1 1 1   31   14   11 o   74.170   23.319   4.5334   2.9513   16.461   7.0882   2.0320   3.2461  133.931   34.397   60.640   23.854 73.29070 41.85856 
1 1 1   31   14   12 o  136.919   15.811   15.015   3.2527   17.718   5.4122   13.487   4.0697  144.252   25.442  127.254   21.670 16.99812 33.42017 
1 1 1   31   14   13 o   45.950   20.864  -1.4976   3.1903   0.0094   5.2837  -2.3623   4.0023   64.426   28.183   49.740   22.878 14.68590 36.29987 
1 1 1   31   14   14 o  101.063   23.283   8.7203   3.5275   18.020   5.5623   2.4640   4.5623  144.878   26.040   68.951   27.888 75.92630 38.15567 
1 1 1   31   14   15 f   55.379   25.967  -4.3265   5.5526  -4.3265   5.5526   0.0000   0.0000   55.379   25.967  ?   ?  0.000000 25.96660 
1 1 1   31   14   16 o  190.970   11.991   28.631   3.4872   37.164   6.4681   25.135   4.1405  213.102   20.066  177.428   15.399 35.67471 25.29379 
1 1 1   31   14   17 o  121.620   17.663   12.087   3.1919   18.868   5.9510   9.3475   3.7819  146.785   27.498  103.954   24.218 42.83122 36.64230 
1 1 1   31   14   18 o  276.811   9.6241   59.530   4.0777   54.502   7.1353   61.969   4.9690  259.484   18.078  281.510   11.532 -22.02597 21.44324 
1 1 1   31   14   19 o   57.386   24.746   0.3846   3.9542   0.3975   6.0935   0.3752   5.1971   68.732   30.161   64.325   28.050 4.406158 41.18808 
1 1 1   31   14   20 o   99.345   22.148   8.4631   3.2819   17.099   6.8087   5.8495   3.7457  134.859   33.206   82.311   26.315 52.54771 42.36871 
1 1 1   31   14   21 o   58.151   23.652   1.5963   3.3022  -0.5884   6.5405   2.3437   3.8257   67.963   30.451   64.224   25.691 3.738594 39.84122 
1 1 1   31   14   22 o  115.795   22.678   11.532   3.8755   12.884   10.672   11.327   4.1595  112.201   43.503  113.680   24.618 -1.478210 49.98526 
1 1 1   31   14   23 o   80.830   25.690   5.7083   3.5739   7.6909   6.6359   4.8983   4.2415   92.794   34.698   77.232   27.932 15.56218 44.54364 
1 1 1   31   14   24 o   94.817   24.931   8.0379   3.6662   14.673   6.7663   5.2803   4.3619  121.579   34.667   78.986   28.357 42.59280 44.78763 
1 1 1   31   14   25 o   75.401   25.798   4.8849   3.5814   2.9023   6.3514   5.8092   4.3367   74.944   31.816   81.225   28.357 -6.280647 42.61839 
1 1 1   31   14   26 o   45.697   21.832  -4.5199   4.2900  -2.5290   6.1332  -6.4272   6.0028   60.274   27.935   52.637   25.325 7.636909 37.70600 
1 1 1   31   14   27 o  110.833   23.105   10.898   3.7927   15.717   6.4116   8.3048   4.7039  125.292   32.982   93.271   29.454 32.02110 44.21941 
1 1 1   31   14   28 o   52.905   23.225   0.1049   3.6165   3.5382   6.0006  -1.8536   4.5321   74.428   31.222   52.783   24.303 21.64534 39.56600 
1 1 1   31   14   29 o  114.460   15.806   10.852   2.6952   12.024   3.2504   8.2719   4.8219  119.036   18.436   92.011   29.901 27.02461 35.12748 
1 1 1   31   14   30 o   78.900   22.653   5.6208   2.8794   5.4981   3.5589   5.8533   4.8995   77.531   25.712   80.039   29.837 -2.507774 39.38703 
1 1 1   31   15    1 o   62.079   18.221   3.1362   1.8446   1.2677   3.1182   4.1420   2.2879   56.319   22.954   70.780   20.150 -14.46129 30.54337 
1 1 1   31   15    2 o   59.471   21.654   2.4555   2.5554   0.0000   0.0000   2.4555   2.5554  ?   ?    59.471   21.654 0.000000 21.65438 
1 1 1   31   15    3 o   98.336   15.426   7.7894   2.2454   7.1810   3.9286   8.0846   2.7365   91.546   26.511   99.154   18.717 -7.607414 32.45260 
1 1 1   31   15    4 o   67.852   20.339   3.7701   2.2792   11.501   4.3660   0.8740   2.6723  116.016   25.299   51.303   21.118 64.71362 32.95474 
1 1 1   31   15    5 o   79.413   29.230   4.6983   4.6742   4.6983   4.6742   0.0000   0.0000   79.413   29.230  ?   ?  0.000000 29.23020 
1 1 1   31   15    6 o  129.495   14.665   13.345   2.8555   10.626   5.2865   14.466   3.3931  109.482   30.443  134.074   16.910 -24.59240 34.82430 
1 1 1   31   15    7 o   59.517   23.268   1.9924   3.0726   0.0000   0.0000   1.9924   3.0726  ?   ?    59.517   23.268 0.000000 23.26820 
1 1 1   31   15    8 o   55.838   21.595   1.8024   2.6247   2.6239   4.4034   1.3496   3.2689   69.157   27.598   57.551   23.484 11.60583 36.23737 
1 1 1   31   15    9 o  124.247   15.589   12.374   2.8995   13.904   4.8105   11.501   3.6337  127.442   25.550  117.661   20.944 9.781090 33.03757 
1 1 1   31   15   10 o  100.397   20.467   8.4146   3.0385   7.3907   5.0475   8.9965   3.8051   92.677   30.616  102.354   24.594 -9.676712 39.27094 
1 1 1   31   15   11 o   77.339   25.107   4.9459   3.4001   19.369   8.1594   1.9153   3.7403  143.259   36.964   62.682   25.287 80.57654 44.78575 
1 1 1   31   15   12 o   83.148   24.294   5.8900   3.2859   5.3466   5.2592   6.2380   4.2084   83.342   30.943   85.726   27.938 -2.384499 41.68910 
1 1 1   31   15   13 f  100.644   23.427   8.6703   3.5413   16.016   5.6360   3.8785   4.5521  135.051   28.176   74.735   28.558 60.31643 40.11839 
1 1 1   31   15   14 o   55.486   23.464   0.6874   3.4335  -0.3133   5.3668   1.3807   4.4673   63.675   28.110   64.207   26.937 -0.5318947 38.93311 
1 1 1   31   15   15 o  252.703   17.014   51.282   6.5425   51.282   6.5425   0.0000   0.0000  252.703   17.014  ?   ?  0.000000 17.01379 
1 1 1   31   15   16 f   63.096   25.949   1.7454   4.0303   0.1918   5.9997   3.0230   5.4406   67.973   29.875   74.231   30.294 -6.258057 42.54740 
1 1 1   31   15   17 o  103.158   25.914   9.3636   4.0865   8.6715   6.0659   9.9386   5.5296   97.996   33.574  104.051   31.790 -6.055473 46.23612 
1 1 1   31   15   18 o  106.334   26.319   10.002   4.2606   7.9675   6.4730   11.557   5.6596   95.102   34.489  111.689   31.656 -16.58713 46.81476 
1 1 1   31   15   19 o   50.192   21.852  -0.0643   3.1432   2.0179   6.3274  -0.7464   3.6216   74.013   31.596   51.257   22.834 22.75570 38.98349 
1 1 1   31   15   20 f   67.740   24.474   3.5161   3.2550  -3.2411   6.4379   5.8366   3.7727   61.693   28.602   82.079   26.427 -20.38664 38.94241 
1 1 1   31   15   21 o   68.696   24.580   3.6991   3.2746  -0.1340   6.5522   4.9753   3.7806   68.809   30.679   76.997   26.499 -8.188080 40.53903 
1 1 1   31   15   22 o  108.605   23.512   10.303   3.7952   6.4018   9.8075   10.990   4.1159   93.622   39.628  111.563   24.751 -17.94090 46.72243 
1 1 1   31   15   23 f   57.202   24.030   1.1391   3.5626  -8.5290   6.3067   5.6700   4.3174   51.621   25.103   80.846   28.290 -29.22474 37.82147 
1 1 1   31   15   24 o  138.192   18.289   15.891   3.7734   21.253   6.6609   13.357   4.5790  151.036   29.871  122.203   25.313 28.83301 39.15361 
1 1 1   31   15   25 o   92.282   25.594   7.7653   3.7416   14.490   6.5348   4.4852   4.5638  119.863   34.031   74.945   28.605 44.91764 44.45644 
1 1 1   31   15   26 o   45.704   22.199  -6.6679   4.8933 -11.7174   8.2418  -3.9190   6.0811   56.264   27.641   57.076   26.892 -0.8121681 38.56400 
1 1 1   31   15   27 o   46.769   21.899  -2.7504   3.9253 -23.0113   7.8174   4.0801   4.5390   44.737   22.666   72.454   28.293 -27.71735 36.25243 
1 1 1   31   15   28 o   53.422   23.265   0.3822   3.5650   2.3612   6.2136  -0.5889   4.3526   71.275   30.877   54.926   24.708 16.34835 39.54560 
1 1 1   31   15   29 o   80.320   21.367   5.7523   2.6728   6.6051   3.2040   3.8007   4.8468   84.987   23.725   71.524   28.809 13.46298 37.32042 
1 1 1   31   16    0 o   25.769   17.550  -1.1576   2.1255  -1.1576   2.1255  -1.1576   2.1255   25.769   17.550   25.769   17.550 0.000000 0.000000 
1 1 1   31   16    1 o  142.517   8.5326   15.748   1.8527   17.364   2.4866   13.732   2.7779  149.062   10.976  131.568   14.010 17.49396 17.79703 
1 1 1   31   16    2 o  138.151   11.674   14.970   2.4455   16.602   3.9520   13.957   3.1131  143.066   18.479  132.068   15.708 10.99809 24.25332 
1 1 1   31   16    3 o   47.216   19.441   0.7077   2.2654  -1.6960   3.8320   1.9990   2.8087   50.439   22.888   58.028   22.368 -7.589008 32.00334 
1 1 1   31   16    4 o  193.831   17.079   30.079   5.0152   30.079   5.0152   0.0000   0.0000  193.831   17.079  ?   ?  0.000000 17.07889 
1 1 1   31   16    5 o  154.570   12.980   18.824   3.0425   22.127   5.1967   17.101   3.7529  164.017   21.196  145.727   17.154 18.28928 27.26751 
1 1 1   31   16    6 o   43.420   19.696  -1.3558   2.8346  -2.5524   4.9469  -0.7709   3.4586   55.745   25.564   50.492   22.414 5.252651 33.99906 
1 1 1   31   16    7 o   68.783   22.649   3.7921   2.7631  -4.3649   4.4179   9.0332   3.5413   48.067   22.730  103.144   23.015 -55.07716 32.34742 
1 1 1   31   16    8 o   96.942   19.892   7.8312   2.8526   7.0073   4.3931   8.4318   3.7509   90.186   28.463   98.940   24.813 -8.754578 37.76002 
1 1 1   31   16    9 o   51.033   21.483   0.5594   2.8572  -2.5399   4.6185   2.4809   3.6366   53.542   24.608   64.689   25.307 -11.14677 35.29915 
1 1 1   31   16   10 o  104.119   20.025   9.0269   3.0755   11.646   4.9635   7.3947   3.9184  114.749   28.410   92.286   26.404 22.46313 38.78574 
1 1 1   31   16   11 o   78.726   26.175   5.1325   3.6872   9.3156   8.1830   4.0667   4.1303  103.198   38.542   74.166   27.444 29.03243 47.31451 
1 1 1   31   16   12 o  116.492   20.713   11.327   3.5579   10.703   5.4136   11.802   4.7205  108.661   31.018  115.895   27.096 -7.233643 41.18574 
1 1 1   31   16   13 o   35.250   17.407  -7.0772   3.4121  -4.7182   5.3123  -8.7340   4.4519   53.009   25.024   40.626   20.028 12.38255 32.05132 
1 1 1   31   16   14 o   96.379   24.314   8.0578   3.5866   8.8296   5.5792   7.5142   4.6823   98.900   32.164   92.295   29.412 6.604889 43.58488 
1 1 1   31   16   15 o   76.993   31.371   3.4353   5.8221   3.4353   5.8221   0.0000   0.0000   76.993   31.371  ?   ?  0.000000 31.37051 
1 1 1   31   16   16 o  131.775   21.323   14.572   4.1540   16.328   5.9864   12.941   5.7689  134.401   29.874  118.474   31.332 15.92756 43.29164 
1 1 1   31   16   17 o   79.907   27.856   5.3088   4.1843   8.5535   6.1338   2.4847   5.7225   97.189   33.736   73.162   30.576 24.02670 45.53025 
1 1 1   31   16   18 o  141.749   20.992   16.831   4.4168   22.501   6.4357   11.783   6.0726  159.928   27.269  111.709   33.133 48.21934 42.91164 
1 1 1   31   16   19 o   98.397   22.702   8.3754   3.3496   18.683   6.5587   4.7383   3.8960  142.402   30.973   76.059   26.853 66.34254 40.99259 
1 1 1   31   16   20 o   48.920   21.742  -0.6103   3.2636   0.9703   6.5374  -1.1350   3.7665   71.429   31.295   50.850   22.919 20.57921 38.78964 
1 1 1   31   16   21 o   80.050   26.927   5.5564   3.9013   0.0000   0.0000   5.5564   3.9013  ?   ?    80.050   26.927 0.000000 26.92727 
1 1 1   31   16   22 o  150.710   17.336   18.670   3.9263   10.804   8.8119   20.618   4.3857  103.689   39.707  157.719   18.520 -54.03013 43.81368 
1 1 1   31   16   23 o   66.409   25.825   3.0742   3.7696 -14.7574   8.2489   7.7809   4.2380   53.708   26.620   91.833   27.780 -38.12517 38.47550 
1 1 1   31   16   24 o   97.067   25.701   8.6063   3.8787   7.3345   7.9897   8.9984   4.4366   90.975   36.867   97.973   28.116 -6.997719 46.36468 
1 1 1   31   16   25 o   88.211   25.624   7.1310   3.6649   8.9667   6.1666   6.1285   4.5570   95.195   33.765   82.240   29.041 12.95544 44.53617 
1 1 1   31   16   26 o  119.182   25.859   13.034   4.5817   17.671   6.5655   8.6323   6.3968  133.089   32.509   93.184   34.210 39.90573 47.19300 
1 1 1   31   16   27 o   51.027   22.784  -0.4451   3.6275  -3.2762   6.1102   1.0960   4.5080   57.927   27.186   60.896   26.340 -2.968704 37.85377 
1 1 1   31   16   28 o  113.405   23.021   11.531   3.8595   17.300   6.3844   8.2089   4.8450  131.010   32.092   91.438   29.985 39.57175 43.92009 
1 1 1   31   17    0 o   85.064   23.251   6.7961   2.6172   6.7961   2.6172   6.7961   2.6172   85.064   23.251   85.064   23.251 0.000000 0.000000 
1 1 1   31   17    1 o  122.062   10.688   11.668   1.9768   11.284   2.5768   12.216   3.0815  118.914   14.455  122.943   16.816 -4.029572 22.17496 
1 1 1   31   17    2 f   43.020   16.564   1.0246   1.5387   1.2828   1.7437   0.1163   3.2710   46.549   17.702   52.272   22.524 -5.722603 28.64757 
1 1 1   31   17    3 o   59.049   15.795   2.8576   1.4555   2.5605   1.5994   4.2889   3.5103   56.376   17.069   73.708   25.524 -17.33201 30.70592 
1 1 1   31   17    4 o  112.183   27.153   11.002   4.6123   11.002   4.6123   0.0000   0.0000  112.183   27.153  ?   ?  0.000000 27.15302 
1 1 1   31   17    5 o   98.619   20.727   8.1527   3.0294   7.2705   4.8023   8.7358   3.9043   91.730   29.841  100.468   25.380 -8.738213 39.17493 
1 1 1   31   17    6 o   61.817   23.461   2.4769   3.0590   3.0654   4.9523   2.1138   3.8897   73.006   29.221   64.273   25.837 8.732689 39.00518 
1 1 1   31   17    7 o  140.899   16.614   15.993   3.5141   10.588   5.6437   19.416   4.4910  108.111   31.910  154.061   19.480 -45.95050 37.38647 
1 1 1   31   17    8 o   39.236   18.788  -4.0774   3.2157  -5.8794   5.8970  -3.3148   3.8363   54.540   25.928   46.022   21.581 8.517998 33.73397 
1 1 1   31   17    9 o   75.018   24.686   4.6333   3.2830   14.042   6.2869   1.1059   3.8495  123.532   32.727   59.751   25.033 63.78086 41.20370 
1 1 1   31   17   10 f   98.904   25.832   8.5476   3.9533   0.0000   0.0000   8.5476   3.9533  ?   ?    98.904   25.832 0.000000 25.83214 
1 1 1   31   17   11 o  102.141   23.977   9.0044   3.6844   18.277   7.0757   5.5547   4.3156  140.450   33.401   81.835   28.304 58.61461 43.78059 
1 1 1   31   17   12 f   96.581   25.967   8.1830   3.9216   12.932   7.6832   6.5100   4.5604  115.772   37.750   86.994   29.114 28.77798 47.67238 
1 1 1   31   17   13 o   79.083   27.168   5.1785   3.9729   9.0972   7.7539   3.7835   4.6263  100.979   37.556   74.125   28.670 26.85366 47.24844 
1 1 1   31   17   14 o  104.749   38.388   10.174   8.0496   10.174   8.0496   0.0000   0.0000  104.749   38.388  ?   ?  0.000000 38.38839 
1 1 1   31   17   15 o  209.622   16.663   35.401   5.3022   61.844   9.2993   22.663   6.4542  272.093   22.532  160.867   27.181 111.2259 35.30527 
1 1 1   31   17   16 o  175.964   19.002   25.412   5.0367   36.818   9.3063   20.687   5.9897  201.832   31.125  153.952   26.367 47.87975 40.79200 
1 1 1   31   17   17 o   62.845   27.077   0.7725   4.7261   10.729   8.5807  -3.5632   5.6624  105.873   39.482   56.928   26.538 48.94527 47.57185 
1 1 1   31   17   18 o  149.229   23.159   19.034   5.1184   30.832   8.9101   13.223   6.2530  181.551   33.291  117.610   33.254 63.94084 47.05412 
1 1 1   31   17   19 o   52.813   23.851  -1.2151   4.1025  -6.1406   6.1520   2.7294   5.5053   54.628   26.112   72.370   30.096 -17.74203 39.84481 
1 1 1   31   17   20 o   60.324   25.413   1.2943   4.0026   0.0000   0.0000   1.2943   4.0026  ?   ?    60.324   25.413 0.000000 25.41286 
1 1 1   31   17   21 o   78.938   26.206   5.4560   3.6964   17.035   9.2219   3.2395   4.0347  124.218   41.399   68.306   26.675 55.91261 49.24857 
1 1 1   31   17   22 o   82.826   25.107   6.1453   3.4590   7.1394   6.1693   5.6894   4.1774   88.747   33.402   80.319   27.843 8.427376 43.48459 
1 1 1   31   17   23 o   70.370   25.260   4.0858   3.4611   0.0561   6.0371   6.0588   4.2243   65.591   29.332   81.985   28.018 -16.39389 40.56258 
1 1 1   31   17   24 o   66.472   25.225   3.3522   3.5362   5.8912   6.1698   2.1102   4.3153   83.169   32.832   64.040   26.640 19.12887 42.28018 
1 1 1   31   17   25 o   94.648   24.938   8.2168   3.6634   12.726   6.1089   5.6847   4.5778  111.582   33.264   79.742   28.991 31.83927 44.12421 
1 1 1   31   17   26 o   54.471   24.402  -0.4519   4.1977  -6.4741   5.9389   5.5604   5.9340   51.649   24.936   80.758   32.097 -29.10855 40.64487 
1 1 1   31   18    0 o   82.861   27.985   7.0267   3.1750   7.0267   3.1750   7.0267   3.1750   82.861   27.985   82.861   27.985 0.000000 0.000000 
1 1 1   31   18    1 o  136.931   11.523   14.728   2.3926   13.929   3.1774   15.774   3.6361  131.544   16.118  139.549   17.401 -8.005432 23.71879 
1 1 1   31   18    2 o   49.351   18.871   1.4429   1.9884  -0.1414   2.3931   4.9750   3.5733   44.056   19.124   77.627   25.765 -33.57129 32.08691 
1 1 1   31   18    3 o   84.504   15.837   5.8336   1.9732   5.8336   1.9732   0.0000   0.0000   84.504   15.837  ?   ?  0.000000 15.83703 
1 1 1   31   18    4 o  183.549   7.3664   25.994   2.0696   25.420   2.3432   28.028   4.4130  181.283   8.4448  187.440   15.521 -6.156281 17.66985 
1 1 1   31   18    5 o   52.349   21.978   0.6838   2.9770  -1.0974   4.6542   1.9171   3.8728   57.399   25.705   63.179   25.645 -5.779446 36.31005 
1 1 1   31   18    6 o  149.479   15.097   17.856   3.4068   22.117   5.3430   14.936   4.4224  162.942   21.984  133.217   22.489 29.72583 31.44958 
1 1 1   31   18    7 o   80.896   23.473   5.5839   3.0770   4.0500   4.3857   7.0709   4.3181   74.718   28.155   90.012   28.191 -15.29409 39.84251 
1 1 1   31   18    8 o  113.585   19.102   10.671   3.2032   19.042   4.6946   3.3788   4.3815  151.576   20.782   71.656   27.849 79.92037 34.74844 
1 1 1   31   18    9 o  126.912   17.235   13.106   3.2613   17.559   4.9515   9.6939   4.3343  144.052   23.249  104.760   26.893 39.29140 35.54906 
1 1 1   31   18   10 o  104.260   25.126   9.4816   3.9626   14.993   8.0883   7.7410   4.5454  123.493   38.568   93.461   28.867 30.03208 48.17430 
1 1 1   31   18   11 o  143.544   17.300   16.740   3.7244   15.131   5.5149   18.089   5.0500  130.307   28.448  146.007   23.386 -15.69957 36.82678 
1 1 1   31   18   12 o  101.295   24.196   8.9152   3.6999   12.973   5.5803   5.7317   4.9425  119.137   30.478   83.505   30.160 35.63213 42.87792 
1 1 1   31   18   13 o   99.058   24.623   8.5728   3.7172   8.6648   5.5637   8.4987   4.9959   97.651   32.137   96.968   30.316 0.6833649 44.17967 
1 1 1   31   18   14 o   53.042   25.131  -4.9782   5.4496  -4.9782   5.4496   0.0000   0.0000   53.042   25.131  ?   ?  0.000000 25.13070 
1 1 1   31   18   15 o  157.821   18.058   20.379   4.2837   26.610   5.9480   13.666   6.1744  177.706   22.363  120.357   32.676 57.34912 39.59572 
1 1 1   31   18   16 o  155.675   18.633   19.950   4.3517   28.460   6.0302   10.701   6.2863  184.007   21.837  105.932   34.114 78.07523 40.50429 
1 1 1   31   18   17 o   79.163   28.397   5.2139   4.3734   6.6829   6.0228   3.5755   6.3609   88.339   33.051   78.140   32.411 10.19873 46.29090 
1 1 1   31   18   18 o   94.302   34.101   8.2022   6.3215   0.0000   0.0000   8.2022   6.3215  ?   ?    94.302   34.101 0.000000 34.10095 
1 1 1   31   18   19 o  131.062   22.942   14.873   4.4347   14.556   6.2233   15.200   6.3210  122.646   32.594  125.380   32.624 -2.733856 46.11612 
1 1 1   31   18   20 o   76.595   27.752   4.9230   4.1897   3.4007   6.0609   6.3161   5.7981   75.592   31.519   85.350   32.322 -9.757736 45.14609 
1 1 1   31   18   21 o   68.672   26.007   3.5846   3.7538   5.8964   8.8665   3.0798   4.1435   88.656   37.611   67.662   26.843 20.99380 46.20780 
1 1 1   31   18   22 o   60.756   24.439   2.1790   3.4827   1.9013   6.0859   2.3143   4.2467   70.553   30.561   64.700   26.626 5.852249 40.53299 
1 1 1   31   18   23 o   93.594   24.907   7.9988   3.6308   1.1430   6.2093   11.561   4.4757   68.641   30.272  111.785   26.552 -43.14423 40.26714 
1 1 1   31   18   24 o   39.912   19.227  -4.4006   3.4859   10.169   6.3697 -10.6297   4.1650   99.401   34.385   35.535   17.813 63.86573 38.72552 
1 1 1   31   18   25 o   42.249   20.555  -6.0530   4.2421  -1.7721   6.1005 -10.0610   5.9029   60.867   28.087   46.604   22.991 14.26342 36.29675 
1 1 1   31   19    0 o   32.705   22.010  -1.1313   3.1512  -1.1313   3.1512  -1.1313   3.1512   32.705   22.010   32.705   22.010 0.000000 0.000000 
1 1 1   31   19    1 o   44.950   19.128   0.2347   2.3054  -0.6146   2.9658   1.5313   3.6645   46.963   20.806   60.316   24.767 -13.35277 32.34657 
1 1 1   31   19    2 o  132.444   16.198   14.155   3.2153   14.155   3.2153   0.0000   0.0000  132.444   16.198  ?   ?  0.000000 16.19830 
1 1 1   31   19    3 o   47.302   18.606   1.1552   1.9748   0.7615   2.2367   2.5468   4.2051   47.059   19.340   67.333   26.935 -20.27332 33.15912 
1 1 1   31   19    4 o   51.824   18.853   1.8570   1.9365   1.9929   2.1912   1.3722   4.1382   54.194   20.002   62.275   26.012 -8.081478 32.81336 
1 1 1   31   19    5 o  123.724   10.257   11.989   1.9248   13.393   2.1320   5.7985   4.4762  130.671   10.755   83.276   28.824 47.39507 30.76503 
1 1 1   31   19    6 o  187.327   13.676   27.794   3.8941   29.712   5.8294   26.249   5.2330  189.949   20.368  179.010   19.410 10.93910 28.13512 
1 1 1   31   19    7 o   74.856   24.156   4.6785   3.1507   2.0968   4.3188   7.6159   4.6067   65.924   26.957   92.741   29.130 -26.81734 39.68953 
1 1 1   31   19    8 o   40.311   19.028  -3.0509   3.0710  -7.0803   4.2990   1.1482   4.3886   41.941   20.469   62.679   26.518 -20.73771 33.49915 
1 1 1   31   19    9 o   84.801   26.845   6.2289   3.9054   13.063   7.8827   4.0056   4.4960  115.627   38.263   74.567   28.409 41.05982 47.65575 
1 1 1   31   19   10 o  152.024   16.087   18.633   3.6864   20.709   5.3126   16.706   5.1194  156.569   22.841  139.116   24.959 17.45280 33.83277 
1 1 1   31   19   11 o  101.167   24.469   8.9329   3.7476   10.716   5.3502   7.2159   5.2510  107.909   30.847   90.643   31.228 17.26559 43.89429 
1 1 1   31   19   12 f  180.398   15.125   26.060   4.1377   25.871   6.0053   26.230   5.7091  174.882   22.992  177.139   21.497 -2.256577 31.47600 
1 1 1   31   19   13 o  136.927   20.249   15.653   4.1159   20.676   5.8819   10.833   5.7615  154.008   25.869  107.426   32.367 46.58157 41.43495 
1 1 1   31   19   14 o  146.627   26.866   19.006   5.8073   19.006   5.8073   0.0000   0.0000  146.627   26.866  ?   ?  0.000000 26.86581 
1 1 1   31   19   15 o   56.525   24.823  -0.0749   4.1347  -2.5988   5.5794   2.9995   6.1579   58.237   26.868   75.664   31.679 -17.42672 41.53844 
1 1 1   31   19   16 o   82.430   27.895   5.9453   4.1869   5.5786   5.6847   6.3801   6.1898   83.058   31.872   87.061   33.294 -4.002945 46.09019 
1 1 1   31   19   17 o   45.361   21.610  -4.3178   4.1402  -7.4954   5.6704  -0.6896   6.0591   49.579   24.039   64.658   29.112 -15.07819 37.75443 
1 1 1   31   19   18 o   61.555   25.989   1.4133   4.2010  -0.6691   5.7906   3.7270   6.1038   63.218   28.462   76.877   31.807 -13.65868 42.68235 
1 1 1   31   19   19 o   46.795   22.157  -3.8088   4.2229   4.0791   6.1062 -11.0398   5.8464   77.697   31.945   45.681   22.600 32.01600 39.13110 
1 1 1   31   19   20 o   79.709   30.248   5.3436   5.0844   12.762   9.1271   2.0056   6.1223  107.993   40.631   71.143   30.735 36.84999 50.94621 
1 1 1   31   19   21 f   76.732   28.338   5.0107   4.3993   1.7853   6.1427   8.4074   6.3036   70.297   30.577   92.991   33.987 -22.69442 45.71744 
1 1 1   31   19   22 f   50.720   23.613  -2.5755   4.4584   2.0717   6.1342  -7.7796   6.4914   70.766   30.668   52.851   25.647 17.91582 39.97866 
1 1 1   31   19   23 o   69.095   25.442   3.9122   3.5418   0.0882   6.2259   5.7419   4.3066   65.736   29.562   79.676   28.222 -13.94046 40.87019 
1 1 1   31   19   24 o   90.011   25.658   7.5367   3.7070   10.139   6.4032   6.2246   4.5465   98.704   34.457   81.965   29.001 16.73848 45.03675 
1 1 1   31   20    0 o   75.835   33.548   6.7848   4.1007   6.7848   4.1007   6.7848   4.1007   75.835   33.548   75.835   33.548 0.000000 0.000000 
1 1 1   31   20    1 o   54.702   21.804   1.5293   2.7456  -2.3934   3.5912   7.0474   4.2594   46.296   21.428   89.590   27.989 -43.29449 35.24997 
1 1 1   31   20    2 o   75.326   25.168   4.6973   3.4079   4.6973   3.4079   0.0000   0.0000   75.326   25.168  ?   ?  0.000000 25.16783 
1 1 1   31   20    3 o  145.275   13.181   16.737   2.8991   17.882   3.5628   14.494   4.9877  149.067   15.858  128.773   26.197 20.29433 30.62268 
1 1 1   31   20    4 o   54.636   20.216   2.0302   2.2411   3.0225   2.5215  -1.7016   4.8898   62.497   21.634   56.938   25.844 5.559685 33.70361 
1 1 1   31   20    5 o   86.692   17.447   6.2314   2.2349   7.4561   2.4789   0.9127   5.1659   94.932   17.711   65.835   28.337 29.09663 33.41685 
1 1 1   31   20    6 o   63.682   18.950   3.3543   1.9839   3.5469   2.1414   2.1873   5.2710   65.426   19.737   70.426   29.382 -4.999588 35.39542 
1 1 1   31   20    7 o   73.935   24.796   4.5161   3.3081   4.2728   4.2778   4.8780   5.2178   75.014   27.896   80.290   30.600 -5.276634 41.40726 
1 1 1   31   20    8 o  123.925   19.023   12.714   3.4930   10.996   4.5356   15.219   5.4759  111.160   26.939  130.446   28.244 -19.28513 39.03143 
1 1 1   31   20    9 o  113.717   26.722   11.495   4.5725   16.903   7.9810   8.8525   5.5789  130.353   37.798   98.260   32.174 32.09248 49.63678 
1 1 1   31   20   10 o  186.974   14.558   27.915   4.1334   32.940   5.5903   21.854   6.1393  200.794   18.393  158.139   26.286 42.65524 32.08241 
1 1 1   31   20   11 o   49.208   22.614  -2.0695   3.8986 -10.3993   5.3663   7.2403   5.6733   44.137   21.802   90.615   32.360 -46.47802 39.01906 
1 1 1   31   20   12 o  112.544   24.311   11.087   4.0654   14.358   5.6663   7.6159   5.8362  124.715   30.040   92.125   32.830 32.59069 44.49948 
1 1 1   31   20   13 o  120.685   30.898   13.657   5.7320   13.657   5.7320   0.0000   0.0000  120.685   30.898  ?   ?  0.000000 30.89769 
1 1 1   31   20   14 o   62.580   26.201   1.5933   4.2124   3.2880   5.6286  -0.5641   6.3509   74.457   30.649   66.459   29.875 7.998276 42.80014 
1 1 1   31   20   15 o  160.886   18.676   21.457   4.5135   29.155   6.0603   11.868   6.7634  185.397   21.770  109.045   35.411 76.35258 41.56816 
1 1 1   31   20   16 o   50.847   23.469  -2.2217   4.2634   0.1589   5.7233  -5.1895   6.3904   65.011   28.847   57.018   27.072 7.992786 39.56117 
1 1 1   31   20   17 o   91.247   28.880   7.7356   4.5204   12.746   6.0073   1.1953   6.8635  113.835   32.730   72.033   31.795 41.80204 45.63100 
1 1 1   31   20   18 o   47.871   22.634  -3.7545   4.3774   6.0514   6.0458 -14.5597   6.3463   84.212   32.718   44.633   22.317 39.57876 39.60399 
1 1 1   31   20   19 o   51.992   23.818  -1.6789   4.2787  -2.4327   5.8159  -0.7895   6.3170   58.792   27.232   64.693   29.368 -5.900963 40.05108 
1 1 1   31   20   20 o   47.126   22.825  -6.4591   5.0770  -0.3692   8.2481 -10.1739   6.4420   72.478   33.154   49.584   24.375 22.89449 41.15029 
1 1 1   31   20   21 o   95.486   29.212   8.7753   4.6674   7.7400   6.2918   10.042   6.9601   89.736   33.740   98.503   35.757 -8.766937 49.16274 
1 1 1   31   20   22 o   42.084   20.708  -8.0967   4.6851 -10.7474   6.2435  -4.6804   7.0881   47.661   23.537   60.036   28.507 -12.37514 36.96823 
1 1 1   31   21    0 o   42.665   27.972  -0.1568   4.5631  -0.1568   4.5631  -0.1568   4.5631   42.665   27.972   42.665   27.972 0.000000 0.000000 
1 1 1   31   21    1 o   91.593   29.111   7.4784   4.5892   7.4784   4.5892   0.0000   0.0000   91.593   29.111  ?   ?  0.000000 29.11114 
1 1 1   31   21    2 f   73.736   24.577   4.5149   3.2502   2.1270   4.2225   7.9867   5.0915   65.300   26.673   94.172   30.731 -28.87164 40.69243 
1 1 1   31   21    3 o   56.500   22.940   1.4851   3.0996   0.5541   3.9401   2.9966   5.0206   57.783   24.807   72.060   29.217 -14.27742 38.32763 
1 1 1   31   21    4 o   93.750   19.316   7.3887   2.6796   5.8182   3.0819   12.254   5.4245   82.038   23.398  115.401   30.317 -33.36298 38.29586 
1 1 1   31   21    5 o  128.710   14.246   13.276   2.7595   14.552   3.1708   9.2911   5.6022  134.182   15.737  100.227   32.197 33.95554 35.83702 
1 1 1   31   21    6 o   79.836   20.836   5.4467   2.5732   5.3215   2.9095   5.8964   5.5141   78.652   22.826   84.800   31.645 -6.148834 39.01793 
1 1 1   31   21    7 o  179.361   9.8342   25.126   2.6895   28.453   3.0253   12.583   5.8743  190.673   10.405  115.588   32.073 75.08454 33.71896 
1 1 1   31   21    8 o  154.651   11.469   18.847   2.6955   18.934   3.0428   18.531   5.8099  154.383   12.998  144.357   27.294 10.02654 30.23099 
1 1 1   31   21    9 o   57.361   24.105   1.0690   3.5870   3.1373   4.6914  -1.8418   5.5655   70.896   28.418   59.903   27.337 10.99327 39.43229 
1 1 1   31   21   10 o   37.390   18.357  -6.6017   3.6174  -6.0922   4.8000  -7.2714   5.5035   46.658   22.498   49.125   23.786 -2.467556 32.74074 
1 1 1   31   21   11 f  133.241   19.945   14.902   3.9426   17.454   5.4652   12.132   5.6930  140.045   26.466  112.898   31.663 27.14737 41.26696 
1 1 1   31   21   12 o  106.263   32.066   10.829   5.6514   10.829   5.6514   0.0000   0.0000  106.263   32.066  ?   ?  0.000000 32.06576 
1 1 1   31   21   13 o   63.004   25.838   2.0419   3.9821   5.4413   5.6147  -1.3986   5.6485   81.893   31.610   60.877   27.688 21.01557 42.02135 
1 1 1   31   21   14 o  122.486   24.317   13.258   4.3982   19.533   5.9541   5.7222   6.5250  146.757   27.517   84.440   33.627 62.31681 43.45057 
1 1 1   31   21   15 o  107.776   26.993   10.677   4.4434   9.5228   5.9497   12.132   6.6814   98.780   33.253  109.340   35.165 -10.56055 48.39830 
1 1 1   31   21   16 o   73.943   28.350   4.2838   4.4952   5.7074   5.9128   2.3341   6.9196   82.704   32.293   74.807   32.496 7.897163 45.81289 
1 1 1   31   21   17 o   99.546   28.929   9.4078   4.6705   6.4018   6.1893   13.383   7.1177   85.398   33.125  112.909   36.293 -27.51048 49.13704 
1 1 1   31   21   18 o  113.756   27.457   12.076   4.7261   13.430   6.3705   10.419   7.0482  114.722   33.915  100.485   36.049 14.23762 49.49509 
1 1 1   31   21   19 o  108.192   30.673   11.485   5.3128   4.9684   8.6098   15.491   6.7515   84.568   36.491  122.441   34.531 -37.87315 50.23917 
1 1 1   31   21   20 o   71.224   28.123   3.8081   4.5277   2.4786   6.1516   5.3797   6.6883   71.718   30.896   81.781   33.507 -10.06326 45.57694 
1 1 1   31   22    1 o  148.138   23.857   18.908   5.2258   0.0000   0.0000   18.908   5.2258  ?   ?   148.138   23.857 0.000000 23.85746 
1 1 1   31   22    2 o   69.844   24.625   3.9084   3.2753   1.4974   4.3751   6.9825   4.9402   63.283   26.609   88.545   30.299 -25.26245 40.32458 
1 1 1   31   22    3 f   75.649   24.419   4.8870   3.2195   2.0564   4.2283   8.7923   4.9666   64.655   26.583   97.613   30.179 -32.95869 40.21716 
1 1 1   31   22    4 o   62.637   23.767   2.7134   3.1388   0.6996   3.9712   6.0658   5.1237   58.164   24.936   84.355   30.670 -26.19038 39.52803 
1 1 1   31   22    5 f   79.389   21.539   5.4389   2.6839   6.7417   3.1559   2.0338   5.1020   87.778   23.155   68.393   28.745 19.38449 36.91138 
1 1 1   31   22    6 o  145.184   12.174   16.708   2.6804   17.503   3.0940   14.315   5.3668  147.898   13.828  125.109   28.644 22.78954 31.80661 
1 1 1   31   22    7 o  101.927   18.396   8.6963   2.7644   9.3219   3.2652   7.1133   5.1944  104.273   21.181   88.914   31.035 15.35899 37.57391 
1 1 1   31   22    8 f  140.614   11.764   15.657   2.5086   16.090   2.8103   13.957   5.5654  142.008   13.076  122.262   29.971 19.74610 32.69959 
1 1 1   31   22    9 o  106.775   14.691   9.2600   2.3374   9.2598   2.5914   9.2610   5.4137  106.002   16.509   98.802   31.641 7.199936 35.68913 
1 1 1   31   22   10 o   46.586   18.854   0.9704   2.0866   1.4649   2.2794  -1.5877   5.1844   50.839   19.992   57.963   26.426 -7.123947 33.13598 
1 1 1   31   22   11 o   89.751   10.841   6.4050   1.4591   7.2412   1.5115  -5.0314   5.5899   95.606   10.502   52.979   25.203 42.62696 27.30318 
1 1 1   31   22   12 o   28.343   13.785  -3.1379   1.9043  -3.1379   1.9043   0.0000   0.0000   28.343   13.785  ?   ?  0.000000 13.78547 
1 1 1   31   22   13 o   49.869   22.638  -1.2625   3.7527  -2.3229   5.4461  -0.3040   5.1781   57.370   26.495   60.891   27.202 -3.521641 37.97304 
1 1 1   31   22   14 o  100.861   27.257   9.4475   4.3080   11.766   5.9758   6.9392   6.2163  108.668   33.014   87.656   33.402 21.01228 46.96389 
1 1 1   31   22   15 o   87.358   28.527   7.0933   4.3871   6.5430   5.9182   7.7646   6.5364   85.545   32.593   90.735   34.328 -5.190010 47.33623 
1 1 1   31   22   16 o  155.502   19.880   20.506   4.6234   19.956   6.3685   21.120   6.7227  145.229   29.652  148.619   30.573 -3.389618 42.59092 
1 1 1   31   22   17 o   79.885   28.885   5.6894   4.5353  -1.9908   6.0935   15.228   6.7907   60.764   28.050  121.150   34.789 -60.38650 44.68875 
1 1 1   31   22   18 o  146.870   22.427   18.869   4.8818   17.438   6.6727   20.517   7.1608  131.444   33.167  142.888   33.349 -11.44412 47.03385 
1 1 1   31   23    0 o   57.864   32.821   4.0122   4.4990   4.0122   4.4990   4.0122   4.4990   57.864   32.821   57.864   32.821 0.000000 0.000000 
1 1 1   31   23    1 o   78.081   24.306   5.3234   3.2154   4.8808   4.4582   5.8032   4.6418   77.243   28.527   81.945   29.270 -4.702164 40.87213 
1 1 1   31   23    2 o   76.449   28.888   4.6286   4.6253   0.0000   0.0000   4.6286   4.6253  ?   ?    76.449   28.888 0.000000 28.88837 
1 1 1   31   23    3 o  141.777   15.631   16.329   3.3356   18.842   4.5084   13.289   4.9582  149.676   20.194  120.788   27.442 28.88823 34.07174 
1 1 1   31   23    4 o  181.707   12.815   26.255   3.5413   25.298   4.7326   27.472   5.3381  175.292   17.890  181.551   19.516 -6.258011 26.47489 
1 1 1   31   23    5 o  116.113   16.175   11.059   2.7967   13.599   3.3929   5.6752   4.9395  128.114   17.782   81.604   30.046 46.51034 34.91384 
1 1 1   31   23    6 o   87.797   21.200   6.6920   2.8166   7.7035   3.4110   4.5241   4.9937   93.116   23.833   76.704   29.753 16.41226 38.12143 
1 1 1   31   23    7 o   82.639   20.221   5.8918   2.5369   6.3867   2.9348   4.4291   5.0459   85.318   22.245   76.358   29.828 8.959869 37.20893 
1 1 1   31   23    8 o   59.766   21.031   2.7933   2.3878   2.5749   2.6897   3.6056   5.1873   59.527   22.123   73.491   29.733 -13.96417 37.06035 
1 1 1   31   23    9 o   92.462   17.573   7.1803   2.3960   5.9977   2.6932   11.670   5.2477   82.951   21.147  110.609   30.164 -27.65852 36.83862 
1 1 1   31   23   10 o   76.395   19.675   5.0331   2.3147   3.6740   2.5756   10.739   5.2773   66.195   21.870  105.526   30.775 -39.33108 37.75440 
1 1 1   31   23   11 o   65.504   21.496   3.6040   2.4898   3.6040   2.4898   0.0000   0.0000   65.504   21.496  ?   ?  0.000000 21.49575 
1 1 1   31   23   12 o  114.680   12.767   10.564   2.2030   11.883   2.4020   3.5736   5.5280  121.550   13.119   73.891   30.390 47.65908 33.10030 
1 1 1   31   23   13 o  207.763   8.6282   33.626   2.7438   36.245   3.0124   20.875   6.6475  215.473   9.1339  148.102   30.344 67.37061 31.68918 
1 1 1   31   23   14 o  140.018   9.1012   15.369   1.9399   15.772   2.0312   11.181   6.5464  141.733   9.4164  104.078   34.882 37.65564 36.13026 
1 1 1   31   23   15 o  130.267   12.239   13.576   2.4116   15.443   2.5915   1.5049   6.5887  138.967   12.311   70.813   31.209 68.15375 33.54974 
1 1 1   31   24    0 o   52.481   31.417   2.8847   4.4995   2.8847   4.4995   2.8847   4.4995   52.481   31.417   52.481   31.417 0.000000 0.000000 
1 1 1   31   24    1 o  144.894   15.453   17.079   3.3743   16.451   4.7256   17.731   4.8197  137.279   23.324  143.002   22.784 -5.723022 32.60537 
1 1 1   31   24    2 o   59.990   23.463   2.3191   3.1254   4.0253   4.2982   0.4049   4.5526   72.431   27.733   59.782   26.156 12.64909 38.12154 
1 1 1   31   24    3 o  114.999   27.271   12.169   4.7274   0.0000   0.0000   12.169   4.7274  ?   ?   114.999   27.271 0.000000 27.27059 
1 1 1   31   24    4 f   59.814   26.286   0.2776   4.6437   0.0000   0.0000   0.2776   4.6437  ?   ?    59.814   26.286 0.000000 26.28647 
1 1 1   31   24    5 o  155.163   13.931   19.371   3.2733   20.640   4.1489   17.280   5.3271  158.086   17.437  138.518   26.082 19.56764 31.37395 
1 1 1   31   24    6 o   83.030   19.961   5.9600   2.5055   4.5989   2.9035   9.9292   4.9583   72.789   23.157  101.951   29.859 -29.16220 37.78630 
1 1 1   31   24    7 o   71.997   21.081   4.4956   2.4719   5.3370   2.8652   2.0461   4.8884   77.798   22.672   66.507   28.055 11.29030 36.07077 
1 1 1   31   24    8 o   61.616   21.368   3.0606   2.4606   2.5815   2.8424   4.4931   4.9149   59.975   22.650   75.696   29.474 -15.72111 37.17212 
1 1 1   31   24    9 o  115.569   15.752   10.984   2.7138   10.987   3.1954   10.974   5.1403  113.881   19.001  106.615   30.152 7.265656 35.63985 
1 1 1   31   24   10 o  151.346   14.957   18.623   3.4196   18.623   3.4196   0.0000   0.0000  151.346   14.957  ?   ?  0.000000 14.95719 
1 1 1   31   24   11 o  109.308   16.879   9.9559   2.7330   9.8355   3.1798   10.296   5.3468  106.856   20.181  102.300   31.261 4.555336 37.20905 
1 1 1   31   24   12 o   65.285   22.379   3.5545   2.6953   2.9687   3.1307   5.2319   5.2978   63.022   23.778   79.046   30.650 -16.02378 38.79227 
1 1 1   31   25    0 o  223.008   16.042   39.783   5.4106   39.783   5.4106   39.783   5.4106  223.008   16.042  223.008   16.042 0.000000 0.000000 
1 1 1   31   25    1 o   49.942   21.641   0.2324   3.0542  -0.9732   4.2248   1.5520   4.4202   53.570   24.197   62.617   26.560 -9.046024 35.92923 
1 1 1   31   25    2 o   74.943   23.984   4.9396   3.1109   2.7039   4.1857   7.6987   4.6498   65.982   26.704   90.359   29.362 -24.37729 39.68919 
1 1 1   31   25    3 o   52.789   22.110   1.0015   3.0015  -1.7346   3.9195   4.8808   4.6671   49.504   22.722   76.685   29.009 -27.18073 36.84821 
1 1 1   31   25    4 o   69.227   23.913   4.0403   3.0800   3.4522   3.9773   4.9213   4.8681   68.451   26.553   77.227   29.528 -8.776939 39.71048 
1 1 1   31   25    5 o   78.195   29.776   5.1274   4.9377   0.0000   0.0000   5.1274   4.9377  ?   ?    78.195   29.776 0.000000 29.77580 
1 1 1   31   25    6 o   62.124   25.385   2.1615   3.8260  -0.5396   6.0522   3.9595   4.9378   63.958   28.918   73.363   29.241 -9.404907 41.12550 
1 1 1   31   25    7 o  100.854   20.105   8.7784   2.9947   7.9235   3.6899   10.428   5.1258   93.010   25.264  103.507   30.371 -10.49753 39.50558 
1 1 1   32    0    0 o   40.633   25.837   0.4461   3.5166   0.4461   3.5166   0.4461   3.5166   40.633   25.837   40.633   25.837 0.000000 0.000000 
1 1 1   32    0    1 o   83.484   23.833   6.6130   2.6394   6.6130   2.6394   6.6130   2.6394   83.484   23.833   83.484   23.833 0.000000 0.000000 
1 1 1   32    0    2 o   51.340   26.369   3.0770   2.6383   3.0770   2.6383   3.0770   2.6383   51.340   26.369   51.340   26.369 0.000000 0.000000 
1 1 1   32    0    3 o  135.803   13.934   14.704   2.8265   14.704   2.8265   14.704   2.8265  135.803   13.934  135.803   13.934 0.000000 0.000000 
1 1 1   32    0    4 o  110.289   17.324   10.110   2.7090   10.110   2.7090   10.110   2.7090  110.289   17.324  110.289   17.324 0.000000 0.000000 
1 1 1   32    0    5 o  178.824   13.382   25.129   3.6157   25.129   3.6157   25.129   3.6157  178.824   13.382  178.824   13.382 0.000000 0.000000 
1 1 1   32    0    6 o   77.447   23.501   5.8078   2.4316   5.8078   2.4316   5.8078   2.4316   77.447   23.501   77.447   23.501 0.000000 0.000000 
1 1 1   32    0    7 o  100.833   15.112   8.3791   2.1780   8.3791   2.1780   8.3791   2.1780  100.833   15.112  100.833   15.112 0.000000 0.000000 
1 1 1   32    0    8 o   20.537   14.613  -2.7431   1.9928  -2.7431   1.9928  -2.7431   1.9928   20.537   14.613   20.537   14.613 0.000000 0.000000 
1 1 1   32    0    9 o   64.629   23.279   4.3224   2.1092   4.3224   2.1092   4.3224   2.1092   64.629   23.279   64.629   23.279 0.000000 0.000000 
1 1 1   32    0   10 o  148.482   10.294   17.221   2.3136   17.221   2.3136   17.221   2.3136  148.482   10.294  148.482   10.294 0.000000 0.000000 
1 1 1   32    0   11 o   18.204   13.140  -3.4427   1.8728  -3.4427   1.8728  -3.4427   1.8728   18.204   13.140   18.204   13.140 0.000000 0.000000 
1 1 1   32    0   12 o   60.929   31.981   4.4281   3.9410   4.4281   3.9410   4.4281   3.9410   60.929   31.981   60.929   31.981 0.000000 0.000000 
1 1 1   32    0   13 o  129.936   23.343   14.475   4.1970   14.475   4.1970   14.475   4.1970  129.936   23.343  129.936   23.343 0.000000 0.000000 
1 1 1   32    0   14 o   68.394   34.149   5.6695   4.3551   5.6695   4.3551   5.6695   4.3551   68.394   34.149   68.394   34.149 0.000000 0.000000 
1 1 1   32    0   15 o   54.392   32.042   3.0056   4.5451   3.0056   4.5451   3.0056   4.5451   54.392   32.042   54.392   32.042 0.000000 0.000000 
1 1 1   32    0   16 o  142.309   24.508   17.345   4.8632   17.345   4.8632   17.345   4.8632  142.309   24.508  142.309   24.508 0.000000 0.000000 
1 1 1   32    0   17 o  114.343   32.437   12.700   4.9177   12.700   4.9177   12.700   4.9177  114.343   32.437  114.343   32.437 0.000000 0.000000 
1 1 1   32    0   18 o   79.795   37.028   7.7152   5.0078   7.7152   5.0078   7.7152   5.0078   79.795   37.028   79.795   37.028 0.000000 0.000000 
1 1 1   32    0   19 o   37.174   26.122  -5.5914   5.7367  -5.5914   5.7367  -5.5914   5.7367   37.174   26.122   37.174   26.122 0.000000 0.000000 
1 1 1   32    0   20 o   42.197   27.425   0.1096   4.2500   0.1096   4.2500   0.1096   4.2500   42.197   27.425   42.197   27.425 0.000000 0.000000 
1 1 1   32    0   21 o   31.378   22.047  -4.0992   4.0816  -4.0992   4.0816  -4.0992   4.0816   31.378   22.047   31.378   22.047 0.000000 0.000000 
1 1 1   32    0   22 o   34.703   23.912  -2.7080   4.2131  -2.7080   4.2131  -2.7080   4.2131   34.703   23.912   34.703   23.912 0.000000 0.000000 
1 1 1   32    0   23 o   51.815   34.591  -0.9713   7.5071  -0.9713   7.5071  -0.9713   7.5071   51.815   34.591   51.815   34.591 0.000000 0.000000 
1 1 1   32    0   24 o  107.497   46.420   14.484   7.8601   14.484   7.8601   14.484   7.8601  107.497   46.420  107.497   46.420 0.000000 0.000000 
1 1 1   32    0   25 o   51.000   30.819   2.4832   4.4130   2.4832   4.4130   2.4832   4.4130   51.000   30.819   51.000   30.819 0.000000 0.000000 
1 1 1   32    0   26 o  140.977   25.032   17.360   4.8936   17.360   4.8936   17.360   4.8936  140.977   25.032  140.977   25.032 0.000000 0.000000 
1 1 1   32    0   27 o   77.132   36.212   7.4656   4.7983   7.4656   4.7983   7.4656   4.7983   77.132   36.212   77.132   36.212 0.000000 0.000000 
1 1 1   32    0   28 f   38.489   25.960  -1.3349   4.4304  -1.3349   4.4304  -1.3349   4.4304   38.489   25.960   38.489   25.960 0.000000 0.000000 
1 1 1   32    0   29 o   38.576   25.779  -0.8064   4.1884  -0.8064   4.1884  -0.8064   4.1884   38.576   25.779   38.576   25.779 0.000000 0.000000 
1 1 1   32    0   30 o   36.417   24.661  -1.4020   4.0764  -1.4020   4.0764  -1.4020   4.0764   36.417   24.661   36.417   24.661 0.000000 0.000000 
1 1 1   32    0   31 o   67.419   36.209   6.1251   5.1499   6.1251   5.1499   6.1251   5.1499   67.419   36.209   67.419   36.209 0.000000 0.000000 
1 1 1   32    0   32 o   36.811   23.977   0.1663   3.2723   0.1663   3.2723   0.1663   3.2723   36.811   23.977   36.811   23.977 0.000000 0.000000 
1 1 1   32    0   33 f   43.943   26.631   1.8912   3.3137   1.8912   3.3137   1.8912   3.3137   43.943   26.631   43.943   26.631 0.000000 0.000000 
1 1 1   32    1    0 o   76.559   24.922   5.8330   2.5847   5.8330   2.5847   5.8330   2.5847   76.559   24.922   76.559   24.922 0.000000 0.000000 
1 1 1   32    1    1 o   44.521   17.614   0.9207   1.7794   0.6482   2.5053   1.1981   2.5278   49.046   20.342   52.074   20.865 -3.028011 29.13991 
1 1 1   32    1    2 o   56.273   18.651   2.4234   1.8726   1.3684   2.5524   3.6533   2.7559   53.177   21.077   68.240   22.626 -15.06308 30.92225 
1 1 1   32    1    3 o  170.683   8.3421   22.473   2.1794   21.900   3.0477   23.074   3.1177  167.384   11.975  171.847   11.927 -4.463715 16.90099 
1 1 1   32    1    4 o   83.216   14.729   5.5813   1.8074   6.0805   2.6061   5.1187   2.5088   85.529   20.225   78.459   20.620 7.069595 28.88339 
1 1 1   32    1    5 o   72.920   14.466   4.3054   1.5576   5.5556   2.2890   3.2273   2.1255   82.036   18.651   63.478   19.762 18.55831 27.17386 
1 1 1   32    1    6 o  163.824   7.3755   20.670   1.8494   20.272   2.8726   20.952   2.4170  161.059   11.733  164.293   9.6538 -3.233780 15.19423 
1 1 1   32    1    7 o   55.477   17.590   2.4174   1.6763   2.2673   2.7243   2.5089   2.1265   59.315   22.222   57.949   19.878 1.365696 29.81481 
1 1 1   32    1    8 o  138.423   9.9820   14.912   2.1007   16.716   2.7425   12.351   3.2678  145.966   12.392  123.619   17.782 22.34659 21.67421 
1 1 1   32    1    9 o   99.328   16.498   7.9833   2.4203   6.4005   3.6510   9.2242   3.2327   87.014   25.661  105.481   20.762 -18.46667 33.00825 
1 1 1   32    1   10 f  188.214   9.5310   27.478   2.7368   31.800   4.1044   24.018   3.6724  201.240   13.401  174.617   13.854 26.62262 19.27514 
1 1 1   32    1   11 o   89.015   15.447   6.4055   2.0283   0.0000   0.0000   6.4055   2.0283  ?   ?    89.015   15.447 0.000000 15.44679 
1 1 1   32    1   12 o   38.626   16.526   0.0233   1.7378   4.1108   3.9223  -0.9751   1.9385   74.313   26.863   36.086   16.337 38.22638 31.44050 
1 1 1   32    1   13 o  168.861   8.2192   22.012   2.1244   19.570   4.4875   22.717   2.4117  155.222   19.305  171.110   9.2427 -15.88811 21.40342 
1 1 1   32    1   14 f  157.904   13.243   19.649   3.1712   18.261   4.5922   20.915   4.3846  149.163   20.669  160.997   18.107 -11.83334 27.47830 
1 1 1   32    1   15 o  220.398   10.535   37.731   3.5538   37.942   5.2524   37.553   4.8263  218.495   15.812  217.984   14.548 0.5108643 21.48677 
1 1 1   32    1   16 o   56.278   23.310   1.0597   3.2837  -3.1826   4.7573   4.9197   4.5380   53.005   24.579   79.769   28.886 -26.76481 37.92760 
1 1 1   32    1   17 o   63.398   24.423   2.5051   3.3468  -2.5324   5.1678   6.1444   4.3925   57.057   26.153   85.492   28.573 -28.43433 38.73470 
1 1 1   32    1   18 o   92.674   25.466   7.4426   3.7238   8.2498   5.3449   6.6813   5.1911   96.668   31.484   89.064   31.028 7.604256 44.20393 
1 1 1   32    1   19 o   69.374   26.185   3.3497   3.7976   0.0000   0.0000   3.3497   3.7976  ?   ?    69.374   26.185 0.000000 26.18547 
1 1 1   32    1   20 o  151.484   15.568   18.401   3.5584   18.174   8.0333   18.457   3.9690  137.066   37.296  150.820   17.520 -13.75362 41.20635 
1 1 1   32    1   21 o  188.116   29.432   31.359   8.1967   31.359   8.1967   0.0000   0.0000  188.116   29.432  ?   ?  0.000000 29.43189 
1 1 1   32    1   22 o   82.923   23.117   5.9336   3.0442   5.1785   4.5125   6.5644   4.1239   79.846   28.821   86.592   27.604 -6.746414 39.90759 
1 1 1   32    1   23 o   65.919   23.715   3.3118   3.0522   3.1050   4.5025   3.4876   4.1518   70.375   27.962   70.714   27.213 -0.3389587 39.01869 
1 1 1   32    1   24 o  114.767   19.106   10.985   3.2383   11.455   4.6803   10.553   4.4853  112.817   27.381  108.353   27.111 4.464706 38.53198 
1 1 1   32    1   25 o   57.906   23.309   1.7463   3.1705   2.1099   4.6320   1.4258   4.3489   66.696   27.661   62.856   26.485 3.840595 38.29577 
1 1 1   32    1   26 o   80.762   27.722   5.6552   4.1363   4.0233   4.7498   10.776   8.4142   74.372   28.970  104.248   39.053 -29.87631 48.62539 
1 1 1   32    1   27 o   65.805   24.106   3.3342   3.1736  -0.6311   4.6740   6.7259   4.3228   57.582   25.775   86.189   28.326 -28.60687 38.29768 
1 1 1   32    1   28 o   83.170   23.638   6.1640   3.1511   4.7965   4.6405   7.3341   4.2925   76.573   28.936   89.021   28.140 -12.44802 40.36217 
1 1 1   32    1   29 o  110.281   19.017   10.337   3.0942   9.2032   4.4334   11.414   4.3204   98.695   28.034  111.658   25.798 -12.96328 38.09758 
1 1 1   32    1   30 o   64.837   24.270   3.2658   3.2486   3.2836   4.2335   3.2404   5.0660   68.077   27.094   70.579   29.067 -2.501442 39.73647 
1 1 1   32    1   31 o   77.961   25.041   5.5437   3.3889   2.8621   5.0891   7.6803   4.5425   68.898   28.818   89.106   29.025 -20.20812 40.90137 
1 1 1   32    1   32 o   55.195   21.512   2.0366   2.6202   4.1052   4.1945   0.7129   3.3555   70.847   27.328   53.096   22.846 17.75096 35.61974 
1 1 1   32    1   33 o  101.690   18.109   8.8719   2.7154   14.983   4.4012   5.1159   3.4504  128.842   23.169   74.794   25.323 54.04799 34.32275 
1 1 1   32    2    0 o  142.440   14.037   16.142   2.9922   16.142   2.9922   16.142   2.9922  142.440   14.037  142.440   14.037 0.000000 0.000000 
1 1 1   32    2    1 o   67.060   18.224   3.6908   1.9195   4.1542   2.6806   3.2033   2.7498   71.506   22.182   65.263   22.592 6.242897 31.66102 
1 1 1   32    2    2 o   78.938   18.604   5.1449   2.2110   7.6950   2.7003  -0.0426   3.8514   96.812   18.901   56.158   24.319 40.65435 30.79998 
1 1 1   32    2    3 o  163.523   10.075   20.779   2.5094   20.276   3.1014   21.731   4.2702  160.811   12.703  164.940   17.166 -4.129791 21.35495 
1 1 1   32    2    4 o  294.725   5.6291   66.721   2.5394   65.226   4.0545   67.685   3.2574  290.548   9.1170  296.510   7.1773 -5.962219 11.60313 
1 1 1   32    2    5 o  140.691   8.1026   15.314   1.7375   15.406   2.5766   15.237   2.3530  140.191   12.127  139.683   11.097 0.5075531 16.43791 
1 1 1   32    2    6 o  148.278   8.7156   17.033   1.9694   18.574   2.5774   14.871   3.0528  154.331   10.982  136.914   14.803 17.41672 18.43228 
1 1 1   32    2    7 o  122.467   10.948   11.729   2.0306   12.301   5.3555   11.633   2.1945  118.622   29.594  121.717   11.933 -3.094879 31.90869 
1 1 1   32    2    8 o  140.869   9.1253   15.400   1.9570   19.863   4.2625   14.208   2.2029  157.175   18.045  134.913   10.757 22.26132 21.00792 
1 1 1   32    2    9 o   97.165   12.930   7.4917   1.8752   5.0835   4.0645   8.1430   2.1136   79.956   27.478  101.061   14.043 -21.10567 30.85884 
1 1 1   32    2   10 o  152.074   8.7231   17.920   2.0220   20.430   4.3130   17.213   2.2891  159.380   17.995  148.715   10.117 10.66473 20.64347 
1 1 1   32    2   11 o   66.699   17.119   3.6591   1.7565   7.0780   4.1699   2.9216   1.9367   91.059   27.559   60.469   18.871 30.59046 33.40026 
1 1 1   32    2   12 o   40.865   16.794   0.4978   1.6865   1.9879   4.1810   0.2083   1.8431   65.636   26.645   40.726   17.206 24.91002 31.71716 
1 1 1   32    2   13 o  157.253   8.5951   19.161   2.0610   23.096   6.7408   18.755   2.1646  164.085   27.834  155.449   9.1377 8.636948 29.29557 
1 1 1   32    2   14 o  105.273   20.776   9.2301   3.2289   6.2342   6.7266   10.127   3.6807   90.947   34.725  109.641   22.681 -18.69326 41.47549 
1 1 1   32    2   15 f  144.237   8.4734   16.130   1.8625   14.772   5.0065   16.348   2.0065  131.340   25.824  145.074   9.0818 -13.73418 27.37466 
1 1 1   32    2   16 o  122.805   9.1641   11.739   1.7102   10.825   5.0266   11.858   1.8187  110.517   29.256  123.305   9.7147 -12.78883 30.82672 
1 1 1   32    2   17 o   70.009   24.098   3.8472   3.1267   1.9880   5.2541   4.8667   3.8907   70.439   29.357   77.774   26.875 -7.334167 39.80062 
1 1 1   32    2   18 o   64.262   22.780   3.0973   2.8064   10.958   5.4862   0.3113   3.2660  110.052   31.159   52.892   22.643 57.16061 38.51728 
1 1 1   32    2   19 o   53.157   21.501   1.2470   2.7121   5.5427   5.6617  -0.0322   3.0896   84.768   31.978   50.178   21.755 34.58989 38.67680 
1 1 1   32    2   20 o  116.854   17.980   11.198   3.1128   13.826   7.6410   10.675   3.4085  119.550   37.510  112.975   20.464 6.574387 42.72972 
1 1 1   32    2   21 o   63.446   22.693   3.0207   2.7909   6.7396   5.1350   1.4616   3.3249   88.506   30.859   57.880   23.659 30.62604 38.88444 
1 1 1   32    2   22 f   70.591   22.975   4.1266   2.8463  -0.1483   5.0173   6.1553   3.4564   61.728   27.218   84.133   25.007 -22.40444 36.96206 
1 1 1   32    2   23 f   80.279   22.879   5.5573   2.9479   11.838   5.1199   2.4424   3.6055  113.893   29.225   63.633   25.105 50.26054 38.52711 
1 1 1   32    2   24 o   42.369   19.515  -1.7992   2.9257  -4.3629   4.9021  -0.3808   3.6463   50.643   23.947   52.477   23.168 -1.834492 33.31993 
1 1 1   32    2   25 o   61.556   23.342   2.6029   3.0265   0.9052   4.8610   3.6775   3.8675   63.643   27.441   70.298   26.449 -6.655064 38.11200 
1 1 1   32    2   26 o  143.276   14.848   16.559   3.2089   13.787   4.9236   18.607   4.2310  123.803   26.763  149.706   18.884 -25.90337 32.75460 
1 1 1   32    2   27 o  119.594   17.630   11.871   3.1304   4.8553   4.7056   17.441   4.1927   77.394   29.163  144.205   19.495 -66.81098 35.07922 
1 1 1   32    2   28 o   62.342   25.625   2.0394   3.9278   1.2312   4.5931   4.2390   7.5773   62.505   26.808   81.620   34.703 -19.11502 43.85154 
1 1 1   32    2   29 o   96.594   21.417   8.1849   3.0834   5.6961   4.6082   10.202   4.1490   80.119   29.093  105.293   25.918 -25.17356 38.96375 
1 1 1   32    2   30 o   81.205   24.128   5.9832   3.2181  -2.5245   4.3181   16.611   4.8264   49.814   23.206  136.287   24.014 -86.47325 33.39462 
1 1 1   32    2   31 o  100.219   20.629   8.8087   3.0590   7.7197   4.5052   9.7402   4.1668   89.326   28.892  101.573   26.516 -12.24669 39.21531 
1 1 1   32    2   32 o   68.608   21.127   4.1485   2.4369   3.2148   3.5766   4.9575   3.3292   65.022   25.192   74.067   24.875 -9.045792 35.40323 
1 1 1   32    3    0 o   59.302   33.767   3.8917   4.7864   3.8917   4.7864   3.8917   4.7864   59.302   33.767   59.302   33.767 0.000000 0.000000 
1 1 1   32    3    1 o  100.332   17.166   8.1644   2.5415   8.8915   3.0411   6.4808   4.6276  103.928   19.841   88.520   29.318 15.40855 35.40079 
1 1 1   32    3    2 o   40.110   17.277  -0.0737   1.9230  -0.8392   2.6369   0.7959   2.8106   43.684   19.471   52.106   21.573 -8.422073 29.06039 
1 1 1   32    3    3 f   91.845   15.026   6.7818   2.0392   7.8251   2.7924   5.5894   2.9851   97.480   19.397   81.747   22.928 15.73279 30.03235 
1 1 1   32    3    4 o  144.723   9.4789   16.264   2.0882   16.323   3.0932   16.214   2.8304  143.702   14.251  143.595   13.019 0.1072845 19.30274 
1 1 1   32    3    5 o  103.269   12.479   8.4234   1.9325   12.493   4.0548   7.2274   2.1982  122.593   22.436   94.670   15.722 27.92317 27.39581 
1 1 1   32    3    6 o  176.610   7.9208   24.047   2.1412   26.085   4.4518   23.434   2.4422  181.177   16.225  173.884   9.2088 7.293228 18.65623 
1 1 1   32    3    7 o   40.014   16.963   0.1483   1.8013  -6.4518   4.2097   1.6275   1.9929   42.783   20.736   50.896   19.018 -8.113541 28.13694 
1 1 1   32    3    8 o  121.482   11.025   11.548   2.0277   14.042   5.9602   11.222   2.1564  126.085   31.081  119.510   11.948 6.574623 33.29899 
1 1 1   32    3    9 o  113.525   11.047   10.099   1.8952   9.7707   4.5784   10.167   2.0820  106.172   27.833  113.635   12.159 -7.463112 30.37312 
1 1 1   32    3   10 o   56.243   23.095   1.1417   3.1862  -1.8782   4.4261   4.3896   4.5902   54.300   24.624   77.938   28.914 -23.63856 37.97849 
1 1 1   32    3   11 o  171.693   13.935   23.246   3.6306   21.204   4.8878   25.760   5.4226  161.323   20.240  177.995   20.265 -16.67177 28.64140 
1 1 1   32    3   12 o  101.325   22.785   8.6653   3.4479   9.0763   4.8037   8.2286   4.9518  101.881   29.261   97.350   30.140 4.530739 42.00768 
1 1 1   32    3   13 f   56.944   23.722   0.9648   3.4284  -3.5543   4.6392   6.4027   5.0890   51.500   24.012   88.299   30.724 -36.79901 38.99433 
1 1 1   32    3   14 o  147.431   17.554   17.526   3.8835   18.046   5.1892   16.866   5.8551  146.591   23.955  139.207   28.440 7.384308 37.18430 
1 1 1   32    3   15 o  123.559   21.931   12.746   3.9957   7.5152   5.1720   20.489   6.2931   93.487   30.996  154.079   27.703 -60.59275 41.57156 
1 1 1   32    3   16 f  227.165   16.852   41.256   5.8178   41.256   5.8178   0.0000   0.0000  227.165   16.852  ?   ?  0.000000 16.85204 
1 1 1   32    3   17 o   79.472   27.590   5.1039   4.1025   2.5903   5.3584   8.6643   6.3773   72.944   29.951   99.284   34.402 -26.34018 45.61319 
1 1 1   32    3   18 o  128.303   22.668   13.872   4.2888   19.160   5.8605   7.7740   6.2931  148.891   26.696   95.200   34.073 53.69070 43.28568 
1 1 1   32    3   19 f  113.789   26.154   11.312   4.4598   8.6230   6.0459   14.522   6.6052   98.330   33.519  124.830   33.758 -26.50029 47.57212 
1 1 1   32    3   20 f   62.311   18.632   3.1911   1.9145  -1.3120   8.5509   3.4288   1.9644   75.476   34.227   64.369   18.777 11.10685 39.03934 
1 1 1   32    3   21 o   65.686   19.078   3.5899   2.0318   8.1914   5.9300   2.9778   2.1627   95.709   33.173   61.038   20.034 34.67038 38.75354 
1 1 1   32    3   22 o   46.965   18.958   0.9584   2.1037  -2.5217   5.6289   1.5234   2.2680   59.074   27.157   51.501   20.031 7.573112 33.74501 
1 1 1   32    3   23 o   93.323   17.080   7.2005   2.3499   20.485   5.6562   4.4292   2.5833  153.964   24.847   72.308   21.648 81.65549 32.95509 
1 1 1   32    3   24 o  113.717   15.028   10.466   2.5517   8.1094   5.4707   11.121   2.8847   94.252   31.886  116.594   16.636 -22.34245 35.96472 
1 1 1   32    3   25 o   84.794   20.100   6.1433   2.5690   5.7678   5.1151   6.2700   2.9709   82.966   30.571   84.894   22.501 -1.928040 37.95926 
1 1 1   32    3   26 o   66.991   22.060   3.7267   2.6213   4.3734   4.9233   3.4708   3.0968   76.236   29.551   66.530   23.892 9.706276 38.00121 
1 1 1   32    3   27 o  105.862   17.283   9.3195   2.7037   6.8665   4.8932   10.398   3.2439   86.907   30.133  110.605   19.893 -23.69794 36.10740 
1 1 1   32    3   28 o   27.531   13.799  -6.7455   2.4952  -4.5762   4.6732  -7.6106   2.9511   48.091   22.923   30.298   15.160 17.79259 27.48258 
1 1 1   32    3   29 o   76.381   20.702   5.1085   2.4809   2.4448   4.6841   6.1470   2.9247   66.691   27.750   83.070   22.463 -16.37837 35.70220 
1 1 1   32    3   30 o   78.056   23.890   5.4936   3.1212   8.1848   4.4262   2.8318   4.4019   92.410   28.477   66.737   27.244 25.67318 39.41017 
1 1 1   32    3   31 o   64.770   19.960   3.6250   2.1745   3.0905   3.1736   4.0979   2.9854   63.337   23.930   68.768   23.553 -5.430729 33.57694 
1 1 1   32    3   32 o   71.020   20.449   4.4605   2.3434   6.2437   3.6592   3.2207   3.0512   81.598   26.001   63.456   23.567 18.14187 35.09241 
1 1 1   32    4    0 o  148.481   14.416   17.539   3.2054   17.539   3.2054   17.539   3.2054  148.481   14.416  148.481   14.416 0.000000 0.000000 
1 1 1   32    4    1 o   98.900   18.076   7.9845   2.6355   16.715   5.4685   5.3432   3.0078  140.404   26.415   80.063   23.201 60.34077 35.15737 
1 1 1   32    4    2 o  186.695   12.884   27.309   3.6593   16.470   5.8238   34.381   4.7038  138.324   28.456  208.826   14.812 -70.50174 32.08039 
1 1 1   32    4    3 o  107.883   16.938   9.4016   2.7049   9.5528   5.6895   9.3575   3.0746  104.538   32.298  106.759   19.535 -2.221024 37.74602 
1 1 1   32    4    4 f   67.210   18.519   3.7097   1.9661   1.0579   5.8019   4.0537   2.0898   70.904   30.262   70.124   18.998 0.7799072 35.73110 
1 1 1   32    4    5 o   98.586   12.651   7.6946   1.8650   5.9724   3.9039   8.2038   2.1229   84.709   26.842  101.472   14.045 -16.76306 30.29419 
1 1 1   32    4    6 o  266.302   5.9929   54.504   2.4427   63.022   5.1029   51.972   2.7822  284.658   11.712  259.843   6.9954 24.81540 13.64183 
1 1 1   32    4    7 o   65.507   23.477   3.1064   2.9887   6.9465   4.2681  -0.5880   4.1864   90.501   27.976   56.509   24.893 33.99187 37.44737 
1 1 1   32    4    8 o  112.795   18.712   10.381   3.1174   11.374   4.5299   9.4869   4.2965  115.203   26.272  104.974   26.683 10.22861 37.44603 
1 1 1   32    4    9 o   71.695   25.231   3.9003   3.4367   4.4197   5.8028   3.6197   4.2653   82.110   32.011   73.249   27.726 8.861366 42.34898 
1 1 1   32    4   10 o  105.344   21.654   9.2671   3.3748   10.789   4.8718   7.8634   4.6794  111.227   28.490   95.519   29.254 15.70765 40.83477 
1 1 1   32    4   11 o  100.454   22.815   8.5163   3.4281   5.9648   4.8989   10.965   4.7987   86.021   30.133  112.214   28.023 -26.19322 41.14919 
1 1 1   32    4   12 o   62.420   24.723   2.0784   3.5093  -0.6747   4.8055   5.2244   5.1369   60.010   26.540   83.090   30.634 -23.07990 40.53168 
1 1 1   32    4   13 o  162.883   15.920   21.158   3.9184   20.154   5.3347   22.334   5.7743  155.592   23.102  163.560   23.760 -7.968033 33.13953 
1 1 1   32    4   14 o   56.881   24.108   0.6313   3.6371  -1.2824   5.1323   2.5618   5.1549   60.153   26.962   72.284   29.493 -12.13119 39.95939 
1 1 1   32    4   15 o  117.418   30.488   12.317   5.5280   12.317   5.5280   0.0000   0.0000  117.418   30.488  ?   ?  0.000000 30.48828 
1 1 1   32    4   16 o   48.113   22.282  -2.6729   3.8916  -0.9127   5.3728  -4.6154   5.6443   62.349   27.791   55.507   26.076 6.841930 38.10909 
1 1 1   32    4   17 o   79.228   27.369   5.0942   4.0349   5.6844   5.8193   4.5477   5.5995   86.030   32.429   80.977   31.480 5.053696 45.19485 
1 1 1   32    4   18 o   45.650   21.543  -3.7757   3.9322  -9.2126   5.5189   1.8306   5.6042   47.029   23.003   71.256   30.047 -24.22704 37.84132 
1 1 1   32    4   19 o   80.395   27.956   5.3058   4.2129   6.2882   5.8452   4.2437   6.0775   88.071   32.637   80.922   32.378 7.149628 45.97248 
1 1 1   32    4   20 o   90.233   28.545   7.1535   4.4163   7.3684   6.0935   6.9156   6.4096   92.603   33.481   91.264   34.106 1.338295 47.79319 
1 1 1   32    4   21 o   76.758   29.943   4.1073   5.0800  -4.6004   8.7225   8.5768   6.2491   69.943   32.716   97.435   34.038 -27.49161 47.21152 
1 1 1   32    4   22 o   68.521   27.444   2.7665   4.3713  -1.3187   6.0246   7.3081   6.3522   63.881   28.871   92.024   34.039 -28.14314 44.63339 
1 1 1   32    4   23 o   44.647   17.228   1.1390   1.6674   1.5119   6.0007   1.1078   1.7357   70.967   30.544   44.964   17.513 26.00327 35.20840 
1 1 1   32    4   24 o   39.469   17.023  -0.0128   1.8720  -0.5379   5.7591   0.0492   1.9795   64.129   28.665   40.832   17.558 23.29678 33.61497 
1 1 1   32    4   25 o   51.221   19.545   1.6528   2.1302  -6.5247   5.6689   2.9974   2.2987   51.251   24.646   61.220   20.669 -9.969528 32.16613 
1 1 1   32    4   26 o   53.518   20.591   1.8058   2.3766   9.6779   5.6317   0.1002   2.6215  100.624   32.277   46.516   20.103 54.10882 38.02555 
1 1 1   32    4   27 o   59.995   20.628   2.8724   2.2908  -0.6004   5.2150   3.7028   2.5500   60.408   27.120   66.448   21.752 -6.039185 34.76526 
1 1 1   32    4   28 o  112.975   14.481   10.389   2.4465   7.9384   5.0249   11.150   2.8009   91.412   30.561  116.276   16.176 -24.86473 34.57784 
1 1 1   32    4   29 o  133.033   13.496   14.284   2.7101   4.2633   4.9248   18.637   3.2457   74.304   29.332  151.746   14.137 -77.44153 32.56133 
1 1 1   32    4   30 o   53.733   20.769   1.9038   2.4266   0.2409   4.6610   2.5221   2.8421   58.988   26.111   59.208   22.580 -0.2202034 34.51959 
1 1 1   32    4   31 o   77.306   21.158   5.3209   2.5765   7.8194   3.1397   0.1686   4.5086   93.246   22.299   57.718   25.608 35.52849 33.95609 
1 1 1   32    4   32 o   55.140   21.150   2.1328   2.5024   0.5928   4.4626   2.8392   3.0223   58.515   25.741   61.218   23.299 -2.703671 34.71958 
1 1 1   32    5    0 o   34.531   22.680  -0.3699   3.0197  -0.3699   3.0197  -0.3699   3.0197   34.531   22.680   34.531   22.680 0.000000 0.000000 
1 1 1   32    5    1 o  346.631   9.3380   92.892   4.9544   86.314   7.6276   97.692   6.5162  331.482   15.033  354.305   12.016 -22.82330 19.24521 
1 1 1   32    5    2 o   65.503   22.168   3.3027   2.6442   4.1787   5.9431   3.0865   2.9526   81.892   32.256   65.281   23.342 16.61100 39.81569 
1 1 1   32    5    3 o  161.654   8.9070   20.245   2.1954   21.694   6.4577   20.056   2.3344  159.784   27.390  160.754   9.5299 -0.9702911 29.00056 
1 1 1   32    5    4 o   85.055   14.912   5.8347   1.8706   5.5933   6.3414   5.8577   1.9577   88.329   33.718   85.037   15.616 3.292198 37.15856 
1 1 1   32    5    5 o   57.883   23.406   1.4464   3.2130 -12.0657   6.3563   6.0837   3.7237   48.876   24.063   85.164   26.099 -36.28885 35.49856 
1 1 1   32    5    6 o  109.317   18.655   9.7571   3.0094   15.254   4.3645   4.7745   4.1552  136.005   21.695   78.594   27.734 57.41129 35.21109 
1 1 1   32    5    7 o   51.414   23.192  -1.5124   3.8663   0.0000   0.0000  -1.5124   3.8663  ?   ?    51.414   23.192 0.000000 23.19210 
1 1 1   32    5    8 o  108.247   18.948   9.5948   3.0250   9.3793   4.4584   9.7786   4.1179  104.105   27.550  106.933   25.515 -2.827972 37.55033 
1 1 1   32    5    9 o  178.598   13.158   25.058   3.5717   30.179   5.1931   20.461   4.9203  194.171   17.666  158.203   20.826 35.96849 27.30947 
1 1 1   32    5   10 o  146.083   17.358   17.156   3.8054   25.091   6.3357   12.677   4.7595  173.317   24.571  121.563   26.340 51.75362 36.02113 
1 1 1   32    5   11 f   99.342   22.948   8.3446   3.4190   8.7918   4.8876   7.9161   4.7846  100.297   29.720   95.671   29.628 4.626167 41.96529 
1 1 1   32    5   12 o   85.539   24.995   6.2096   3.4782   6.4937   4.8379   5.9058   5.0040   88.329   29.985   85.799   30.418 2.529953 42.71208 
1 1 1   32    5   13 o   98.076   24.535   8.2375   3.6740   9.3139   5.1043   7.0803   5.2925  102.709   30.356   91.671   31.360 11.03845 43.64593 
1 1 1   32    5   14 o  146.336   24.170   18.036   5.2247   18.036   5.2247   0.0000   0.0000  146.336   24.170  ?   ?  0.000000 24.16982 
1 1 1   32    5   15 o   62.008   24.949   1.8887   3.6308   3.8594   5.1494  -0.0598   5.1201   77.032   30.120   63.381   27.734 13.65064 40.94401 
1 1 1   32    5   16 o  115.332   23.083   11.269   3.9326   2.4934   5.4658   20.687   5.6624   73.083   30.156  156.463   24.443 -83.37959 38.81879 
1 1 1   32    5   17 o  133.010   20.678   14.665   4.0730   23.969   5.7667   5.4023   5.7537  169.402   22.821   84.658   32.165 84.74358 39.43806 
1 1 1   32    5   18 o   75.068   27.082   4.3609   3.9835  -4.0418   5.4371   14.099   5.8531   55.168   25.813  124.758   30.829 -69.59035 40.20850 
1 1 1   32    5   19 o  115.664   23.867   11.482   4.0852   13.445   5.6358   9.3090   5.9300  121.793   30.343  101.191   33.173 20.60217 44.95690 
1 1 1   32    5   20 o   54.203   24.411  -1.2599   4.2630  -8.7670   5.9295   6.7716   6.1331   49.904   24.285   90.112   33.423 -40.20872 41.31444 
1 1 1   32    5   21 o  128.362   27.720   14.669   5.2868   14.400   9.1474   14.804   6.4785  118.981   41.203  125.335   33.230 -6.353729 52.93362 
1 1 1   32    5   22 o   52.821   24.165  -1.9818   4.3834  -1.2992   6.2384  -2.6475   6.1605   64.926   29.357   61.554   28.339 3.371990 40.80386 
1 1 1   32    5   23 o  182.471   17.688   27.148   4.8781   25.221   6.6007   29.468   7.2410  169.890   26.228  183.563   26.543 -13.67258 37.31505 
1 1 1   32    5   24 o   54.947   23.198   0.8344   3.3471  -1.4524   6.1887   1.7799   3.9793   63.972   29.052   62.361   25.731 1.610962 38.80864 
1 1 1   32    5   25 o   81.775   14.053   5.4504   1.6956  -5.0875   6.0725   6.3414   1.7658   55.874   26.489   88.555   13.450 -32.68148 29.70785 
1 1 1   32    5   26 o   60.652   19.227   3.0370   2.0028  -3.2155   5.5585   3.9699   2.1471   56.393   26.291   68.308   19.546 -11.91500 32.76048 
1 1 1   32    5   27 o  173.305   8.8570   23.449   2.3416   16.787   5.6408   24.836   2.5739  134.879   28.229  178.119   9.4749 -43.23978 29.77670 
1 1 1   32    5   28 o  104.574   14.586   8.9352   2.2711   3.3936   5.2237   10.227   2.5219   72.204   29.601  111.731   15.136 -39.52678 33.24592 
1 1 1   32    5   29 o   41.104   18.092  -0.2503   2.2072   1.0031   4.9540  -0.5607   2.4654   62.880   27.404   42.103   18.792 20.77705 33.22812 
1 1 1   32    5   30 o  134.205   13.200   14.544   2.6764   6.8196   7.5615   15.650   2.8617   86.864   35.612  139.024   13.623 -52.16006 38.12906 
1 1 1   32    5   31 o   36.872   16.864  -1.0801   2.1327   1.0059   3.5469  -2.2613   2.6691   55.394   23.652   38.061   17.897 17.33288 29.65995 
1 1 1   32    5   32 o   60.074   22.885   2.7052   2.9175   6.3726   3.8180  -2.4422   4.5232   82.070   26.602   50.744   23.677 31.32597 35.61281 
1 1 1   32    6    1 o   82.785   27.873   5.5524   4.1802   9.1650   6.2536   2.6343   5.6204  102.833   34.083   75.106   30.737 27.72643 45.89555 
1 1 1   32    6    2 o  135.823   13.917   14.581   2.8523   8.9052   6.2896   16.051   3.2004  101.705   34.190  142.242   14.922 -40.53704 37.30449 
1 1 1   32    6    3 f  132.088   9.4056   13.559   1.8892   20.197   6.5321   12.953   1.9735  153.138   28.928  128.940   10.080 24.19739 30.63382 
1 1 1   32    6    4 o  308.381   10.184   73.681   4.8070   76.441   8.0452   72.149   5.9947  310.315   17.003  304.046   12.881 6.269836 21.33125 
1 1 1   32    6    5 o  233.071   11.842   42.376   4.2108   44.583   7.5589   41.383   5.0703  234.253   21.315  229.228   14.526 5.025467 25.79393 
1 1 1   32    6    6 o   80.340   23.201   5.3984   3.0125   4.7305   4.5589   5.9161   4.0136   79.491   28.926   84.432   27.266 -4.941444 39.75093 
1 1 1   32    6    7 o  123.096   17.356   12.228   3.1794   10.944   4.6505   13.355   4.3565  112.544   27.280  126.296   23.398 -13.75210 35.94001 
1 1 1   32    6    8 o  137.589   15.781   15.108   3.2632   21.716   4.8490   9.6375   4.4118  163.542   19.773  105.570   27.150 57.97201 33.58658 
1 1 1   32    6    9 o   65.911   23.878   3.1142   3.1015  -2.7326   4.5998   7.9886   4.1999   53.240   24.502   96.249   27.267 -43.00934 36.65834 
1 1 1   32    6   10 o  100.315   24.850   8.6066   3.7958   4.4347   6.2237   11.077   4.7897   83.322   32.948  112.792   27.898 -29.46997 43.17318 
1 1 1   32    6   11 o   83.860   25.224   5.9390   3.5011   15.119   5.1297  -2.0668   4.7904  132.967   26.136   56.090   25.506 76.87637 36.51923 
1 1 1   32    6   12 o   70.732   25.529   3.7049   3.5405   2.0349   4.9923   5.3947   5.0218   69.702   28.796   83.422   30.359 -13.72028 41.84339 
1 1 1   32    6   13 o   64.582   27.999   0.3099   5.1173   0.3099   5.1173   0.0000   0.0000   64.582   27.999  ?   ?  0.000000 27.99921 
1 1 1   32    6   14 o  106.297   23.139   9.5881   3.6580   4.6723   5.1277   14.682   5.2198   80.346   30.403  130.179   27.079 -49.83237 40.71405 
1 1 1   32    6   15 o   96.023   24.587   7.9359   3.6294   16.206   5.2415   0.3181   5.0304  137.448   25.864   63.958   27.745 73.48985 37.93016 
1 1 1   32    6   16 o   91.125   25.762   7.1888   3.7530   11.067   5.3841   3.5237   5.2343  110.859   30.686   75.800   30.139 35.05910 43.01194 
1 1 1   32    6   17 o  149.113   17.917   18.052   4.0075   25.153   5.5182   10.127   5.8296  174.542   21.082  105.472   32.710 69.06989 38.91569 
1 1 1   32    6   18 o  115.094   24.228   11.391   4.1331   4.8840   5.2954   21.534   6.6114   81.059   30.843  156.398   28.675 -75.33904 42.11327 
1 1 1   32    6   19 o   65.103   26.119   2.3066   3.9668   0.0299   5.3548   5.0757   5.9054   64.318   28.248   83.215   32.334 -18.89668 42.93503 
1 1 1   32    6   20 o   90.178   27.745   7.1771   4.2036   10.247   5.6887   3.4851   6.2388  105.242   32.259   78.396   32.268 26.84589 45.62759 
1 1 1   32    6   21 o   63.272   24.745   2.4745   3.4761 -10.6916   8.7688   4.9293   3.7863   61.517   29.843   77.088   26.520 -15.57064 39.92340 
1 1 1   32    6   22 o  135.500   16.643   14.934   3.3791   10.095   6.1868   16.991   4.0340  103.515   33.881  143.524   18.816 -40.00900 38.75508 
1 1 1   32    6   23 f   92.401   23.572   7.4649   3.3445   0.8292   5.9897   10.471   4.0315   68.863   30.068  109.154   24.706 -40.29041 38.91640 
1 1 1   32    6   24 o  183.687   13.028   26.788   3.6390   25.101   6.3176   27.626   4.4517  169.959   25.035  184.962   15.878 -15.00287 29.64581 
1 1 1   32    6   25 o   52.750   22.509   0.5617   3.2085  -5.3601   5.8196   3.1478   3.8458   53.937   25.674   67.439   26.124 -13.50287 36.62842 
1 1 1   32    6   26 o   57.778   25.176   0.3673   4.1800   2.0923   5.6587  -1.7044   6.2015   70.196   29.921   62.748   28.720 7.448269 41.47395 
1 1 1   32    6   27 o   68.133   25.612   3.5686   3.6250   7.0890   5.1541   0.1226   5.0993   87.565   30.889   61.574   27.280 25.99106 41.21103 
1 1 1   32    6   28 o   80.813   25.705   5.9124   3.5775   9.5057   7.4005   4.8167   4.0867   96.857   36.555   75.147   27.381 21.71069 45.67276 
1 1 1   32    6   29 o  161.179   9.8559   20.450   2.4198   7.6206   7.3582   22.005   2.5623   89.687   35.712  167.120   10.064 -77.43343 37.10259 
1 1 1   32    6   30 o   59.341   19.756   2.9299   2.1003  -7.6602   5.0041   5.1944   2.3140   44.538   21.810   77.048   19.581 -32.50988 29.30985 
1 1 1   32    6   31 o  133.257   10.554   14.100   2.1350   12.686   3.3148   15.102   2.7909  122.100   18.301  136.386   13.549 -14.28608 22.77011 
1 1 1   32    7    0 o   61.839   35.333   4.2710   5.2645   4.2710   5.2645   4.2710   5.2645   61.839   35.333   61.839   35.333 0.000000 0.000000 
1 1 1   32    7    1 o   49.973   23.398  -3.8136   4.4808   0.0000   0.0000  -3.8136   4.4808  ?   ?    49.973   23.398 0.000000 23.39832 
1 1 1   32    7    2 o  111.783   19.036   10.218   3.1404   6.2559   6.3485   11.501   3.6134   90.778   33.939  118.098   20.747 -27.31982 39.77786 
1 1 1   32    7    3 o  172.234   27.422   25.185   6.9868   25.185   6.9868   0.0000   0.0000  172.234   27.422  ?   ?  0.000000 27.42201 
1 1 1   32    7    4 o  122.454   19.286   12.238   3.4953   18.447   7.0462   10.212   4.0255  143.921   32.726  109.674   24.587 34.24709 40.93312 
1 1 1   32    7    5 o   52.243   22.610  -0.0609   3.3252   0.8719   7.2065  -0.3132   3.7480   76.636   33.226   54.384   23.765 22.25196 40.85023 
1 1 1   32    7    6 o  145.735   14.906   16.855   3.2782   11.984   4.8627   20.913   4.4383  117.732   27.484  161.114   18.323 -43.38220 33.03238 
1 1 1   32    7    7 o  278.436   9.5886   60.009   4.0865   56.357   5.6063   64.149   5.9691  267.928   13.717  286.241   13.624 -18.31314 19.33295 
1 1 1   32    7    8 o  106.022   21.356   9.3732   3.3459   4.6036   4.9259   13.459   4.5589   79.865   29.888  126.184   24.487 -46.31931 38.63853 
1 1 1   32    7    9 o  168.581   14.437   22.477   3.6893   18.843   5.1234   26.390   5.3168  150.569   22.957  180.445   19.564 -29.87642 30.16214 
1 1 1   32    7   10 o   58.917   24.473   1.1236   3.6340   5.4870   6.3073  -1.0447   4.4462   87.263   33.552   56.649   25.264 30.61356 41.99990 
1 1 1   32    7   11 o  122.245   28.834   13.114   5.3077   13.114   5.3077   0.0000   0.0000  122.245   28.834  ?   ?  0.000000 28.83401 
1 1 1   32    7   12 f   77.823   30.692   3.7992   5.3870   3.7992   5.3870   0.0000   0.0000   77.823   30.692  ?   ?  0.000000 30.69202 
1 1 1   32    7   13 o   57.991   24.075   1.1116   3.5142   0.8337   5.4074   1.3148   4.6237   67.631   29.049   65.156   27.374 2.474976 39.91438 
1 1 1   32    7   14 o  114.495   22.533   11.051   3.8082   6.5816   5.7384   14.569   5.0908   89.797   32.487  129.850   26.511 -40.05338 41.93162 
1 1 1   32    7   15 o   70.412   25.891   3.6147   3.6660   1.6089   5.3293   5.4164   5.0509   69.479   29.299   83.123   30.417 -13.64382 42.23310 
1 1 1   32    7   16 o   89.082   26.566   6.8753   3.8960   8.0223   5.6604   5.8427   5.3706   95.675   32.434   85.543   31.355 10.13288 45.11209 
1 1 1   32    7   17 o   52.442   23.423  -0.9444   3.8370  -2.9337   5.4356   1.0315   5.4171   57.503   26.526   67.802   29.097 -10.29860 39.37379 
1 1 1   32    7   18 o   49.041   22.568  -2.2553   3.9007  -0.7307   5.4907  -3.8089   5.5425   63.024   28.093   56.153   26.204 6.871307 38.41707 
1 1 1   32    7   19 o   94.461   21.368   7.5940   3.0172   6.2211   5.4985   8.1855   3.6091   86.749   31.737   96.991   24.348 -10.24267 40.00062 
1 1 1   32    7   20 o   58.387   22.844   2.0097   2.9633   0.6892   5.5727   2.5303   3.4990   67.008   29.135   63.701   24.851 3.307278 38.29350 
1 1 1   32    7   21 o  105.588   20.603   9.4238   3.2103   8.6310   5.9975   9.7421   3.8006   97.181   33.380  105.784   24.021 -8.603386 41.12438 
1 1 1   32    7   22 o   74.089   25.662   4.5118   3.5482   11.284   8.9583   3.2516   3.8643  107.496   40.291   68.457   26.276 39.03968 48.10180 
1 1 1   32    7   23 o  201.135   12.256   31.945   3.7552   18.898   6.3192   39.067   4.6691  143.913   29.674  221.587   13.836 -77.67432 32.74054 
1 1 1   32    7   24 o   69.585   24.399   3.9172   3.2124   0.3176   5.6497   5.6370   3.9052   65.581   28.902   80.548   26.941 -14.96730 39.51152 
1 1 1   32    7   25 o   73.468   25.544   4.5178   3.5172   6.9298   7.8590   3.9137   3.9331   91.032   36.678   71.267   26.700 19.76535 45.36731 
1 1 1   32    7   26 o   54.342   26.616 -10.7480   7.4646 -10.7480   7.4646   0.0000   0.0000   54.342   26.616  ?   ?  0.000000 26.61620 
1 1 1   32    7   27 o   76.027   25.002   5.0893   3.3676  -1.9499   5.3308   9.7641   4.3443   57.384   26.398  102.423   27.238 -45.03817 37.93127 
1 1 1   32    7   28 o   52.601   22.579   0.5970   3.2632  -2.3530   5.0118   2.7680   4.2994   54.466   25.247   66.391   26.994 -11.92422 36.96018 
1 1 1   32    7   29 o   42.739   19.957  -2.2800   3.2231  -4.7866   5.0031  -0.5016   4.2142   49.271   23.550   54.429   24.411 -5.157814 33.91916 
1 1 1   32    7   30 f   51.026   20.520   1.4236   2.4546   0.6263   2.9499   3.2180   4.4257   50.372   21.540   67.964   27.475 -17.59134 34.91219 
1 1 1   32    7   31 o   65.049   21.878   3.6409   2.5753   6.6978   3.1653  -2.3448   4.4293   85.402   23.484   50.487   23.514 34.91496 33.23261 
1 1 1   32    8    0 o   46.127   29.259   0.8997   4.4782   0.8997   4.4782   0.8997   4.4782   46.127   29.259   46.127   29.259 0.000000 0.000000 
1 1 1   32    8    1 o  144.650   17.697   16.837   3.8366   0.0000   0.0000   16.837   3.8366  ?   ?   144.650   17.697 0.000000 17.69728 
1 1 1   32    8    2 o   78.152   31.267   3.4813   5.6674   3.4813   5.6674   0.0000   0.0000   78.152   31.267  ?   ?  0.000000 31.26725 
1 1 1   32    8    3 o  184.524   23.147   28.103   6.3937   28.103   6.3937   0.0000   0.0000  184.524   23.147  ?   ?  0.000000 23.14693 
1 1 1   32    8    4 o   85.364   33.831   4.6427   6.5748   4.6427   6.5748   0.0000   0.0000   85.364   33.831  ?   ?  0.000000 33.83054 
1 1 1   32    8    5 o  201.559   24.480   33.769   7.3974   33.769   7.3974   0.0000   0.0000  201.559   24.480  ?   ?  0.000000 24.48023 
1 1 1   32    8    6 o  235.922   10.681   43.205   3.8571   41.345   5.4164   45.119   5.4938  228.500   15.580  238.984   15.096 -10.48402 21.69394 
1 1 1   32    8    7 o  118.965   19.183   11.578   3.3743   12.837   4.9835   10.513   4.5852  121.809   27.394  110.086   27.337 11.72380 38.70030 
1 1 1   32    8    8 o   63.901   24.392   2.5783   3.3184  -1.0330   4.9221   5.5877   4.4932   59.699   26.606   83.265   28.875 -23.56640 39.26388 
1 1 1   32    8    9 o   71.332   24.893   3.9192   3.3419   0.4829   4.9388   6.8215   4.5388   64.254   27.682   89.647   29.000 -25.39298 40.09062 
1 1 1   32    8   10 o   57.472   26.141  -2.1147   5.0363  -2.1147   5.0363   0.0000   0.0000   57.472   26.141  ?   ?  0.000000 26.14123 
1 1 1   32    8   11 o   81.961   26.294   5.6139   3.7374   9.1048   6.4061   3.8126   4.6017  101.729   34.504   75.014   28.702 26.71477 44.88127 
1 1 1   32    8   12 o  163.258   15.424   21.230   3.8086   22.217   5.7164   20.442   5.1073  162.984   23.601  157.193   21.815 5.791306 32.13907 
1 1 1   32    8   13 f   60.971   26.465   0.1636   4.5827   0.0000   0.0000   0.1636   4.5827  ?   ?    60.971   26.465 0.000000 26.46518 
1 1 1   32    8   14 o  138.946   18.572   15.737   3.8510   14.957   5.6279   16.423   5.2808  130.088   29.004  138.266   25.904 -8.178482 38.88809 
1 1 1   32    8   15 o  131.605   20.205   14.316   3.9399   17.857   5.5989   10.842   5.5452  143.850   26.402  109.375   31.446 34.47520 41.05962 
1 1 1   32    8   16 o   71.918   22.778   4.2778   2.8115   4.2917   5.4841   4.2729   3.2746   79.366   31.070   72.772   24.669 6.594246 39.67227 
1 1 1   32    8   17 o   99.869   20.072   8.3594   2.9618  -1.8209   5.4088   12.719   3.5397   59.853   27.173  124.147   19.251 -64.29419 33.30091 
1 1 1   32    8   18 o   44.867   20.077  -0.8699   2.8336  -0.5772   5.1530  -0.9968   3.3925   61.496   27.326   48.907   21.921 12.58880 35.03181 
1 1 1   32    8   19 o   74.051   23.153   4.6201   2.9139   1.1790   5.5153   5.9526   3.4320   68.240   29.325   82.947   24.979 -14.70637 38.52120 
1 1 1   32    8   20 o   55.510   22.667   1.3397   3.0480   11.040   6.7968  -1.1020   3.4101  107.578   35.526   48.563   21.855 59.01477 41.71032 
1 1 1   32    8   21 o  143.092   15.950   16.558   3.4340   10.381   7.1722   18.396   3.9115  104.361   36.465  150.202   17.332 -45.84047 40.37443 
1 1 1   32    8   22 o   47.854   22.051  -2.1338   3.7407   0.0000   0.0000  -2.1338   3.7407  ?   ?    47.854   22.051 0.000000 22.05055 
1 1 1   32    8   23 o  158.152   15.753   20.226   3.7627   3.7628   7.3548   26.062   4.3791   81.570   34.410  179.479   16.112 -97.90909 37.99571 
1 1 1   32    8   24 o   73.358   24.792   4.5366   3.3071  -1.0243   5.6599   7.4193   4.0751   62.041   28.016   90.545   27.208 -28.50368 39.05372 
1 1 1   32    8   25 o   61.927   25.448   1.9297   3.8721   3.0335   5.5227   0.8624   5.4306   72.736   30.187   65.606   28.639 7.130615 41.61069 
1 1 1   32    8   26 o   75.171   28.050   4.6332   4.3326   6.9724   5.5480   0.9769   6.9362   87.319   31.890   71.506   31.742 15.81319 44.99454 
1 1 1   32    8   27 o   48.306   21.842  -1.0206   3.4528  -8.9940   5.4266   4.4029   4.4755   45.561   22.392   74.034   28.311 -28.47353 36.09581 
1 1 1   32    8   28 f   71.711   24.898   4.4413   3.3412   6.8986   5.1859   2.6974   4.3688   85.694   30.902   66.236   27.102 19.45753 41.10329 
1 1 1   32    8   29 f   44.814   20.697  -1.7836   3.3233  -1.5667   5.3029  -1.9239   4.2646   57.420   26.383   50.796   23.455 6.624477 35.30106 
1 1 1   32    8   30 o   62.315   21.061   3.2751   2.3868   4.0548   2.8319   1.3633   4.4348   68.221   22.942   61.060   26.269 7.160419 34.87677 
1 1 1   32    8   31 f   62.131   21.978   3.2013   2.6109  -0.7161   3.1779   11.338   4.5798   46.762   21.066  108.362   27.551 -61.59989 34.68208 
1 1 1   32    9    0 o  165.587   16.959   21.995   4.1950   21.995   4.1950   21.995   4.1950  165.587   16.959  165.587   16.959 0.000000 0.000000 
1 1 1   32    9    1 o  192.956   9.3392   28.803   2.7583   27.397   5.1358   29.374   3.2698  184.544   18.428  194.140   11.049 -9.596039 21.48714 
1 1 1   32    9    3 o  149.786   27.784   19.266   6.1354   19.266   6.1354   0.0000   0.0000  149.786   27.784  ?   ?  0.000000 27.78401 
1 1 1   32    9    4 o  119.442   33.804   12.913   6.4584   12.913   6.4584   0.0000   0.0000  119.442   33.804  ?   ?  0.000000 33.80401 
1 1 1   32    9    5 o  180.915   25.180   27.444   6.7837   27.444   6.7837   0.0000   0.0000  180.915   25.180  ?   ?  0.000000 25.18016 
1 1 1   32    9    6 o   83.049   29.141   5.5072   4.5828   5.5072   4.5828   0.0000   0.0000   83.049   29.141  ?   ?  0.000000 29.14126 
1 1 1   32    9    7 o  172.826   13.231   23.505   3.4734   24.422   4.9791   22.635   4.8480  173.711   19.038  167.035   19.318 6.676270 27.12286 
1 1 1   32    9    8 o   71.873   32.638  -2.2080   7.8096  -2.2080   7.8096   0.0000   0.0000   71.873   32.638  ?   ?  0.000000 32.63792 
1 1 1   32    9    9 o   96.544   37.331   7.1707   7.8421   7.1707   7.8421   0.0000   0.0000   96.544   37.331  ?   ?  0.000000 37.33105 
1 1 1   32    9   10 o  166.242   17.537   22.240   4.3949   10.099   8.2979   26.974   5.1813  107.026   39.013  182.594   18.808 -75.56798 43.31033 
1 1 1   32    9   11 o  129.362   25.058   14.277   4.7824   0.0000   0.0000   14.277   4.7824  ?   ?   129.362   25.058 0.000000 25.05781 
1 1 1   32    9   12 o   85.529   27.571   6.2012   4.1054  -0.7316   8.1788   8.5363   4.7467   76.095   34.077   98.456   29.315 -22.36057 44.95076 
1 1 1   32    9   13 o  154.434   20.189   19.588   4.6581   10.823   8.0332   24.028   5.7174  108.737   38.541  169.921   22.539 -61.18327 44.64789 
1 1 1   32    9   14 o  104.935   18.820   9.0950   2.9118   5.3872   7.3623   9.7826   3.1703   88.772   35.594  108.518   19.817 -19.74650 40.73897 
1 1 1   32    9   15 o  108.261   26.294   10.256   4.3139   3.4155   7.2098   14.070   5.3840   82.147   34.325  125.960   28.581 -43.81250 44.66644 
1 1 1   32    9   16 o  124.672   17.206   12.644   3.1958  -2.9599   6.9727   16.793   3.5957   65.558   30.170  144.232   16.589 -78.67349 34.43036 
1 1 1   32    9   17 o   80.463   23.246   5.5401   3.0237   9.1565   6.8711   4.6716   3.3672  100.564   35.645   75.143   25.014 25.42041 43.54618 
1 1 1   32    9   18 o  104.165   19.046   9.0362   2.9248   12.733   5.3230   7.4374   3.5005  118.516   29.468   92.371   24.396 26.14518 38.25642 
1 1 1   32    9   19 o   68.847   23.064   3.8563   2.8621   0.9672   5.2209   5.0975   3.4221   66.104   28.470   77.556   25.189 -11.45158 38.01361 
1 1 1   32    9   20 o  108.889   18.884   9.8722   3.0333   4.5143   5.4811   12.237   3.6417   79.248   31.051  120.734   20.436 -41.48639 37.17221 
1 1 1   32    9   21 o  112.032   18.704   10.440   3.0943   10.693   5.5584   10.327   3.7249  106.826   31.703  109.330   22.988 -2.503342 39.16047 
1 1 1   32    9   22 o   68.555   25.154   3.5844   3.4578   16.687   9.1731   1.4144   3.7331  125.399   41.265   59.591   24.783 65.80789 48.13532 
1 1 1   32    9   23 o   71.769   26.546   4.0074   3.8636   0.0000   0.0000   4.0074   3.8636  ?   ?    71.769   26.546 0.000000 26.54633 
1 1 1   32    9   24 o   56.631   24.392   0.5864   3.8327   4.9601   5.4275  -3.7637   5.4129   79.635   30.983   54.480   25.575 25.15424 40.17467 
1 1 1   32    9   25 o   97.992   25.873   8.7423   3.9379   10.925   5.5053   6.4554   5.6352  106.121   31.564   85.480   31.972 20.64104 44.92789 
1 1 1   32    9   26 o   52.184   23.901  -1.6716   4.3050   0.2783   5.2957  -5.4710   7.3923   62.787   27.810   60.739   28.919 2.048042 40.12094 
1 1 1   32    9   27 o   59.028   24.081   1.8953   3.4364  -1.0098   5.1031   4.3054   4.6482   58.153   26.398   73.823   28.686 -15.67046 38.98389 
1 1 1   32    9   28 o  103.616   22.540   9.5710   3.4730   5.3306   5.1280   13.164   4.7204   78.632   30.248  118.928   26.598 -40.29661 40.27926 
1 1 1   32    9   29 o   55.248   23.331   1.1657   3.3867   4.7052   5.1884  -1.4619   4.4704   75.816   30.051   53.090   24.330 22.72598 38.66542 
1 1 1   32    9   30 o   57.074   23.736   1.6005   3.4246   5.9358   5.1304  -1.8837   4.5993   80.296   30.405   52.597   24.311 27.69836 38.92928 
1 1 1   32   10    0 o  118.612   18.991   11.774   3.1828   11.774   3.1828   11.774   3.1828  118.612   18.991  118.612   18.991 0.000000 0.000000 
1 1 1   32   10    1 o  149.054   18.479   17.976   4.1255   17.976   4.1255   0.0000   0.0000  149.054   18.479  ?   ?  0.000000 18.47870 
1 1 1   32   10    3 o  101.182   31.387   8.9918   5.3671   8.9918   5.3671   0.0000   0.0000  101.182   31.387  ?   ?  0.000000 31.38695 
1 1 1   32   10    4 o  170.162   24.454   24.235   6.1862   24.235   6.1862   0.0000   0.0000  170.162   24.454  ?   ?  0.000000 24.45442 
1 1 1   32   10    5 o  198.024   23.013   32.414   6.8451   32.414   6.8451   0.0000   0.0000  198.024   23.013  ?   ?  0.000000 23.01283 
1 1 1   32   10    6 o  158.036   20.790   20.480   4.9069   20.480   4.9069   0.0000   0.0000  158.036   20.790  ?   ?  0.000000 20.78998 
1 1 1   32   10    7 o  205.316   16.550   33.627   5.1570   33.627   5.1570   0.0000   0.0000  205.316   16.550  ?   ?  0.000000 16.55036 
1 1 1   32   10    8 o  104.305   28.787   9.5681   4.7462   9.5681   4.7462   0.0000   0.0000  104.305   28.787  ?   ?  0.000000 28.78666 
1 1 1   32   10    9 o   62.759   24.197   2.4170   3.2874   5.9110   4.9875  -0.2669   4.3713   85.539   30.363   58.398   25.588 27.14071 39.70729 
1 1 1   32   10   10 o  130.976   18.083   13.944   3.5284   17.655   5.1388   10.635   4.8533  144.694   24.047  109.774   28.599 34.92023 37.36488 
1 1 1   32   10   11 o  141.555   19.422   16.402   4.0972   20.000   7.1007   14.607   5.0166  149.042   32.076  130.196   26.082 18.84644 41.34199 
1 1 1   32   10   12 o   43.687   18.948  -0.1325   2.3452  -0.6295   4.9297   0.0129   2.6663   60.502   26.813   47.102   20.316 13.39970 33.64050 
1 1 1   32   10   13 o  164.314   11.383   21.155   2.8452   23.882   5.2392   20.015   3.3885  170.419   20.496  158.822   14.085 11.59656 24.86937 
1 1 1   32   10   14 o   97.465   18.165   7.8456   2.6102   12.643   5.0882   6.1321   3.0407  119.408   28.276   84.696   22.905 34.71212 36.38918 
1 1 1   32   10   15 o   50.149   22.505  -1.0873   3.5871   0.2373   4.8934  -2.6258   5.2739   62.578   27.255   57.176   26.285 5.401566 37.86474 
1 1 1   32   10   16 o  107.727   18.302   9.5786   2.9099   2.8526   5.1506   12.732   3.5267   72.440   29.510  124.146   19.178 -51.70602 35.19373 
1 1 1   32   10   17 f   83.876   22.271   6.0369   2.9072   4.3501   5.1332   6.8335   3.5275   77.965   30.187   88.512   24.959 -10.54676 39.16909 
1 1 1   32   10   18 f  165.574   13.225   21.736   3.3238   5.5619   5.5058   31.010   4.1692   83.709   31.545  197.612   13.872 -113.9029 34.46043 
1 1 1   32   10   19 o  142.697   14.401   16.299   3.1024   14.640   5.5136   17.067   3.7529  127.217   28.964  144.701   17.287 -17.48425 33.73072 
1 1 1   32   10   20 o   54.031   21.944   1.3308   2.8374  -4.6336   5.2772   3.7561   3.3652   52.493   24.829   69.381   24.907 -16.88831 35.16904 
1 1 1   32   10   21 o  131.092   15.720   13.928   3.0914   11.546   5.5585   14.995   3.7198  110.875   31.354  134.688   18.535 -23.81306 36.42255 
1 1 1   32   10   22 o   77.540   25.020   5.1886   3.3803   15.651   9.4035   3.6359   3.6224  120.676   41.777   69.218   25.684 51.45764 49.04080 
1 1 1   32   10   23 o  100.053   25.312   8.9752   3.8793   9.7027   5.5753   8.2926   5.4010  100.806   32.092   94.198   31.683 6.608437 45.09655 
1 1 1   32   10   24 f   49.114   21.731  -0.3736   3.2255  -4.4817   5.2345   2.1411   4.0954   51.896   24.600   63.749   26.181 -11.85330 35.92467 
1 1 1   32   10   25 o   37.257   18.102  -4.9232   3.2593  -4.0904   5.2599  -5.4423   4.1526   52.575   24.844   43.019   20.789 9.556522 32.39397 
1 1 1   32   10   26 o  133.616   22.745   15.652   4.4851   10.077   5.5606   26.032   7.5877  100.795   32.045  164.641   31.252 -63.84563 44.76183 
1 1 1   32   10   27 o   57.787   24.143   1.4806   3.5663  -0.9994   5.2971   3.5368   4.8233   59.002   26.826   70.981   28.687 -11.97979 39.27578 
1 1 1   32   10   28 o   55.894   23.565   1.2222   3.4463   4.7187   5.1954  -1.5252   4.6053   76.078   30.098   53.798   24.670 22.28043 38.91592 
1 1 1   32   10   29 o  123.182   20.153   13.152   3.6683   12.945   5.5163   13.315   4.9117  113.384   30.929  118.074   27.662 -4.690193 41.49401 
1 1 1   32   11    0 o   31.272   20.534  -0.3087   2.4733  -0.3087   2.4733  -0.3087   2.4733   31.272   20.534   31.272   20.534 0.000000 0.000000 
1 1 1   32   11    1 o  227.641   12.844   40.639   4.4569   40.639   4.4569   0.0000   0.0000  227.641   12.844  ?   ?  0.000000 12.84377 
1 1 1   32   11    3 o  192.331   18.390   29.806   5.3477   29.806   5.3477   0.0000   0.0000  192.331   18.390  ?   ?  0.000000 18.38955 
1 1 1   32   11    4 o  188.593   21.097   29.119   5.9856   29.119   5.9856   0.0000   0.0000  188.593   21.097  ?   ?  0.000000 21.09679 
1 1 1   32   11    5 o  141.272   29.802   17.562   6.2415   17.562   6.2415   0.0000   0.0000  141.272   29.802  ?   ?  0.000000 29.80176 
1 1 1   32   11    6 o   81.110   29.015   5.1670   4.5627   5.1670   4.5627   0.0000   0.0000   81.110   29.015  ?   ?  0.000000 29.01463 
1 1 1   32   11    7 o  175.173   18.760   24.853   4.9518   24.853   4.9518   0.0000   0.0000  175.173   18.760  ?   ?  0.000000 18.76014 
1 1 1   32   11    8 o  166.441   20.649   22.732   5.1475   22.732   5.1475   0.0000   0.0000  166.441   20.649  ?   ?  0.000000 20.64870 
1 1 1   32   11    9 o   79.561   30.518   4.4546   5.2104   4.4546   5.2104   0.0000   0.0000   79.561   30.518  ?   ?  0.000000 30.51755 
1 1 1   32   11   10 o  117.018   15.838   11.031   2.7639   8.0788   5.0399   12.301   3.3052   95.885   30.511  122.777   18.134 -26.89140 35.49259 
1 1 1   32   11   11 o  151.273   11.971   17.986   2.7492   33.966   7.5800   15.565   2.9501  200.350   25.280  139.989   13.954 60.36038 28.87595 
1 1 1   32   11   12 o  198.816   9.7527   30.683   2.9679   28.871   5.5769   31.400   3.5055  187.999   19.672  200.272   11.484 -12.27280 22.77861 
1 1 1   32   11   13 o   61.216   21.686   2.7929   2.5429   3.1602   4.8139   2.6507   2.9948   72.524   28.883   62.313   23.307 10.21079 37.11395 
1 1 1   32   11   14 o   69.531   22.059   3.9851   2.6361   1.6559   4.8735   4.9484   3.1341   67.073   28.137   76.653   24.019 -9.580055 36.99488 
1 1 1   32   11   15 o   60.010   26.772  -0.8036   4.9971  -0.8036   4.9971   0.0000   0.0000   60.010   26.772  ?   ?  0.000000 26.77152 
1 1 1   32   11   16 o  135.653   15.605   14.824   3.1811   6.1384   5.4473   19.319   3.9188   86.200   31.581  154.466   16.848 -68.26585 35.79418 
1 1 1   32   11   17 o   42.309   19.444  -1.7360   2.8824  -5.5827   5.2824  -0.1050   3.4397   50.945   24.308   52.207   22.791 -1.261990 33.32133 
1 1 1   32   11   18 o  105.720   19.809   9.3833   3.0877   3.4150   5.4845   12.153   3.7360   75.247   30.527  120.006   21.110 -44.75897 37.11527 
1 1 1   32   11   19 o   90.112   22.305   7.0164   3.0600   6.9365   5.6257   7.0500   3.6466   89.306   32.189   89.388   25.437 -0.8186340E-01 41.02617 
1 1 1   32   11   20 o  109.987   18.882   10.095   3.0642   9.0218   5.6322   10.546   3.6520   98.478   32.331  110.778   22.310 -12.30018 39.28135 
1 1 1   32   11   21 o  186.482   11.995   27.462   3.4056   29.141   6.0871   26.697   4.1089  185.800   21.820  182.373   14.849 3.427017 26.39261 
1 1 1   32   11   22 o   43.311   20.940  -5.7239   4.2265  -9.9575   9.1898  -4.5881   4.7598   63.195   30.632   49.008   23.297 14.18771 38.48459 
1 1 1   32   11   23 o   84.562   24.838   6.3869   3.4265   2.5803   5.6129   8.6484   4.3263   71.538   30.113   96.774   27.762 -25.23590 40.95737 
1 1 1   32   11   24 o  109.932   21.673   10.497   3.5172   11.621   5.6947   9.8031   4.4721  108.850   32.033  102.547   27.796 6.303818 42.41162 
1 1 1   32   11   25 o   40.352   19.300  -3.8238   3.3714  -8.6045   5.4652  -0.8867   4.2836   46.327   22.708   54.113   24.410 -7.785019 33.33976 
1 1 1   32   11   26 o  115.904   26.089   12.374   4.5168   9.9781   5.7859   16.113   7.2272   99.538   32.773  123.181   36.041 -23.64291 48.71370 
1 1 1   32   11   27 o   49.734   22.434  -0.8344   3.6178   6.8776   5.7281  -5.9523   4.6662   85.495   32.184   45.176   21.881 40.31951 38.91746 
1 1 1   32   11   28 o   99.625   24.434   9.1336   3.6976   7.3648   5.8131   10.336   4.7921   86.997   32.486  102.657   29.141 -15.65987 43.64087 
1 1 1   32   11   29 o  113.308   22.536   11.505   3.7710   10.362   5.7873   12.349   4.9712   99.590   32.777  112.387   28.775 -12.79773 43.61535 
1 1 1   32   12    0 o   29.076   19.328  -0.5724   2.3001  -0.5724   2.3001  -0.5724   2.3001   29.076   19.328   29.076   19.328 0.000000 0.000000 
1 1 1   32   12    1 o  104.651   21.008   9.1518   3.2482   9.1518   3.2482   0.0000   0.0000  104.651   21.008  ?   ?  0.000000 21.00838 
1 1 1   32   12    2 o  154.963   17.986   19.407   4.1867   19.407   4.1867   0.0000   0.0000  154.963   17.986  ?   ?  0.000000 17.98562 
1 1 1   32   12    3 o   86.759   28.041   6.3782   4.2444   6.3782   4.2444   0.0000   0.0000   86.759   28.041  ?   ?  0.000000 28.04094 
1 1 1   32   12    4 o   58.811   26.159  -0.8670   4.7336  -0.8670   4.7336   0.0000   0.0000   58.811   26.159  ?   ?  0.000000 26.15896 
1 1 1   32   12    5 o  116.297   31.060   12.150   5.6332   12.150   5.6332   0.0000   0.0000  116.297   31.060  ?   ?  0.000000 31.05956 
1 1 1   32   12    6 o  140.824   21.930   16.500   4.5732   16.500   4.5732   0.0000   0.0000  140.824   21.930  ?   ?  0.000000 21.93031 
1 1 1   32   12    7 o  130.340   24.366   14.446   4.6824   14.446   4.6824   0.0000   0.0000  130.340   24.366  ?   ?  0.000000 24.36627 
1 1 1   32   12    8 o   39.929   18.186  -1.3156   2.4475   0.3362   4.6610  -1.9444   2.8759   61.889   26.777   41.833   19.297 20.05539 33.00547 
1 1 1   32   12    9 o   50.712   20.810   0.9271   2.5849   6.4253   4.8447  -1.2612   3.0564   87.374   30.002   45.552   20.577 41.82177 36.38018 
1 1 1   32   12   10 o   42.310   19.132  -1.1673   2.6494  -5.4479   5.0176   0.4876   3.1198   49.861   23.763   52.549   22.303 -2.687832 32.58997 
1 1 1   32   12   11 o  142.811   15.331   16.330   3.2989   9.6092   7.3216   18.042   3.6952  103.246   36.773  149.728   16.391 -46.48242 40.26099 
1 1 1   32   12   12 o   60.742   21.491   2.7539   2.4966   4.4183   5.3988   2.3012   2.8157   79.469   30.906   59.434   22.520 20.03495 38.24021 
1 1 1   32   12   13 o  115.264   16.097   10.765   2.7625   5.5572   5.2711   12.737   3.2436   83.654   30.994  124.981   17.430 -41.32703 35.55901 
1 1 1   32   12   14 o   51.920   21.100   1.1484   2.6254   2.1679   5.3913   0.8315   3.0060   70.975   29.672   53.036   22.163 17.93978 37.03516 
1 1 1   32   12   15 o   90.216   25.985   7.1473   3.7833   3.8003   5.3971   10.381   5.3050   76.639   30.563  106.395   30.806 -29.75505 43.39494 
1 1 1   32   12   16 o   52.637   21.862   0.9252   2.8997  -0.2108   5.3276   1.4034   3.4565   63.225   27.954   58.287   24.008 4.938042 36.84876 
1 1 1   32   12   17 o  113.752   18.134   10.687   3.0513   6.3164   5.5636   12.568   3.6490   86.777   31.898  122.559   20.152 -35.78277 37.73041 
1 1 1   32   12   18 o   64.355   23.729   3.0310   3.0824  -4.5495   5.7462   6.0936   3.6524   55.421   26.121   83.525   25.889 -28.10392 36.77689 
1 1 1   32   12   19 o   76.862   23.480   5.0800   3.0167   4.4873   5.8072   5.2991   3.5305   79.727   31.732   78.547   25.588 1.179375 40.76343 
1 1 1   32   12   20 o   61.642   23.930   2.4488   3.2325 -14.2944   6.0845   9.0328   3.8155   43.903   21.936  100.939   24.860 -57.03660 33.15418 
1 1 1   32   12   21 o  133.874   20.157   15.090   4.0022   11.081   6.0854   18.146   5.3130  106.780   33.470  143.704   25.066 -36.92390 41.81599 
1 1 1   32   12   22 o  113.996   21.977   11.244   3.6956   16.913   9.1917   10.151   4.0362  123.671   41.333  106.351   25.184 17.32040 48.40131 
1 1 1   32   12   23 o   95.970   23.566   8.2039   3.4363   3.2330   5.9034   10.751   4.2260   74.252   31.046  108.826   25.769 -34.57430 40.34721 
1 1 1   32   12   24 o  153.383   16.333   19.319   3.7756   17.386   6.0368   20.561   4.8388  135.231   29.954  155.075   20.920 -19.84361 36.53595 
1 1 1   32   12   25 o   60.504   24.699   2.0348   3.6175   0.1226   5.7835   3.2638   4.6365   64.219   28.714   69.544   28.119 -5.324226 40.18915 
1 1 1   32   12   26 o   88.779   28.634   7.5171   4.4275   10.019   5.7479   3.8663   6.9428   99.344   32.664   77.629   33.117 21.71528 46.51519 
1 1 1   32   12   27 o   93.353   24.855   8.0658   3.6146   5.2786   5.6759   9.9672   4.6881   78.959   31.388  101.134   28.863 -22.17447 42.64144 
1 1 1   32   12   28 o   69.980   25.897   4.1327   3.6776   7.7697   5.7148   1.5619   4.8047   88.375   32.352   63.280   27.283 25.09514 42.32001 
1 1 1   32   13    1 o  134.907   16.637   14.663   3.3626   14.663   3.3626   0.0000   0.0000  134.907   16.637  ?   ?  0.000000 16.63710 
1 1 1   32   13    2 o   66.769   25.010   3.0654   3.4506   3.0654   3.4506   0.0000   0.0000   66.769   25.010  ?   ?  0.000000 25.00988 
1 1 1   32   13    3 o  189.180   17.167   28.743   4.9168   28.743   4.9168   0.0000   0.0000  189.180   17.167  ?   ?  0.000000 17.16698 
1 1 1   32   13    4 o   69.609   28.009   2.6061   4.5762   2.6061   4.5762   0.0000   0.0000   69.609   28.009  ?   ?  0.000000 28.00903 
1 1 1   32   13    5 o  177.022   21.199   25.825   5.6297   25.825   5.6297   0.0000   0.0000  177.022   21.199  ?   ?  0.000000 21.19892 
1 1 1   32   13    6 o   94.344   18.209   7.3516   2.5342   6.8207   4.2388   7.6469   3.1615   88.896   27.946   94.887   22.168 -5.990868 35.67023 
1 1 1   32   13    7 o   58.218   21.403   2.3416   2.5049   9.0300   4.5044  -0.6527   3.0139  101.102   28.097   47.302   20.964 53.79969 35.05629 
1 1 1   32   13    8 o  132.619   14.461   14.029   2.8879   14.300   4.8705   13.882   3.5863  128.753   25.615  130.288   18.503 -1.535065 31.59932 
1 1 1   32   13    9 o   26.356   13.316  -8.4028   2.5833 -14.4295   4.7697  -5.9011   3.0731   36.327   18.321   34.362   16.880 1.965233 24.91214 
1 1 1   32   13   10 o   49.507   20.647   0.6778   2.6015   3.7764   4.9597  -0.4982   3.0555   75.472   29.546   48.114   21.227 27.35796 36.38092 
1 1 1   32   13   11 o   42.342   19.347  -1.5273   2.7987   1.7562   6.9329  -2.1665   3.0590   76.220   32.817   42.649   19.753 33.57089 38.30370 
1 1 1   32   13   12 o   90.525   21.647   6.9913   2.9588   5.6248   5.2271   7.6356   3.5892   83.732   30.896   93.625   24.692 -9.893036 39.55056 
1 1 1   32   13   13 o  102.415   21.697   8.9236   3.2954   8.6366   5.4726   9.0869   4.1276   97.678   31.860  101.400   26.353 -3.722069 41.34647 
1 1 1   32   13   14 o  142.920   27.213   17.979   5.7357   17.979   5.7357   0.0000   0.0000  142.920   27.213  ?   ?  0.000000 27.21329 
1 1 1   32   13   15 o  119.544   22.529   12.192   3.9710   10.288   5.6935   13.995   5.5414  105.170   32.278  124.061   29.596 -18.89050 43.79278 
1 1 1   32   13   16 o   89.154   21.913   6.8374   2.9691   3.5748   5.5275   8.1604   3.5200   75.934   30.702   96.705   23.914 -20.77113 38.91686 
1 1 1   32   13   17 o   93.615   21.780   7.5348   3.0621   3.3793   5.9608   9.0246   3.5690   76.575   31.533  101.910   23.377 -25.33490 39.25306 
1 1 1   32   13   18 o  117.451   18.426   11.443   3.2035   12.738   6.1566   10.962   3.7514  115.382   33.123  112.877   22.502 2.505257 40.04344 
1 1 1   32   13   19 o   80.652   26.974   5.6416   3.9147   3.4492   5.8460   7.4239   5.2710   75.928   31.242   90.618   31.283 -14.69010 44.21216 
1 1 1   32   13   20 o   73.750   27.019   4.3654   3.9870   0.3463   6.1078   7.3495   5.2630   67.512   29.887   89.868   31.246 -22.35515 43.23803 
1 1 1   32   13   21 o  117.409   19.526   11.639   3.3858   11.212   6.1570   11.824   4.0537  106.625   33.701  115.967   23.639 -9.342140 41.16537 
1 1 1   32   13   22 o  107.918   24.506   10.425   3.9555   21.477   9.8079   8.2785   4.3227  137.375   42.399   94.349   27.948 43.02576 50.78168 
1 1 1   32   13   23 o   38.928   18.808  -4.6058   3.3946  -0.2734   5.8797  -6.7719   4.1575   63.989   28.757   40.756   19.941 23.23290 34.99421 
1 1 1   32   13   24 o  118.752   20.749   12.178   3.6342   10.837   5.7679   13.061   4.6800  103.851   32.591  119.116   26.366 -15.26584 41.92054 
1 1 1   32   13   25 o  123.901   20.477   13.250   3.7477   9.4523   6.0707   15.588   4.7637   96.474   33.558  131.512   24.569 -35.03806 41.59006 
1 1 1   32   13   26 o   93.664   28.478   8.4736   4.4453   9.8754   5.9174   6.6578   6.7350   97.975   33.162   85.332   34.105 12.64298 47.56934 
1 1 1   32   13   27 o   85.243   26.082   6.8251   3.7206   13.108   5.6379   1.9782   4.9519  113.762   31.366   65.285   27.913 48.47672 41.98740 
1 1 1   32   14    1 o  247.963   11.655   47.999   4.4234   47.999   4.4234   0.0000   0.0000  247.963   11.655  ?   ?  0.000000 11.65456 
1 1 1   32   14    3 o   96.125   26.460   8.0704   4.0162   8.0704   4.0162   0.0000   0.0000   96.125   26.460  ?   ?  0.000000 26.46043 
1 1 1   32   14    4 f  111.188   16.018   9.9994   2.6474   15.623   4.8524   7.6159   3.1590  135.458   24.296   94.612   22.197 40.84609 32.90907 
1 1 1   32   14    5 o  193.783   19.638   30.663   5.7444   30.663   5.7444   0.0000   0.0000  193.783   19.638  ?   ?  0.000000 19.63815 
1 1 1   32   14    6 o   52.937   20.924   1.4593   2.5088  -2.7210   4.2937   3.6263   3.0914   50.732   23.464   68.382   23.938 -17.65002 33.51936 
1 1 1   32   14    7 f  186.826   10.995   27.301   3.1304   30.074   5.0673   25.590   3.9808  193.124   17.327  179.374   14.626 13.74991 22.67468 
1 1 1   32   14    8 o   83.042   21.573   5.8677   2.7668   12.642   4.9032   2.7030   3.3513  119.696   27.359   64.156   24.507 55.54076 36.73027 
1 1 1   32   14    9 o   71.202   22.676   4.1981   2.7834   5.6003   4.9434   3.5472   3.3680   83.145   30.142   68.680   24.883 14.46487 39.08558 
1 1 1   32   14   10 o  205.945   10.976   33.186   3.4476   45.964   5.9221   26.635   4.2402  239.480   16.252  182.523   15.319 56.95691 22.33398 
1 1 1   32   14   11 o   84.111   23.589   6.1015   3.1598   11.143   7.6819   5.0747   3.4666  108.277   37.744   77.645   25.359 30.63188 45.47165 
1 1 1   32   14   12 f   75.943   23.913   4.8769   3.1023  -3.1609   5.3949   8.8478   3.7920   56.456   26.178  100.612   24.785 -44.15639 36.04952 
1 1 1   32   14   13 o  124.015   18.741   12.702   3.4464   14.678   5.6326   11.520   4.3573  127.280   29.490  114.630   25.493 12.65052 38.98143 
1 1 1   32   14   14 o  178.722   13.742   25.387   3.7304   25.659   6.0890   25.223   4.7198  173.789   23.493  175.998   17.764 -2.208618 29.45258 
1 1 1   32   14   15 o   74.636   26.292   4.5249   3.7329   9.3045   5.6613   0.8485   4.9651  100.190   32.385   64.315   27.732 35.87575 42.63615 
1 1 1   32   14   16 o  110.167   19.180   10.142   3.1168   20.280   5.9989   6.3939   3.6478  151.618   26.831   85.281   25.768 66.33717 37.20085 
1 1 1   32   14   17 o   47.446   21.101  -0.6279   3.0788   1.4793   5.9072  -1.4138   3.6075   70.210   30.261   48.872   22.189 21.33764 37.52440 
1 1 1   32   14   18 o   46.265   21.803  -3.4938   4.0024  -5.5185   6.0299  -1.8993   5.3512   54.934   26.145   58.444   26.723 -3.509468 37.38581 
1 1 1   32   14   19 o   43.993   20.418  -2.2172   3.2931  -9.5564   6.0486   0.8748   3.9260   48.866   23.939   58.288   24.886 -9.422581 34.53126 
1 1 1   32   14   20 o   82.686   25.295   6.0980   3.4997  -0.0753   6.1221   9.0945   4.2653   66.149   29.562   99.462   27.223 -33.31390 40.18750 
1 1 1   32   14   21 o   71.430   25.135   4.2669   3.4107   4.5432   5.9912   4.1345   4.1485   78.813   31.930   72.443   27.363 6.369942 42.05035 
1 1 1   32   14   22 o  103.105   25.691   9.7216   4.0397   4.2220   9.8225   10.841   4.4319   86.017   37.998  108.227   26.876 -22.20990 46.54229 
1 1 1   32   14   23 o   64.587   25.248   2.9262   3.6173  -4.7038   5.9308   7.4461   4.5647   54.805   26.039   88.768   29.104 -33.96267 39.05235 
1 1 1   32   14   24 o   56.395   24.017   1.0350   3.6402   0.4781   5.8557   1.3858   4.6474   65.181   29.036   62.615   26.913 2.566257 39.59079 
1 1 1   32   14   25 f  123.604   20.459   13.227   3.7353   4.3490   5.8834   19.222   4.8346   76.289   31.361  148.192   21.981 -71.90276 38.29670 
1 1 1   32   14   26 o   63.571   26.588   2.1737   4.3315  -3.1709   5.6394   9.8633   6.7643   55.536   26.081   96.489   35.216 -40.95299 43.82277 
1 1 1   32   15    1 o   89.132   22.966   6.8140   3.1528   6.8140   3.1528   0.0000   0.0000   89.132   22.966  ?   ?  0.000000 22.96646 
1 1 1   32   15    2 f   40.465   18.268  -1.0343   2.4046   0.0000   0.0000  -1.0343   2.4046  ?   ?    40.465   18.268 0.000000 18.26816 
1 1 1   32   15    3 o  107.935   15.177   9.3953   2.4381   8.3490   4.0389   9.9951   3.0582   97.506   26.410  109.967   18.847 -12.46102 32.44516 
1 1 1   32   15    4 o   78.880   20.882   5.2687   2.5608   7.9613   4.4174   3.9058   3.1428   94.855   28.288   70.127   24.159 24.72793 37.20039 
1 1 1   32   15    5 o   71.338   28.636   2.9430   4.7707   2.9430   4.7707   0.0000   0.0000   71.338   28.636  ?   ?  0.000000 28.63565 
1 1 1   32   15    6 o   42.791   18.873  -0.4557   2.4137   0.4639   4.1776  -0.9165   2.9572   59.149   25.471   45.761   20.492 13.38767 32.69063 
1 1 1   32   15    7 o   52.153   21.194   1.1574   2.6488   3.6608   4.5064  -0.1640   3.2741   73.183   28.299   50.930   22.235 22.25308 35.98863 
1 1 1   32   15    8 o   38.226   18.046  -2.7931   2.7629  -4.9692   4.6816  -1.6301   3.4225   48.322   23.009   47.146   21.485 1.175556 31.48028 
1 1 1   32   15    9 f  118.605   17.284   11.497   3.0456   9.0659   5.1930   12.772   3.7602   99.894   30.855  123.577   20.605 -23.68289 37.10251 
1 1 1   32   15   10 o   41.257   19.048  -1.8802   2.8112   3.7736   5.1369  -4.2973   3.3587   75.649   29.928   39.803   19.097 35.84600 35.50119 
1 1 1   32   15   11 o   85.209   24.946   6.3194   3.4615   10.042   8.2687   5.5284   3.8115  104.007   38.763   80.559   26.604 23.44834 47.01406 
1 1 1   32   15   12 o   67.875   24.458   3.5266   3.2478   10.786   5.6674  -0.0230   3.9631  107.586   32.032   55.932   24.439 51.65428 40.29017 
1 1 1   32   15   13 o  133.069   18.758   14.621   3.7147   16.883   5.8495   13.092   4.8087  136.947   28.818  121.543   26.588 15.40369 39.20991 
1 1 1   32   15   14 o   58.420   24.175   1.3765   3.5269  -2.0283   5.5753   3.6479   4.5538   59.716   27.294   72.741   28.358 -13.02457 39.35898 
1 1 1   32   15   15 o   92.203   32.792   7.6236   5.8199   7.6236   5.8199   0.0000   0.0000   92.203   32.792  ?   ?  0.000000 32.79172 
1 1 1   32   15   16 o   93.728   26.676   7.8980   4.0102   4.1992   5.9716   10.936   5.4122   78.940   31.914  107.864   31.082 -28.92361 44.54910 
1 1 1   32   15   17 o  136.107   20.550   15.627   4.1479   21.717   6.1454   10.532   5.6216  156.361   26.632  105.045   32.044 51.31565 41.66680 
1 1 1   32   15   18 o   69.239   24.878   3.8376   3.3579  -2.8530   5.9327   6.9911   4.0731   59.139   27.432   87.848   27.358 -28.70934 38.74239 
1 1 1   32   15   19 o   57.531   23.624   1.5644   3.3343   14.493   6.0137  -4.1741   4.0065  122.453   31.801   44.570   21.240 77.88300 38.24200 
1 1 1   32   15   20 o  168.759   14.626   23.007   3.7405   15.994   6.1583   27.106   4.7086  128.566   31.534  181.542   17.148 -52.97548 35.89504 
1 1 1   32   15   21 o   78.573   24.989   5.5134   3.3812   4.6482   5.9160   5.9331   4.1205   78.531   31.759   81.130   27.672 -2.598839 42.12315 
1 1 1   32   15   22 o   53.649   23.627   0.0139   3.7695  -0.1763   9.1485   0.0528   4.1370   75.437   34.658   55.936   24.687 19.50130 42.55159 
1 1 1   32   15   23 o   49.254   23.097  -2.9899   4.3951   0.0000   0.0000  -2.9899   4.3951  ?   ?    49.254   23.097 0.000000 23.09705 
1 1 1   32   15   24 o   77.615   25.800   5.4703   3.5824  -2.9858   6.0653   10.001   4.4395   58.186   27.237  102.326   27.677 -44.14033 38.83114 
1 1 1   32   15   25 o   58.576   24.806   1.4108   3.8459   3.1312   8.0568   0.9031   4.3767   77.771   34.382   59.382   25.819 18.38907 42.99693 
1 1 1   32   16    1 o  136.522   13.828   14.842   2.8498   0.0000   0.0000   14.842   2.8498  ?   ?   136.522   13.828 0.000000 13.82838 
1 1 1   32   16    2 o   50.788   21.096   0.8078   2.7002   0.0000   0.0000   0.8078   2.7002  ?   ?    50.788   21.096 0.000000 21.09574 
1 1 1   32   16    3 o  129.233   13.312   13.278   2.5956   10.823   4.3207   14.663   3.2467  111.084   25.890  134.780   16.054 -23.69526 30.46352 
1 1 1   32   16    4 o   40.945   18.403  -0.8992   2.4084   3.7995   4.2705  -3.0908   2.9165   72.931   27.710   38.842   18.398 34.08867 33.26155 
1 1 1   32   16    5 o  128.298   14.976   13.219   2.8855   13.760   5.0042   12.950   3.5318  124.915   26.963  125.229   19.024 -0.3136215 32.99891 
1 1 1   32   16    6 o   55.855   21.532   1.9030   2.6026   4.8949   4.2113   0.0543   3.3104   77.971   27.877   51.952   22.522 26.01816 35.83775 
1 1 1   32   16    7 o   35.932   17.225  -3.5307   2.7204  -0.6462   4.3587  -5.3712   3.4817   56.542   25.128   38.656   18.764 17.88615 31.36114 
1 1 1   32   16    8 o   53.488   22.321   0.8935   3.0430   5.1118   4.7333  -2.0781   3.9728   80.086   29.424   49.879   22.887 30.20646 37.27736 
1 1 1   32   16    9 o  103.187   21.576   9.0695   3.2982   4.8614   4.9073   12.536   4.4541   79.313   29.802  119.900   25.076 -40.58724 38.94881 
1 1 1   32   16   10 o   49.505   21.818  -0.4012   3.2202  -2.0637   5.0693   0.7235   4.1694   56.915   26.019   59.729   25.577 -2.813728 36.48513 
1 1 1   32   16   11 o   48.787   22.302  -1.7884   3.7241  -2.1534   7.6572  -1.6753   4.2621   69.521   31.854   52.835   24.038 16.68604 39.90651 
1 1 1   32   16   12 o   65.298   24.788   2.9626   3.4154   4.7353   5.4117   1.7891   4.4030   79.788   30.967   64.683   26.909 15.10468 41.02448 
1 1 1   32   16   13 o  142.442   17.809   16.649   3.7979   12.528   5.7934   19.755   5.0294  115.315   31.796  152.684   22.169 -37.36873 38.76105 
1 1 1   32   16   14 o   74.190   25.667   4.5657   3.5490   7.4433   5.5083   2.5232   4.6407   90.982   31.947   68.277   27.935 22.70532 42.43793 
1 1 1   32   16   15 o   74.704   30.382   3.5140   5.4481   3.5140   5.4481   0.0000   0.0000   74.704   30.382  ?   ?  0.000000 30.38162 
1 1 1   32   16   16 o  100.677   25.440   9.0965   3.9219   11.510   5.7234   6.9599   5.3849  109.382   32.092   88.089   31.520 21.29278 44.98224 
1 1 1   32   16   17 o   46.287   21.702  -3.0082   3.8771  -2.6029   5.6255  -3.3750   5.3510   57.962   26.825   54.830   25.640 3.131550 37.10731 
1 1 1   32   16   18 o   64.257   24.372   3.0012   3.2999   5.4250   5.6972   1.7775   4.0481   81.494   31.733   62.004   25.798 19.48999 40.89655 
1 1 1   32   16   19 o  184.919   14.383   27.565   4.0388   30.014   8.5522   26.862   4.5820  175.948   32.967  180.941   16.734 -4.992569 36.97099 
1 1 1   32   16   20 o   76.801   25.905   5.2144   3.6106   6.1222   7.2484   4.9148   4.1640   85.798   34.985   75.869   27.640 9.928459 44.58624 
1 1 1   32   16   21 o   62.880   25.941   2.1494   4.0435   0.0000   0.0000   2.1494   4.0435  ?   ?    62.880   25.941 0.000000 25.94102 
1 1 1   32   16   22 o   81.826   26.379   6.1609   3.7581   11.388   7.6752   4.5124   4.3102  102.485   37.496   73.700   27.878 28.78500 46.72410 
1 1 1   32   16   23 o   46.942   21.761  -2.0635   3.7251  -5.1114   7.5797  -1.0929   4.2773   61.206   29.180   53.055   24.116 8.151085 37.85614 
1 1 1   32   16   24 o   55.103   23.490   0.9913   3.4882  -3.8527   5.8058   3.7275   4.3635   55.119   26.063   69.904   27.606 -14.78530 37.96484 
1 1 1   32   17    0 o   27.945   18.862  -0.9628   2.3470  -0.9628   2.3470  -0.9628   2.3470   27.945   18.862   27.945   18.862 0.000000 0.000000 
1 1 1   32   17    1 o   72.503   16.050   4.3484   1.7341   4.9947   2.2821   3.4653   2.6676   76.934   19.387   65.859   22.266 11.07533 29.52314 
1 1 1   32   17    2 o   61.794   20.531   3.0430   2.2687   0.7913   3.6669   4.4394   2.8877   57.094   24.202   72.808   23.087 -15.71456 33.44803 
1 1 1   32   17    3 o  181.369   10.862   25.766   3.0016   28.696   4.9972   24.112   3.7543  188.075   17.562  174.012   14.220 14.06303 22.59720 
1 1 1   32   17    4 o  156.111   21.213   20.357   4.9376   20.357   4.9376   0.0000   0.0000  156.111   21.213  ?   ?  0.000000 21.21326 
1 1 1   32   17    5 o   69.131   23.060   3.8985   2.8611   3.5642   4.3641   4.1505   3.7890   71.983   27.845   72.950   26.398 -0.9664841 38.36872 
1 1 1   32   17    6 o   50.297   21.387   0.4404   2.8783  -2.7356   4.0620   3.6432   4.0791   48.775   22.651   71.309   27.085 -22.53452 35.30799 
1 1 1   32   17    7 o  152.030   14.349   18.469   3.2996   23.857   4.8819   13.939   4.4771  170.375   19.046  127.213   23.870 43.16207 30.53723 
1 1 1   32   17    8 o   94.615   24.562   7.8528   3.5884   14.579   6.2889   4.6060   4.3695  124.453   32.618   76.622   28.252 47.83169 43.15278 
1 1 1   32   17    9 o   59.432   24.268   1.6481   3.4939  -1.5454   6.1921   3.1397   4.2320   64.046   29.075   69.409   27.257 -5.363670 39.85397 
1 1 1   32   17   10 f   50.790   23.307  -2.0517   4.1209   0.0000   0.0000  -2.0517   4.1209  ?   ?    50.790   23.307 0.000000 23.30706 
1 1 1   32   17   11 o  119.236   22.515   12.202   3.9585   19.087   7.5580   9.5998   4.6469  139.988   35.285  102.536   28.553 37.45197 45.39053 
1 1 1   32   17   12 o   45.151   21.353  -3.6802   3.9001 -13.3833   7.6520  -0.2748   4.5331   52.923   26.121   58.230   25.764 -5.307465 36.68930 
1 1 1   32   17   13 o  122.681   22.959   13.016   4.1528   18.974   8.0964   10.889   4.8377  136.574   37.559  108.702   28.665 27.87277 47.24837 
1 1 1   32   17   14 o   88.248   35.795   6.1411   7.5392   6.1411   7.5392   0.0000   0.0000   88.248   35.795  ?   ?  0.000000 35.79501 
1 1 1   32   17   15 o   46.557   21.677  -2.5586   3.7590  -7.5443   7.3615  -0.8001   4.3719   58.170   28.002   55.364   24.845 2.805565 37.43505 
1 1 1   32   17   16 o   44.073   20.979  -3.9906   3.8860  -3.2813   5.6145  -4.6427   5.3839   56.360   26.325   52.440   24.884 3.920052 36.22427 
1 1 1   32   17   17 o  111.495   24.681   11.144   4.1007   15.533   5.8421   6.8827   5.7574  127.707   30.337   87.132   32.371 40.57500 44.36426 
1 1 1   32   17   18 o   48.529   22.408  -2.0469   3.8929  -0.8668   5.5907  -3.1576   5.4239   61.235   27.731   55.261   25.832 5.974503 37.89861 
1 1 1   32   17   19 o   37.099   18.034  -4.9057   3.2460 -12.1725   5.7090  -1.4345   3.9458   43.400   21.616   50.420   23.013 -7.019718 31.57276 
1 1 1   32   17   20 o  102.474   22.301   9.3040   3.3985   10.963   5.8633   8.4649   4.1705  103.979   32.890   94.826   27.273 9.152779 42.72672 
1 1 1   32   17   21 o  125.278   20.979   13.622   3.8806   13.873   8.8748   13.563   4.3149  109.369   40.274  123.005   23.778 -13.63645 46.76950 
1 1 1   32   17   22 o  103.070   22.987   9.5497   3.5341   11.563   6.0312   8.4972   4.3613  105.511   33.356   94.021   28.123 11.48990 43.62930 
1 1 1   32   18    0 o   67.180   26.792   4.9806   2.6664   4.9806   2.6664   4.9806   2.6664   67.180   26.792   67.180   26.792 0.000000 0.000000 
1 1 1   32   18    1 o   75.097   17.494   4.7153   1.9735   4.1138   2.5514   5.6112   3.1136   70.047   21.626   80.620   23.675 -10.57270 32.06564 
1 1 1   32   18    2 o  132.373   10.745   13.768   2.1582   13.619   2.6270   14.080   3.7856  130.748   13.312  130.127   19.615 0.6215363 23.70622 
1 1 1   32   18    3 o   29.592   13.619  -0.9941   1.4211  -0.5520   1.5524  -3.2809   3.5305   33.303   14.885   43.418   20.467 -10.11486 25.30680 
1 1 1   32   18    4 o   63.809   23.231   3.0232   2.9410   0.7269   4.4476   4.8074   3.9204   61.198   26.317   76.544   26.946 -15.34550 37.66551 
1 1 1   32   18    5 o   82.470   23.097   5.8910   3.0315   12.376   4.7513   1.4381   3.9371  117.771   26.942   60.972   25.412 56.79876 37.03523 
1 1 1   32   18    6 o   62.888   22.785   2.9530   2.8242   2.7017   4.0078   3.2009   3.9804   66.523   26.398   68.655   26.582 -2.132156 37.46265 
1 1 1   32   18    7 o   98.079   20.978   8.2101   3.0540   8.2708   4.3546   8.1514   4.2843   95.669   27.971   95.078   27.729 0.5912018 39.38664 
1 1 1   32   18    8 o   53.974   22.473   1.0096   3.0748   0.9084   4.4042   1.1059   4.2947   61.390   26.288   61.490   26.135 -0.9969711E-01 37.06858 
1 1 1   32   18    9 o   63.932   24.223   2.8628   3.2575   3.8864   4.7940   1.9849   4.4399   74.207   29.050   65.334   27.087 8.872490 39.71886 
1 1 1   32   18   10 o   78.577   26.352   5.3135   3.7363   6.0592   7.6088   5.0766   4.2891   88.630   35.957   78.147   28.112 10.48275 45.64187 
1 1 1   32   18   11 o   93.150   23.621   7.6496   3.3727   8.7607   5.0334   6.7443   4.5435   96.907   30.451   86.710   29.060 10.19706 42.09178 
1 1 1   32   18   12 o   67.315   25.221   3.3878   3.5095   7.1303   5.2695   0.4044   4.7048   88.713   31.240   60.915   26.622 27.79808 41.04435 
1 1 1   32   18   13 o   39.916   19.198  -4.3930   3.4419  -1.7795   5.4227  -6.1561   4.4541   58.739   26.874   44.027   21.337 14.71230 34.31456 
1 1 1   32   18   14 o   72.075   29.878   3.0138   5.4007   3.0138   5.4007   0.0000   0.0000   72.075   29.878  ?   ?  0.000000 29.87750 
1 1 1   32   18   15 o   60.720   24.694   2.0107   3.5993   1.1887   5.4895   2.6305   4.7671   66.467   28.908   68.213   28.156 -1.746017 40.35407 
1 1 1   32   18   16 o   54.228   23.907  -0.0615   3.8692  -1.6257   5.3875   1.6047   5.5604   58.467   26.763   67.783   29.287 -9.316448 39.67352 
1 1 1   32   18   17 f  112.492   25.064   11.462   4.2052   14.543   5.8998   8.2794   5.9956  121.900   31.421   92.427   33.239 29.47356 45.73962 
1 1 1   32   18   18 o  111.434   25.637   11.376   4.2819   7.3026   5.8186   16.188   6.3238   87.978   32.570  127.571   32.342 -39.59371 45.89999 
1 1 1   32   18   19 o  157.280   18.375   20.767   4.3401   28.271   6.1607   13.374   6.1152  179.618   22.932  114.521   33.051 65.09650 40.22696 
1 1 1   32   18   20 o   62.911   26.046   2.1721   4.0968   8.0749   5.8277  -3.5952   5.7604   90.513   32.740   55.617   26.195 34.89530 41.92944 
1 1 1   32   18   21 f   56.554   24.346   0.8802   3.8143  -2.1176   8.6594   1.6018   4.2487   69.710   32.604   61.291   26.021 8.418125 41.71416 
1 1 1   32   19    0 o   49.402   27.697   2.8018   3.1542   2.8018   3.1542   2.8018   3.1542   49.402   27.697   49.402   27.697 0.000000 0.000000 
1 1 1   32   19    1 o  135.130   12.366   14.486   2.5294   17.515   3.4626   11.021   3.7039  147.229   15.603  113.354   22.142 33.87508 27.08741 
1 1 1   32   19    2 f   60.768   20.387   2.9489   2.2362   3.5670   2.8336   1.9284   3.6409   66.632   22.941   61.272   24.867 5.359570 33.83277 
1 1 1   32   19    3 o   63.345   19.834   3.3187   2.1375   3.3187   2.1375   0.0000   0.0000   63.345   19.834  ?   ?  0.000000 19.83379 
1 1 1   32   19    4 o  193.363   7.5433   28.928   2.2326   30.762   2.5673   23.237   4.5216  199.135   8.4230  168.423   17.810 30.71146 19.70134 
1 1 1   32   19    5 o   61.046   23.458   2.4696   3.0821   6.0347   4.8508   0.0558   3.9914   83.754   29.921   56.025   24.502 27.72920 38.67330 
1 1 1   32   19    6 o  100.232   20.317   8.5524   3.0104   8.6757   4.2172   8.4243   4.2986   97.797   27.189   96.209   27.694 1.587662 38.80999 
1 1 1   32   19    7 o   85.133   23.410   6.3646   3.1456   3.8341   4.4008   9.0078   4.4978   72.514   27.986   99.048   28.272 -26.53401 39.78097 
1 1 1   32   19    8 o   35.395   17.320  -5.4777   3.1391  -5.7568   4.5830  -5.2310   4.3084   45.697   22.022   44.780   21.523 0.9167404 30.79281 
1 1 1   32   19    9 o   45.768   21.467  -3.0235   3.8002   1.2197   7.5468  -4.4649   4.3985   75.043   33.221   46.826   22.298 28.21617 40.01019 
1 1 1   32   19   10 o   63.161   24.731   2.6050   3.4751  -1.3022   4.9830   6.3048   4.8489   57.541   26.107   84.370   29.939 -26.82866 39.72336 
1 1 1   32   19   11 o  126.822   19.984   13.611   3.7508   10.562   5.4582   16.339   5.1631  104.676   31.496  135.108   25.909 -30.43194 40.78353 
1 1 1   32   19   12 o   55.672   23.797   0.7600   3.5974   1.0026   5.2964   0.5522   4.9015   65.195   28.375   62.013   27.135 3.182159 39.26181 
1 1 1   32   19   13 o   46.023   21.381  -2.3158   3.6250  -6.7427   5.4333   1.2357   4.8665   49.022   23.711   63.827   27.488 -14.80518 36.30188 
1 1 1   32   19   14 o   65.001   28.473   0.8653   5.4089   0.8653   5.4089   0.0000   0.0000   65.001   28.473  ?   ?  0.000000 28.47253 
1 1 1   32   19   15 o   57.379   24.291   1.1495   3.6858   5.5902   5.6432  -2.1543   4.8675   81.332   31.606   54.275   25.060 27.05702 40.33565 
1 1 1   32   19   16 o  102.413   26.016   9.6851   4.0862   10.056   5.6880   9.2892   5.8739  100.330   32.465   96.558   33.038 3.772446 46.31937 
1 1 1   32   19   17 o   60.256   25.642   1.3553   4.1434   4.3910   5.7823  -1.8484   5.9402   76.737   31.264   60.226   27.764 16.51121 41.81288 
1 1 1   32   19   18 o   85.703   28.181   6.9132   4.2784   7.9117   5.9025   5.8079   6.2102   89.983   32.888   82.211   32.785 7.771538 46.43788 
1 1 1   32   19   19 o   66.988   26.859   3.1035   4.1920   3.7768   5.9384   2.4348   5.9184   74.632   31.166   70.489   30.336 4.143883 43.49208 
1 1 1   32   20    0 o   66.160   31.553   5.3627   3.6579   5.3627   3.6579   5.3627   3.6579   66.160   31.553   66.160   31.553 0.000000 0.000000 
1 1 1   32   20    1 o  140.865   12.749   15.806   2.7190   10.917   3.5657   22.597   4.2029  112.816   21.433  166.437   16.724 -53.62119 27.18618 
1 1 1   32   20    2 o   76.178   24.212   5.0248   3.1746   5.0248   3.1746   0.0000   0.0000   76.178   24.212  ?   ?  0.000000 24.21237 
1 1 1   32   20    3 o   52.188   20.369   1.6078   2.3516   2.2315   2.8594   0.3044   4.1337   58.512   22.565   57.471   25.040 1.041508 33.70721 
1 1 1   32   20    4 o   48.904   19.018   1.3958   2.0443   2.7920   2.3153  -3.5435   4.3548   59.657   20.725   48.447   22.805 11.20968 30.81565 
1 1 1   32   20    5 o   37.931   16.510  -0.1322   1.7933  -0.3757   1.9658   1.0748   4.3770   38.522   17.009   61.335   26.234 -22.81391 31.26530 
1 1 1   32   20    6 o  105.400   20.619   9.5148   3.2073   5.1953   4.3440   14.691   4.7555   78.341   28.278  128.705   25.041 -50.36395 37.77161 
1 1 1   32   20    7 o   80.803   24.370   5.7810   3.2650   6.1333   4.6021   5.4239   4.6329   83.170   29.201   79.811   29.142 3.359131 41.25515 
1 1 1   32   20    8 o  138.982   16.456   15.837   3.4328   18.165   4.7918   13.383   4.9201  145.220   22.268  120.953   27.232 24.26691 35.17762 
1 1 1   32   20    9 o   48.958   22.591  -2.0852   3.9466  -8.5467   7.4084   0.4751   4.6634   56.767   27.513   60.572   26.487 -3.805012 38.19083 
1 1 1   32   20   10 o   41.060   19.494  -3.3553   3.3125  -0.2385   4.7885  -6.2154   4.5871   59.021   26.278   44.657   21.645 14.36437 34.04449 
1 1 1   32   20   11 f  136.393   18.668   15.595   3.7950   16.952   5.4903   14.353   5.2515  136.014   27.321  124.113   28.275 11.90034 39.31793 
1 1 1   32   20   12 o   59.234   24.453   1.7105   3.5960   4.8247   5.4143  -0.7474   4.8100   78.087   30.778   57.546   25.921 20.54150 40.23946 
1 1 1   32   20   13 o  159.945   24.587   22.724   5.8267   22.724   5.8267   0.0000   0.0000  159.945   24.587  ?   ?  0.000000 24.58722 
1 1 1   32   20   14 o   86.664   26.606   6.9488   3.8680   7.9237   5.6893   6.1109   5.2745   90.617   32.401   82.629   30.927 7.988335 44.79147 
1 1 1   32   20   15 o  175.283   16.855   25.382   4.4664   30.655   6.2656   19.934   6.3686  187.929   22.212  144.523   29.780 43.40594 37.15125 
1 1 1   32   20   16 o   53.827   24.155  -0.5696   4.1327   5.7771   5.6643  -7.7937   6.0431   81.353   31.651   50.360   24.509 30.99318 40.03122 
1 1 1   32   20   17 o  123.312   24.210   13.719   4.4064   13.692   6.0059   13.750   6.4850  116.013   32.516  114.518   34.303 1.494522 47.26463 
1 1 1   32   21    0 o  141.925   21.727   17.157   4.3912   17.157   4.3912   17.157   4.3912  141.925   21.727  141.925   21.727 0.000000 0.000000 
1 1 1   32   21    1 o   48.651   22.229  -1.5651   3.6937  -1.5651   3.6937   0.0000   0.0000   48.651   22.229  ?   ?  0.000000 22.22882 
1 1 1   32   21    2 o   64.478   22.647   3.3389   2.7682   5.8822   3.4988  -0.9178   4.5263   81.222   25.366   55.786   25.136 25.43586 35.71037 
1 1 1   32   21    3 o  100.483   18.803   8.5448   2.7857   10.127   3.4528   5.5952   4.7146  108.073   21.628   80.525   29.399 27.54741 36.49752 
1 1 1   32   21    4 o   60.982   20.316   3.0403   2.2209   1.6325   2.5181   7.9707   4.7124   53.138   20.975   92.236   29.519 -39.09820 36.21203 
1 1 1   32   21    5 o   48.039   19.139   1.2029   2.1147  -0.1896   2.3496   7.1406   4.8518   42.835   18.765   87.893   30.027 -45.05813 35.40762 
1 1 1   32   21    6 o   78.724   17.066   5.2256   1.9971   3.0389   2.1702   17.317   5.1032   60.810   20.074  139.651   24.782 -78.84087 31.89187 
1 1 1   32   21    7 o  158.482   9.1477   19.655   2.2096   22.386   2.4264   6.3895   5.3478  169.059   9.4142   84.538   31.239 84.52061 32.62677 
1 1 1   32   21    8 o   76.490   28.347   4.9170   4.4098   10.174   8.3169   2.8611   5.2012   99.773   38.482   70.424   29.267 29.34879 48.34731 
1 1 1   32   21    9 o   39.829   19.116  -4.0816   3.3727  -7.5683   4.4835   0.4634   5.1189   41.747   20.484   62.434   27.513 -20.68717 34.30142 
1 1 1   32   21   10 o  140.997   18.040   16.607   3.8041   17.486   5.1255   15.529   5.6761  139.810   24.862  127.700   29.615 12.11027 38.66742 
1 1 1   32   21   11 o  116.970   22.279   12.009   3.8431   16.418   5.3499   7.3072   5.5244  133.407   27.124   88.002   31.870 45.40482 41.84964 
1 1 1   32   21   12 o   51.112   24.475  -5.3358   5.4576  -5.3358   5.4576   0.0000   0.0000   51.112   24.475  ?   ?  0.000000 24.47487 
1 1 1   32   21   13 o   70.486   26.673   3.9807   3.9467  -0.7461   5.5644   8.7660   5.5987   60.942   27.626   94.074   32.254 -33.13182 42.46799 
1 1 1   32   21   14 o  105.768   25.434   10.307   4.0671   12.835   5.7254   7.7316   5.7784  113.143   31.760   89.281   32.554 23.86274 45.48083 
1 1 1   32   22    1 o   91.091   22.506   7.3539   3.1197   5.8437   4.2283   9.1584   4.6218   80.789   28.011   98.290   28.839 -17.50064 40.20389 
1 1 1   32   22    2 o   97.788   21.697   8.3817   3.1626   8.0478   4.1756   8.8309   4.8435   92.928   27.453   96.095   29.818 -3.166832 40.53144 
1 1 1   32   22    3 o   53.116   22.205   1.0464   3.0193  -5.6206   3.8532   11.652   4.8598   40.505   19.680  111.156   28.446 -70.65098 34.58999 
1 1 1   32   22    4 o   33.533   16.412  -4.9097   2.8226  -5.9575   3.5055  -2.9778   4.7598   37.289   18.259   51.802   24.210 -14.51270 30.32337 
1 1 1   32   22    5 o   73.171   21.278   4.6750   2.5261   6.1367   2.9399   0.5515   4.9378   83.095   22.543   61.769   27.127 21.32606 35.27076 
1 1 1   32   22    6 o   67.704   21.690   3.9287   2.5437   6.3224   2.9577  -2.8715   4.9851   84.305   22.501   53.293   24.863 31.01245 33.53292 
1 1 1   32   22    7 o   35.711   16.797  -2.1394   2.3542  -0.0149   2.6626  -9.7504   5.0396   45.981   20.063   42.263   20.922 3.718056 28.98697 
1 1 1   32   22    8 o   56.866   19.494   2.5895   2.0450   1.6904   2.2136   7.8286   5.3433   51.444   19.850   90.233   31.477 -38.78947 37.21358 
1 1 1   32   22    9 o   80.909   15.659   5.4683   1.8691   6.2932   1.9993  -0.2541   5.2659   86.968   15.592   60.859   27.292 26.10980 31.43171 
1 1 1   32   22   10 o   67.691   25.592   3.5809   3.6311   5.6617   4.9166   1.0842   5.3856   80.030   29.878   64.985   28.440 15.04504 41.24900 
1 1 1   32   22   11 o   85.059   26.015   6.6895   3.7020   2.4215   4.9394   12.160   5.5919   67.308   28.286  110.333   31.534 -43.02550 42.36180 
1 1 1   32   23    0 o   44.673   28.340   1.1859   4.2028   1.1859   4.2028   1.1859   4.2028   44.673   28.340   44.673   28.340 0.000000 0.000000 
1 1 1   32   23    1 o   85.720   28.691   6.8629   4.4287   0.0000   0.0000   6.8629   4.4287  ?   ?    85.720   28.691 0.000000 28.69053 
1 1 1   32   23    2 o   83.164   23.005   6.1978   3.0270   5.1914   4.0154   7.5227   4.6071   76.816   27.246   89.051   29.241 -12.23489 39.96769 
1 1 1   32   23    3 o   40.013   18.733  -2.2675   2.8710  -0.8450   3.7662  -4.2409   4.4359   50.866   22.922   46.982   22.378 3.883881 32.03458 
1 1 1   32   23    4 o   53.743   22.045   1.3787   2.8995   2.0583   3.6767   0.2606   4.7157   60.839   24.875   59.583   26.324 1.256371 36.21759 
1 1 1   32   23    5 o   73.810   22.921   4.8144   2.8614   2.3642   3.5268   9.5339   4.8947   61.495   24.643   99.033   29.832 -37.53860 38.69452 
1 1 1   32   23    6 o   76.375   20.164   5.0998   2.3919   4.9983   2.7370   5.4277   4.9207   75.123   22.236   78.992   29.809 -3.869133 37.18882 
1 1 1   33    0    1 o   45.001   25.699   2.1484   2.7830   2.1484   2.7830   2.1484   2.7830   45.001   25.699   45.001   25.699 0.000000 0.000000 
1 1 1   33    0    2 o   47.458   26.189   2.5378   2.7693   2.5378   2.7693   2.5378   2.7693   47.458   26.189   47.458   26.189 0.000000 0.000000 
1 1 1   33    0    3 o  165.060   12.722   21.443   3.1702   21.443   3.1702   21.443   3.1702  165.060   12.722  165.060   12.722 0.000000 0.000000 
1 1 1   33    0    4 o  192.413   11.217   28.861   3.2779   28.861   3.2779   28.861   3.2779  192.413   11.217  192.413   11.217 0.000000 0.000000 
1 1 1   33    0    5 o  226.594   12.928   40.122   4.4505   40.122   4.4505   40.122   4.4505  226.594   12.928  226.594   12.928 0.000000 0.000000 
1 1 1   33    0    6 o  157.611   10.645   19.416   2.5410   19.416   2.5410   19.416   2.5410  157.611   10.645  157.611   10.645 0.000000 0.000000 
1 1 1   33    0    7 o  253.911   8.0558   49.713   3.1237   49.713   3.1237   49.713   3.1237  253.911   8.0558  253.911   8.0558 0.000000 0.000000 
1 1 1   33    0    8 o   60.803   24.951   4.0803   2.2933   4.0803   2.2933   4.0803   2.2933   60.803   24.951   60.803   24.951 0.000000 0.000000 
1 1 1   33    0    9 o   83.917   20.424   6.3787   2.2731   6.3787   2.2731   6.3787   2.2731   83.917   20.424   83.917   20.424 0.000000 0.000000 
1 1 1   33    0   10 f  208.138   9.0378   33.539   2.8669   33.539   2.8669   33.539   2.8669  208.138   9.0378  208.138   9.0378 0.000000 0.000000 
1 1 1   33    0   11 o  135.262   12.040   14.479   2.4473   14.479   2.4473   14.479   2.4473  135.262   12.040  135.262   12.040 0.000000 0.000000 
1 1 1   33    0   12 o  145.311   11.309   16.606   2.4803   16.606   2.4803   16.606   2.4803  145.311   11.309  145.311   11.309 0.000000 0.000000 
1 1 1   33    0   13 o  277.899   12.015   60.098   5.0888   60.098   5.0888   60.098   5.0888  277.899   12.015  277.899   12.015 0.000000 0.000000 
1 1 1   33    0   14 o  103.380   31.346   10.637   4.3287   10.637   4.3287   10.637   4.3287  103.380   31.346  103.380   31.346 0.000000 0.000000 
1 1 1   33    0   15 o  112.182   29.106   11.880   4.3190   11.880   4.3190   11.880   4.3190  112.182   29.106  112.182   29.106 0.000000 0.000000 
1 1 1   33    0   16 o   53.515   30.927   3.1587   4.1036   3.1587   4.1036   3.1587   4.1036   53.515   30.927   53.515   30.927 0.000000 0.000000 
1 1 1   33    0   17 o   51.273   30.190   2.7411   4.0315   2.7411   4.0315   2.7411   4.0315   51.273   30.190   51.273   30.190 0.000000 0.000000 
1 1 1   33    0   18 o   97.639   35.510   10.409   4.8816   10.409   4.8816   10.409   4.8816   97.639   35.510   97.639   35.510 0.000000 0.000000 
1 1 1   33    0   20 o   32.671   22.596  -2.6945   3.8474  -2.6945   3.8474  -2.6945   3.8474   32.671   22.596   32.671   22.596 0.000000 0.000000 
1 1 1   33    0   21 o   31.456   21.895  -3.0499   3.7658  -3.0499   3.7658  -3.0499   3.7658   31.456   21.895   31.456   21.895 0.000000 0.000000 
1 1 1   33    0   22 o   92.103   32.507   9.1166   4.1635   9.1166   4.1635   9.1166   4.1635   92.103   32.507   92.103   32.507 0.000000 0.000000 
1 1 1   33    0   23 o  124.408   24.766   13.786   4.1875   13.786   4.1875   13.786   4.1875  124.408   24.766  124.408   24.766 0.000000 0.000000 
1 1 1   33    0   24 o   87.062   45.216   10.748   7.8153   10.748   7.8153   10.748   7.8153   87.062   45.216   87.062   45.216 0.000000 0.000000 
1 1 1   33    0   25 o   64.445   40.125   4.5006   8.0106   4.5006   8.0106   4.5006   8.0106   64.445   40.125   64.445   40.125 0.000000 0.000000 
1 1 1   33    0   26 o   28.834   20.430  -4.3037   3.7507  -4.3037   3.7507  -4.3037   3.7507   28.834   20.430   28.834   20.430 0.000000 0.000000 
1 1 1   33    0   27 o   32.995   22.718  -2.2052   3.7860  -2.2052   3.7860  -2.2052   3.7860   32.995   22.718   32.995   22.718 0.000000 0.000000 
1 1 1   33    0   28 o   43.687   27.604   1.2703   3.9431   1.2703   3.9431   1.2703   3.9431   43.687   27.604   43.687   27.604 0.000000 0.000000 
1 1 1   33    0   29 o  102.498   30.614   10.763   4.1823   10.763   4.1823   10.763   4.1823  102.498   30.614  102.498   30.614 0.000000 0.000000 
1 1 1   33    1    0 o   55.747   27.615   3.6746   2.8388   3.6746   2.8388   3.6746   2.8388   55.747   27.615   55.747   27.615 0.000000 0.000000 
1 1 1   33    1    1 o  150.012   9.7008   17.511   2.2155   15.667   3.1649   19.283   3.1024  140.249   14.975  156.429   13.077 -16.18047 19.88100 
1 1 1   33    1    2 o  113.493   12.144   10.161   2.0769   7.4604   2.9858   12.693   2.8909   94.227   21.214  125.969   15.308 -31.74276 26.16017 
1 1 1   33    1    3 o  103.586   15.191   8.6292   2.3370   8.6608   2.9203   8.5730   3.8973  102.347   19.351   99.701   25.452 2.646156 31.97241 
1 1 1   33    1    4 o  148.404   9.5002   17.130   2.1467   16.275   3.0443   17.975   3.0274  143.276   14.063  150.923   13.239 -7.647461 19.31438 
1 1 1   33    1    5 o   81.930   13.720   5.4010   1.6597   5.9315   2.3764   4.8958   2.3191   84.470   18.858   76.544   19.684 7.926102 27.25893 
1 1 1   33    1    6 o  133.515   9.1329   13.863   1.8552   15.401   2.8789   12.770   2.4261  139.450   13.663  127.189   12.629 12.26152 18.60601 
1 1 1   33    1    7 o  152.276   8.3386   17.971   1.9362   20.611   3.1165   16.311   2.4708  161.832   12.683  144.293   11.277 17.53844 16.97149 
1 1 1   33    1    8 o   56.387   17.431   2.5482   1.6569   2.3129   2.5729   2.7149   2.1659   58.459   21.655   59.364   20.063 -0.9046440 29.52065 
1 1 1   33    1    9 o  260.483   7.0388   52.299   2.8064   52.276   3.7667   52.328   4.2075  259.677   9.4766  259.389   10.597 0.2881470 14.21657 
1 1 1   33    1   10 o   81.902   20.826   5.6610   2.6167   9.4332   3.9677   2.7575   3.4810  104.393   25.133   65.220   24.961 39.17273 35.42213 
1 1 1   33    1   11 o   70.008   17.956   4.0774   1.9334   4.7731   4.1019   3.8787   2.1922   77.575   27.536   68.334   19.808 9.241096 33.92040 
1 1 1   33    1   12 o   94.942   13.910   7.2382   1.9614   4.0694   4.2937   8.0739   2.2049   74.569   27.905  100.063   14.847 -25.49375 31.60862 
1 1 1   33    1   13 o   67.271   18.197   3.7667   1.9189   1.5554   4.4134   4.2822   2.1309   64.446   26.886   71.512   19.105 -7.066193 32.98267 
1 1 1   33    1   14 o  142.481   9.4697   15.827   2.0534   12.014   4.6341   16.759   2.2906  116.930   26.504  146.394   10.288 -29.46391 28.43059 
1 1 1   33    1   15 o   44.860   19.871  -0.5696   2.7044  -0.4892   4.5969  -0.6122   3.3445   58.507   25.913   49.803   22.078 8.703499 34.04251 
1 1 1   33    1   16 o   90.743   20.275   6.9747   2.7451   3.7541   4.8119   8.5285   3.3423   74.370   29.106   99.644   22.452 -25.27403 36.75985 
1 1 1   33    1   17 o   49.461   21.364   0.1078   2.9571   3.6809   4.7847  -2.1007   3.7616   73.823   28.985   48.217   22.178 25.60594 36.49699 
1 1 1   33    1   18 o   60.229   22.350   2.5610   2.7431   2.2979   4.6504   2.7014   3.3970   67.739   27.868   63.895   24.608 3.844318 37.17768 
1 1 1   33    1   19 o   73.585   23.591   4.5832   3.0087  -1.3148   5.5617   7.0233   3.5774   61.232   27.700   89.170   25.131 -27.93871 37.40173 
1 1 1   33    1   20 o   55.960   23.160   1.2388   3.2378   5.2027   7.3889   0.2968   3.6021   85.887   35.207   54.468   23.553 31.41932 42.35854 
1 1 1   33    1   21 o  125.668   19.208   13.196   3.5774  -3.9463   7.8922   17.629   4.0134   66.505   31.111  146.054   18.358 -79.54913 36.12395 
1 1 1   33    1   22 o   74.521   25.528   4.7017   3.5069   15.011   7.9121   2.1810   3.9122  120.006   38.233   63.320   25.748 56.68563 46.09433 
1 1 1   33    1   23 f   52.157   21.555   1.0920   2.7986  -3.1878   4.1369   4.7034   3.8002   47.631   22.359   74.733   26.506 -27.10268 34.67726 
1 1 1   33    1   24 o   34.810   16.797  -3.7261   2.6868   0.0277   4.0653  -6.6376   3.5803   55.719   24.538   36.791   18.103 18.92794 30.49334 
1 1 1   33    1   25 o   88.737   20.695   6.8801   2.7593   6.0031   4.2023   7.5448   3.6584   81.325   27.941   90.712   25.361 -9.386688 37.73434 
1 1 1   33    1   26 o   52.805   21.360   1.4707   2.6766  -0.6515   3.9847   3.2154   3.6130   52.705   23.681   65.742   25.362 -13.03671 34.69861 
1 1 1   33    1   27 o  122.097   20.530   12.934   3.7006   11.952   4.1276   16.960   8.3541  114.650   24.277  121.001   39.359 -6.351234 46.24384 
1 1 1   33    1   28 o   69.995   23.001   4.3286   2.8504   4.6380   4.0775   4.0329   3.9863   73.200   27.232   70.121   26.741 3.079018 38.16672 
1 1 1   33    1   29 o   99.113   19.990   8.6172   2.9279   11.954   4.1647   5.3567   4.1170  113.706   24.641   76.488   27.540 37.21784 36.95441 
1 1 1   33    2    0 o   97.376   22.677   8.5245   2.9391   8.5245   2.9391   8.5245   2.9391   97.376   22.677   97.376   22.677 0.000000 0.000000 
1 1 1   33    2    1 o   76.152   18.041   4.8074   2.0706   5.5943   2.9464   4.0395   2.9106   81.392   22.761   70.820   23.241 10.57232 32.53050 
1 1 1   33    2    2 f  110.367   15.027   9.7658   2.4725   10.997   2.9939   7.1255   4.3846  116.412   17.331   90.996   28.392 25.41522 33.26381 
1 1 1   33    2    3 o   61.900   19.357   3.0840   2.0367   0.5309   2.8470   5.7601   2.9147   50.906   21.438   82.541   22.468 -31.63509 31.05508 
1 1 1   33    2    4 o   82.822   14.820   5.5561   1.8097   6.3779   2.9406   5.0551   2.2960   86.814   22.079   77.827   19.355 8.987534 29.36152 
1 1 1   33    2    5 o   67.229   16.438   3.7246   1.6773   2.3754   2.4566   4.9030   2.2958   58.326   21.232   76.614   19.521 -18.28849 28.84263 
1 1 1   33    2    6 o  233.762   6.6801   42.080   2.3902   45.601   3.1696   37.438   3.6392  242.874   8.5263  219.389   10.837 23.48460 13.78933 
1 1 1   33    2    7 o  139.913   8.7476   15.200   1.8639   15.160   2.9211   15.227   2.4208  138.203   14.002  139.331   11.453 -1.128311 18.08930 
1 1 1   33    2    8 o   64.262   18.470   3.3997   1.9133  -0.1569   3.9363   4.4999   2.1893   55.849   24.381   73.422   19.246 -17.57353 31.06199 
1 1 1   33    2    9 o   83.675   15.631   5.7094   1.9284   8.2994   4.0734   4.9612   2.1892   97.526   26.567   77.113   18.733 20.41330 32.50732 
1 1 1   33    2   10 o   97.816   13.087   7.6294   1.9102   9.6438   4.2155   7.1089   2.1429  105.092   26.276   93.622   15.496 11.47000 30.50479 
1 1 1   33    2   11 o   49.033   18.137   1.5784   1.8036  -6.7288   4.1306   3.5352   2.0047   41.415   20.179   65.394   18.938 -23.97913 27.67423 
1 1 1   33    2   12 o  131.852   9.5845   13.561   1.9211   15.686   4.5436   13.099   2.1199  136.540   22.526  129.238   10.816 7.302185 24.98812 
1 1 1   33    2   13 o  140.127   8.6243   15.259   1.8408   7.7979   4.7317   16.589   1.9982   93.863   29.529  146.038   8.9827 -52.17467 30.86498 
1 1 1   33    2   14 o   59.958   16.286   2.9650   1.5333   8.4138   4.6595   2.3033   1.6238   97.026   29.079   53.948   17.334 43.07724 33.85385 
1 1 1   33    2   15 o   76.613   13.470   4.7516   1.5219   8.6851   4.9139   4.3342   1.6006   98.087   29.968   72.704   14.884 25.38277 33.46042 
1 1 1   33    2   16 o   45.109   16.701   1.3281   1.5299   6.3597   4.9878   0.8056   1.6074   86.280   30.392   41.861   16.684 44.41858 34.67026 
1 1 1   33    2   17 o   83.084   12.714   5.5470   1.5654   3.9698   5.0965   5.7113   1.6449   76.004   29.892   84.182   13.200 -8.178177 32.67644 
1 1 1   33    2   18 o   44.644   19.354  -0.0464   2.4446   6.5400   5.1139  -1.9973   2.7832   86.919   30.757   40.549   18.802 46.36948 36.04883 
1 1 1   33    2   19 f   70.938   22.655   4.2285   2.7767   0.1704   7.1603   4.9468   3.0125   72.049   32.101   75.974   23.506 -3.924782 39.78753 
1 1 1   33    2   20 o   84.065   20.723   6.0651   2.6495   4.8763   4.9862   6.5328   3.1276   78.901   29.951   86.470   23.164 -7.568939 37.86367 
1 1 1   33    2   21 o   38.454   17.929  -2.0532   2.5860  -2.1208   4.9245  -2.0275   3.0386   55.445   25.456   42.524   19.692 12.92039 32.18392 
1 1 1   33    2   22 o   74.020   22.121   4.7293   2.6991   2.5559   4.8133   5.7263   3.2599   68.634   28.307   80.633   24.359 -11.99988 37.34515 
1 1 1   33    2   23 o   89.045   20.172   6.8312   2.6856   7.1694   4.4187   6.6331   3.3819   88.316   28.618   86.092   24.495 2.223541 37.66954 
1 1 1   33    2   24 o   53.008   21.308   1.4875   2.6458   0.8440   4.3551   1.8639   3.3309   59.962   25.913   58.626   23.788 1.336685 35.17625 
1 1 1   33    2   25 o   53.440   21.384   1.5946   2.6512   4.2354   4.3108  -0.0119   3.3623   72.778   27.796   50.996   22.390 21.78124 35.69216 
1 1 1   33    2   26 o   49.138   20.661   0.7776   2.6373  -6.0848   4.1251   5.5215   3.4298   41.444   20.187   78.128   25.202 -36.68333 32.29057 
1 1 1   33    2   27 o   43.482   19.411  -0.5256   2.6317  -1.0908   3.9872  -0.0892   3.5032   51.243   23.289   51.300   22.676 -0.5762863E-01 32.50513 
1 1 1   33    2   28 o   45.475   19.901  -0.0007   2.6371  -2.0339   4.0271   1.5258   3.4892   48.809   22.627   57.108   23.872 -8.298958 32.89137 
1 1 1   33    2   29 o   72.036   27.264   4.4472   4.1241   4.4472   4.1241   0.0000   0.0000   72.036   27.264  ?   ?  0.000000 27.26443 
1 1 1   33    3    0 o   35.094   24.609  -4.8225   5.0114  -4.8225   5.0114  -4.8225   5.0114   35.094   24.609   35.094   24.609 0.000000 0.000000 
1 1 1   33    3    1 o   86.754   16.955   6.1700   2.1707   6.8113   3.0509   5.5125   3.0890   89.668   22.318   80.812   23.539 8.855598 32.43692 
1 1 1   33    3    2 o   64.201   19.682   3.3512   2.1176   3.1435   2.9921   3.5597   2.9974   65.442   23.487   67.984   23.584 -2.541252 33.28391 
1 1 1   33    3    3 o  103.790   13.960   8.6025   2.1616   6.2218   2.9709   11.280   3.1508   85.693   22.399  117.623   18.080 -31.93044 28.78572 
1 1 1   33    3    4 o  106.985   12.623   9.0669   2.0272   8.8233   3.0176   9.2672   2.7367  103.107   19.841  106.643   17.363 -3.536224 26.36569 
1 1 1   33    3    5 o   55.196   17.573   2.4067   1.6717   2.1757   2.5823   2.5733   2.1932   57.714   21.632   58.467   20.180 -0.7526207 29.58319 
1 1 1   33    3    6 o  150.378   9.0950   17.569   2.0836   16.988   4.2463   17.753   2.3912  143.974   19.792  150.817   10.423 -6.842468 22.36892 
1 1 1   33    3    7 o   58.584   18.747   2.7266   1.9007   0.4008   4.0854   3.3691   2.1472   58.738   25.240   64.334   19.835 -5.595669 32.10125 
1 1 1   33    3    8 o   87.374   16.052   6.2292   2.0676   3.2912   5.6812   6.6778   2.2198   76.696   31.086   90.343   16.667 -13.64735 35.27176 
1 1 1   33    3    9 o  136.387   9.5299   14.492   1.9770   14.129   4.4652   14.581   2.2048  129.218   23.439  136.512   10.636 -7.293762 25.73961 
1 1 1   33    3   10 o   89.339   23.671   6.8518   3.2886   11.338   4.4800   1.6094   4.8428  114.075   26.208   67.001   28.075 47.07428 38.40678 
1 1 1   33    3   11 o  143.406   16.405   16.567   3.5362   15.669   4.7755   17.656   5.2617  135.823   23.841  143.806   24.800 -7.983597 34.40111 
1 1 1   33    3   12 o   87.586   24.648   6.6282   3.4439   5.8303   4.7061   7.5481   5.0531   83.940   29.526   92.765   30.632 -8.824257 42.54557 
1 1 1   33    3   13 o  116.154   22.268   11.430   3.8149   11.721   5.0404   11.040   5.8369  114.370   28.808  109.417   32.491 4.952911 43.42321 
1 1 1   33    3   14 o   81.197   26.498   5.6069   3.7853   7.0927   5.0655   3.7279   5.6963   90.217   30.681   77.573   31.237 12.64418 43.78459 
1 1 1   33    3   15 o  128.094   21.573   13.819   4.0794   14.886   5.2841   12.244   6.4182  129.619   27.486  113.735   34.138 15.88326 43.82843 
1 1 1   33    3   16 o   58.306   26.374  -1.4490   5.0405  -1.4490   5.0405   0.0000   0.0000   58.306   26.374  ?   ?  0.000000 26.37433 
1 1 1   33    3   17 o   46.254   21.706  -3.2538   3.8941 -11.2053   5.1267   7.5904   5.9871   41.734   20.736   92.629   33.226 -50.89502 39.16532 
1 1 1   33    3   18 o   56.654   24.658   0.1690   3.9995  -1.3860   5.4026   2.0545   5.9491   60.292   27.286   72.314   30.748 -12.02233 41.10909 
1 1 1   33    3   19 o   53.700   23.832  -0.5289   3.9079   2.8880   5.3745  -4.3623   5.6926   72.602   29.924   55.332   26.054 17.27025 39.67722 
1 1 1   33    3   20 o  104.496   29.575   10.112   4.9436   12.132   7.6780   8.6822   6.4611  110.019   37.769   96.651   34.532 13.36726 51.17588 
1 1 1   33    3   21 o   84.485   27.965   6.3403   4.2107   5.2168   5.4980   7.9340   6.5482   81.137   31.290   93.296   34.550 -12.15910 46.61274 
1 1 1   33    3   22 o   94.396   14.621   7.2686   2.0443   1.0558   5.2146   8.3968   2.2222   65.323   28.292  101.547   14.726 -36.22370 31.89559 
1 1 1   33    3   23 o  170.649   9.7179   22.825   2.5278   28.048   5.2739   21.267   2.8802  183.402   19.066  163.906   11.554 19.49570 22.29370 
1 1 1   33    3   24 o   43.867   18.769   0.2557   2.2420   3.3366   4.7574  -0.6238   2.5419   70.608   28.506   42.661   19.058 27.94732 34.29030 
1 1 1   33    3   25 o   64.021   26.925   1.9446   4.4809   1.9446   4.4809   0.0000   0.0000   64.021   26.925  ?   ?  0.000000 26.92505 
1 1 1   33    3   26 o   63.401   21.133   3.3868   2.4029   1.7352   4.6279   3.9965   2.8116   63.624   27.088   68.160   22.860 -4.535503 35.44477 
1 1 1   33    3   27 o   53.794   20.793   1.9288   2.4321   2.2982   4.4503   1.7715   2.9041   64.581   26.975   55.382   22.303 9.199203 35.00098 
1 1 1   33    3   28 o   65.315   21.529   3.6878   2.4966   7.9898   4.2791   1.4678   3.0740   90.755   28.005   54.664   22.591 36.09113 35.98071 
1 1 1   33    3   29 o   68.370   22.347   4.1325   2.6920   0.1840   4.1606   6.9759   3.5306   55.605   24.638   86.077   25.192 -30.47157 35.23755 
1 1 1   33    4    0 o   61.440   28.787   4.4327   3.0307   4.4327   3.0307   4.4327   3.0307   61.440   28.787   61.440   28.787 0.000000 0.000000 
1 1 1   33    4    1 o   43.412   18.497   0.1531   2.1612   1.1923   3.1063  -0.8217   3.0087   55.728   22.834   46.759   20.823 8.968880 30.90263 
1 1 1   33    4    2 o   76.602   24.788   4.8353   3.3160   8.4610   6.0885   3.3063   3.9539   98.521   33.637   70.134   26.660 28.38713 42.92028 
1 1 1   33    4    3 o   44.037   18.245   0.5309   2.0122   6.4385   6.1827  -0.1690   2.1281   90.188   33.537   41.538   18.032 48.65091 38.07769 
1 1 1   33    4    4 o  117.349   12.217   10.866   2.1622  -0.7119   6.4842   12.315   2.2935   68.699   30.583  125.022   12.138 -56.32300 32.90366 
1 1 1   33    4    5 o   98.765   13.234   7.7733   1.9503   15.007   4.2239   5.8132   2.1987  134.530   21.216   83.898   17.679 50.63186 27.61665 
1 1 1   33    4    6 o   33.853   15.456  -1.0676   1.7815   5.6269   4.1086  -2.6177   1.9771   82.346   27.634   30.810   14.747 51.53606 31.32275 
1 1 1   33    4    7 o   53.504   22.144   0.9430   2.9598  -1.6447   4.1570   3.6037   4.2152   52.752   23.899   72.399   27.525 -19.64667 36.45234 
1 1 1   33    4    8 o  207.235   11.384   33.582   3.5973   28.617   4.8239   39.802   5.3994  188.847   16.866  223.481   15.888 -34.63429 23.17086 
1 1 1   33    4    9 o  164.531   16.056   21.685   3.9919   22.974   6.2537   20.800   5.1859  163.995   25.763  158.098   22.029 5.896942 33.89688 
1 1 1   33    4   10 o  148.473   15.424   17.641   3.4541   16.324   4.6422   19.275   5.1700  139.447   22.516  151.459   23.026 -12.01199 32.20553 
1 1 1   33    4   11 o   66.846   25.016   3.1255   3.4507   6.5535   4.6202  -1.1990   5.1892   87.490   29.304   60.254   27.052 27.23642 39.88130 
1 1 1   33    4   12 o   76.786   25.895   4.8563   3.6080   6.1008   4.8838   3.3609   5.3533   85.480   30.077   75.258   30.290 10.22231 42.68635 
1 1 1   33    4   13 o  129.840   19.804   13.962   3.8112   9.2888   5.1228   19.755   5.7037  101.334   30.518  151.486   25.505 -50.15206 39.77237 
1 1 1   33    4   14 o   67.755   28.843   1.3880   5.2459   1.3880   5.2459   0.0000   0.0000   67.755   28.843  ?   ?  0.000000 28.84311 
1 1 1   33    4   15 o   70.366   29.489   2.1012   5.3440   2.1012   5.3440   0.0000   0.0000   70.366   29.489  ?   ?  0.000000 29.48886 
1 1 1   33    4   16 o   63.525   26.027   1.9199   4.0355   0.6556   5.4772   3.4211   5.9685   66.342   28.865   76.991   31.611 -10.64832 42.80667 
1 1 1   33    4   17 o   75.806   27.357   4.6049   4.0652   6.7288   5.6644   2.3491   5.8377   88.553   32.240   72.898   30.699 15.65572 44.51841 
1 1 1   33    4   18 o   45.388   21.435  -3.6340   3.9053  -4.5503   5.4529  -2.6691   5.5956   53.663   25.339   58.325   26.909 -4.662617 36.96101 
1 1 1   33    4   19 o   95.110   27.281   8.1572   4.1781   7.2069   5.8106   9.1744   6.0119   90.297   32.688   98.929   33.426 -8.632645 46.75239 
1 1 1   33    4   20 o  106.481   29.433   10.507   4.9573   13.534   8.2010   8.7641   6.2228  114.678   39.039   96.807   33.958 17.87135 51.74151 
1 1 1   33    4   21 o  105.267   26.042   9.9766   4.1730   19.817   5.6494  -1.8390   6.1906  149.960   25.527   62.734   28.707 87.22528 38.41499 
1 1 1   33    4   22 o   66.536   26.526   2.8183   4.0641   4.5430   5.3500   0.4651   6.2493   77.681   30.602   68.106   30.186 9.574905 42.98484 
1 1 1   33    4   23 o   68.016   26.720   3.2198   4.0679  -4.1326   5.1147   15.877   6.7109   51.735   24.462  125.957   34.012 -74.22176 41.89521 
1 1 1   33    4   24 o   98.797   11.884   7.8203   1.7611   12.860   4.9645   7.0948   1.8836  117.195   28.049   93.410   13.571 23.78508 31.16013 
1 1 1   33    4   25 o  136.938   11.199   14.893   2.3269   5.7599   4.9447   17.490   2.6371   80.578   29.987  148.218   11.720 -67.63978 32.19539 
1 1 1   33    4   26 o  108.300   14.509   9.6112   2.3446   8.3366   4.8791   9.9940   2.6735   92.397   30.080  109.475   16.465 -17.07797 34.29149 
1 1 1   33    4   27 o  133.396   12.382   14.300   2.4994   10.814   4.9468   15.496   2.8963  104.683   29.570  138.071   13.893 -33.38856 32.67117 
1 1 1   33    4   28 o   91.039   20.031   7.2887   2.7155   7.0326   4.7806   7.4107   3.2995   85.072   29.768   89.736   23.678 -4.664085 38.03703 
1 1 1   33    4   29 o   41.311   19.459  -2.5792   3.1805  -4.3858   4.6384  -0.9761   4.3693   47.333   22.638   53.379   24.306 -6.045902 33.21574 
1 1 1   33    5    0 o   97.212   24.973   8.7524   3.2118   8.7524   3.2118   8.7524   3.2118   97.212   24.973   97.212   24.973 0.000000 0.000000 
1 1 1   33    5    1 o   46.081   19.464   0.3434   2.3580  -0.1644   3.1040   1.0362   3.6259   49.941   21.729   58.338   24.356 -8.396759 32.64042 
1 1 1   33    5    2 o  107.548   18.197   9.4782   2.8886   7.5067   6.1341   10.040   3.2744   94.398   33.655  109.983   20.195 -15.58469 39.24933 
1 1 1   33    5    3 f   50.848   18.783   1.7028   1.9331  -1.1134   6.3564   1.9898   2.0292   67.079   30.040   53.464   19.322 13.61554 35.71771 
1 1 1   33    5    4 o   44.548   17.858   0.8567   1.8526   5.5058   6.3681   0.4269   1.9364   86.951   33.635   42.745   17.819 44.20583 38.06344 
1 1 1   33    5    5 o  128.387   15.685   13.227   3.0182   15.079   4.4241   11.614   4.1280  134.278   22.308  116.782   23.899 17.49551 32.69258 
1 1 1   33    5    6 o  119.576   17.295   11.614   3.0734   13.938   4.4054   9.4106   4.2898  128.484   23.257  103.742   26.819 24.74180 35.49872 
1 1 1   33    5    7 o  115.932   18.278   11.005   3.1359   7.8654   4.3774   14.315   4.4946   94.764   28.137  130.111   23.430 -35.34736 36.61508 
1 1 1   33    5    8 o  213.629   11.003   35.640   3.5855   39.988   4.9164   30.701   5.2404  224.766   14.366  195.111   17.741 29.65477 22.82823 
1 1 1   33    5    9 o  145.032   17.691   17.064   3.8459   12.922   6.0900   19.811   4.9601  118.616   32.556  154.415   21.575 -35.79929 39.05594 
1 1 1   33    5   10 o  129.464   17.251   13.610   3.3333   13.434   4.4897   13.826   4.9758  125.293   24.288  125.877   26.655 -0.5836487 36.06115 
1 1 1   33    5   11 o  184.329   13.132   26.825   3.6810   29.130   4.9034   23.849   5.5718  190.192   17.024  169.148   22.045 21.04396 27.85266 
1 1 1   33    5   12 o   51.995   22.731  -0.1991   3.4328  -1.5053   4.5432   1.5388   5.2403   55.433   25.060   68.398   28.960 -12.96553 38.29755 
1 1 1   33    5   13 o   78.242   29.369   4.6345   4.7633   4.6345   4.7633   0.0000   0.0000   78.242   29.369  ?   ?  0.000000 29.36929 
1 1 1   33    5   14 o  119.556   28.359   12.817   5.1112   12.817   5.1112   0.0000   0.0000  119.556   28.359  ?   ?  0.000000 28.35944 
1 1 1   33    5   15 o  139.344   19.787   16.110   4.1017   14.327   5.3409   18.673   6.4042  126.393   28.310  143.482   30.120 -17.08855 41.33649 
1 1 1   33    5   16 o   87.318   26.877   6.7176   3.9441   2.9590   5.3714   11.115   5.8100   73.202   30.014  108.840   32.438 -35.63770 44.19322 
1 1 1   33    5   17 o   89.116   27.029   7.0529   4.0080   7.0295   5.4112   7.0813   5.9654   89.482   31.641   90.326   33.056 -0.8442383 45.75846 
1 1 1   33    5   18 o   52.934   23.696  -0.8745   3.9509   2.1166   5.3594  -4.4347   5.8472   69.998   29.443   56.094   26.411 13.90389 39.55252 
1 1 1   33    5   19 o   70.706   27.096   3.5934   4.1052   3.7334   5.5125   3.4192   6.1512   75.956   30.678   76.964   31.894 -1.007980 44.25341 
1 1 1   33    5   20 o   62.876   25.978   1.8493   4.0636  -1.9507   5.6913   5.8013   5.8040   60.113   27.514   84.173   32.228 -24.05986 42.37466 
1 1 1   33    5   21 o   51.754   24.223  -3.3402   4.7953  -8.1297   8.5542  -1.1454   5.7906   62.798   30.219   62.281   28.212 0.5174370 41.34110 
1 1 1   33    5   22 o   70.644   27.237   3.6882   4.1649   6.5017   5.5855   0.1646   6.2507   85.815   31.883   67.228   29.970 18.58746 43.75785 
1 1 1   33    5   23 o   91.430   27.758   7.7627   4.2255   10.595   5.2551   2.5807   7.1076  104.689   30.761   75.980   32.970 28.70883 45.09169 
1 1 1   33    5   24 o   50.316   22.980  -1.4683   3.9423  -5.3961   4.8104   6.5665   6.8800   47.295   22.734   86.541   34.509 -39.24614 41.32417 
1 1 1   33    5   25 o  103.631   25.725   9.9215   4.0616   3.4751   5.0269   22.042   6.8929   71.398   29.127  150.939   30.876 -79.54124 42.44659 
1 1 1   33    5   26 o  101.989   21.853   9.2247   3.3087   4.3891   4.8385   13.472   4.5346   74.053   29.125  121.252   25.254 -47.19931 38.54864 
1 1 1   33    5   27 o   87.199   14.854   6.3168   1.9115   10.083   4.8748   5.6324   2.0779  100.881   29.623   81.185   17.254 19.69518 34.28164 
1 1 1   33    5   28 o   46.103   20.810  -0.7907   3.1187  -2.2703   4.7122   0.3625   4.1603   52.250   24.308   56.265   24.799 -4.015339 34.72533 
1 1 1   33    6    1 o  146.966   13.549   17.091   3.0135   19.953   6.5523   16.323   3.3937  150.619   29.477  142.768   15.794 7.851028 33.44158 
1 1 1   33    6    2 o   65.080   22.285   3.2832   2.6725   6.0375   6.4490   2.7122   2.9365   89.066   34.002   62.587   23.144 26.47885 41.13128 
1 1 1   33    6    3 o   61.952   17.530   3.1522   1.7371   7.2808   6.4688   2.8314   1.8033   93.824   34.409   59.214   18.165 34.60984 38.90911 
1 1 1   33    6    4 o   51.380   22.395  -0.1797   3.3097   2.7548   6.6390  -1.1501   3.8179   78.590   32.897   51.818   23.238 26.77201 40.27698 
1 1 1   33    6    5 o   74.351   25.391   4.4355   3.4693   12.113   6.8567   1.7938   4.0221  114.146   35.487   63.603   26.012 50.54315 43.99992 
1 1 1   33    6    6 o   56.018   22.742   1.3653   3.0462  -4.8015   4.4078   7.0032   4.2146   46.997   22.364   89.911   27.801 -42.91412 35.67937 
1 1 1   33    6    7 o   77.475   23.989   5.0427   3.1368   4.4551   4.4347   5.6310   4.4375   76.961   28.446   82.721   28.695 -5.760315 40.40520 
1 1 1   33    6    8 o  151.424   14.589   18.259   3.3394   22.235   4.7465   14.362   4.6992  165.044   19.145  129.567   24.595 35.47705 31.16762 
1 1 1   33    6    9 o  132.724   16.455   14.223   3.2712   12.457   4.4131   16.376   4.8734  120.292   24.793  138.936   23.771 -18.64408 34.34727 
1 1 1   33    6   10 o  156.710   18.031   19.960   4.2461   18.268   6.5217   21.204   5.5942  142.328   30.828  158.329   23.822 -16.00047 38.95984 
1 1 1   33    6   11 o   85.366   24.542   6.2882   3.3777   7.6346   4.4628   4.4827   5.1679   92.997   28.584   78.928   30.365 14.06895 41.70193 
1 1 1   33    6   12 o  185.107   17.376   27.711   4.8655   27.711   4.8655   0.0000   0.0000  185.107   17.376  ?   ?  0.000000 17.37590 
1 1 1   33    6   13 o   49.115   21.959  -0.8976   3.3821  -5.4207   4.5114   4.9063   5.1104   46.276   22.184   80.241   30.355 -33.96480 37.59697 
1 1 1   33    6   14 o   98.575   24.370   8.4811   3.6561   8.8220   4.8423   8.0290   5.5759   98.691   29.659   94.601   32.190 4.089706 43.77072 
1 1 1   33    6   15 o   99.139   25.093   8.6461   3.8111   10.360   5.1190   6.5147   5.7084  106.269   30.102   87.902   32.310 18.36697 44.15964 
1 1 1   33    6   16 o   54.987   23.923   0.1016   3.7621   1.9033   5.1823  -1.9058   5.4703   68.742   28.935   59.484   27.129 9.258057 39.66409 
1 1 1   33    6   17 o  131.556   20.973   14.577   4.0814   13.299   5.5029   16.141   6.0848  120.120   30.015  132.198   30.665 -12.07819 42.90981 
1 1 1   33    6   18 o  119.978   23.206   12.434   4.1074   11.180   5.3761   14.193   6.3661  109.385   30.801  121.698   33.238 -12.31202 45.31478 
1 1 1   33    6   19 o   82.652   27.995   5.9581   4.2172  -0.7439   5.6470   14.409   6.3412   62.869   28.223  122.428   33.063 -59.55980 43.47055 
1 1 1   33    6   20 o  128.351   23.072   14.254   4.3660   11.032   5.8621   18.268   6.5428  107.003   32.738  139.278   31.437 -32.27438 45.38773 
1 1 1   33    6   21 o  189.242   19.652   29.883   5.6093   29.054   8.8599   30.437   7.2466  172.585   34.742  185.291   26.288 -12.70595 43.56688 
1 1 1   33    6   22 o   46.531   21.973  -3.5482   4.1025  -5.7289   5.3309  -0.3810   6.4246   50.150   24.060   66.492   29.954 -16.34271 38.42046 
1 1 1   33    6   23 o   93.736   23.164   7.8324   3.3044   11.722   5.3482   5.4312   4.2024  109.981   30.634   78.662   27.877 31.31882 41.41925 
1 1 1   33    6   24 o   71.245   24.375   4.3702   3.1972   5.2994   4.9934   3.7245   4.1624   78.786   29.957   70.044   27.166 8.741638 40.43990 
1 1 1   33    6   25 o   43.659   20.143  -1.7207   3.1362   1.5633   4.9343  -3.9466   4.0623   64.385   27.704   44.983   21.423 19.40178 35.02063 
1 1 1   33    6   26 o  121.887   27.577   14.070   5.0247   14.070   5.0247   0.0000   0.0000  121.887   27.577  ?   ?  0.000000 27.57727 
1 1 1   33    6   27 o   76.469   26.156   5.3383   3.6816   1.2378   4.8408   10.965   5.6703   62.381   27.139  102.853   32.320 -40.47173 42.20301 
1 1 1   33    6   28 o   55.124   26.518  -5.8437   6.5751  -5.8437   6.5751   0.0000   0.0000   55.124   26.518  ?   ?  0.000000 26.51782 
1 1 1   33    7    0 o  192.795   20.824   30.268   5.9637   30.268   5.9637   30.268   5.9637  192.795   20.824  192.795   20.824 0.000000 0.000000 
1 1 1   33    7    1 o   79.202   29.127   4.7839   4.6399   0.0000   0.0000   4.7839   4.6399  ?   ?    79.202   29.127 0.000000 29.12716 
1 1 1   33    7    2 o  230.350   7.3507   40.926   2.5917   34.616   6.4730   42.131   2.8283  205.434   20.876  233.572   7.9111 -28.13829 22.32427 
1 1 1   33    7    3 o  109.458   21.902   10.095   3.5414   7.6582   6.3580   11.190   4.2641   95.002   34.222  113.926   25.128 -18.92449 42.45679 
1 1 1   33    7    4 o  195.648   13.701   30.235   4.0770   24.734   7.0048   33.054   5.0138  168.757   28.107  203.350   16.244 -34.59308 32.46323 
1 1 1   33    7    5 o  123.155   19.851   12.535   3.6148   18.098   6.7591   10.306   4.2779  141.289   31.997  108.775   26.040 32.51357 41.25428 
1 1 1   33    7    6 o  116.581   18.466   11.154   3.1853   12.160   4.6281   10.249   4.3906  118.183   26.266  108.143   26.688 10.03972 37.44519 
1 1 1   33    7    7 f   49.605   21.612  -0.1644   3.0793  -0.5966   4.4994   0.2165   4.2232   57.895   25.639   58.775   25.459 -0.8794823 36.13184 
1 1 1   33    7    8 o  128.395   17.920   13.450   3.4256   19.737   4.8606   7.2450   4.8287  154.259   21.142   91.198   29.936 63.06064 36.64907 
1 1 1   33    7    9 o  123.707   18.874   12.591   3.4606   12.151   4.6667   13.129   5.1582  117.788   26.523  121.606   28.252 -3.818069 38.75086 
1 1 1   33    7   10 o   46.163   21.695  -3.4525   3.9142 -10.7010   6.4041   0.8703   4.9455   50.158   24.585   64.802   27.806 -14.64379 37.11588 
1 1 1   33    7   11 o  144.589   22.165   17.566   4.7489   17.566   4.7489   0.0000   0.0000  144.589   22.165  ?   ?  0.000000 22.16479 
1 1 1   33    7   12 o   61.029   24.328   2.0344   3.4184   3.4375   4.5709   0.2538   5.1492   72.353   28.354   63.776   27.862 8.577305 39.75231 
1 1 1   33    7   13 o  195.853   19.975   31.604   5.9042   0.0000   0.0000   31.604   5.9042  ?   ?   195.853   19.975 0.000000 19.97481 
1 1 1   33    7   14 o  112.449   21.632   10.739   3.5881   4.9306   4.7527   18.437   5.4717   79.187   29.412  145.748   25.454 -66.56097 38.89701 
1 1 1   33    7   15 o   60.745   24.651   1.8350   3.5776  -0.7729   4.9878   4.5985   5.1343   59.705   26.683   78.611   30.260 -18.90624 40.34371 
1 1 1   33    7   16 o  154.184   17.191   19.367   3.9879   21.649   5.4954   16.828   5.7959  159.386   23.207  136.636   28.630 22.74976 36.85423 
1 1 1   33    7   17 o   85.544   26.304   6.4579   3.7790   3.3013   5.1422   10.165   5.5722   73.277   29.618  104.035   31.933 -30.75847 43.55419 
1 1 1   33    7   18 o   40.171   19.545  -5.9583   3.8360 -10.2252   5.2808  -1.1915   5.5816   43.727   21.604   61.504   27.793 -17.77717 35.20251 
1 1 1   33    7   19 o   47.601   22.239  -2.9344   4.0108  -3.5750   5.3362  -2.1025   6.0807   54.637   25.567   61.756   28.329 -7.118637 38.16022 
1 1 1   33    7   20 o  109.609   25.526   10.761   4.2027   4.1027   5.3443   21.553   6.8035   76.237   30.410  152.470   30.221 -76.23303 42.87241 
1 1 1   33    7   21 o  142.435   17.175   16.710   3.6688   17.722   8.1093   16.450   4.1139  129.626   38.248  139.752   19.785 -10.12668 43.06229 
1 1 1   33    7   22 o  146.305   15.038   17.381   3.3196   17.455   5.2370   17.332   4.2919  139.673   25.434  142.957   20.175 -3.284515 32.46401 
1 1 1   33    7   23 o  110.972   20.342   10.597   3.3279   0.8844   5.0894   17.852   4.3984   63.439   27.708  144.619   20.440 -81.18062 34.43116 
1 1 1   33    7   24 o   58.411   23.542   1.9849   3.2390  -2.9273   5.0402   5.4407   4.2274   53.299   24.911   78.217   27.934 -24.91761 37.42780 
1 1 1   33    7   25 o   89.141   28.068   7.5701   4.2741   12.461   6.8848   4.5034   5.4518  107.605   35.766   75.969   30.570 31.63676 47.05053 
1 1 1   33    7   26 o   59.996   27.985  -2.5120   6.3104  -2.5120   6.3104   0.0000   0.0000   59.996   27.985  ?   ?  0.000000 27.98452 
1 1 1   33    7   27 o   76.039   24.480   5.2786   3.2373   3.8835   4.8708   6.3826   4.3328   71.521   28.855   81.995   28.360 -10.47401 40.45837 
1 1 1   33    7   28 o   52.118   22.543   0.5803   3.3015   6.0804   5.1143  -3.3492   4.3228   80.479   30.385   47.479   22.462 32.99983 37.78645 
1 1 1   33    8    0 f   38.698   26.109  -1.6235   4.4885  -1.6235   4.4885  -1.6235   4.4885   38.698   26.109   38.698   26.109 0.000000 0.000000 
1 1 1   33    8    1 o  238.615   12.389   44.677   4.5094   0.0000   0.0000   44.677   4.5094  ?   ?   238.615   12.389 0.000000 12.38941 
1 1 1   33    8    2 o   94.396   32.750   7.7109   5.7802   7.7109   5.7802   0.0000   0.0000   94.396   32.750  ?   ?  0.000000 32.74987 
1 1 1   33    8    3 o  178.724   24.076   26.898   6.4186   26.898   6.4186   0.0000   0.0000  178.724   24.076  ?   ?  0.000000 24.07591 
1 1 1   33    8    4 o  118.186   32.211   12.790   5.9862   12.790   5.9862   0.0000   0.0000  118.186   32.211  ?   ?  0.000000 32.21080 
1 1 1   33    8    5 o  102.241   23.637   8.9730   3.6251   2.8103   6.0351   12.452   4.5342   76.155   31.577  119.958   25.481 -43.80290 40.57619 
1 1 1   33    8    6 o   37.309   18.238  -6.0514   3.4546  -5.7928   6.0149  -6.1787   4.2201   55.282   26.253   42.990   20.819 12.29136 33.50563 
1 1 1   33    8    7 o  123.946   21.281   12.858   3.8919   21.769   6.5033   7.8850   4.8579  157.808   27.946   94.435   29.944 63.37304 40.95939 
1 1 1   33    8    8 o   65.842   24.640   3.0265   3.3480  -0.2021   4.5032   7.0163   5.0060   59.001   25.909   90.057   30.501 -31.05599 40.01993 
1 1 1   33    8    9 o   78.857   28.763   4.8861   4.5113   4.8861   4.5113   0.0000   0.0000   78.857   28.763  ?   ?  0.000000 28.76278 
1 1 1   33    8   10 o   88.297   24.624   6.7702   3.4534   8.2493   4.6595   4.9674   5.1441   96.093   29.143   80.719   30.474 15.37415 42.16602 
1 1 1   33    8   11 o   58.971   25.142   0.7453   3.9972  -6.6267   6.4901   5.2507   5.0737   56.250   26.868   81.638   30.376 -25.38774 40.55392 
1 1 1   33    8   12 o   81.821   25.005   5.7784   3.4208   1.9186   4.6975   10.136   4.9914   66.838   27.799  105.515   29.667 -38.67709 40.65574 
1 1 1   33    8   13 o   61.849   26.828   0.4610   4.7028   0.0000   0.0000   0.4610   4.7028  ?   ?    61.849   26.828 0.000000 26.82789 
1 1 1   33    8   14 o   34.836   17.211  -6.9340   3.3491  -4.3930   4.6568  -9.6563   4.8202   49.111   23.258   41.678   20.601 7.433353 31.06963 
1 1 1   33    8   15 o  101.337   23.950   8.9690   3.6561   10.432   4.9403   7.1980   5.4361  106.731   29.334   90.269   31.735 16.46179 43.21555 
1 1 1   33    8   16 o   87.374   25.427   6.7371   3.6060   1.8126   4.7799   13.242   5.4937   66.450   27.871  119.786   30.022 -53.33546 40.96451 
1 1 1   33    8   17 o   46.084   21.397  -2.4477   3.6218  -5.1701   4.8861   0.8721   5.3956   48.922   23.353   66.179   28.721 -17.25620 37.01697 
1 1 1   33    8   18 o   75.061   22.843   4.8466   2.8591   10.034   5.0401   2.3852   3.4718  103.760   30.022   62.400   24.630 41.35979 38.83254 
1 1 1   33    8   19 o  171.856   13.713   23.600   3.5772   8.2963   6.8617   29.311   4.1919   94.766   35.313  191.211   14.429 -96.44547 38.14688 
1 1 1   33    8   20 o   94.000   22.781   7.7703   3.2434   12.800   7.0275   6.4090   3.6561  112.152   36.064   84.562   25.852 27.59035 44.37247 
1 1 1   33    8   21 o  170.091   16.369   23.649   4.2089   0.0000   0.0000   23.649   4.2089  ?   ?   170.091   16.369 0.000000 16.36852 
1 1 1   33    8   22 o   42.650   20.067  -2.8376   3.3654  -2.4668   6.7258  -2.9615   3.8870   62.992   29.215   46.213   21.687 16.77892 36.38501 
1 1 1   33    8   23 o   65.402   24.359   3.3257   3.2642  -3.5261   4.9989   8.4189   4.3099   51.906   24.433   94.404   27.892 -42.49789 37.08007 
1 1 1   33    8   24 o  126.782   18.099   13.537   3.4126   16.833   5.1426   10.943   4.5618  135.861   25.670  107.502   27.586 28.35896 37.68236 
1 1 1   33    8   25 o   62.650   25.176   2.5444   3.6923   2.2844   4.9530   2.8696   5.5393   66.526   28.161   70.441   29.797 -3.914597 40.99860 
1 1 1   33    8   26 o   57.878   24.960   1.0057   4.0236  -2.5268   4.8915   8.3970   7.0755   52.837   24.643   90.772   35.358 -37.93467 43.09863 
1 1 1   33    8   27 o   39.201   18.769  -3.5768   3.2072  -0.4425   4.8936  -5.9369   4.2464   57.660   26.043   42.194   20.537 15.46565 33.16652 
1 1 1   33    9    0 o  227.781   13.037   40.602   4.5111   40.602   4.5111   40.602   4.5111  227.781   13.037  227.781   13.037 0.000000 0.000000 
1 1 1   33    9    1 f   32.468   15.207  -1.7751   1.8950  -5.4211   4.5269  -1.0005   2.0867   46.563   22.295   37.437   16.949 9.126373 28.00584 
1 1 1   33    9    3 f   97.035   32.622   8.3547   5.7257   8.3547   5.7257   0.0000   0.0000   97.035   32.622  ?   ?  0.000000 32.62160 
1 1 1   33    9    4 o  128.322   33.056   15.228   6.5325   15.228   6.5325   0.0000   0.0000  128.322   33.056  ?   ?  0.000000 33.05605 
1 1 1   33    9    5 o  121.757   33.425   13.788   6.4189   13.788   6.4189   0.0000   0.0000  121.757   33.425  ?   ?  0.000000 33.42546 
1 1 1   33    9    6 o   62.470   23.991   2.4931   3.2226   0.5245   4.3369   4.9204   4.8157   60.365   25.973   79.874   29.619 -19.50904 39.39389 
1 1 1   33    9    7 o  108.193   27.083   10.353   4.4747   10.353   4.4747   0.0000   0.0000  108.193   27.083  ?   ?  0.000000 27.08327 
1 1 1   33    9    8 o   58.195   25.537  -0.1693   4.3683  -0.1693   4.3683   0.0000   0.0000   58.195   25.537  ?   ?  0.000000 25.53687 
1 1 1   33    9    9 o   45.786   20.804  -1.4437   3.1793  -0.2231   4.2828  -2.9421   4.7452   57.446   25.245   53.031   24.576 4.415604 35.23192 
1 1 1   33    9   10 o  151.937   15.298   18.522   3.5093   14.288   4.6339   24.216   5.3737  128.754   24.407  170.676   21.014 -41.92186 32.20652 
1 1 1   33    9   11 o   80.874   27.372   5.5354   4.0315   3.1774   6.6235   6.9232   5.0811   78.612   32.878   89.102   30.717 -10.49068 44.99482 
1 1 1   33    9   12 o  115.228   24.063   11.503   4.1070   7.2046   6.4062   14.503   5.3515   91.769   34.135  127.206   28.223 -35.43710 44.29178 
1 1 1   33    9   13 o  106.418   25.207   9.9652   4.0426   9.1838   6.1775   10.550   5.3464   99.597   33.882  106.764   30.930 -7.166496 45.87667 
1 1 1   33    9   14 o   69.397   26.585   3.3742   3.9510   5.1359   5.8881   1.9313   5.3288   82.565   32.229   69.427   29.289 13.13718 43.54973 
1 1 1   33    9   15 o   54.295   23.994  -0.3835   3.9202   5.0907   6.3131  -3.8192   5.0013   83.276   33.104   52.381   24.587 30.89579 41.23586 
1 1 1   33    9   16 o   51.801   21.438   0.9750   2.7741   4.7434   4.8943  -0.8088   3.3673   78.210   29.677   49.021   21.915 29.18935 36.89178 
1 1 1   33    9   17 o  113.729   17.210   10.660   2.9021   6.1508   4.9945   12.959   3.5659   84.452   30.341  124.518   19.337 -40.06599 35.97901 
1 1 1   33    9   18 o   95.222   21.258   7.8177   3.0199   5.0246   5.1485   9.2828   3.7287   79.551   30.378  102.488   24.163 -22.93689 38.81599 
1 1 1   33    9   19 o   39.785   18.780  -2.8457   2.9914  -6.2596   5.2400  -1.1950   3.6435   48.904   23.562   49.505   22.406 -0.6018639 32.51474 
1 1 1   33    9   20 o  222.446   10.517   38.800   3.5808   25.788   5.5494   48.082   4.6872  174.137   21.262  246.146   12.482 -72.00916 24.65466 
1 1 1   33    9   21 o   43.011   19.894  -1.8982   3.0880  -3.4717   5.2531  -1.0673   3.8171   53.742   25.218   50.784   22.963 2.958035 34.10643 
1 1 1   33    9   22 o   54.642   23.362   0.7761   3.4690  -3.5651   8.2413   1.7109   3.8243   66.918   31.459   60.243   25.071 6.675163 40.22749 
1 1 1   33    9   23 o   76.158   26.221   5.1514   3.7018   7.9786   5.0504   1.8691   5.4417   90.810   30.637   67.491   29.067 23.31870 42.23161 
1 1 1   33    9   24 o   67.276   25.658   3.5257   3.6702   6.7743   5.0222  -0.1978   5.3767   84.681   30.425   61.164   27.492 23.51741 41.00591 
1 1 1   33    9   25 o   59.623   23.935   2.2339   3.3331   1.6717   4.9059   2.7160   4.5426   64.179   27.620   66.401   27.453 -2.221718 38.94263 
1 1 1   33    9   26 o  107.934   25.659   10.914   4.1768   12.569   5.0896   7.4992   7.3096  112.991   29.213   87.637   35.351 25.35431 45.85969 
1 1 1   33   10    0 o  145.127   15.509   16.950   3.3458   16.950   3.3458   16.950   3.3458  145.127   15.509  145.127   15.509 0.000000 0.000000 
1 1 1   33   10    1 o  121.123   22.754   12.442   4.0637   12.442   4.0637   0.0000   0.0000  121.123   22.754  ?   ?  0.000000 22.75447 
1 1 1   33   10    3 o  162.200   23.112   22.145   5.5756   22.145   5.5756   0.0000   0.0000  162.200   23.112  ?   ?  0.000000 23.11176 
1 1 1   33   10    4 o  100.993   33.678   9.2761   6.1026   9.2761   6.1026   0.0000   0.0000  100.993   33.678  ?   ?  0.000000 33.67809 
1 1 1   33   10    5 o  119.410   33.632   13.355   6.4089   13.355   6.4089   0.0000   0.0000  119.410   33.632  ?   ?  0.000000 33.63203 
1 1 1   33   10    6 o   46.721   22.351  -5.2687   4.5276  -5.2687   4.5276   0.0000   0.0000   46.721   22.351  ?   ?  0.000000 22.35098 
1 1 1   33   10    7 o   94.306   29.582   7.9334   4.7526   7.9334   4.7526   0.0000   0.0000   94.306   29.582  ?   ?  0.000000 29.58200 
1 1 1   33   10    8 o   51.675   22.573  -0.1506   3.3790   1.0320   4.7773  -1.3346   4.7799   64.248   27.441   57.204   25.797 7.043930 37.66320 
1 1 1   33   10    9 o  170.598   14.641   23.234   3.7861   12.898   5.0294   36.752   5.7517  120.145   27.886  212.847   17.819 -92.70194 33.09280 
1 1 1   33   10   10 o   64.173   24.331   2.8139   3.2879   3.2730   4.5303   2.3030   4.7792   71.344   28.143   68.564   28.234 2.780182 39.86479 
1 1 1   33   10   11 o   81.890   26.579   5.7783   3.8104   6.4893   6.3767   5.3834   4.7522   88.948   33.846   81.233   29.537 7.715057 44.92180 
1 1 1   33   10   12 o  175.981   14.316   24.708   3.8227   25.449   5.1532   23.802   5.7002  175.654   19.496  167.667   22.803 7.986893 30.00091 
1 1 1   33   10   13 o   50.947   22.421  -0.3192   3.3890  -1.3283   4.5505   0.9375   5.0783   55.550   25.100   65.089   28.056 -9.538868 37.64455 
1 1 1   33   10   14 o   83.314   20.922   5.9498   2.6643   6.1884   4.8440   5.8464   3.1902   84.811   29.943   81.971   23.934 2.840874 38.33280 
1 1 1   33   10   15 o   67.509   25.448   3.3001   3.5837   4.6655   4.7788   1.5454   5.4173   77.575   29.352   68.339   29.206 9.235970 41.40686 
1 1 1   33   10   16 o  112.906   17.190   10.507   2.8770   10.710   5.0316   10.409   3.5067  107.415   29.637  110.244   21.554 -2.828918 36.64619 
1 1 1   33   10   17 o  145.591   14.103   17.009   3.1033   13.479   5.1962   18.966   3.8691  121.221   28.487  152.342   16.877 -31.12077 33.11116 
1 1 1   33   10   18 o   54.609   22.319   1.3719   2.9583   7.3510   5.0480  -1.7557   3.6510   89.550   30.628   47.942   21.977 41.60830 37.69672 
1 1 1   33   10   19 o  113.218   19.128   10.818   3.1967   9.5123   5.2752   11.576   4.0186   99.611   31.153  114.527   23.705 -14.91582 39.14650 
1 1 1   33   10   20 o  140.017   15.376   15.976   3.2411   19.783   5.5184   13.972   4.0045  149.138   25.063  127.425   21.282 21.71352 32.88026 
1 1 1   33   10   21 o  113.991   18.960   11.015   3.1920   3.8338   5.3257   15.041   3.9875   74.018   30.063  132.698   20.276 -58.68003 36.26167 
1 1 1   33   10   22 o  129.297   23.967   14.922   4.5686   15.228   8.4323   14.795   5.4355  115.858   39.585  124.621   29.034 -8.762375 49.09132 
1 1 1   33   10   23 o   71.524   26.262   4.3047   3.7699   1.1092   5.4956   7.1453   5.1813   65.285   28.646   86.546   30.923 -21.26123 42.15231 
1 1 1   33   10   24 o   58.932   23.906   2.0413   3.3631   4.7325   5.4146   0.3510   4.2912   76.440   30.569   57.252   25.212 19.18839 39.62477 
1 1 1   33   10   25 o   76.263   25.129   5.3041   3.4012   5.4304   5.4592   5.2240   4.3482   78.777   30.951   76.401   28.181 2.376869 41.85900 
1 1 1   33   10   26 o   69.836   27.270   3.8992   4.2166   4.7295   5.1630   2.2362   7.3068   75.276   29.933   73.152   32.521 2.123802 44.19926 
1 1 1   33   11    0 o   49.431   24.982   2.8894   2.3462   2.8894   2.3462   2.8894   2.3462   49.431   24.982   49.431   24.982 0.000000 0.000000 
1 1 1   33   11    1 o   35.344   17.363  -6.1806   3.2515  -6.1806   3.2515   0.0000   0.0000   35.344   17.363  ?   ?  0.000000 17.36326 
1 1 1   33   11    2 o   54.972   24.327  -0.5357   4.0435  -0.5357   4.0435   0.0000   0.0000   54.972   24.327  ?   ?  0.000000 24.32703 
1 1 1   33   11    3 o  251.551   15.685   50.550   6.0090   50.550   6.0090   0.0000   0.0000  251.551   15.685  ?   ?  0.000000 15.68473 
1 1 1   33   11    4 o   89.908   32.320   6.8940   5.6681   6.8940   5.6681   0.0000   0.0000   89.908   32.320  ?   ?  0.000000 32.32007 
1 1 1   33   11    5 o   57.048   26.678  -4.0065   5.7952  -4.0065   5.7952   0.0000   0.0000   57.048   26.678  ?   ?  0.000000 26.67850 
1 1 1   33   11    6 o   69.126   27.936   2.6573   4.5737   2.6573   4.5737   0.0000   0.0000   69.126   27.936  ?   ?  0.000000 27.93566 
1 1 1   33   11    7 o  124.802   26.794   13.751   4.9654   13.751   4.9654   0.0000   0.0000  124.802   26.794  ?   ?  0.000000 26.79393 
1 1 1   33   11    8 o  167.421   20.920   23.332   5.2439   23.332   5.2439   0.0000   0.0000  167.421   20.920  ?   ?  0.000000 20.91974 
1 1 1   33   11    9 o   61.241   27.139  -0.3742   5.0495  -0.3742   5.0495   0.0000   0.0000   61.241   27.139  ?   ?  0.000000 27.13909 
1 1 1   33   11   10 o   61.158   24.640   1.9574   3.5462  -1.5598   4.9665   5.6159   5.0653   57.529   26.087   82.850   30.438 -25.32057 40.08774 
1 1 1   33   11   11 o  120.391   16.026   11.775   2.8798   13.750   7.5015   11.434   3.1187  117.835   37.194  117.810   17.855 0.2513123E-01 41.25795 
1 1 1   33   11   12 o   99.006   17.675   8.1263   2.5803   12.022   5.2708   6.8985   2.9591  114.287   29.817   89.497   21.802 24.78961 36.93778 
1 1 1   33   11   13 f  136.487   13.822   14.896   2.8477   14.770   5.2882   14.947   3.3795  128.220   27.751  135.452   16.651 -7.232224 32.36274 
1 1 1   33   11   14 o  141.837   13.448   16.052   2.8847   11.107   5.1407   18.326   3.4851  109.466   29.856  150.741   15.318 -41.27468 33.55596 
1 1 1   33   11   15 o  101.152   24.962   9.0875   3.8411   11.448   5.2288   6.3208   5.6612  110.773   30.069   86.122   32.079 24.65063 43.96756 
1 1 1   33   11   16 o   69.243   23.121   3.9925   2.8760   4.6794   5.2516   3.6982   3.4373   78.388   30.482   68.851   25.108 9.537025 39.49141 
1 1 1   33   11   17 o   53.201   22.073   1.0813   2.9515  -5.5652   5.4249   3.8759   3.5177   51.181   24.480   69.856   25.411 -18.67423 35.28433 
1 1 1   33   11   18 o  110.785   19.128   10.366   3.1262   4.3375   5.5286   13.200   3.7904   77.147   30.876  124.427   20.625 -47.28002 37.13094 
1 1 1   33   11   19 o  125.187   17.410   13.016   3.2458   10.063   5.5915   14.517   3.9861  101.380   32.124  130.343   20.669 -28.96298 38.19909 
1 1 1   33   11   20 o  201.167   11.710   32.087   3.5900   23.407   5.7543   37.619   4.5937  163.192   23.732  216.327   13.948 -53.13480 27.52731 
1 1 1   33   11   21 o   61.922   25.147   2.2532   3.7256   5.0814   5.4363  -0.2515   5.1159   78.639   30.890   60.171   26.948 18.46799 40.99232 
1 1 1   33   11   22 o   83.542   28.849   6.5091   4.4826  -0.0223   8.1443   9.3476   5.3690   72.191   32.993   96.866   31.555 -24.67485 45.65397 
1 1 1   33   11   23 o  119.096   19.839   12.222   3.4892   8.5691   5.6320   14.497   4.4450   92.450   32.313  127.040   23.732 -34.59019 40.09142 
1 1 1   33   11   24 o   75.193   25.452   5.1098   3.4858   0.6068   5.7194   7.7710   4.3968   64.343   28.677   89.553   28.498 -25.21011 40.42912 
1 1 1   33   11   25 o   79.209   25.424   5.8199   3.4937   7.0968   5.5246   4.9690   4.5101   85.290   31.705   75.268   28.506 10.02202 42.63541 
1 1 1   33   12    0 o   21.745   15.168  -1.6884   1.8338  -1.6884   1.8338  -1.6884   1.8338   21.745   15.168   21.745   15.168 0.000000 0.000000 
1 1 1   33   12    1 o   60.654   23.020   2.4385   2.9452   2.4385   2.9452   0.0000   0.0000   60.654   23.020  ?   ?  0.000000 23.02010 
1 1 1   33   12    2 o   84.787   27.006   6.2380   3.9478   6.2380   3.9478   0.0000   0.0000   84.787   27.006  ?   ?  0.000000 27.00597 
1 1 1   33   12    3 o   43.556   21.047  -5.9039   4.2548  -5.9039   4.2548   0.0000   0.0000   43.556   21.047  ?   ?  0.000000 21.04691 
1 1 1   33   12    4 o   87.593   31.299   6.5326   5.3083   6.5326   5.3083   0.0000   0.0000   87.593   31.299  ?   ?  0.000000 31.29948 
1 1 1   33   12    5 o   57.637   26.706  -3.1303   5.5999  -3.1303   5.5999   0.0000   0.0000   57.637   26.706  ?   ?  0.000000 26.70570 
1 1 1   33   12    6 o   78.304   28.644   4.8740   4.4788   4.8740   4.4788   0.0000   0.0000   78.304   28.644  ?   ?  0.000000 28.64417 
1 1 1   33   12    7 o  158.930   21.085   21.100   5.0027   21.100   5.0027   0.0000   0.0000  158.930   21.085  ?   ?  0.000000 21.08543 
1 1 1   33   12    8 o   62.784   27.047   0.7569   4.7141   0.7569   4.7141   0.0000   0.0000   62.784   27.047  ?   ?  0.000000 27.04685 
1 1 1   33   12    9 o  108.040   19.842   9.8012   3.1603   7.1193   5.2535   11.322   3.9562   89.856   31.219  114.527   23.360 -24.67088 38.99155 
1 1 1   33   12   10 o  136.006   15.265   14.913   3.1230   15.168   5.1642   14.767   3.9213  130.860   26.687  133.088   19.857 -2.227722 33.26425 
1 1 1   33   12   11 o   57.857   21.756   2.2708   2.6161  -5.5462   7.2056   3.4577   2.8077   61.203   28.968   65.952   22.828 -4.749592 36.88226 
1 1 1   33   12   12 o   47.538   20.242   0.3559   2.5849  -0.9238   5.0728   0.8047   3.0042   59.547   26.739   52.600   22.080 6.946423 34.67751 
1 1 1   33   12   13 o   70.509   22.202   4.1973   2.6743   0.0557   5.1858   5.6978   3.1213   62.723   27.664   80.858   23.693 -18.13439 36.42300 
1 1 1   33   12   14 o   55.906   21.713   1.9228   2.6621   5.7246   5.2137   0.5821   3.0961   82.803   30.796   52.140   22.176 30.66319 37.94962 
1 1 1   33   12   15 o   51.159   22.879  -0.7577   3.6736   2.6556   5.2334  -4.0733   5.1580   70.741   29.375   52.478   24.738 18.26284 38.40371 
1 1 1   33   12   16 o  102.254   19.056   8.8359   2.8728   8.5541   5.2722   8.9549   3.4261   95.231   31.281  101.125   22.692 -5.894196 38.64525 
1 1 1   33   12   17 o   65.993   23.603   3.4712   3.0193   2.9743   5.4910   3.6865   3.6148   72.223   30.048   68.898   25.639 3.324860 39.49981 
1 1 1   33   12   18 o   54.084   22.399   1.2234   3.0313  -7.4675   5.2812   5.4935   3.7019   46.992   22.879   78.711   26.229 -31.71895 34.80556 
1 1 1   33   12   19 o  132.824   16.761   14.587   3.3317   13.268   5.7772   15.244   4.0781  116.124   31.641  133.396   20.640 -17.27209 37.77760 
1 1 1   33   12   20 o   90.047   26.295   7.5192   3.8505   1.4855   5.3902   13.807   5.5025   66.309   28.742  119.429   30.109 -53.12040 41.62511 
1 1 1   33   12   21 o   80.321   24.510   5.8567   3.2884   2.1173   5.6298   7.7934   4.0514   68.811   29.600   90.991   27.081 -22.18059 40.11893 
1 1 1   33   12   22 o  173.855   15.330   24.742   4.0377   27.350   9.1605   24.113   4.4983  158.467   38.212  169.942   17.546 -11.47543 42.04728 
1 1 1   33   12   23 o   89.701   24.763   7.4620   3.5115   4.5090   5.7355   9.2326   4.4412   76.144   31.093   97.614   28.164 -21.47029 41.95259 
1 1 1   33   12   24 o   84.276   25.189   6.6330   3.4998   4.9610   5.5295   7.7504   4.5204   77.020   30.860   89.029   28.952 -12.00850 42.31487 
1 1 1   33   13    1 o  163.645   14.138   21.345   3.5065   21.345   3.5065   0.0000   0.0000  163.645   14.138  ?   ?  0.000000 14.13809 
1 1 1   33   13    2 o  120.384   21.009   12.207   3.7303   12.207   3.7303   0.0000   0.0000  120.384   21.009  ?   ?  0.000000 21.00862 
1 1 1   33   13    3 o  141.768   21.267   16.866   4.4724   16.866   4.4724   0.0000   0.0000  141.768   21.267  ?   ?  0.000000 21.26682 
1 1 1   33   13    4 o   96.004   30.066   8.3528   4.9116   8.3528   4.9116   0.0000   0.0000   96.004   30.066  ?   ?  0.000000 30.06578 
1 1 1   33   13    5 o  138.092   28.071   17.026   5.7311   17.026   5.7311   0.0000   0.0000  138.092   28.071  ?   ?  0.000000 28.07112 
1 1 1   33   13    6 o   84.094   29.015   6.0720   4.5342   6.0720   4.5342   0.0000   0.0000   84.094   29.015  ?   ?  0.000000 29.01549 
1 1 1   33   13    7 o  118.971   26.337   12.543   4.6693   12.543   4.6693   0.0000   0.0000  118.971   26.337  ?   ?  0.000000 26.33734 
1 1 1   33   13    8 o   78.598   22.746   5.3189   2.8929   8.1764   4.7692   3.6555   3.6387   94.908   29.611   69.686   25.765 25.22211 39.25105 
1 1 1   33   13    9 o  133.235   20.344   14.870   4.0173   0.0000   0.0000   14.870   4.0173  ?   ?   133.235   20.344 0.000000 20.34404 
1 1 1   33   13   10 f   42.536   19.446  -1.4821   2.8315   0.3032   4.9149  -2.3689   3.4641   62.172   27.189   45.113   20.939 17.05884 34.31757 
1 1 1   33   13   11 o   92.758   23.689   7.5504   3.3753   11.699   7.1248   6.3500   3.8327  108.932   36.391   84.766   26.561 24.16530 45.05304 
1 1 1   33   13   12 o  133.247   15.933   14.432   3.1852   13.323   5.3026   15.059   3.9840  120.302   29.112  133.978   20.043 -13.67662 35.34459 
1 1 1   33   13   13 o  148.554   13.187   17.602   2.9672   3.9537   5.4530   23.343   3.5366   76.207   30.606  170.995   13.626 -94.78799 33.50218 
1 1 1   33   13   14 o   98.171   19.486   8.1808   2.8247   10.995   5.4237   7.1333   3.3089  107.374   31.166   89.767   23.724 17.60751 39.16830 
1 1 1   33   13   15 o   63.270   25.341   2.4059   3.7271  -5.0364   5.1547   10.560   5.3955   50.438   24.051  104.860   31.261 -54.42244 39.44287 
1 1 1   33   13   16 o  116.777   16.652   11.260   2.8921   10.817   5.2541   11.453   3.4641  106.124   30.638  115.854   20.273 -9.729591 36.73802 
1 1 1   33   13   17 o  176.815   12.596   24.919   3.3866   23.392   5.7197   25.744   4.2023  163.605   23.517  177.880   15.592 -14.27539 28.21602 
1 1 1   33   13   18 o   84.130   26.373   6.4731   3.7782   11.735   5.4533   1.6160   5.2393  109.450   31.093   66.305   28.539 43.14507 42.20434 
1 1 1   33   13   19 o  109.423   24.846   10.880   4.0664   5.9414   5.6744   16.094   5.8303   82.364   31.781  129.346   30.027 -46.98151 43.72236 
1 1 1   33   13   20 o   62.539   24.141   2.8130   3.2752  -2.7926   5.5265   5.8477   4.0662   56.103   26.175   80.055   27.486 -23.95219 37.95543 
1 1 1   33   13   21 o  155.972   15.411   19.954   3.6311   18.943   5.9083   20.567   4.6029  141.585   28.253  155.105   19.843 -13.52094 34.52526 
1 1 1   33   13   22 o   82.062   26.549   6.2891   3.8042   4.4470   8.7227   6.7218   4.2274   82.063   36.046   84.178   28.028 -2.115219 45.66092 
1 1 1   33   13   23 o   60.541   24.305   2.3641   3.4376   7.5184   5.7327  -0.5298   4.2956   87.236   32.323   54.441   24.512 32.79507 40.56577 
1 1 1   33   14    1 o   91.638   21.184   7.1829   2.9119   7.1829   2.9119   0.0000   0.0000   91.638   21.184  ?   ?  0.000000 21.18417 
1 1 1   33   14    2 o  108.605   22.124   10.099   3.5529   10.099   3.5529   0.0000   0.0000  108.605   22.124  ?   ?  0.000000 22.12385 
1 1 1   33   14    3 o   56.866   24.294   0.6508   3.7460   0.6508   3.7460   0.0000   0.0000   56.866   24.294  ?   ?  0.000000 24.29434 
1 1 1   33   14    4 o   73.218   28.875   3.5811   4.7682   3.5811   4.7682   0.0000   0.0000   73.218   28.875  ?   ?  0.000000 28.87549 
1 1 1   33   14    5 o   90.799   31.250   7.3514   5.2580   7.3514   5.2580   0.0000   0.0000   90.799   31.250  ?   ?  0.000000 31.25046 
1 1 1   33   14    6 o  155.242   12.489   19.085   2.9426   18.244   4.8172   19.586   3.7166  146.728   22.138  155.740   15.810 -9.011948 27.20391 
1 1 1   33   14    7 o   40.398   18.533  -1.5182   2.6032  -5.7629   4.5706   0.5198   3.1671   45.815   22.057   52.519   22.385 -6.704967 31.42634 
1 1 1   33   14    8 o   51.784   21.533   0.9078   2.8178   0.3555   4.8916   1.1821   3.4472   62.165   27.157   57.011   23.771 5.154285 36.09140 
1 1 1   33   14    9 f   50.461   21.627   0.3476   2.9856  -0.1938   5.0381   0.6406   3.7066   61.256   27.129   56.379   24.128 4.877167 36.30632 
1 1 1   33   14   10 f  111.529   18.671   10.385   3.0747   17.186   5.2116   6.7538   3.8081  139.912   25.265   87.033   26.335 52.87868 36.49489 
1 1 1   33   14   11 o   99.394   22.485   8.5981   3.3407   6.8930   7.4280   9.0304   3.7403   90.674   35.951  100.928   24.466 -10.25361 43.48656 
1 1 1   33   14   12 o   88.040   23.230   6.8278   3.1758   11.948   5.4166   4.1458   3.9203  112.314   30.652   72.404   26.748 39.91041 40.68228 
1 1 1   33   14   13 o   99.374   22.415   8.6341   3.3282   10.104   5.3896   7.7279   4.2313  102.694   31.386   91.772   27.758 10.92144 41.89989 
1 1 1   33   14   14 o   27.697   13.947  -8.0277   2.7051 -13.1268   5.0832  -6.0130   3.1951   39.009   19.572   34.825   17.129 4.183765 26.00878 
1 1 1   33   14   15 o  121.564   21.618   12.769   3.8750   7.3739   5.2852   19.040   5.6981   88.992   31.291  145.086   26.640 -56.09359 41.09555 
1 1 1   33   14   16 o   56.674   23.562   1.3805   3.3727   0.0000   0.0000   1.3805   3.3727  ?   ?    56.674   23.562 0.000000 23.56171 
1 1 1   33   14   17 o   56.926   24.173   1.0724   3.6678  -2.1806   5.1751   4.3557   5.1992   55.870   25.812   75.557   30.040 -19.68651 39.60573 
1 1 1   33   14   18 o   48.847   21.545  -0.1816   3.1460  -1.5802   5.3599   0.5535   3.8858   58.050   26.617   56.113   24.363 1.936432 36.08397 
1 1 1   33   14   19 o   80.078   24.642   5.8273   3.3157   2.9059   5.5470   7.4515   4.1360   70.930   29.901   88.837   27.552 -17.90699 40.65923 
1 1 1   33   14   20 o   83.303   24.691   6.3750   3.3730   3.0908   5.6720   8.1718   4.1955   71.636   30.219   92.562   27.560 -20.92676 40.89908 
1 1 1   33   14   21 o   60.289   24.052   2.3648   3.3436   0.9846   5.6995   3.0890   4.1286   65.358   28.905   66.474   26.655 -1.115959 39.31847 
1 1 1   33   14   22 o   64.740   25.944   2.8975   3.9090   5.4079   9.1763   2.3409   4.3206   84.513   37.051   64.014   26.645 20.49831 45.63678 
1 1 1   33   15    2 o  168.429   15.833   22.898   4.0340   22.898   4.0340   0.0000   0.0000  168.429   15.833  ?   ?  0.000000 15.83345 
1 1 1   33   15    3 o   48.238   22.082  -1.7920   3.6680  -1.7920   3.6680   0.0000   0.0000   48.238   22.082  ?   ?  0.000000 22.08175 
1 1 1   33   15    4 o  133.996   13.393   14.334   2.7101   15.680   4.6216   13.628   3.3458  135.059   23.192  128.835   17.413 6.224503 29.00100 
1 1 1   33   15    5 o  122.785   27.609   13.600   5.0628   13.600   5.0628   0.0000   0.0000  122.785   27.609  ?   ?  0.000000 27.60880 
1 1 1   33   15    6 o   90.086   20.185   6.9237   2.7142   8.1516   4.6092   6.2719   3.3582   94.455   29.051   84.443   24.528 10.01191 38.02095 
1 1 1   33   15    7 o   55.275   21.967   1.6799   2.7791   1.3671   4.7494   1.8428   3.4271   64.510   27.453   59.663   24.157 4.847450 36.56777 
1 1 1   33   15    8 o  158.786   13.513   20.127   3.2530   15.482   5.3042   22.927   4.1184  131.089   27.321  168.070   16.210 -36.98062 31.76803 
1 1 1   33   15    9 o   60.425   23.188   2.4454   3.0090   3.4267   4.9964   1.8870   3.7692   72.693   29.261   61.466   25.165 11.22732 38.59355 
1 1 1   33   15   10 o   95.610   21.637   7.9296   3.0926   8.7350   5.1077   7.4634   3.8858   96.419   30.719   90.829   26.384 5.590393 40.49420 
1 1 1   33   15   11 o  110.670   22.731   10.690   3.7216   26.437   8.3341   6.7679   4.1593  164.842   34.153   86.417   27.740 78.42525 43.99990 
1 1 1   33   15   12 o   58.468   23.507   1.9042   3.2204   7.0016   5.2470  -1.1764   4.0791   87.609   31.138   52.357   23.701 35.25181 39.13213 
1 1 1   33   15   13 o   42.394   19.962  -2.9034   3.3419 -10.3585   5.0851   2.7642   4.4338   41.991   20.827   67.459   27.418 -25.46877 34.43191 
1 1 1   33   15   14 f   76.386   25.055   5.1379   3.3828   6.2365   5.2077   4.3359   4.4494   83.641   30.843   73.944   28.240 9.697289 41.81815 
1 1 1   33   15   15 o   72.709   29.633   3.5618   5.1969   3.5618   5.1969   0.0000   0.0000   72.709   29.633  ?   ?  0.000000 29.63325 
1 1 1   33   15   16 o   64.784   24.948   3.0592   3.4911   10.405   5.2035  -2.9543   4.7080  103.087   30.693   51.417   24.046 51.66962 38.99024 
1 1 1   33   15   17 o   49.108   21.561  -0.0477   3.1178  -0.2571   5.0959   0.0777   3.9417   59.951   26.869   54.780   24.141 5.170528 36.12120 
1 1 1   33   15   18 o   68.189   24.348   3.8957   3.2115   2.2329   5.2242   4.9058   4.0717   67.600   28.780   75.090   27.335 -7.490135 39.69293 
1 1 1   33   15   19 o   49.059   21.880  -0.4334   3.3354  -2.2104   5.5121   0.5931   4.1894   57.018   26.446   57.561   25.140 -0.5422745 36.48838 
1 1 1   33   15   20 o  124.476   19.271   13.281   3.5530   7.7125   5.5463   17.156   4.6272   88.414   31.946  139.252   22.474 -50.83837 39.05976 
1 1 1   33   16    2 o   52.804   21.249   1.3826   2.6341   0.0000   0.0000   1.3826   2.6341  ?   ?    52.804   21.249 0.000000 21.24909 
1 1 1   33   16    3 o   58.301   20.649   2.5864   2.3055   3.6075   3.8531   2.0169   2.8775   69.732   26.363   57.551   22.512 12.18130 34.66700 
1 1 1   33   16    4 o   54.373   20.916   1.8677   2.4519  -0.5571   4.1099   3.2075   3.0550   54.679   24.344   64.915   23.671 -10.23574 33.95520 
1 1 1   33   16    5 o  103.879   28.994   10.014   4.7858   10.014   4.7858   0.0000   0.0000  103.879   28.994  ?   ?  0.000000 28.99428 
1 1 1   33   16    6 o  189.992   11.912   28.536   3.4464   24.094   5.8188   30.936   4.2775  167.190   23.377  196.479   14.322 -29.28912 27.41568 
1 1 1   33   16    7 o   83.603   23.729   6.1732   3.1777   10.616   6.0323   4.4667   3.7384  104.365   33.398   73.580   26.269 30.78529 42.49115 
1 1 1   33   16    8 o   90.060   23.938   7.2114   3.3564  -2.4649   6.2709   11.096   3.9734   61.535   28.423  112.148   23.879 -50.61327 37.12284 
1 1 1   33   16    9 o  106.263   20.497   9.6714   3.2129   7.4991   5.1360   11.068   4.1182   89.976   30.891  111.323   24.804 -21.34746 39.61625 
1 1 1   33   16   10 o   38.095   18.247  -3.6759   3.0389  -2.0892   4.8993  -4.6681   3.8743   54.940   25.286   42.578   20.450 12.36233 32.52028 
1 1 1   33   16   11 o   98.046   25.942   8.7829   3.9536   12.969   8.2477   7.5340   4.5049  109.881   39.041   89.963   28.869 19.91721 48.55540 
1 1 1   33   16   12 o   48.221   21.632  -0.7654   3.3113   2.3931   4.9867  -3.2564   4.4286   68.044   28.499   49.221   23.115 18.82370 36.69465 
1 1 1   33   16   13 o   55.673   23.742   0.8759   3.5657   6.7119   5.2366  -4.1693   4.8689   85.541   31.021   49.996   23.707 35.54558 39.04255 
1 1 1   33   16   14 o   93.164   25.203   7.9464   3.6809   6.9826   5.2174   8.9015   5.1938   86.504   31.018   95.596   31.031 -9.091797 43.87505 
1 1 1   33   16   15 o  104.956   31.235   10.912   5.3898   10.912   5.3898   0.0000   0.0000  104.956   31.235  ?   ?  0.000000 31.23462 
1 1 1   33   16   16 o   89.701   27.787   7.6138   4.2082   10.023   7.0409   6.2747   5.2489   98.026   35.906   82.892   30.886 15.13400 47.36194 
1 1 1   33   16   17 f  148.730   16.832   18.375   3.7644   12.894   7.2499   20.397   4.4047  108.533   36.707  155.232   18.930 -46.69833 41.30037 
1 1 1   33   16   18 o   57.793   24.129   1.5546   3.5588   0.2597   7.1037   1.9885   4.1120   68.899   31.225   62.085   25.931 6.813698 40.58805 
1 1 1   33   16   19 o   60.145   24.732   2.0294   3.6607   10.174   7.3666  -0.6413   4.2184   97.118   36.510   53.800   24.251 43.31840 43.83015 
1 1 1   33   17    0 o   83.356   24.198   6.7472   2.6795   6.7472   2.6795   6.7472   2.6795   83.356   24.198   83.356   24.198 0.000000 0.000000 
1 1 1   33   17    1 o   69.693   22.148   4.1279   2.6565   0.0000   0.0000   4.1279   2.6565  ?   ?    69.693   22.148 0.000000 22.14849 
1 1 1   33   17    2 f   85.017   23.146   6.3745   3.0929   0.0000   0.0000   6.3745   3.0929  ?   ?    85.017   23.146 0.000000 23.14574 
1 1 1   33   17    3 o   47.308   19.748   0.6878   2.3831   1.2442   3.9846   0.3779   2.9736   59.831   25.288   50.243   21.560 9.588737 33.23135 
1 1 1   33   17    4 o   79.230   28.344   5.3872   4.3542   5.3872   4.3542   0.0000   0.0000   79.230   28.344  ?   ?  0.000000 28.34367 
1 1 1   33   17    5 o   97.337   20.351   8.1376   2.9344   6.9269   4.5362   9.0088   3.8480   87.101   29.035  100.008   25.160 -12.90681 38.41980 
1 1 1   33   17    6 o   52.754   21.637   1.2269   2.7928   0.3858   4.1018   1.9538   3.8131   57.304   24.955   61.634   25.281 -4.330906 35.52357 
1 1 1   33   17    7 o   45.587   20.352  -0.6445   2.8938   0.4334   4.3730  -1.4842   3.8598   58.902   25.706   49.991   22.795 8.911652 34.35732 
1 1 1   33   17    8 o   48.278   21.312  -0.2934   3.0850   6.0480   4.7314  -4.9834   4.0690   82.500   29.542   43.318   20.844 39.18190 36.15567 
1 1 1   33   17    9 o  168.884   14.045   22.959   3.5976   24.015   5.1692   21.967   5.0101  168.275   20.492  160.579   20.878 7.696136 29.25446 
1 1 1   33   17   10 o  109.814   25.032   10.904   4.1140   17.863   8.0841   8.4723   4.7791  128.711   38.241   94.340   29.676 34.37100 48.40536 
1 1 1   33   17   11 o   74.433   25.906   4.7954   3.6182   2.6926   5.2675   6.6738   4.9785   69.891   29.283   85.161   30.324 -15.26989 42.15501 
1 1 1   33   17   12 o   88.315   25.775   7.1717   3.7005   9.1701   5.3605   5.3524   5.1148   96.662   31.532   79.296   30.279 17.36649 43.71590 
1 1 1   33   17   13 o  113.839   22.346   11.422   3.7547   12.224   5.3692   10.654   5.2525  111.740   30.527  104.031   30.806 7.709068 43.36947 
1 1 1   33   17   14 o  110.786   30.541   12.077   5.3457   12.077   5.3457   0.0000   0.0000  110.786   30.541  ?   ?  0.000000 30.54081 
1 1 1   33   17   15 f   55.254   23.535   0.9677   3.4965  -1.6333   5.1955   3.1209   4.7272   56.843   26.116   68.922   28.196 -12.07877 38.43255 
1 1 1   33   17   16 o   75.136   26.216   5.0288   3.7063   9.7157   5.3800   0.7952   5.1133   98.222   31.552   62.604   27.546 35.61742 41.88453 
1 1 1   33   17   17 o   49.116   22.552  -1.5695   3.8655  -2.5707   5.3383  -0.4658   5.6048   55.278   25.769   61.322   27.768 -6.043610 37.88282 
1 1 1   33   18    0 o  168.757   12.848   22.569   3.2745   22.569   3.2745   22.569   3.2745  168.757   12.848  168.757   12.848 0.000000 0.000000 
1 1 1   33   18    1 o   67.869   17.773   3.9128   1.8681   6.4554   2.4033   0.0311   2.9694   87.085   18.595   48.666   21.212 38.41943 28.20892 
1 1 1   33   18    2 o   88.285   24.548   7.0154   3.4374   0.0000   0.0000   7.0154   3.4374  ?   ?    88.285   24.548 0.000000 24.54820 
1 1 1   33   18    3 o  185.511   11.352   27.205   3.2078   29.458   4.9727   25.600   4.1981  189.144   17.371  177.441   15.616 11.70366 23.35821 
1 1 1   33   18    4 o   72.611   28.460   3.9124   4.6058   3.9124   4.6058   0.0000   0.0000   72.611   28.460  ?   ?  0.000000 28.46008 
1 1 1   33   18    5 o  123.010   18.054   12.653   3.2980   9.4586   4.9673   15.171   4.4105   99.349   30.081  131.912   22.660 -32.56326 37.66111 
1 1 1   33   18    6 o   37.046   17.804  -3.7556   2.9475  -7.2340   4.0454   0.1803   4.3033   39.270   19.307   57.507   25.288 -18.23711 31.81585 
1 1 1   33   18    7 o   55.755   22.845   1.5095   3.1095   0.8043   4.3389   2.2541   4.4585   59.662   25.824   65.331   27.120 -5.669373 37.44809 
1 1 1   33   18    8 o   60.263   23.498   2.4257   3.1273  -0.2462   4.4922   4.9383   4.3562   57.137   25.444   76.301   28.195 -19.16427 37.97842 
1 1 1   33   18    9 o   57.032   23.324   1.6632   3.2336   2.1843   4.7239   1.2037   4.4358   65.988   27.693   61.333   26.326 4.654869 38.20928 
1 1 1   33   18   10 o   51.716   23.291  -0.8157   3.8810  -1.9087   7.6424  -0.4359   4.5052   67.364   31.208   56.514   25.301 10.85022 40.17527 
1 1 1   33   18   11 o   54.616   23.373   0.7919   3.4776  -7.5171   4.9746   8.7340   4.8635   44.785   21.891   94.894   29.948 -50.10924 37.09617 
1 1 1   33   18   12 o  106.556   23.857   10.249   3.7942   7.9844   5.6467   12.113   5.1230   90.421   32.285  111.759   29.512 -21.33753 43.74066 
1 1 1   33   18   13 o  163.608   16.158   22.055   3.9934   30.886   6.1009   15.435   5.2822  188.995   21.471  128.058   27.750 60.93707 35.08665 
1 1 1   33   18   14 o   63.928   28.415   0.5456   5.5756   0.5456   5.5756   0.0000   0.0000   63.928   28.415  ?   ?  0.000000 28.41457 
1 1 1   33   18   15 o  100.040   24.983   9.2562   3.8140   7.4910   5.4539   10.946   5.3357   87.659   31.678  104.292   31.087 -16.63374 44.38344 
1 1 1   33   19    0 o   74.212   28.867   6.1505   3.1252   6.1505   3.1252   6.1505   3.1252   74.212   28.867   74.212   28.867 0.000000 0.000000 
1 1 1   33   19    1 o   89.791   16.762   6.7580   2.2190   5.8615   2.8519   8.1335   3.5326   81.342   22.259   94.877   24.237 -13.53508 32.90760 
1 1 1   33   19    2 o   53.137   19.159   2.1030   1.9934   1.3270   2.3332   4.2004   3.8358   50.097   20.055   71.639   26.460 -21.54216 33.20176 
1 1 1   33   19    3 o   75.763   17.323   4.8752   1.9651   4.8752   1.9651   0.0000   0.0000   75.763   17.323  ?   ?  0.000000 17.32306 
1 1 1   33   19    4 o   44.449   20.171  -1.1087   2.9762  -3.3703   4.3799   0.8312   4.0566   48.513   22.847   58.152   25.070 -9.638466 33.91876 
1 1 1   33   19    5 o   72.826   24.655   4.6088   3.2709   2.9044   4.9328   5.9462   4.3696   69.299   28.626   81.109   28.456 -11.81002 40.36321 
1 1 1   33   19    6 f   37.036   17.796  -3.6973   2.9410  -1.7294   4.2295  -5.5397   4.0924   51.385   23.592   42.259   20.474 9.125866 31.23697 
1 1 1   33   19    7 o   55.600   22.626   1.6185   3.0240  -3.0964   4.1902   6.7434   4.3686   47.789   22.456   85.061   28.495 -37.27190 36.27971 
1 1 1   33   19    8 o   58.620   23.486   2.0685   3.2023   4.8021   4.5226  -0.6798   4.5348   75.587   28.565   55.898   25.175 19.68910 38.07561 
1 1 1   33   19    9 o   82.786   24.316   6.2325   3.2842   10.577   4.6807   2.0197   4.6091  105.115   28.414   64.629   27.251 40.48639 39.36935 
1 1 1   33   19   10 o   71.545   26.917   4.2034   4.0055   7.1462   7.9490   3.2018   4.6373   88.631   36.446   68.990   28.041 19.64128 45.98442 
1 1 1   33   19   11 o   59.019   24.046   1.9684   3.4207  -1.7384   5.0884   5.0248   4.6205   56.007   25.774   76.431   28.875 -20.42398 38.70512 
1 1 1   33   19   12 o   92.146   24.315   7.7924   3.4792   9.8660   5.2715   6.1919   4.6312   99.215   31.160   81.730   29.232 17.48475 42.72568 
1 1 1   33   20    0 o  110.843   25.738   11.388   3.7981   11.388   3.7981   11.388   3.7981  110.843   25.738  110.843   25.738 0.000000 0.000000 
1 1 1   33   20    1 o   63.477   21.359   3.3695   2.4547   4.7952   3.3383   1.6913   3.6220   73.836   24.908   58.991   24.462 14.84538 34.91136 
1 1 1   33   20    2 o  128.143   12.677   13.190   2.4539   13.684   3.1951   12.480   3.8317  128.436   16.644  119.437   21.761 8.998596 27.39698 
1 1 1   33   20    3 o   48.533   20.067   0.9440   2.4272   0.9440   2.4272   0.0000   0.0000   48.533   20.067  ?   ?  0.000000 20.06677 
1 1 1   33   20    4 o  110.301   10.960   9.6826   1.8259   8.7350   2.0296   13.703   4.1808  103.885   13.052  124.506   22.778 -20.62122 26.25234 
1 1 1   33   20    5 f  104.019   21.361   9.4981   3.2872   14.691   5.2628   6.1759   4.2093  124.585   28.249   81.845   27.968 42.73955 39.75174 
1 1 1   33   20    6 o   91.982   22.264   7.5532   3.1008   6.1587   4.4235   8.9005   4.3479   81.747   28.633   96.626   27.864 -14.87924 39.95308 
1 1 1   33   20    7 o  167.475   13.563   22.625   3.4469   30.101   4.9180   15.407   4.8324  190.611   17.036  130.138   25.170 60.47285 30.39375 
1 1 1   33   20    8 o  118.998   18.650   12.033   3.2852   13.582   4.6602   10.503   4.6319  121.350   25.880  104.577   28.264 16.77257 38.32264 
1 1 1   33   20    9 o   86.514   27.630   7.0789   4.1304   9.4681   8.3688   6.3095   4.7491   95.253   38.035   82.371   29.587 12.88238 48.18802 
1 1 1   33   21    0 o   72.062   30.976   6.1919   3.5026   6.1919   3.5026   6.1919   3.5026   72.062   30.976   72.062   30.976 0.000000 0.000000 
1 1 1   33   21    1 o   92.620   18.379   7.3434   2.5135   8.6944   3.4207   5.7580   3.7056   98.231   23.133   79.365   26.233 18.86639 34.97564 
1 1 1   33   21    2 o   74.844   24.188   5.0098   3.1583   5.0098   3.1583   0.0000   0.0000   74.844   24.188  ?   ?  0.000000 24.18847 
1 1 1   34    0    0 o   29.649   21.113  -5.7844   4.1910  -5.7844   4.1910  -5.7844   4.1910   29.649   21.113   29.649   21.113 0.000000 0.000000 
1 1 1   34    0    1 o   52.729   27.948   3.3097   3.0318   3.3097   3.0318   3.3097   3.0318   52.729   27.948   52.729   27.948 0.000000 0.000000 
1 1 1   34    0    2 o  163.607   13.649   21.219   3.3634   21.219   3.3634   21.219   3.3634  163.607   13.649  163.607   13.649 0.000000 0.000000 
1 1 1   34    0    3 o  128.843   16.604   13.592   3.1250   13.592   3.1250   13.592   3.1250  128.843   16.604  128.843   16.604 0.000000 0.000000 
1 1 1   34    0    4 o   49.084   26.968   2.7872   2.9219   2.7872   2.9219   2.7872   2.9219   49.084   26.968   49.084   26.968 0.000000 0.000000 
1 1 1   34    0    5 o   99.741   29.879   9.8445   3.9739   9.8445   3.9739   9.8445   3.9739   99.741   29.879   99.741   29.879 0.000000 0.000000 
1 1 1   34    0    6 o   46.172   24.944   2.4759   2.4573   2.4759   2.4573   2.4759   2.4573   46.172   24.944   46.172   24.944 0.000000 0.000000 
1 1 1   34    0    7 o   42.584   23.924   2.0047   2.3602   2.0047   2.3602   2.0047   2.3602   42.584   23.924   42.584   23.924 0.000000 0.000000 
1 1 1   34    0    8 o   32.746   20.920   0.2924   2.3389   0.2924   2.3389   0.2924   2.3389   32.746   20.920   32.746   20.920 0.000000 0.000000 
1 1 1   34    0    9 o   25.947   17.876  -1.6236   2.3525  -1.6236   2.3525  -1.6236   2.3525   25.947   17.876   25.947   17.876 0.000000 0.000000 
1 1 1   34    0   10 o  131.324   13.055   13.781   2.5647   13.781   2.5647   13.781   2.5647  131.324   13.055  131.324   13.055 0.000000 0.000000 
1 1 1   34    0   11 o   73.781   24.702   5.5474   2.4888   5.5474   2.4888   5.5474   2.4888   73.781   24.702   73.781   24.702 0.000000 0.000000 
1 1 1   34    0   12 o  176.104   10.148   24.197   2.7147   24.197   2.7147   24.197   2.7147  176.104   10.148  176.104   10.148 0.000000 0.000000 
1 1 1   34    0   13 o   35.651   21.832   0.9530   2.2790   0.9530   2.2790   0.9530   2.2790   35.651   21.832   35.651   21.832 0.000000 0.000000 
1 1 1   34    0   14 o  108.568   30.857   11.580   4.4425   11.580   4.4425   11.580   4.4425  108.568   30.857  108.568   30.857 0.000000 0.000000 
1 1 1   34    0   15 o   32.282   22.570  -3.6244   4.1249  -3.6244   4.1249  -3.6244   4.1249   32.282   22.570   32.282   22.570 0.000000 0.000000 
1 1 1   34    0   16 f   84.876   33.557   8.1912   4.1957   8.1912   4.1957   8.1912   4.1957   84.876   33.557   84.876   33.557 0.000000 0.000000 
1 1 1   34    0   17 o   73.541   36.264   6.9260   4.8865   6.9260   4.8865   6.9260   4.8865   73.541   36.264   73.541   36.264 0.000000 0.000000 
1 1 1   34    0   18 o   43.582   27.678   1.0108   4.0203   1.0108   4.0203   1.0108   4.0203   43.582   27.678   43.582   27.678 0.000000 0.000000 
1 1 1   34    0   19 o   96.355   28.192   9.2061   3.6112   9.2061   3.6112   9.2061   3.6112   96.355   28.192   96.355   28.192 0.000000 0.000000 
1 1 1   34    0   20 o   38.357   24.781   0.3515   3.4008   0.3515   3.4008   0.3515   3.4008   38.357   24.781   38.357   24.781 0.000000 0.000000 
1 1 1   34    0   21 f   34.100   22.851  -0.8308   3.3301  -0.8308   3.3301  -0.8308   3.3301   34.100   22.851   34.100   22.851 0.000000 0.000000 
1 1 1   34    0   22 o   30.390   20.966  -2.0818   3.2624  -2.0818   3.2624  -2.0818   3.2624   30.390   20.966   30.390   20.966 0.000000 0.000000 
1 1 1   34    0   23 o   44.311   26.865   1.8907   3.3753   1.8907   3.3753   1.8907   3.3753   44.311   26.865   44.311   26.865 0.000000 0.000000 
1 1 1   34    0   24 o   41.337   25.878   1.2344   3.3774   1.2344   3.3774   1.2344   3.3774   41.337   25.878   41.337   25.878 0.000000 0.000000 
1 1 1   34    0   25 o   75.909   42.889   8.6351   7.6430   8.6351   7.6430   8.6351   7.6430   75.909   42.889   75.909   42.889 0.000000 0.000000 
1 1 1   34    1    0 o  171.505   13.789   23.291   3.5659   23.291   3.5659   23.291   3.5659  171.505   13.789  171.505   13.789 0.000000 0.000000 
1 1 1   34    1    1 o   81.224   18.477   5.5269   2.2454   3.6499   3.2397   7.2621   3.1149   68.710   24.462   91.964   22.348 -23.25457 33.13392 
1 1 1   34    1    2 o   33.814   15.899  -2.0592   2.1067  -3.5857   3.0067  -0.5870   2.9526   38.408   18.330   46.841   20.755 -8.432186 27.69059 
1 1 1   34    1    3 o   99.261   16.850   8.0863   2.4686   7.1813   3.1063   9.6375   4.0668   91.406   22.381  104.710   25.591 -13.30412 33.99734 
1 1 1   34    1    4 o   58.430   17.844   2.7832   1.7425   4.9399   2.5502   0.8945   2.3864   76.242   21.124   48.825   20.011 27.41690 29.09744 
1 1 1   34    1    5 o  107.134   11.269   9.0665   1.8202   8.0392   2.6339   10.006   2.5183   98.429   18.151  111.268   15.183 -12.83913 23.66413 
1 1 1   34    1    6 o  135.570   9.4987   14.352   1.9586   14.336   3.0672   14.363   2.5450  133.428   15.295  134.658   12.490 -1.230652 19.74672 
1 1 1   34    1    7 o  126.135   9.4024   12.430   1.8022   12.266   2.6607   12.569   2.4499  123.660   14.322  125.725   12.914 -2.065170 19.28454 
1 1 1   34    1    8 o   64.751   17.810   3.4993   1.8203   2.7451   2.9479   3.9641   2.3142   62.250   23.156   68.722   20.470 -6.472023 30.90667 
1 1 1   34    1    9 o   46.056   18.987   0.7209   2.1643   2.1943   2.7676  -1.5988   3.4726   58.239   22.265   47.444   21.629 10.79516 31.04065 
1 1 1   34    1   10 o   77.163   15.023   4.8888   1.7106   4.3406   2.4608   5.4012   2.3795   71.578   21.055   79.766   19.624 -8.188248 28.78229 
1 1 1   34    1   11 o   50.410   17.465   1.9037   1.6436   3.3700   2.4848   0.7632   2.1915   64.499   21.489   46.462   19.124 18.03699 28.76686 
1 1 1   34    1   12 o   40.374   17.237   0.1401   1.8834   4.7058   4.3280  -0.9265   2.0918   76.672   28.141   37.579   16.995 39.09369 32.87483 
1 1 1   34    1   13 o   28.889   13.914  -2.6175   1.8239  -6.2969   4.4145  -1.8602   2.0028   43.754   21.214   33.222   15.583 10.53154 26.32220 
1 1 1   34    1   14 o   58.071   18.422   2.7457   1.8384  -0.7524   4.5586   3.4251   2.0090   56.929   25.471   63.993   19.075 -7.063770 31.82196 
1 1 1   34    1   15 o  155.191   9.7310   18.852   2.2998   15.147   4.8676   19.917   2.6094  131.044   25.182  159.133   10.777 -28.08931 27.39144 
1 1 1   34    1   16 o   95.350   12.483   7.2917   1.7781   13.695   4.6957   6.2199   1.9211  123.972   25.594   87.089   14.950 36.88327 29.64080 
1 1 1   34    1   17 o   56.542   21.972   2.0165   2.7271  -3.0220   4.5791   4.7858   3.3948   50.963   23.794   74.677   25.119 -23.71446 34.59892 
1 1 1   34    1   18 o  109.346   17.444   9.9652   2.8215   14.164   5.7938   8.6597   3.2305  121.314   31.067   99.609   21.794 21.70498 37.94895 
1 1 1   34    1   19 o   78.562   20.556   5.3774   2.5004   13.359   4.3243   1.3687   3.0647  122.700   23.884   54.877   22.605 67.82356 32.88536 
1 1 1   34    1   20 o   75.962   23.497   5.1201   3.0102   0.0000   0.0000   5.1201   3.0102  ?   ?    75.962   23.497 0.000000 23.49659 
1 1 1   34    1   21 o   56.992   22.167   2.1545   2.7777   0.2550   7.2933   2.4767   3.0041   70.088   31.713   59.742   23.104 10.34621 39.23635 
1 1 1   34    1   22 o   58.204   22.501   2.3446   2.8484   3.0145   7.1839   2.2196   3.1027   75.732   33.002   58.685   23.245 17.04715 40.36718 
1 1 1   34    1   23 o   36.778   17.164  -1.8069   2.3785  -4.2595   3.5736   0.1438   3.1871   40.671   19.561   50.002   21.880 -9.331146 29.34918 
1 1 1   34    1   24 o   62.343   21.575   3.2604   2.5078  -2.1856   3.6663   8.0490   3.4379   45.976   21.407   93.410   23.936 -47.43356 32.11224 
1 1 1   34    1   25 o   67.527   21.849   4.0212   2.5764   3.2443   3.7872   4.6905   3.5152   65.561   25.773   72.370   25.512 -6.809860 36.26418 
1 1 1   34    2    0 o   72.162   28.947   5.7881   3.1073   5.7881   3.1073   5.7881   3.1073   72.162   28.947   72.162   28.947 0.000000 0.000000 
1 1 1   34    2    1 o   84.574   20.790   6.0845   2.6723   5.6153   3.2042   7.1566   4.8435   80.826   24.090   90.201   30.000 -9.374931 38.47441 
1 1 1   34    2    2 o   71.109   21.925   4.2335   2.6233   2.0503   3.1814   8.8714   4.6370   59.817   23.588   99.291   28.816 -39.47362 37.23915 
1 1 1   34    2    3 o   53.501   20.096   1.8714   2.2309   0.0856   3.1020   3.7848   3.2108   50.537   21.855   69.358   24.389 -18.82119 32.74836 
1 1 1   34    2    4 o  141.795   9.5487   15.693   2.0603   10.450   3.3085   19.015   2.6333  111.692   20.091  155.618   11.129 -43.92614 22.96745 
1 1 1   34    2    5 f  126.194   9.8037   12.460   1.8788   10.703   2.8421   13.823   2.5039  114.518   16.706  132.078   12.536 -17.55975 20.88630 
1 1 1   34    2    6 o  103.235   13.405   8.5368   2.0681   6.7872   2.7480   10.822   3.1407   89.364   20.523  114.323   18.587 -24.95946 27.68888 
1 1 1   34    2    7 o   50.965   18.143   1.8763   1.7821   6.1740   2.8797  -0.7910   2.2687   84.712   22.010   39.953   17.915 44.75889 28.37940 
1 1 1   34    2    8 o  116.929   10.162   10.732   1.8006   11.690   2.7200   9.9837   2.4023  120.352   15.098  111.347   14.435 9.004959 20.88809 
1 1 1   34    2    9 o   63.611   18.644   3.3669   1.9325   1.6119   4.0298   3.8910   2.2022   62.156   25.791   68.057   19.890 -5.901604 32.56919 
1 1 1   34    2   10 o   54.639   18.741   2.2898   1.8902   5.3211   4.1684   1.5052   2.1207   79.592   27.800   50.335   19.427 29.25743 33.91552 
1 1 1   34    2   11 o   66.409   17.696   3.6965   1.8312  -3.8409   4.2791   5.3864   2.0261   47.588   22.463   80.410   16.994 -32.82210 28.16690 
1 1 1   34    2   12 o  126.604   10.140   12.580   1.9484   0.0000   0.0000   12.580   1.9484  ?   ?   126.604   10.140 0.000000 10.13980 
1 1 1   34    2   13 o   42.247   16.091   1.0659   1.4423   4.2186   4.5734   0.7177   1.5198   74.953   28.629   40.344   16.174 34.60910 32.88170 
1 1 1   34    2   14 o   80.867   11.916   5.2442   1.4307   2.5395   4.7746   5.5110   1.4996   68.750   28.255   82.853   12.189 -14.10310 30.77226 
1 1 1   34    2   15 o  103.368   24.458   9.4676   3.8094   11.716   4.9427   6.1778   5.9784  112.724   28.601   85.779   32.740 26.94485 43.47324 
1 1 1   34    2   16 o   99.780   13.650   8.0428   2.0301   4.6518   4.8605   8.7594   2.2343   77.084   29.497  103.888   14.442 -26.80455 32.84251 
1 1 1   34    2   17 o  138.141   7.6434   14.833   1.6099   6.7578   4.9985   15.768   1.7005   86.449   30.428  142.385   7.8327 -55.93572 31.41949 
1 1 1   34    2   18 o   79.469   12.049   5.0924   1.4197   1.8186   4.7859   5.4082   1.4866   65.437   27.690   81.880   12.237 -16.44261 30.27303 
1 1 1   34    2   19 o   59.418   20.650   2.8148   2.2985  -0.5322   5.7312   3.4563   2.5091   62.693   28.262   64.421   21.595 -1.727901 35.56841 
1 1 1   34    2   20 o   40.817   18.176  -0.5102   2.2922   4.8779   4.4302  -2.4799   2.6786   75.954   28.360   37.761   17.808 38.19249 33.48797 
1 1 1   34    2   21 o   86.451   18.997   6.4491   2.4452   6.5341   4.5266   6.4140   2.9056   83.729   28.985   84.775   22.149 -1.045929 36.47892 
1 1 1   34    2   22 o   76.911   20.287   5.2045   2.4226   4.2275   4.2898   5.6620   2.9356   72.093   27.682   79.269   22.906 -7.175903 35.92975 
1 1 1   34    2   23 o  106.837   16.102   9.5261   2.5514   14.794   4.6059   7.1941   3.0645  127.467   24.497   89.260   22.451 38.20655 33.22906 
1 1 1   34    2   24 o   50.087   20.301   1.3125   2.4232  -0.4448   4.2807   2.1411   2.9395   54.505   24.512   57.201   22.636 -2.695717 33.36481 
1 1 1   34    2   25 f   51.410   22.669   0.0962   3.4802  -1.1616   3.9852   4.1364   7.1425   50.631   23.116   77.116   33.256 -26.48528 40.50102 
1 1 1   34    3    0 o   78.014   37.899   7.6262   5.3042   7.6262   5.3042   7.6262   5.3042   78.014   37.899   78.014   37.899 0.000000 0.000000 
1 1 1   34    3    1 o   62.693   22.590   2.9205   2.7707   3.3308   5.2272   2.7601   3.2675   74.266   29.917   63.857   24.244 10.40902 38.50703 
1 1 1   34    3    2 o   63.507   20.387   3.2805   2.2464   6.4912   3.2385   0.3026   3.1188   86.537   23.736   51.516   22.092 35.02106 32.42626 
1 1 1   34    3    3 f   80.263   16.259   5.3172   1.9289   4.8368   3.3237   5.5612   2.3687   75.897   24.832   81.186   19.338 -5.289032 31.47383 
1 1 1   34    3    4 o   40.577   17.619  -0.1281   2.0323   0.4652   3.0781  -0.5866   2.7059   51.867   22.087   44.754   19.848 7.113224 29.69491 
1 1 1   34    3    5 o   98.126   12.148   7.6626   1.7855   8.0501   2.7519   7.3809   2.3465   98.117   19.010   94.693   16.805 3.423187 25.37312 
1 1 1   34    3    6 o  157.867   8.0592   19.339   1.9409   21.170   3.0460   18.088   2.5183  163.756   12.241  151.788   10.912 11.96703 16.39886 
1 1 1   34    3    7 o   65.179   19.023   3.5432   2.0157   2.2862   4.1875   3.9223   2.2997   65.695   26.667   68.395   20.414 -2.700478 33.58308 
1 1 1   34    3    8 o  116.106   12.036   10.688   2.1079   9.5716   5.8258   10.856   2.2611  101.344   32.862  116.742   12.867 -15.39737 35.29145 
1 1 1   34    3    9 o   88.562   24.209   6.8676   3.3755   2.9008   4.3788   12.677   5.2993   68.949   27.519  117.665   29.484 -48.71656 40.33093 
1 1 1   34    3   10 o   53.256   22.838   0.4145   3.3331  -1.4378   4.3423   3.0710   5.2002   53.894   24.420   72.730   29.642 -18.83553 38.40577 
1 1 1   34    3   11 o   71.569   25.452   4.0980   3.5060   4.6023   4.5569   3.3665   5.4885   76.797   28.746   74.721   30.453 2.075836 41.87741 
1 1 1   34    3   12 o  134.793   18.221   14.993   3.6629   18.748   4.8965   10.221   5.5197  148.528   22.221  104.212   31.744 44.31544 38.74883 
1 1 1   34    3   13 f   77.224   25.887   5.0891   3.6055   2.4320   4.7996   8.5307   5.4623   68.532   28.267   95.895   31.857 -27.36246 42.58941 
1 1 1   34    3   14 o   94.377   25.920   7.9918   3.8590   15.902   5.1337  -2.2842   5.8514  133.901   25.985   60.212   27.683 73.68956 37.96830 
1 1 1   34    3   15 o   56.126   25.717  -1.9630   4.9911  -1.9630   4.9911   0.0000   0.0000   56.126   25.717  ?   ?  0.000000 25.71688 
1 1 1   34    3   16 o  104.599   23.730   9.6570   3.7121   11.376   4.9001   7.3420   5.6866  110.673   28.689   89.796   32.363 20.87765 43.24817 
1 1 1   34    3   17 o   68.782   26.034   3.5676   3.7604   9.3429   4.8771  -4.8997   5.9054   99.437   29.739   54.887   26.050 44.54990 39.53502 
1 1 1   34    3   18 o  108.123   23.811   10.401   3.8342   7.1496   4.9719   15.171   6.0225   87.838   30.380  125.144   31.472 -37.30518 43.74234 
1 1 1   34    3   19 o   78.863   28.910   5.3999   4.5658  -4.8460   6.4227   15.868   6.4919   57.205   27.155  125.938   33.205 -68.73271 42.89472 
1 1 1   34    3   20 o   95.977   25.542   8.4868   3.8183   5.7330   4.7153   13.732   6.5073   80.254   29.386  115.248   34.325 -34.99460 45.18570 
1 1 1   34    3   21 o   53.615   23.716  -0.0669   3.8385   1.2356   4.6090  -3.0155   6.9347   61.904   26.705   62.194   29.116 -0.2899628 39.50859 
1 1 1   34    3   22 o   76.811   26.676   5.3249   3.8356   2.9475   4.6411   10.447   6.8123   67.779   27.857   99.138   35.454 -31.35944 45.08875 
1 1 1   34    3   23 o   81.861   17.011   5.7114   2.0619   7.8487   4.5083   5.1460   2.3186   89.747   28.888   76.526   19.683 13.22156 34.95648 
1 1 1   34    3   24 f   89.695   26.399   7.6744   3.8675   11.385   4.6446  -0.7159   6.9841  108.365   27.850   65.799   30.249 42.56674 41.11732 
1 1 1   34    3   25 o  121.919   22.110   13.285   3.9741   9.0724   4.7153   23.614   7.3839   95.099   29.406  151.493   32.795 -56.39451 44.04770 
1 1 1   34    4    0 o   35.881   23.391  -0.0721   3.1245  -0.0721   3.1245  -0.0721   3.1245   35.881   23.391   35.881   23.391 0.000000 0.000000 
1 1 1   34    4    1 o  102.505   15.187   8.5155   2.3107   8.2710   3.3582   8.7353   3.1843   97.952   22.822  101.413   21.196 -3.461655 31.14714 
1 1 1   34    4    2 f   52.054   20.624   1.4176   2.4429   0.8877   3.1025   2.2823   3.9629   53.839   22.508   64.754   26.061 -10.91482 34.43579 
1 1 1   34    4    3 o   75.360   17.865   4.7547   2.0293   2.2955   5.6944   5.1125   2.1719   72.388   30.393   78.012   18.474 -5.624313 35.56759 
1 1 1   34    4    4 o   64.903   18.780   3.5089   1.9721  -3.9764   5.9069   4.4479   2.0922   57.571   26.927   72.705   18.696 -15.13364 32.78070 
1 1 1   34    4    5 o   40.676   17.006   0.3778   1.7711  -3.5122   4.0114   1.3198   1.9739   46.540   21.901   48.207   18.704 -1.667385 28.80121 
1 1 1   34    4    6 o  105.627   11.043   8.8109   1.7589   11.283   4.2590   8.3025   1.9313  113.414   25.190  102.014   12.639 11.39995 28.18279 
1 1 1   34    4    7 o  158.747   14.230   20.125   3.4210   21.744   4.5658   18.051   5.1657  162.708   18.671  144.861   24.147 17.84694 30.52396 
1 1 1   34    4    8 o   60.941   24.560   1.9508   3.5245  -0.6274   5.2599   4.0517   4.7481   61.526   27.456   75.120   29.048 -13.59407 39.96977 
1 1 1   34    4    9 o  157.816   14.896   19.987   3.5557   21.216   4.6304   18.221   5.5510  160.234   19.266  144.061   26.137 16.17354 32.47018 
1 1 1   34    4   10 o   75.340   25.330   4.7699   3.4521   3.6649   4.5582   6.2559   5.2862   72.713   28.364   85.712   31.155 -12.99924 42.13268 
1 1 1   34    4   11 o   61.992   24.641   2.2416   3.4976   2.2345   4.6090   2.2513   5.3708   67.119   27.693   70.414   29.538 -3.294930 40.49004 
1 1 1   34    4   12 o   66.574   25.443   3.1011   3.6135   4.3878   4.8251   1.4579   5.4527   76.415   29.354   68.147   29.217 8.267891 41.41643 
1 1 1   34    4   13 o   78.168   26.105   5.2482   3.6663   3.4706   4.8519   7.6140   5.5975   72.632   28.974   91.621   32.203 -18.98914 43.31901 
1 1 1   34    4   14 o   56.616   25.888  -1.8613   5.0224  -1.8613   5.0224   0.0000   0.0000   56.616   25.888  ?   ?  0.000000 25.88834 
1 1 1   34    4   15 o  101.888   24.903   9.2637   3.8509   8.5548   5.1246   10.183   5.8366   95.613   30.802  102.789   32.847 -7.176636 45.02984 
1 1 1   34    4   16 f   74.313   26.314   4.6192   3.7439   5.9088   5.1657   3.1924   5.4337   82.914   30.690   73.016   30.091 9.898453 42.98081 
1 1 1   34    4   17 o   46.955   21.682  -2.0457   3.6451  -2.6125   4.9434  -1.3703   5.3963   53.982   25.040   59.373   27.027 -5.391544 36.84359 
1 1 1   34    4   18 o   69.527   26.070   3.7824   3.7514   0.3584   4.8471   8.8968   5.9239   60.944   26.818   95.527   33.154 -34.58269 42.64233 
1 1 1   34    4   19 o   46.506   21.628  -2.3464   3.7248  -3.8763   4.6659   0.3415   6.1848   49.278   23.320   66.642   29.753 -17.36415 37.80322 
1 1 1   34    4   20 o   50.284   23.467  -2.7087   4.4471   5.7373   6.2653 -11.2845   6.3132   82.370   32.904   47.509   23.501 34.86093 40.43425 
1 1 1   34    4   21 o   75.141   26.220   5.0034   3.7076   4.3040   4.5153   6.4507   6.4958   73.105   28.310   84.701   33.608 -11.59604 43.94278 
1 1 1   34    4   22 o   75.657   26.348   5.1391   3.7430   4.6145   4.5572   6.2267   6.5617   74.232   28.525   83.529   33.564 -9.297287 44.04788 
1 1 1   34    4   23 o   45.623   21.364  -2.5463   3.7375  -2.4706   4.4967  -2.7152   6.7218   50.667   23.630   61.190   28.653 -10.52363 37.13952 
1 1 1   34    4   24 o   63.335   25.440   2.7395   3.7679   6.2060   4.5875  -4.4470   6.6053   80.923   29.078   57.450   27.348 23.47284 39.91822 
1 1 1   34    4   25 o   59.081   24.545   1.8869   3.6563   0.4532   4.3855   5.1557   6.6218   57.479   25.391   78.882   32.923 -21.40366 41.57640 
1 1 1   34    5    0 o   60.789   28.314   4.3757   2.9293   4.3757   2.9293   4.3757   2.9293   60.789   28.314   60.789   28.314 0.000000 0.000000 
1 1 1   34    5    1 o   44.231   19.081   0.0244   2.3529  -2.0670   2.9682   3.5604   3.8595   42.031   19.464   70.128   26.414 -28.09737 32.81076 
1 1 1   34    5    2 o   36.622   16.632  -1.0204   2.0285  -4.4624   2.9332   2.1349   2.8083   35.756   17.325   58.184   22.384 -22.42815 28.30569 
1 1 1   34    5    3 f   41.193   17.294   0.3468   1.8433   2.9966   5.0985  -0.0516   1.9770   72.343   29.403   40.389   17.457 31.95390 34.19438 
1 1 1   34    5    4 o   79.667   15.056   5.1987   1.7687  -0.6168   5.3118   5.9239   1.8757   61.937   27.619   85.216   14.925 -23.27966 31.39310 
1 1 1   34    5    5 o   39.157   18.465  -2.8042   2.8785  -5.5804   3.8285   0.8061   4.3659   40.917   19.818   61.068   26.162 -20.15140 32.82122 
1 1 1   34    5    6 o   68.995   23.656   3.8422   3.0117   5.2108   4.0718   2.1891   4.4750   78.978   27.482   66.601   27.361 12.37619 38.78022 
1 1 1   34    5    7 o   52.004   21.971   0.6435   3.0056   3.6564   4.0911  -2.8894   4.4300   71.232   27.108   50.835   23.623 20.39660 35.95714 
1 1 1   34    5    8 o   72.785   23.805   4.4399   3.0543   1.0932   4.0786   8.7132   4.6088   60.396   25.559   97.911   28.819 -37.51563 38.51992 
1 1 1   34    5    9 o   59.225   24.586   1.3957   3.6645   3.3261   5.9186   0.1958   4.6664   76.128   31.393   60.571   26.491 15.55712 41.07687 
1 1 1   34    5   10 o   63.069   24.277   2.6427   3.3048   1.6100   4.4028   3.9755   5.0017   63.872   26.767   75.370   29.622 -11.49792 39.92383 
1 1 1   34    5   11 o   52.428   22.679   0.2075   3.3420  -1.6222   4.5360   2.3802   4.9429   54.511   24.800   69.034   28.597 -14.52338 37.85294 
1 1 1   34    5   12 o   56.058   23.736   0.8580   3.5204   0.6203   4.6788   1.1680   5.3443   61.773   26.777   66.721   28.770 -4.948589 39.30312 
1 1 1   34    5   13 o   92.980   30.267   7.9434   4.9400   7.9434   4.9400   0.0000   0.0000   92.980   30.267  ?   ?  0.000000 30.26730 
1 1 1   34    5   14 o   62.220   25.239   2.0871   3.7483  -0.2564   4.8658   5.5077   5.8786   59.905   26.589   82.980   32.256 -23.07507 41.80214 
1 1 1   34    5   15 o   64.944   25.618   2.7207   3.7538   3.9849   4.9780   1.0541   5.7155   74.628   29.481   67.557   29.438 7.071259 41.66224 
1 1 1   34    5   16 o   84.195   26.433   6.3778   3.7938   6.1075   4.8425   6.8074   6.1046   83.233   29.879   87.661   33.173 -4.428505 44.64487 
1 1 1   34    5   17 o   75.335   26.439   4.8620   3.7724   1.2187   4.8824   10.259   5.9423   63.878   27.522  101.899   33.197 -38.02188 43.12190 
1 1 1   34    5   18 o   49.898   22.662  -1.2372   3.7670  -0.4458   4.7752  -2.5411   6.1297   58.187   26.049   60.107   27.882 -1.920101 38.15701 
1 1 1   34    5   19 o   61.075   25.156   1.9639   3.7950  -0.6632   4.7327   6.6954   6.3515   57.157   25.732   86.167   33.518 -29.01027 42.25693 
1 1 1   34    5   20 o   85.211   29.624   6.8211   4.7308  -4.2305   6.7643   17.402   6.6187   59.426   28.109  131.387   32.966 -71.96151 43.32307 
1 1 1   34    5   21 o  124.462   20.757   13.443   3.8150   13.808   4.6840   12.724   6.5756  122.377   25.818  109.436   34.853 12.94073 43.37420 
1 1 1   34    5   22 o   57.135   24.301   1.2058   3.7177   3.1747   4.5262  -2.8771   6.5179   68.094   27.693   60.209   28.200 7.885185 39.52378 
1 1 1   34    5   23 o   43.656   20.731  -3.4167   3.7498   0.6899   4.5668 -11.9151   6.5696   59.393   26.085   47.613   23.626 11.77999 35.19409 
1 1 1   34    5   24 o   52.582   23.469  -0.2275   3.8454  -4.8988   4.6566   9.7881   6.8186   46.539   22.370   95.046   35.244 -48.50783 41.74392 
1 1 1   34    6    0 o  167.619   19.544   23.040   4.8363   23.040   4.8363   23.040   4.8363  167.619   19.544  167.619   19.544 0.000000 0.000000 
1 1 1   34    6    1 o   91.081   18.369   6.9313   2.4725   4.5439   4.4728   7.9817   2.9670   76.633   28.519   96.982   20.622 -20.34901 35.19415 
1 1 1   34    6    2 o  125.197   13.848   12.536   2.6093   14.786   4.9422   11.667   3.0725  129.915   25.763  119.303   17.332 10.61164 31.05106 
1 1 1   34    6    3 o   67.687   16.413   3.8118   1.6829  -3.0522   4.8210   4.7643   1.7958   53.039   24.646   75.909   15.962 -22.87018 29.36345 
1 1 1   34    6    4 o   65.195   24.564   2.9919   3.3381   5.3373   4.8897   0.9449   4.5682   81.176   29.894   62.601   26.789 18.57500 40.14065 
1 1 1   34    6    5 o   61.261   22.913   2.6189   2.8942   2.5027   3.7869   2.7821   4.4879   64.732   25.668   68.965   27.742 -4.232643 37.79511 
1 1 1   34    6    6 f   67.354   23.587   3.5866   3.0017  -1.2960   3.8705   10.955   4.7548   51.205   23.141  110.007   28.129 -58.80157 36.42447 
1 1 1   34    6    7 o  104.794   19.873   9.2484   3.0710   14.133   4.1974   3.6216   4.5050  128.922   22.064   72.425   28.213 56.49631 35.81653 
1 1 1   34    6    8 o   54.061   22.432   1.0566   3.0488   0.8365   4.1196   1.3233   4.5333   59.648   25.480   63.564   26.926 -3.916714 37.07045 
1 1 1   34    6    9 o   70.349   24.525   4.0000   3.2432   5.1129   4.3539   2.6127   4.8612   78.737   28.324   69.632   28.552 9.104988 40.21741 
1 1 1   34    6   10 o  135.903   19.871   15.434   4.0114   16.715   6.3588   14.588   5.1699  133.554   31.600  127.535   27.308 6.018806 41.76422 
1 1 1   34    6   11 o  132.316   24.152   15.219   4.7111   15.219   4.7111   0.0000   0.0000  132.316   24.152  ?   ?  0.000000 24.15173 
1 1 1   34    6   13 o  122.563   19.889   12.649   3.6033   11.628   4.8985   13.854   5.3191  112.399   28.448  122.694   28.814 -10.29472 40.49137 
1 1 1   34    6   14 o   63.279   24.846   2.5726   3.5155   1.5508   4.7545   3.8051   5.2218   64.869   27.532   74.747   29.975 -9.878098 40.70008 
1 1 1   34    6   15 o   55.218   23.779   0.5351   3.6411   5.1632   4.8527  -5.4267   5.5078   79.074   29.651   51.839   24.759 27.23431 38.62882 
1 1 1   34    6   16 o  158.229   17.020   20.584   4.0572   21.742   5.2641   18.889   6.3676  158.978   22.242  141.574   30.300 17.40320 37.58705 
1 1 1   34    6   17 o   54.702   24.169  -0.1245   3.9760  -4.1160   4.9738   6.9410   6.6175   50.835   24.063   88.067   34.225 -37.23214 41.83783 
1 1 1   34    6   18 o  148.112   18.992   18.462   4.2064   12.760   5.2036   29.214   7.1452  115.594   29.355  179.417   26.843 -63.82307 39.77829 
1 1 1   34    6   19 o   57.255   24.462   1.0062   3.7980  -3.0721   4.6211   9.4963   6.6675   50.564   23.702   96.615   35.009 -46.05071 42.27786 
1 1 1   34    6   20 o   83.631   26.800   6.4962   3.8832   4.8369   4.7211   9.9669   6.8281   75.891   29.064   97.797   35.429 -21.90599 45.82491 
1 1 1   34    6   21 o   60.135   26.570   0.4442   4.8052   4.2098   6.9398  -3.0239   6.6599   78.145   33.218   60.713   28.458 17.43145 43.74147 
1 1 1   34    6   22 o   39.996   19.424  -5.2506   3.7427  -3.8095   4.5456  -8.2841   6.5951   48.134   22.848   52.083   25.403 -3.948498 34.16660 
1 1 1   34    6   23 o   68.466   26.084   3.8178   3.7903   1.3375   4.6799   8.5467   6.4619   61.850   26.795   90.885   34.189 -29.03488 43.43840 
1 1 1   34    6   24 o   59.058   24.775   1.7300   3.7785   1.0901   4.6194   3.0239   6.5683   60.605   26.436   72.852   31.653 -12.24713 41.24038 
1 1 1   34    7    0 o   67.863   35.673   5.7985   4.9090   5.7985   4.9090   5.7985   4.9090   67.863   35.673   67.863   35.673 0.000000 0.000000 
1 1 1   34    7    1 o  151.452   20.712   19.162   4.6754   0.0000   0.0000   19.162   4.6754  ?   ?   151.452   20.712 0.000000 20.71150 
1 1 1   34    7    2 o   46.972   17.108   1.5115   1.5952   0.9099   4.6917   1.5902   1.6963   63.101   27.079   48.227   17.630 14.87429 32.31266 
1 1 1   34    7    3 o   71.621   24.391   4.2043   3.2013   2.2550   4.7628   5.8107   4.3237   68.093   28.128   82.434   28.340 -14.34026 39.92963 
1 1 1   34    7    4 o  119.169   19.405   11.842   3.4177   11.529   5.1209   12.094   4.5893  112.152   29.453  116.735   26.314 -4.583527 39.49574 
1 1 1   34    7    5 o   72.275   23.052   4.3971   2.8758   1.2575   3.8310   8.4497   4.3526   59.642   24.980   96.782   27.870 -37.14004 37.42642 
1 1 1   34    7    6 o   77.881   23.175   5.2231   2.9671   4.2948   3.9295   6.4545   4.5257   73.778   26.854   85.839   29.002 -12.06129 39.52529 
1 1 1   34    7    7 f  147.849   14.997   17.582   3.3470   12.515   4.3111   25.270   5.3102  119.807   24.339  174.267   20.288 -54.45992 31.68602 
1 1 1   34    7    8 o   71.271   24.016   4.2032   3.1035   4.0393   4.0261   4.4432   4.8718   72.669   27.055   76.906   29.507 -4.236610 40.03296 
1 1 1   34    7    9 o  115.034   18.992   11.044   3.2273   8.4967   4.1413   14.983   5.1502   97.122   26.923  129.604   26.845 -32.48264 38.01964 
1 1 1   34    7   10 o   60.549   27.700  -1.9746   5.7591  -1.9746   5.7591   0.0000   0.0000   60.549   27.700  ?   ?  0.000000 27.69963 
1 1 1   34    7   11 o   96.446   22.505   8.0905   3.2615   5.2020   4.1961   12.499   5.1837   78.624   27.857  116.370   29.161 -37.74569 40.32828 
1 1 1   34    7   12 o   47.431   21.319  -0.9401   3.2329   4.5712   4.3273  -7.9020   4.8635   75.657   28.072   44.124   21.585 31.53236 35.41112 
1 1 1   34    7   13 o   83.554   24.889   6.1894   3.4210   6.0633   4.3843   6.3858   5.4698   82.969   28.537   85.676   31.607 -2.706909 42.58357 
1 1 1   34    7   14 f   69.817   25.443   3.8720   3.5288  -3.9534   4.5367   15.859   5.6148   48.715   23.036  131.059   28.778 -82.34410 36.86201 
1 1 1   34    7   15 o   61.375   24.781   2.1359   3.5957  -2.1689   4.6541   8.5100   5.6632   53.326   24.581   94.461   32.437 -41.13549 40.69833 
1 1 1   34    7   16 o   64.564   25.606   2.7143   3.7693   4.1673   4.8901   0.5874   5.9165   74.476   29.284   66.554   29.441 7.922241 41.52454 
1 1 1   34    7   17 o   60.429   25.144   1.7039   3.8455   9.0957   4.9208  -9.8916   6.1632   97.284   30.033   48.575   23.872 48.70812 38.36487 
1 1 1   34    7   18 o   56.021   24.307   0.5455   3.8631   1.2797   4.8221  -0.7699   6.4544   63.297   27.311   65.001   29.577 -1.704369 40.25745 
1 1 1   34    7   19 o   98.313   25.981   8.9831   3.9685   8.8933   4.8764   9.1594   6.8291   95.550   29.964   94.951   35.259 0.5995560 46.27096 
1 1 1   34    7   20 o   64.464   25.933   2.7346   3.9220  -2.1147   4.7592   12.997   6.9236   53.298   24.669  109.693   35.838 -56.39464 43.50793 
1 1 1   34    7   21 o   65.186   29.968  -1.0287   6.8551   0.0000   0.0000  -1.0287   6.8551  ?   ?    65.186   29.968 0.000000 29.96772 
1 1 1   34    7   22 o   41.002   19.862  -5.0939   3.8489  -7.3601   4.5899   0.2753   7.0648   42.270   20.738   68.321   31.032 -26.05086 37.32345 
1 1 1   34    7   23 o   77.046   24.132   5.4515   3.1640   7.1733   4.7458   4.0738   4.2450   85.563   29.676   70.614   27.421 14.94919 40.40482 
1 1 1   34    8    0 o   51.708   30.863   2.6879   4.3167   2.6879   4.3167   2.6879   4.3167   51.708   30.863   51.708   30.863 0.000000 0.000000 
1 1 1   34    8    1 o   96.768   19.982   7.9209   2.8616   4.9693   5.2481   9.1697   3.4137   80.279   30.667  103.249   22.257 -22.97005 37.89218 
1 1 1   34    8    2 o   85.726   31.629   6.1655   5.4777   6.1655   5.4777   0.0000   0.0000   85.726   31.629  ?   ?  0.000000 31.62855 
1 1 1   34    8    3 o  130.388   31.529   15.859   6.2234   15.859   6.2234   0.0000   0.0000  130.388   31.529  ?   ?  0.000000 31.52928 
1 1 1   34    8    4 o   91.971   24.878   7.4636   3.5867   2.8075   5.4258   11.077   4.7801   72.629   30.014  110.471   28.179 -37.84248 41.16923 
1 1 1   34    8    5 o   60.648   24.294   2.0195   3.4259   0.7029   5.2889   2.9712   4.4969   65.282   28.384   69.595   27.849 -4.313408 39.76456 
1 1 1   34    8    6 o   99.947   23.963   8.7551   3.6184   4.0329   5.5337   12.282   4.7824   77.252   30.900  116.905   27.233 -39.65285 41.18794 
1 1 1   34    8    7 o  107.237   23.221   9.9900   3.7011   11.068   5.6583   9.1838   4.8930  108.234   31.953   99.824   29.772 8.410309 43.67359 
1 1 1   34    8    8 o   74.644   30.640   3.2677   5.6059   3.2677   5.6059   0.0000   0.0000   74.644   30.640  ?   ?  0.000000 30.63995 
1 1 1   34    8    9 o   65.173   28.512   0.5414   5.4088   0.5414   5.4088   0.0000   0.0000   65.173   28.512  ?   ?  0.000000 28.51196 
1 1 1   34    8   10 o   82.191   29.711   5.7411   4.7979   0.0000   0.0000   5.7411   4.7979  ?   ?    82.191   29.711 0.000000 29.71061 
1 1 1   34    8   11 o   50.794   21.933   0.2308   3.1146  -0.1612   4.1401   0.7418   4.7275   56.091   24.729   62.225   26.945 -6.134048 36.57262 
1 1 1   34    8   12 o   70.715   24.813   4.0986   3.3226   4.2176   4.3615   3.9340   5.1289   73.953   28.027   74.987   29.829 -1.033440 40.92973 
1 1 1   34    8   13 o   64.874   24.766   2.9946   3.4213   5.7316   4.3683  -1.3487   5.5027   81.053   28.451   60.198   27.360 20.85425 39.47131 
1 1 1   34    8   14 o  136.647   17.920   15.498   3.6577   8.6597   4.5655   27.755   6.1119   96.267   28.769  179.548   22.750 -83.28102 36.67740 
1 1 1   34    8   15 o   44.633   20.792  -2.3966   3.4657  -0.9278   4.4451  -4.6738   5.5346   55.169   24.878   53.098   25.206 2.071243 35.41582 
1 1 1   34    8   16 o  101.714   24.244   9.3073   3.7210   5.1398   4.6472   16.753   6.2115   77.884   29.053  131.517   31.307 -53.63373 42.71110 
1 1 1   34    8   17 o   47.045   21.778  -2.0910   3.7119  -2.8550   4.7307  -0.8671   5.9873   51.798   24.184   62.837   28.551 -11.03945 37.41682 
1 1 1   34    8   18 o   52.553   24.041  -1.4980   4.3375   3.1943   6.1172  -6.2427   6.1512   73.780   31.267   53.282   25.636 20.49731 40.43288 
1 1 1   34    8   19 o   53.894   24.452  -1.0142   4.3713  -2.6456   5.9755   0.8639   6.4113   58.535   27.279   68.142   30.367 -9.606827 40.82068 
1 1 1   34    8   20 o   75.015   24.603   5.0606   3.2617   1.1586   6.0909   6.6295   3.8622   67.414   29.844   84.104   26.703 -16.68974 40.04650 
1 1 1   34    8   21 o   51.587   23.253  -0.6915   3.8781   0.0000   0.0000  -0.6915   3.8781  ?   ?    51.587   23.253 0.000000 23.25274 
1 1 1   34    8   22 o  121.544   20.005   12.830   3.5921   13.873   6.2809   12.323   4.3790  114.214   33.650  114.890   25.561 -0.6756897 42.25731 
1 1 1   34    8   23 o   47.616   21.319  -0.4848   3.1993  -1.0738   4.7338   0.0105   4.3408   55.100   25.171   56.003   24.970 -0.9031639 35.45539 
1 1 1   34    9    0 o   27.908   19.683  -3.6686   3.3510  -3.6686   3.3510  -3.6686   3.3510   27.908   19.683   27.908   19.683 0.000000 0.000000 
1 1 1   34    9    1 o  104.504   27.640   9.8822   4.4892   9.8822   4.4892   0.0000   0.0000  104.504   27.640  ?   ?  0.000000 27.64025 
1 1 1   34    9    3 o   50.410   24.306  -6.8930   5.6009  -6.8930   5.6009   0.0000   0.0000   50.410   24.306  ?   ?  0.000000 24.30634 
1 1 1   34    9    4 o  100.162   34.462   9.4586   6.3940   9.4586   6.3940   0.0000   0.0000  100.162   34.462  ?   ?  0.000000 34.46205 
1 1 1   34    9    5 f   83.428   27.179   6.1017   3.9831  -0.5182   6.4044   10.277   5.0865   67.157   30.109  105.260   30.073 -38.10220 42.55456 
1 1 1   34    9    6 o   82.152   28.737   5.7888   4.4548   5.7888   4.4548   0.0000   0.0000   82.152   28.737  ?   ?  0.000000 28.73672 
1 1 1   34    9    7 o   76.288   28.152   4.6497   4.3400   4.6497   4.3400   0.0000   0.0000   76.288   28.152  ?   ?  0.000000 28.15180 
1 1 1   34    9    8 o   58.574   23.217   1.9796   3.0971   2.7707   4.3446   1.1623   4.4160   67.906   27.303   62.155   26.461 5.751831 38.02152 
1 1 1   34    9    9 o  160.831   14.570   20.779   3.5478   20.073   4.6823   21.731   5.4366  154.763   20.252  159.225   22.972 -4.462296 30.62428 
1 1 1   34    9   10 o   44.758   20.358  -1.3256   3.0538  -3.2630   4.1228   1.0296   4.5457   47.563   22.325   62.203   26.673 -14.63984 34.78324 
1 1 1   34    9   11 o  183.408   16.633   27.406   4.6187   29.195   7.1828   26.145   6.0307  181.266   26.687  174.343   23.173 6.922668 35.34418 
1 1 1   34    9   12 o   94.259   23.866   7.8956   3.4468   9.1832   4.5184   6.1034   5.3305   99.472   28.317   83.973   31.157 15.49955 42.10277 
1 1 1   34    9   13 o  111.897   22.116   10.884   3.6536   8.8941   4.7722   13.703   5.6795   97.168   29.498  119.666   30.820 -22.49799 42.66188 
1 1 1   34    9   14 o   81.524   25.395   5.9579   3.5093   2.1944   4.4801   11.934   5.6454   65.426   27.174  110.537   31.714 -45.11063 41.76362 
1 1 1   34    9   15 o   78.363   25.930   5.4628   3.6201   1.3307   4.5712   12.414   5.9288   62.597   26.792  111.662   32.635 -49.06602 42.22429 
1 1 1   34    9   16 o  123.145   21.343   13.141   3.8772   11.397   4.8126   16.367   6.5447  109.666   28.433  127.716   33.179 -18.05066 43.69570 
1 1 1   34    9   17 o   92.190   26.130   7.8924   3.8560   5.9550   4.8766   11.125   6.2988   81.352   29.869  103.838   34.195 -22.48619 45.40384 
1 1 1   34    9   18 o   93.674   22.270   7.8300   3.1463   4.5542   5.1074   9.8335   3.9942   75.540   29.855  103.195   25.447 -27.65573 39.22861 
1 1 1   34    9   19 o   84.107   23.729   6.4490   3.1875   4.8811   5.1514   7.4218   4.0575   76.605   30.076   88.490   27.264 -11.88540 40.59459 
1 1 1   34    9   20 o   88.666   22.430   7.0951   3.0462   1.9129   4.8722   10.421   3.9032   64.792   27.694  106.527   24.455 -41.73524 36.94634 
1 1 1   34    9   21 o   47.167   21.619  -1.4084   3.5310  -6.6803   8.2097  -0.2118   3.9113   60.917   29.387   53.159   23.702 7.758106 37.75426 
1 1 1   34    9   22 o   61.195   23.431   2.8188   3.0679   8.4156   4.8375  -0.9468   3.9680   91.643   29.957   51.193   23.254 40.44997 37.92344 
1 1 1   34   10    0 o  112.256   17.071   10.522   2.7321   10.522   2.7321   10.522   2.7321  112.256   17.071  112.256   17.071 0.000000 0.000000 
1 1 1   34   10    1 o   98.466   25.761   8.6511   3.9272   8.6511   3.9272   0.0000   0.0000   98.466   25.761  ?   ?  0.000000 25.76076 
1 1 1   34   10    3 o  235.008   17.156   44.846   6.1286   44.846   6.1286   0.0000   0.0000  235.008   17.156  ?   ?  0.000000 17.15617 
1 1 1   34   10    4 o   67.121   29.401   0.6348   5.7674   0.6348   5.7674   0.0000   0.0000   67.121   29.401  ?   ?  0.000000 29.40091 
1 1 1   34   10    5 o   81.605   32.972   4.6870   6.3700   4.6870   6.3700   0.0000   0.0000   81.605   32.972  ?   ?  0.000000 32.97177 
1 1 1   34   10    6 o   82.256   28.641   5.8552   4.4228   5.8552   4.4228   0.0000   0.0000   82.256   28.641  ?   ?  0.000000 28.64126 
1 1 1   34   10    7 o  107.599   21.201   9.9111   3.3675   15.557   4.7915   4.4009   4.7336  133.460   24.353   75.977   29.101 57.48396 37.94653 
1 1 1   34   10    8 o  104.388   21.905   9.4148   3.3884   3.8463   4.6585   15.670   4.9375   73.310   28.653  133.346   25.113 -60.03594 38.10059 
1 1 1   34   10    9 o   84.870   24.841   6.3980   3.4328   6.2682   4.7414   6.5411   4.9764   84.310   29.638   85.830   30.344 -1.519585 42.41666 
1 1 1   34   10   10 o  170.282   14.324   23.293   3.6986   20.801   4.9296   26.503   5.5946  156.661   21.094  177.092   21.052 -20.43123 29.80189 
1 1 1   34   10   11 o   72.669   27.087   4.1863   4.0380  -2.3265   6.4625   8.3575   5.1719   62.632   28.903   94.159   30.985 -31.52736 42.37291 
1 1 1   34   10   12 o   70.427   25.631   4.0032   3.5795   4.1711   4.6690   3.7637   5.5750   74.091   28.761   75.124   30.663 -1.033104 42.04114 
1 1 1   34   10   13 o   94.676   24.853   8.1080   3.6472   11.339   4.9351   4.2202   5.4138  109.541   28.984   76.074   30.516 33.46712 42.08693 
1 1 1   34   10   14 o   65.880   25.419   3.1412   3.6299   4.2583   4.7635   1.5943   5.6056   74.288   28.991   67.846   29.359 6.442398 41.26103 
1 1 1   34   10   15 o  129.809   19.986   14.379   3.8435   13.851   4.9367   15.190   6.1245  122.317   27.083  123.913   32.051 -1.595566 41.96088 
1 1 1   34   10   16 o   64.872   22.832   3.4601   2.8144   2.5539   4.8830   3.9110   3.4441   67.699   28.265   68.981   25.136 -1.282005 37.82489 
1 1 1   34   10   17 o   39.108   18.437  -2.5608   2.8666  -0.5029   4.9185  -3.6195   3.5278   58.292   26.239   41.847   19.939 16.44514 32.95529 
1 1 1   34   10   18 f  119.208   18.205   12.033   3.2164   5.4839   5.3062   15.837   4.0440   79.315   30.697  135.723   20.072 -56.40775 36.67680 
1 1 1   34   10   19 o   78.076   24.228   5.5561   3.1976   0.5776   5.3537   8.3170   3.9869   62.843   27.892   93.666   26.577 -30.82373 38.52679 
1 1 1   34   10   20 o   41.851   19.478  -1.9821   3.0303  -3.8799   5.2907  -1.0556   3.6966   52.222   24.748   49.322   22.420 2.900093 33.39302 
1 1 1   34   10   21 o   91.876   25.214   7.9362   3.6531  -3.0174   7.9872   10.834   4.1080   65.220   30.756  107.606   25.357 -42.38590 39.86150 
1 1 1   34   11    1 o   77.949   24.081   5.2714   3.1629   5.2714   3.1629   0.0000   0.0000   77.949   24.081  ?   ?  0.000000 24.08077 
1 1 1   34   11    2 o   61.584   25.872   1.4211   4.1302   1.4211   4.1302   0.0000   0.0000   61.584   25.872  ?   ?  0.000000 25.87228 
1 1 1   34   11    3 o   93.186   30.076   7.9829   4.8840   7.9829   4.8840   0.0000   0.0000   93.186   30.076  ?   ?  0.000000 30.07556 
1 1 1   34   11    4 o   67.732   29.037   1.4974   5.3849   1.4974   5.3849   0.0000   0.0000   67.732   29.037  ?   ?  0.000000 29.03725 
1 1 1   34   11    5 o   90.843   32.723   7.4719   5.8133   7.4719   5.8133   0.0000   0.0000   90.843   32.723  ?   ?  0.000000 32.72343 
1 1 1   34   11    6 o  104.128   28.298   9.9960   4.6280   9.9960   4.6280   0.0000   0.0000  104.128   28.298  ?   ?  0.000000 28.29801 
1 1 1   34   11    7 o  122.720   26.637   13.577   4.8599   13.577   4.8599   0.0000   0.0000  122.720   26.637  ?   ?  0.000000 26.63701 
1 1 1   34   11    8 f   85.835   29.920   6.6071   4.8273   6.6071   4.8273   0.0000   0.0000   85.835   29.920  ?   ?  0.000000 29.92043 
1 1 1   34   11    9 o  108.411   22.039   10.204   3.5325   12.049   4.7822   7.9886   5.2407  114.483   27.611   92.385   31.209 22.09825 41.66933 
1 1 1   34   11   10 o  105.919   22.410   9.8091   3.5198   13.005   4.7628   5.9632   5.2248  119.508   26.709   82.952   30.833 36.55535 40.79302 
1 1 1   34   11   11 o   66.720   26.269   3.0328   3.9402   9.5528   6.3562  -1.0362   5.0214   98.422   34.332   58.140   26.309 40.28216 43.25331 
1 1 1   34   11   12 o   68.422   25.322   3.6964   3.5162   4.7549   4.8052   2.4762   5.1591   76.613   29.326   69.005   28.949 7.607521 41.20745 
1 1 1   34   11   13 o   69.009   22.325   4.0889   2.6898   6.0488   4.8707   3.2289   3.2265   82.233   29.903   64.918   24.210 17.31519 38.47477 
1 1 1   34   11   14 o  164.985   12.124   21.688   3.0403   14.513   5.0975   25.650   3.7878  124.975   27.403  178.357   13.987 -53.38255 30.76626 
1 1 1   34   11   15 o   96.796   25.713   8.6640   3.8742   2.4685   4.8765   19.266   6.3791   67.346   28.193  141.437   30.373 -74.09122 41.44100 
1 1 1   34   11   16 o   85.286   21.461   6.4512   2.7993   7.0734   4.9551   6.1595   3.3925   86.275   30.300   82.097   24.860 4.178795 39.19333 
1 1 1   34   11   17 o   67.595   23.385   3.8966   2.9462   5.6520   4.9960   2.9606   3.6481   79.587   30.036   64.433   25.306 15.15415 39.27523 
1 1 1   34   11   18 o   65.383   23.939   3.4839   3.1294  -7.9834   5.2158   9.9338   3.9117   45.280   22.193  103.652   24.955 -58.37159 33.39578 
1 1 1   34   11   19 o  105.966   20.784   9.8732   3.2506   6.4538   5.3528   11.871   4.0915   82.738   31.118  113.959   24.204 -31.22120 39.42325 
1 1 1   34   11   20 o   57.250   24.365   1.2664   3.7418   1.5432   5.3214   0.9957   5.2626   65.054   28.375   63.253   27.884 1.801380 39.78275 
1 1 1   34   12    1 o   96.755   20.365   8.0093   2.9206   8.0093   2.9206   0.0000   0.0000   96.755   20.365  ?   ?  0.000000 20.36514 
1 1 1   34   12    2 o   62.057   24.866   2.2315   3.5906   2.2315   3.5906   0.0000   0.0000   62.057   24.866  ?   ?  0.000000 24.86637 
1 1 1   34   12    4 o  159.670   23.843   22.127   5.6487   22.127   5.6487   0.0000   0.0000  159.670   23.843  ?   ?  0.000000 23.84343 
1 1 1   34   12    5 o   60.415   27.213  -0.8499   5.3004  -0.8499   5.3004   0.0000   0.0000   60.415   27.213  ?   ?  0.000000 27.21274 
1 1 1   34   12    6 o  108.519   26.691   10.732   4.4028   10.732   4.4028   0.0000   0.0000  108.519   26.691  ?   ?  0.000000 26.69116 
1 1 1   34   12    7 o  107.167   27.704   10.614   4.5776   10.614   4.5776   0.0000   0.0000  107.167   27.704  ?   ?  0.000000 27.70360 
1 1 1   34   12    8 o   43.997   21.346  -6.2671   4.4908  -6.2671   4.4908   0.0000   0.0000   43.997   21.346  ?   ?  0.000000 21.34636 
1 1 1   34   12    9 o  111.594   28.250   11.628   4.8299   11.628   4.8299   0.0000   0.0000  111.594   28.250  ?   ?  0.000000 28.25010 
1 1 1   34   12   10 f   45.446   21.056  -2.1199   3.4806   2.1325   4.7527  -7.0389   5.1116   66.255   27.790   46.606   22.649 19.64856 35.85069 
1 1 1   34   12   11 o   83.762   21.639   6.1764   2.7940   12.000   6.7444   4.9699   3.0698  107.734   35.380   75.143   23.802 32.59081 42.64096 
1 1 1   34   12   12 o   95.010   19.461   7.7569   2.7349   2.5459   4.7958   10.268   3.3294   67.595   28.099  108.950   20.722 -41.35428 34.91340 
1 1 1   34   12   13 o  104.684   18.286   9.2808   2.8233   2.8589   4.9297   12.415   3.4441   69.037   28.576  120.820   19.271 -51.78343 34.46638 
1 1 1   34   12   14 o   45.488   19.979  -0.1461   2.6793  -0.9442   4.8134   0.2122   3.2251   56.678   25.693   50.797   22.125 5.881123 33.90670 
1 1 1   34   12   15 o   42.178   20.136  -3.8247   3.6345  -3.9054   4.8025  -3.7166   5.5604   49.768   23.583   54.385   25.651 -4.616756 34.84472 
1 1 1   34   12   16 o   47.376   20.651   0.1052   2.8148   1.4532   4.8609  -0.5748   3.4525   63.499   27.409   49.391   22.128 14.10706 35.22638 
1 1 1   34   12   17 o   52.331   22.118   0.9417   3.0482   6.3422   5.0841  -2.0890   3.8086   82.373   30.455   47.340   21.966 35.03297 37.55042 
1 1 1   34   12   18 o  188.051   12.176   28.303   3.4858   32.458   5.6135   25.695   4.4472  195.542   18.995  175.786   16.730 19.75629 25.31219 
1 1 1   34   12   19 o   65.657   25.694   3.2486   3.7495   6.2565   5.3677   0.3822   5.2399   81.690   31.060   61.494   27.425 20.19640 41.43502 
1 1 1   34   13    1 o   83.893   21.311   6.1279   2.7418   6.1279   2.7418   0.0000   0.0000   83.893   21.311  ?   ?  0.000000 21.31052 
1 1 1   34   13    2 o   46.457   20.797  -0.7479   3.0438  -0.7479   3.0438   0.0000   0.0000   46.457   20.797  ?   ?  0.000000 20.79738 
1 1 1   34   13    4 o   75.667   29.347   4.4112   4.8578   4.4112   4.8578   0.0000   0.0000   75.667   29.347  ?   ?  0.000000 29.34713 
1 1 1   34   13    5 o  125.266   29.686   14.786   5.6047   14.786   5.6047   0.0000   0.0000  125.266   29.686  ?   ?  0.000000 29.68560 
1 1 1   34   13    6 o   74.277   28.192   4.3814   4.4173   4.3814   4.4173   0.0000   0.0000   74.277   28.192  ?   ?  0.000000 28.19179 
1 1 1   34   13    7 o   75.863   28.619   4.6955   4.5348   4.6955   4.5348   0.0000   0.0000   75.863   28.619  ?   ?  0.000000 28.61938 
1 1 1   34   13    8 o   82.338   29.335   6.0682   4.6596   6.0682   4.6596   0.0000   0.0000   82.338   29.335  ?   ?  0.000000 29.33513 
1 1 1   34   13    9 o   38.448   18.035  -2.2715   2.6831  -3.3907   4.4686  -1.6404   3.3552   49.117   23.114   45.787   21.018 3.329590 31.24162 
1 1 1   34   13   10 o   36.966   17.669  -3.2770   2.8161  -0.3077   4.6583  -4.9872   3.5353   57.831   25.820   39.241   19.016 18.58971 32.06667 
1 1 1   34   13   11 o   65.935   24.557   3.3925   3.3174   19.755   7.2914  -0.8786   3.7253  139.366   34.391   50.539   22.784 88.82731 41.25405 
1 1 1   34   13   12 o   43.979   21.359  -6.2152   4.5258  -6.2152   4.5258   0.0000   0.0000   43.979   21.359  ?   ?  0.000000 21.35880 
1 1 1   34   13   13 o   48.527   20.700   0.5261   2.7121   1.1969   4.6472   0.1796   3.3399   61.990   26.779   51.386   22.445 10.60378 34.94106 
1 1 1   34   13   14 o   51.681   21.485   1.1004   2.8041  -4.1592   5.0074   3.5032   3.3845   50.437   23.952   66.375   24.787 -15.93827 34.46935 
1 1 1   34   13   15 o   51.153   22.853  -0.4300   3.6555  -1.1768   4.8679   0.5356   5.5355   56.065   25.578   63.635   28.297 -7.570568 38.14410 
1 1 1   34   13   16 o   73.219   22.831   4.7927   2.8357   1.8736   5.0180   6.1623   3.4372   65.249   28.003   81.641   25.084 -16.39203 37.59473 
1 1 1   34   13   17 o  117.413   21.315   12.143   3.6896   12.293   5.1948   11.990   5.2412  111.224   29.879  109.454   30.268 1.770180 42.53112 
1 1 1   34   13   18 o   97.236   25.030   8.8406   3.7473   12.982   5.2934   4.6794   5.3057  114.109   29.934   75.433   30.227 38.67572 42.54111 
1 1 1   34   14    2 o   43.217   19.980  -1.8936   3.1086  -1.8936   3.1086   0.0000   0.0000   43.217   19.980  ?   ?  0.000000 19.97952 
1 1 1   34   14    4 o  153.656   21.211   20.207   4.8555   20.207   4.8555   0.0000   0.0000  153.656   21.211  ?   ?  0.000000 21.21056 
1 1 1   34   14    5 o   82.472   30.649   5.9961   5.1621   5.9961   5.1621   0.0000   0.0000   82.472   30.649  ?   ?  0.000000 30.64903 
1 1 1   34   14    6 o   49.544   23.127  -2.7811   4.3227  -2.7811   4.3227   0.0000   0.0000   49.544   23.127  ?   ?  0.000000 23.12676 
1 1 1   34   14    7 o   57.673   22.327   2.2132   2.8076  -0.0230   4.5730   3.5661   3.5569   58.226   25.814   67.680   25.384 -9.454517 36.20350 
1 1 1   34   14    8 o  112.632   17.626   10.633   2.9391   14.798   4.8368   8.1956   3.7006  127.691   25.638   94.668   25.123 33.02320 35.89504 
1 1 1   34   14    9 o   43.694   19.701  -0.8700   2.7864   1.6154   4.6388  -2.2729   3.4852   63.566   27.093   44.892   20.892 18.67465 34.21235 
1 1 1   34   14   10 o   87.048   22.761   6.7892   3.0669   2.6090   4.8466   9.5810   3.9608   67.739   28.210  102.047   25.445 -34.30759 37.99038 
1 1 1   34   14   11 o   55.173   23.537   0.9109   3.5068   4.3011   7.2700  -0.1171   4.0033   79.729   33.948   54.463   24.149 25.26600 41.66078 
1 1 1   34   14   12 o   52.169   22.150   0.8194   3.0791   4.4516   4.7783  -1.7600   4.0267   74.312   29.026   49.800   22.921 24.51214 36.98547 
1 1 1   34   14   13 o   43.799   20.160  -1.5900   3.1152  -2.4179   4.7676  -0.9732   4.1153   52.609   24.467   52.404   23.756 0.2050591 34.10273 
1 1 1   34   14   14 o  108.734   17.868   10.025   2.8705   7.6127   4.9806   11.226   3.5126   88.309   30.414  113.175   21.052 -24.86573 36.98883 
1 1 1   34   14   15 o   43.501   20.627  -3.3131   3.6854  -4.6552   4.9110  -1.5830   5.5758   48.722   23.300   58.471   26.935 -9.748051 35.61436 
1 1 1   34   14   16 o   67.609   25.013   3.7911   3.4307  -4.2022   5.0256   10.767   4.6948   50.140   23.865  104.995   28.488 -54.85529 37.16296 
1 1 1   34   15    2 o   52.583   22.549   0.5882   3.2489   0.5882   3.2489   0.0000   0.0000   52.583   22.549  ?   ?  0.000000 22.54887 
1 1 1   34   15    4 o   99.233   27.062   9.2036   4.2238   9.2036   4.2238   0.0000   0.0000   99.233   27.062  ?   ?  0.000000 27.06183 
1 1 1   34   15    5 o   66.928   27.843   2.4752   4.7141   2.4752   4.7141   0.0000   0.0000   66.928   27.843  ?   ?  0.000000 27.84283 
1 1 1   34   15    6 o   45.628   20.004  -0.1172   2.6752  -3.1044   4.3137   1.7496   3.4101   48.598   22.819   58.257   23.903 -9.658604 33.04662 
1 1 1   34   15    7 f   98.684   19.965   8.4230   2.9122   14.553   4.6555   4.4827   3.7326  126.963   24.846   72.620   26.212 54.34322 36.11661 
1 1 1   34   15    8 o   54.238   22.048   1.5313   2.8676  -2.4440   4.7520   3.8079   3.5962   52.674   24.474   68.723   25.573 -16.04889 35.39703 
1 1 1   34   15    9 o   47.066   20.786  -0.2331   2.9374  -8.1912   4.8000   4.5317   3.7141   42.675   20.991   72.671   26.159 -29.99600 33.53930 
1 1 1   34   15   10 o   52.762   22.156   1.0338   3.0266  -1.3119   4.8660   2.5138   3.8652   55.860   25.519   63.348   25.653 -7.487564 36.18399 
1 1 1   34   15   11 o   74.833   25.879   4.9872   3.6080   3.2094   7.1308   5.5990   4.1829   76.047   33.011   78.539   27.814 -2.491768 43.16653 
1 1 1   34   15   12 f   87.881   23.719   7.0584   3.2646   8.2024   4.9979   6.2069   4.3115   91.215   30.479   81.563   28.285 9.652519 41.58128 
1 1 1   34   15   13 o   99.764   22.484   8.9410   3.3511   11.745   4.9898   6.6371   4.5230  109.450   29.232   83.581   28.972 25.86840 41.15679 
1 1 1   34   15   14 o   67.886   24.858   3.8541   3.3741  -3.5852   4.9906   10.117   4.5792   51.178   24.188  101.937   28.330 -50.75898 37.25102 
1 1 1   34   16    2 o   50.385   21.949   0.1870   3.1749   0.1870   3.1749   0.0000   0.0000   50.385   21.949  ?   ?  0.000000 21.94854 
1 1 1   34   16    3 f   71.488   26.727   4.1919   3.9370   4.1919   3.9370   0.0000   0.0000   71.488   26.727  ?   ?  0.000000 26.72668 
1 1 1   34   16    4 o   36.740   17.200  -1.9878   2.4201  -7.1594   4.0818   0.8155   3.0052   39.461   19.400   51.777   21.927 -12.31551 29.27702 
1 1 1   34   16    5 o   62.747   26.681   1.6499   4.4794   1.6499   4.4794   0.0000   0.0000   62.747   26.681  ?   ?  0.000000 26.68056 
1 1 1   34   16    6 o   97.692   20.536   8.3342   2.9733   11.539   5.1271   6.7105   3.6496  108.586   29.900   85.164   25.784 23.42111 39.48172 
1 1 1   34   16    7 o   78.587   23.932   5.5838   3.1375   6.2041   5.6298   5.3044   3.7786   82.768   31.728   76.839   26.489 5.928848 41.33231 
1 1 1   34   16    8 o  147.897   15.810   18.014   3.5236   24.480   6.4833   15.303   4.1977  162.758   26.969  132.434   21.441 30.32440 34.45349 
1 1 1   34   16    9 o   97.923   23.234   8.6742   3.4300   1.5379   6.4242   11.520   4.0566   69.616   30.743  112.528   24.266 -42.91249 39.16547 
1 1 1   34   16   10 o  160.732   15.981   21.314   3.8795   34.644   7.2664   16.000   4.5881  196.170   24.751  133.888   23.230 62.28250 33.94508 
1 1 1   34   16   11 o   73.216   28.110   4.4714   4.4231   0.0000   0.0000   4.4714   4.4231  ?   ?    73.216   28.110 0.000000 28.10962 
1 1 1   34   16   12 o   59.774   24.876   1.8396   3.7650  -4.1675   6.7754   4.5232   4.5285   58.959   27.960   73.544   28.388 -14.58500 39.84474 
1 1 1   34   17    2 o   33.399   16.254  -4.1703   2.6573   0.0000   0.0000  -4.1703   2.6573  ?   ?    33.399   16.254 0.000000 16.25406 
1 1 1   34   17    3 o   40.637   18.138  -0.5330   2.2968  -2.0122   3.7712   0.3391   2.8958   47.411   21.949   48.935   21.139 -1.523952 30.47350 
1 1 1   34   17    4 o  139.579   13.836   15.801   2.9170   16.075   4.8125   15.642   3.6674  133.393   24.473  136.297   18.021 -2.904633 30.39208 
1 1 1   34   17    5 o  143.053   14.194   16.644   3.0669   17.289   4.9594   16.244   3.9025  138.552   24.270  138.262   18.938 0.2895508 30.78454 
1 1 1   34   17    6 o   40.819   18.685  -1.2626   2.6262  -4.5608   3.9951   1.2470   3.4849   43.163   20.740   56.166   23.690 -13.00294 31.48591 
1 1 1   34   17    7 o   74.115   23.069   4.9174   2.8966   1.5007   4.2712   7.8267   3.9414   60.964   25.991   90.960   26.616 -29.99545 37.20110 
1 1 1   34   17    8 o  214.652   12.353   36.854   4.0414   37.486   6.7354   36.498   5.0519  207.766   21.490  210.785   15.773 -3.018875 26.65736 
1 1 1   34   17    9 o   80.458   23.909   5.9223   3.1597   9.7851   4.7644   2.8894   4.2217   99.648   29.293   65.894   26.765 33.75447 39.67960 
1 1 1   34   18    0 o   28.010   18.964  -0.9750   2.4079  -0.9750   2.4079  -0.9750   2.4079   28.010   18.964   28.010   18.964 0.000000 0.000000 
1 1 1   34   18    1 o   64.261   22.463   3.4522   2.7217   0.0000   0.0000   3.4522   2.7217  ?   ?    64.261   22.463 0.000000 22.46279 
1 1 1   34   18    2 o   71.691   23.787   4.5505   3.0457   0.0000   0.0000   4.5505   3.0457  ?   ?    71.691   23.787 0.000000 23.78665 
1 1 1   34   18    3 o  101.554   17.427   8.7316   2.6113   4.4216   4.0632   11.764   3.4084   72.331   27.130  116.725   19.784 -44.39316 33.57772 
1 1 1   34   18    4 o   62.953   26.703   1.8428   4.4682   1.8428   4.4682   0.0000   0.0000   62.953   26.703  ?   ?  0.000000 26.70282 
1 1 1   35    0    1 o   44.589   28.461   0.8955   4.3179   0.8955   4.3179   0.8955   4.3179   44.589   28.461   44.589   28.461 0.000000 0.000000 
1 1 1   35    0    2 f  251.980   10.306   49.359   3.9598   49.359   3.9598   49.359   3.9598  251.980   10.306  251.980   10.306 0.000000 0.000000 
1 1 1   35    0    3 o   33.166   21.992  -0.5197   2.9484  -0.5197   2.9484  -0.5197   2.9484   33.166   21.992   33.166   21.992 0.000000 0.000000 
1 1 1   35    0    4 o   91.505   25.633   8.0673   3.1070   8.0673   3.1070   8.0673   3.1070   91.505   25.633   91.505   25.633 0.000000 0.000000 
1 1 1   35    0    5 o   33.242   22.152  -0.6822   3.0540  -0.6822   3.0540  -0.6822   3.0540   33.242   22.152   33.242   22.152 0.000000 0.000000 
1 1 1   35    0    6 o   99.457   24.850   9.2165   3.2728   9.2165   3.2728   9.2165   3.2728   99.457   24.850   99.457   24.850 0.000000 0.000000 
1 1 1   35    0    7 o   25.818   17.901  -1.9092   2.4540  -1.9092   2.4540  -1.9092   2.4540   25.818   17.901   25.818   17.901 0.000000 0.000000 
1 1 1   35    0    8 o   86.667   22.302   7.0057   2.5571   7.0057   2.5571   7.0057   2.5571   86.667   22.302   86.667   22.302 0.000000 0.000000 
1 1 1   35    0    9 o   52.009   25.835   3.2683   2.4874   3.2683   2.4874   3.2683   2.4874   52.009   25.835   52.009   25.835 0.000000 0.000000 
1 1 1   35    0   10 o   43.627   24.552   2.1598   2.4914   2.1598   2.4914   2.1598   2.4914   43.627   24.552   43.627   24.552 0.000000 0.000000 
1 1 1   35    0   11 o   22.794   16.116  -2.6799   2.2937  -2.6799   2.2937  -2.6799   2.2937   22.794   16.116   22.794   16.116 0.000000 0.000000 
1 1 1   35    0   12 o   50.819   25.037   3.1190   2.3283   3.1190   2.3283   3.1190   2.3283   50.819   25.037   50.819   25.037 0.000000 0.000000 
1 1 1   35    0   13 o   45.734   23.928   2.5147   2.2009   2.5147   2.2009   2.5147   2.2009   45.734   23.928   45.734   23.928 0.000000 0.000000 
1 1 1   35    0   14 o   65.847   31.874   5.4612   3.7466   5.4612   3.7466   5.4612   3.7466   65.847   31.874   65.847   31.874 0.000000 0.000000 
1 1 1   35    0   15 o   46.467   27.943   2.1751   3.5922   2.1751   3.5922   2.1751   3.5922   46.467   27.943   46.467   27.943 0.000000 0.000000 
1 1 1   35    0   16 o   33.633   22.788  -1.2879   3.4897  -1.2879   3.4897  -1.2879   3.4897   33.633   22.788   33.633   22.788 0.000000 0.000000 
1 1 1   35    0   17 o   74.211   34.086   6.9505   4.2393   6.9505   4.2393   6.9505   4.2393   74.211   34.086   74.211   34.086 0.000000 0.000000 
1 1 1   35    0   18 o   37.848   24.753   0.0873   3.5410   0.0873   3.5410   0.0873   3.5410   37.848   24.753   37.848   24.753 0.000000 0.000000 
1 1 1   35    0   19 o   36.576   23.724   0.2679   3.1593   0.2679   3.1593   0.2679   3.1593   36.576   23.724   36.576   23.724 0.000000 0.000000 
1 1 1   35    0   20 o   50.999   28.014   3.2454   3.1521   3.2454   3.1521   3.2454   3.1521   50.999   28.014   50.999   28.014 0.000000 0.000000 
1 1 1   35    1    0 o  131.472   18.215   14.369   3.4646   14.369   3.4646   14.369   3.4646  131.472   18.215  131.472   18.215 0.000000 0.000000 
1 1 1   35    1    1 o   52.957   20.117   1.8255   2.2504   0.4637   3.1992   3.1592   3.1660   52.279   22.396   64.981   24.032 -12.70189 32.84971 
1 1 1   35    1    2 o  135.898   13.678   14.803   2.8064   12.171   3.4896   19.623   4.7219  120.264   19.635  152.528   20.765 -32.26398 28.57824 
1 1 1   35    1    3 o   41.983   18.930  -0.9424   2.5729   1.7421   3.2579  -5.3919   4.1943   58.141   23.549   43.674   21.052 14.46653 31.58721 
1 1 1   35    1    4 o   81.843   15.267   5.5224   1.8421   6.4000   2.6688   4.7237   2.5459   86.214   20.520   74.048   21.312 12.16603 29.58511 
1 1 1   35    1    5 o   47.047   18.190   1.3044   1.8617   3.7440   2.9474  -0.3151   2.4015   67.698   23.392   42.889   18.875 24.80917 30.05700 
1 1 1   35    1    6 o   36.649   15.995  -0.1767   1.6931  -2.8870   2.5339   2.0094   2.2757   35.542   16.925   54.192   20.308 -18.64987 26.43610 
1 1 1   35    1    7 o   50.398   17.802   1.8876   1.7125  -0.3777   2.5200   3.8316   2.3344   43.619   19.259   67.233   20.674 -23.61446 28.25439 
1 1 1   35    1    8 o   54.968   18.443   2.3980   1.8300   6.6969   3.0326  -0.0639   2.2949   87.226   22.549   42.971   18.690 44.25510 29.28811 
1 1 1   35    1    9 o   29.171   14.298  -3.9952   2.1657  -4.0365   2.8084  -3.9346   3.4019   35.274   17.058   40.498   19.374 -5.223694 25.81332 
1 1 1   35    1   10 o  102.592   12.056   8.4231   1.8571   6.0424   3.0003   9.9016   2.3644   82.586   22.924  110.401   14.330 -27.81576 27.03442 
1 1 1   35    1   11 o   97.907   11.842   7.6746   1.7386   8.8153   2.5712   6.7136   2.3599  102.853   16.921   89.048   17.935 13.80489 24.65683 
1 1 1   35    1   12 o   33.525   15.054  -0.5902   1.6077  -0.5677   2.3965  -0.6086   2.1679   41.574   18.544   39.309   17.578 2.264740 25.55107 
1 1 1   35    1   13 o  115.132   11.275   10.552   1.9614   6.5856   4.0473   11.770   2.2423   84.438   27.392  121.238   12.252 -36.80034 30.00692 
1 1 1   35    1   14 o   83.650   15.302   5.8205   1.8871   10.635   4.0827   4.5124   2.1280  107.772   25.201   72.217   18.997 35.55489 31.55852 
1 1 1   35    1   15 o   60.883   17.630   3.1509   1.7375  -0.6092   3.9648   4.0445   1.9329   52.653   23.642   68.555   18.139 -15.90167 29.79894 
1 1 1   35    1   16 o   52.918   17.832   2.2488   1.7110   3.4570   3.9924   1.9770   1.8937   67.812   26.520   51.503   18.658 16.30934 32.42581 
1 1 1   35    1   17 o   33.661   14.865  -0.2873   1.5019   0.4973   3.8964  -0.4242   1.6276   55.533   24.250   34.391   15.315 21.14177 28.68102 
1 1 1   35    1   18 o   51.365   20.144   1.6527   2.3084   3.9952   4.8129   0.9528   2.6307   71.860   28.791   49.632   20.736 22.22760 35.48134 
1 1 1   35    1   19 o   47.074   19.298   1.0094   2.2201  -0.0285   3.8415   1.5299   2.7205   53.220   23.624   52.912   21.488 0.3081093 31.93460 
1 1 1   35    1   20 o   77.208   25.374   5.5390   3.4688   6.5972   3.9568   2.0244   7.2106   82.955   27.092   72.007   32.139 10.94849 42.03419 
1 1 1   35    2    0 o   29.503   20.466  -2.4590   3.2175  -2.4590   3.2175  -2.4590   3.2175   29.503   20.466   29.503   20.466 0.000000 0.000000 
1 1 1   35    2    1 o  158.181   12.387   19.859   2.9752   21.638   3.5760   15.859   5.3623  164.160   14.377  132.499   27.347 31.66092 30.89611 
1 1 1   35    2    2 o   33.886   16.137  -2.6737   2.3042  -1.4119   3.1709  -4.0856   3.3541   45.399   20.686   39.931   19.138 5.468624 28.18087 
1 1 1   35    2    3 o   42.001   17.869   0.2438   2.0113  -3.7595   3.2930   2.6260   2.5402   40.145   19.165   59.411   21.597 -19.26588 28.87431 
1 1 1   35    2    4 o   64.140   18.207   3.4637   1.8706   7.2203   2.7568   0.2582   2.5466   91.804   20.170   46.602   19.973 45.20214 28.38596 
1 1 1   35    2    5 o   47.867   18.071   1.4757   1.8088   0.2663   2.6659   2.5076   2.4623   47.549   20.409   58.290   21.251 -10.74152 29.46445 
1 1 1   35    2    6 o   51.192   19.479   1.6886   2.1121   2.0153   2.9495   1.3448   3.0258   57.740   22.730   54.868   22.515 2.872623 31.99342 
1 1 1   35    2    7 o   47.305   18.580   1.2388   1.9667   1.0578   2.6410   1.4641   2.9468   50.993   20.992   54.914   22.340 -3.920547 30.65533 
1 1 1   35    2    8 o   91.225   13.070   6.7245   1.7729   4.8135   2.5943   8.3989   2.4284   74.483   21.536  100.806   16.294 -26.32333 27.00557 
1 1 1   35    2    9 o   79.458   14.847   5.2111   1.7393   2.9504   2.6145   7.0061   2.3297   61.507   21.968   91.421   17.282 -29.91350 27.95060 
1 1 1   35    2   10 o   64.310   17.127   3.4966   1.7159   0.8391   2.7488   5.1933   2.1965   50.512   21.158   77.897   18.666 -27.38525 28.21489 
1 1 1   35    2   11 o   47.417   17.871   1.4775   1.7672   6.5156   4.1575   0.3664   1.9524   84.377   27.781   41.922   17.709 42.45481 32.94562 
1 1 1   35    2   12 o   97.139   11.205   7.5289   1.6354   3.1975   4.3982   8.2239   1.7617   68.687   27.522  101.449   11.552 -32.76253 29.84780 
1 1 1   35    2   13 o   43.590   20.342  -2.3540   3.3409   2.6266   4.1916 -11.0304   5.5323   65.438   26.635   43.611   21.647 21.82714 34.32205 
1 1 1   35    2   14 o  102.409   23.035   9.3851   3.5233   9.4018   4.3750   9.3542   5.9434   99.547   27.700   96.329   33.221 3.217140 43.25378 
1 1 1   35    2   15 o   60.834   25.692   1.6118   4.1078   1.6118   4.1078   0.0000   0.0000   60.834   25.692  ?   ?  0.000000 25.69247 
1 1 1   35    2   16 o   64.887   25.165   3.1203   3.5718   5.1300   4.3256  -1.1868   6.3325   76.286   28.113   62.930   28.883 13.35550 40.30609 
1 1 1   35    2   17 o   76.556   25.263   5.3376   3.4371   4.9960   4.0432   6.2276   6.5269   75.049   27.252   83.229   33.464 -8.179955 43.15652 
1 1 1   35    2   18 o   61.404   25.746   1.9341   4.0769   4.4997   5.3703  -1.5557   6.2633   74.996   30.284   61.425   28.384 13.57077 41.50633 
1 1 1   35    2   19 o   73.536   25.885   4.8704   3.6175   8.6025   4.4529  -2.3736   6.2038   93.436   28.524   59.330   27.698 34.10633 39.75922 
1 1 1   35    2   20 o   71.863   25.528   4.6142   3.5263   5.7840   4.2629   2.0790   6.2756   78.485   28.048   69.405   30.528 9.079773 41.45708 
1 1 1   35    3    0 o  149.133   16.674   18.108   3.6841   18.108   3.6841   18.108   3.6841  149.133   16.674  149.133   16.674 0.000000 0.000000 
1 1 1   35    3    1 o  121.895   16.217   12.160   2.9507   4.8658   5.4829   15.134   3.5009   79.533   31.085  135.633   17.254 -56.10090 35.55270 
1 1 1   35    3    2 o   41.889   19.212  -1.5350   2.7947  -0.0284   5.6125  -2.0317   3.2227   64.210   28.526   43.948   20.326 20.26194 35.02682 
1 1 1   35    3    3 o   78.735   17.101   5.2022   2.0020   1.1200   3.3389   7.4936   2.5015   55.802   23.341   94.536   17.944 -38.73479 29.44157 
1 1 1   35    3    4 o   83.539   18.828   5.9329   2.3498   1.4564   3.9188   8.4462   2.9363   60.374   25.273   99.540   19.967 -39.16653 32.20914 
1 1 1   35    3    5 o   64.018   17.345   3.4492   1.7418   0.4746   2.7038   5.5594   2.2773   48.735   20.726   80.821   18.769 -32.08584 27.96092 
1 1 1   35    3    6 o  116.816   10.286   10.756   1.8203   10.479   2.8144   10.956   2.3868  112.634   16.841  116.658   13.623 -4.023796 21.66176 
1 1 1   35    3    7 o   85.672   14.481   6.0114   1.8312   8.2369   3.1447   4.8695   2.2526   97.302   21.671   75.342   19.413 21.96033 29.09430 
1 1 1   35    3    8 o   33.863   15.219  -0.6311   1.6471  -1.1420   3.9776  -0.5253   1.8096   51.776   23.424   36.155   16.121 15.62038 28.43541 
1 1 1   35    3    9 o  113.893   20.032   11.060   3.3646   10.358   4.2275   12.273   5.5575  106.541   26.124  112.581   31.181 -6.040291 40.67838 
1 1 1   35    3   10 o   79.305   24.965   5.6081   3.3814   9.9848   4.2679  -1.7713   5.5418  104.062   26.672   58.970   27.049 45.09224 37.98706 
1 1 1   35    3   11 o   86.150   24.936   6.7306   3.4764   10.343   4.4470   1.0541   5.5748  105.329   27.343   66.147   28.942 39.18269 39.81562 
1 1 1   35    3   12 o  107.078   21.961   10.063   3.4785   14.252   4.4843   3.7355   5.5119  126.460   24.046   74.119   30.398 52.34177 38.75880 
1 1 1   35    3   13 o   46.634   21.287  -1.3590   3.3772   1.8404   4.3045  -6.4818   5.4468   62.823   26.404   49.165   23.771 13.65797 35.52779 
1 1 1   35    3   14 o   54.055   24.596  -1.1846   4.4633  -1.1846   4.4633   0.0000   0.0000   54.055   24.596  ?   ?  0.000000 24.59554 
1 1 1   35    3   15 o   69.023   27.846   3.3222   4.5358   3.3222   4.5358   0.0000   0.0000   69.023   27.846  ?   ?  0.000000 27.84573 
1 1 1   35    3   16 o   80.664   25.800   6.0086   3.6003   7.2462   4.4490   3.6602   6.1286   86.924   28.745   74.525   31.423 12.39883 42.58716 
1 1 1   35    3   17 o   66.028   25.228   3.4074   3.5521   6.0878   4.3599  -1.8842   6.1259   80.705   28.416   60.319   27.943 20.38646 39.85301 
1 1 1   35    3   18 o   44.998   20.933  -2.0955   3.4940  -2.1231   4.1964  -2.0329   6.3086   49.588   23.026   60.606   28.172 -11.01769 36.38533 
1 1 1   35    3   19 o   58.566   25.563   0.8558   4.3258   1.9877   5.7870  -0.5777   6.5122   67.800   29.581   64.180   29.395 3.619659 41.70269 
1 1 1   35    3   20 o   62.748   24.939   2.8031   3.5825   3.6976   4.3898   1.0193   6.1989   69.081   27.559   66.447   29.718 2.634171 40.52958 
1 1 1   35    4    0 o   64.559   30.045   5.0301   3.2981   5.0301   3.2981   5.0301   3.2981   64.559   30.045   64.559   30.045 0.000000 0.000000 
1 1 1   35    4    1 o   64.151   20.227   3.4355   2.2190   4.3646   3.2752   2.6471   3.0170   72.133   24.670   61.483   23.308 10.65053 33.93896 
1 1 1   35    4    2 o   49.207   20.496   0.7978   2.5591   0.8413   3.2340   0.7250   4.1858   53.970   22.795   59.136   25.481 -5.166409 34.18887 
1 1 1   35    4    3 o   96.078   14.715   7.5305   2.0950   8.9843   5.6895   7.3024   2.2534   97.119   32.519   93.972   16.254 3.146172 36.35482 
1 1 1   35    4    4 o   57.580   18.736   2.6895   1.8930   1.2310   5.6368   2.8749   2.0098   67.660   29.360   59.355   19.305 8.304817 35.13799 
1 1 1   35    4    5 o   57.955   17.000   2.7921   1.6061   5.8124   2.8167   1.3369   1.9551   81.536   22.042   47.868   18.603 33.66781 28.84341 
1 1 1   35    4    6 o   60.212   16.355   3.0348   1.5463   5.1133   3.9029   2.6477   1.6841   77.132   26.902   56.721   17.580 20.41079 32.13708 
1 1 1   35    4    7 o   48.591   21.315  -0.1426   3.0411   0.8006   3.8448  -1.7186   4.9701   57.290   24.548   56.259   25.735 1.030811 35.56547 
1 1 1   35    4    8 o  104.740   24.541   9.8350   3.8656   7.1989   5.5658   12.292   5.3730   88.455   31.996  113.338   30.361 -24.88254 44.10855 
1 1 1   35    4    9 o   73.250   24.563   4.6293   3.2461   5.7006   3.9607   2.4376   5.6650   80.031   27.131   70.816   30.054 9.214172 40.48879 
1 1 1   35    4   10 o  100.815   23.118   9.0286   3.4914   1.9543   4.2241   24.282   6.2026   63.242   26.337  165.009   25.371 -101.7667 36.56906 
1 1 1   35    4   11 o  124.048   19.277   13.044   3.5413   13.606   4.4347   12.056   5.8833  123.363   24.351  109.780   32.625 13.58331 40.71029 
1 1 1   35    4   12 o   39.562   18.977  -3.9497   3.3126   0.7513   4.0945 -12.8562   5.6359   58.013   25.098   42.247   21.109 15.76605 32.79535 
1 1 1   35    4   13 o   84.515   28.287   6.6588   4.3050   6.6588   4.3050   0.0000   0.0000   84.515   28.287  ?   ?  0.000000 28.28684 
1 1 1   35    4   14 o   54.610   23.426   0.7744   3.5087  -1.8363   4.3462   5.6601   5.9457   51.631   23.783   81.252   32.181 -29.62090 40.01504 
1 1 1   35    4   15 o   79.303   25.895   5.7603   3.6148   1.6885   4.4108   14.089   6.3083   62.367   26.496  116.496   33.554 -54.12868 42.75377 
1 1 1   35    4   16 o   64.275   25.110   3.0115   3.5762   5.5676   4.4013  -1.9548   6.1349   78.331   28.435   60.349   27.959 17.98231 39.87775 
1 1 1   35    4   17 o   88.063   25.544   7.2796   3.6445   3.2434   4.4013   16.084   6.5006   67.808   27.404  124.041   33.466 -56.23287 43.25458 
1 1 1   35    4   18 o   63.190   24.924   2.8659   3.5527   5.3891   4.3828  -1.9689   6.0669   76.972   28.308   59.621   27.686 17.35050 39.59612 
1 1 1   35    4   19 o   94.940   28.153   8.8638   4.3846   8.1410   6.1532   9.6092   6.2493   88.994   33.385   94.822   33.952 -5.827972 47.61654 
1 1 1   35    4   20 o   56.379   23.955   1.2869   3.6058   2.0637   4.3307  -0.4686   6.5104   62.521   26.391   64.133   29.380 -1.611248 39.49303 
1 1 1   35    5    0 o   54.779   27.785   3.6593   2.9083   3.6593   2.9083   3.6593   2.9083   54.779   27.785   54.779   27.785 0.000000 0.000000 
1 1 1   35    5    1 o  110.345   15.573   9.9568   2.5572   8.9374   3.1145   12.066   4.4795  102.080   20.643  115.813   25.917 -13.73320 33.13316 
1 1 1   35    5    2 o   46.437   18.655   1.0239   2.0266  -1.3440   3.1053   2.7807   2.6748   45.016   20.495   60.815   22.153 -15.79948 30.17968 
1 1 1   35    5    3 o   81.555   14.089   5.4378   1.6951   5.1894   3.3017   5.5267   1.9753   77.090   24.712   81.390   16.422 -4.299706 29.67114 
1 1 1   35    5    4 o   51.499   17.838   2.0248   1.7145   3.1821   5.1189   1.8785   1.8196   71.826   29.357   50.847   18.309 20.97854 34.59829 
1 1 1   35    5    5 o   76.573   23.660   5.1318   3.0532   6.1217   3.9818   3.7195   4.7563   82.689   27.186   72.609   28.775 10.07933 39.58626 
1 1 1   35    5    6 o  126.582   17.505   13.286   3.3009   9.1376   4.1920   20.056   5.3550   99.707   26.863  151.420   23.898 -51.71296 35.95480 
1 1 1   35    5    7 o   96.967   22.216   8.2524   3.2266   7.4818   4.1182   9.4775   5.1925   90.129   27.412   99.342   30.882 -9.212799 41.29265 
1 1 1   35    5    8 o  132.774   16.731   14.536   3.3247   12.431   4.1251   18.437   5.6167  118.640   23.547  142.587   26.717 -23.94742 35.61266 
1 1 1   35    5    9 o   57.925   24.449   1.2191   3.7164   6.8752   5.4965  -3.5444   5.0441   86.626   31.725   52.363   24.615 34.26345 40.15480 
1 1 1   35    5   10 o   60.394   23.896   2.3156   3.2754   3.1045   4.1030   0.9295   5.4383   67.326   26.711   65.163   28.546 2.162460 39.09472 
1 1 1   35    5   11 o   62.921   24.491   2.7502   3.3924   0.9525   4.1867   6.1872   5.7889   59.221   25.500   83.652   32.148 -24.43128 41.03392 
1 1 1   35    5   12 o   79.715   28.261   5.7126   4.3196   5.7126   4.3196   0.0000   0.0000   79.715   28.261  ?   ?  0.000000 28.26130 
1 1 1   35    5   13 o   57.379   23.855   1.5231   3.4574   3.5823   4.1653  -3.0381   6.1992   69.163   27.077   58.938   27.572 10.22488 38.64437 
1 1 1   35    5   14 o   80.115   25.316   5.8709   3.4744   7.6870   4.1418   1.5576   6.3831   90.015   27.515   69.711   30.721 20.30456 41.24140 
1 1 1   35    5   15 o   50.768   22.536  -0.2344   3.4963  -0.3831   4.2504   0.0767   6.1482   54.836   24.560   64.980   29.285 -10.14452 38.22055 
1 1 1   35    5   16 o   43.004   20.257  -2.7847   3.4473  -0.1571   4.1971  -8.2323   6.0434   55.074   24.555   49.430   24.155 5.644016 34.44395 
1 1 1   35    5   17 o   71.100   25.987   4.3646   3.6852   2.7267   4.4574   7.9020   6.5506   65.889   27.214   88.677   34.166 -22.78806 43.68023 
1 1 1   35    5   18 o   55.687   23.888   0.9962   3.6481  -5.3310   4.3631   15.699   6.6509   43.965   21.261  120.805   34.344 -76.83986 40.39220 
1 1 1   35    5   19 o   49.435   22.222  -0.5560   3.5139   0.4055   4.1950  -2.8169   6.4328   56.395   24.876   59.328   27.860 -2.933647 37.35000 
1 1 1   35    6    0 o   49.994   29.861   2.5647   4.0465   2.5647   4.0465   2.5647   4.0465   49.994   29.861   49.994   29.861 0.000000 0.000000 
1 1 1   35    6    1 o   88.726   16.094   6.5276   2.1052   2.6774   2.9547   10.497   3.0003   61.247   23.102  112.068   18.108 -50.82067 29.35366 
1 1 1   35    6    2 o   77.631   16.163   5.0317   1.8581   0.3729   4.3028   6.0996   2.0601   58.435   25.501   85.607   16.318 -27.17192 30.27449 
1 1 1   35    6    3 o  157.007   7.6057   19.106   1.8278   15.830   4.8588   19.646   1.9727  133.790   24.634  158.866   8.1400 -25.07639 25.94436 
1 1 1   35    6    4 o   54.710   22.919   1.0706   3.2261  -3.5444   4.6268   5.4371   4.5005   50.028   23.536   79.504   28.770 -29.47603 37.17021 
1 1 1   35    6    5 o   66.039   23.265   3.5295   2.9229   1.4463   3.7059   6.9589   4.7548   58.950   24.619   87.068   29.725 -28.11838 38.59619 
1 1 1   35    6    6 o   36.907   17.741  -3.7730   2.9304   0.2712   3.7360 -10.2398   4.7243   54.650   23.808   39.869   19.825 14.78139 30.98160 
1 1 1   35    6    7 f   96.754   21.701   8.1914   3.1347   8.3694   3.9622   7.8935   5.1250   95.452   26.285   91.335   30.862 4.116951 40.53852 
1 1 1   35    6    8 o   73.197   24.241   4.6496   3.1637   6.2822   3.9465   1.7139   5.2922   83.128   27.052   67.006   28.758 16.12263 39.48208 
1 1 1   35    6    9 o  118.468   23.762   12.481   4.1589   16.668   6.1049   8.8544   5.6812  131.412   30.875   95.131   32.492 36.28065 44.82168 
1 1 1   35    6   10 o   90.131   23.849   7.3307   3.3412   9.0971   4.2039   4.3011   5.5056   98.675   27.034   76.080   30.683 22.59494 40.89416 
1 1 1   35    6   11 o   43.504   20.992  -5.2308   4.1960  -5.2308   4.1960   0.0000   0.0000   43.504   20.992  ?   ?  0.000000 20.99216 
1 1 1   35    6   12 o   47.835   21.633  -0.9756   3.3894  -1.4539   4.1777  -0.0546   5.7975   51.657   23.617   63.638   28.581 -11.98149 37.07577 
1 1 1   35    6   13 o   39.306   18.958  -4.3962   3.4137  -7.2060   4.1555   1.4353   5.9866   39.850   19.587   68.061   29.880 -28.21063 35.72789 
1 1 1   35    6   14 o   74.704   25.280   4.9876   3.4386   7.0518   4.2094   0.8469   5.9618   86.223   27.931   66.223   29.411 19.99996 40.56046 
1 1 1   35    6   15 o   64.155   24.861   3.0528   3.4837   1.8567   4.1809   5.7693   6.3006   61.797   26.000   81.515   32.842 -19.71718 41.88792 
1 1 1   35    6   16 o   94.108   25.154   8.2753   3.6929   6.5057   4.3633   12.743   6.9333   82.759   28.469  107.444   35.898 -24.68577 45.81664 
1 1 1   35    6   17 o   72.271   26.113   4.5992   3.7056   2.4311   4.4902   9.2290   6.5616   64.815   27.086   93.441   34.588 -28.62532 43.93208 
1 1 1   35    6   18 o   68.854   26.046   3.9444   3.7623   2.7823   4.4781   6.7330   6.9371   65.901   27.253   84.374   34.295 -18.47246 43.80500 
1 1 1   35    6   19 o   85.094   26.368   6.9354   3.7889   4.1050   4.5713   13.148   6.7725   71.202   28.212  108.259   35.449 -37.05688 45.30468 
1 1 1   35    7    0 o  183.224   17.915   27.303   4.9140   27.303   4.9140   27.303   4.9140  183.224   17.915  183.224   17.915 0.000000 0.000000 
1 1 1   35    7    1 o  118.051   17.606   11.596   3.0840   0.0000   0.0000   11.596   3.0840  ?   ?   118.051   17.606 0.000000 17.60625 
1 1 1   35    7    2 o   36.907   15.347   0.3621   1.4313   1.6687   4.8428   0.2371   1.4982   65.231   27.739   36.823   15.532 28.40813 31.79164 
1 1 1   35    7    3 o   51.502   22.317   0.2569   3.2479   2.1760   4.9985  -1.1454   4.2729   67.561   28.427   53.566   24.252 13.99478 37.36626 
1 1 1   35    7    4 o   42.324   19.806  -2.4933   3.2026  -7.9933   4.5264   3.0202   4.5319   41.509   20.411   68.803   27.807 -27.29466 34.49365 
1 1 1   35    7    5 o  108.136   21.756   10.182   3.4763   7.0135   4.7885   13.713   5.0547   87.103   29.830  121.691   27.752 -34.58797 40.74319 
1 1 1   35    7    6 o   71.514   23.469   4.4086   2.9679   5.7874   3.7651   2.1458   4.8232   80.351   26.437   66.547   27.958 13.80419 38.47817 
1 1 1   35    7    7 o   84.285   23.518   6.3575   3.1492   4.4953   3.9513   9.5998   5.2139   73.483   26.901   99.409   30.952 -25.92636 41.00855 
1 1 1   35    7    8 o   42.711   19.798  -1.9589   3.0819  -6.7318   3.8985   5.9933   5.0322   38.947   19.108   82.093   30.310 -43.14619 35.83031 
1 1 1   35    7    9 o   93.824   26.319   8.1609   3.9331   8.1609   3.9331   0.0000   0.0000   93.824   26.319  ?   ?  0.000000 26.31898 
1 1 1   35    7   10 o  115.581   24.200   12.017   4.1439   9.4304   5.8640   14.597   5.8568   97.012   33.011  121.801   31.258 -24.78954 45.46236 
1 1 1   35    7   11 o   40.757   19.313  -3.0739   3.2203  -4.8789   3.9494   0.5071   5.5626   42.389   20.432   64.085   28.438 -21.69649 35.01688 
1 1 1   35    7   12 o  146.167   16.309   17.654   3.5865   19.876   4.3853   13.167   6.2328  153.155   19.123  112.810   33.592 40.34491 38.65424 
1 1 1   35    7   13 o  119.765   20.016   12.371   3.5397   8.7224   4.2467   20.677   6.4070   95.613   27.527  146.793   29.538 -51.17964 40.37653 
1 1 1   35    7   14 o   67.970   24.961   3.8267   3.4057   3.2207   4.1950   4.9985   5.8332   67.290   26.908   78.164   31.562 -10.87457 41.47558 
1 1 1   35    7   15 f   70.641   25.428   4.3081   3.5095   5.7054   4.3140   1.5736   6.0348   78.775   28.209   68.008   29.925 10.76680 41.12501 
1 1 1   35    7   16 o   53.809   23.463   0.4711   3.6357   0.0809   4.3816   1.3336   6.5143   56.610   25.174   68.795   30.638 -12.18489 39.65389 
1 1 1   35    7   17 o   46.375   21.533  -2.0093   3.6688  -2.8033   4.5249  -0.4857   6.2680   49.923   23.419   63.497   28.990 -13.57421 37.26773 
1 1 1   35    7   18 o   81.061   26.541   6.2321   3.7965   3.2739   4.5953   12.593   6.7383   68.049   27.815  106.181   35.388 -38.13193 45.01041 
1 1 1   35    8    0 o   42.266   26.734   1.0089   3.7093   1.0089   3.7093   1.0089   3.7093   42.266   26.734   42.266   26.734 0.000000 0.000000 
1 1 1   35    8    1 o   56.539   20.868   2.3284   2.3851   9.3937   4.3279  -0.7532   2.8583  100.518   27.385   44.847   20.110 55.67109 33.97568 
1 1 1   35    8    2 o   57.114   25.737  -0.8192   4.7471  -0.8192   4.7471   0.0000   0.0000   57.114   25.737  ?   ?  0.000000 25.73699 
1 1 1   35    8    3 o  121.998   19.930   12.671   3.5931   15.491   5.2922   10.259   4.8940  129.665   27.517  103.721   29.451 25.94351 40.30598 
1 1 1   35    8    4 o  133.160   19.038   14.938   3.7699   5.7834   5.4734   23.200   5.1999   82.036   31.323  164.790   21.100 -82.75353 37.76693 
1 1 1   35    8    5 o   44.656   20.296  -1.1917   3.0286  -2.4179   4.0251   0.4086   4.5980   48.462   22.519   59.731   26.206 -11.26965 34.55221 
1 1 1   35    8    6 o  118.415   18.331   11.797   3.2152   13.429   4.1965   9.4775   5.0029  123.463   23.055   99.027   30.234 24.43580 38.02140 
1 1 1   35    8    7 o   56.703   26.312  -2.4997   5.4652  -2.4997   5.4652   0.0000   0.0000   56.703   26.312  ?   ?  0.000000 26.31186 
1 1 1   35    8    8 o   76.753   30.611   4.5797   5.4142   4.5797   5.4142   0.0000   0.0000   76.753   30.611  ?   ?  0.000000 30.61056 
1 1 1   35    8    9 o  108.947   24.156   10.712   3.9224   12.216   5.6698   9.3316   5.4322  110.608   31.796   97.029   31.747 13.57954 44.93158 
1 1 1   35    8   10 o   87.589   31.969   7.3185   5.5744   0.0000   0.0000   7.3185   5.5744  ?   ?    87.589   31.969 0.000000 31.96895 
1 1 1   35    8   11 f   90.501   27.411   7.7520   4.1241  -2.4395   5.9166   17.383   5.7517   58.682   27.280  135.320   28.661 -76.63792 39.56824 
1 1 1   35    8   12 o   77.069   27.595   5.3157   4.1282  -1.5350   6.0759   11.190   5.6264   61.163   28.153  104.887   32.070 -43.72375 42.67455 
1 1 1   35    8   13 o   78.346   27.982   5.5845   4.2423   7.2770   5.9836   3.8738   6.0155   86.805   32.844   74.851   31.322 11.95351 45.38473 
1 1 1   35    8   14 o   59.109   25.443   1.1505   4.1650  -4.0235   5.7239   6.9730   6.0721   54.307   25.738   85.390   32.896 -31.08256 41.76828 
1 1 1   35    8   15 o   56.530   24.594   0.7116   3.9758   2.5515   5.4619  -1.3619   5.7984   68.706   29.344   59.828   27.525 8.878357 40.23320 
1 1 1   35    8   16 o   48.763   22.534  -1.8096   3.9478  -2.4404   5.2938  -1.0193   5.9255   54.958   25.633   60.979   27.970 -6.021332 37.93949 
1 1 1   35    8   17 o   51.560   23.556  -1.1773   4.1467  -3.4983   5.6704   1.4908   6.0797   54.631   25.809   67.384   29.824 -12.75328 39.44085 
1 1 1   35    9    0 o   55.471   29.136   3.8220   3.2729   3.8220   3.2729   3.8220   3.2729   55.471   29.136   55.471   29.136 0.000000 0.000000 
1 1 1   35    9    1 o   86.314   27.130   6.8667   3.9951   6.8667   3.9951   0.0000   0.0000   86.314   27.130  ?   ?  0.000000 27.13003 
1 1 1   35    9    3 o   86.377   30.300   6.9392   4.9544   6.9392   4.9544   0.0000   0.0000   86.377   30.300  ?   ?  0.000000 30.30018 
1 1 1   35    9    4 o  118.483   22.325   12.306   3.9002   7.0361   5.3511   18.277   5.6966   86.880   31.381  140.825   27.414 -53.94495 41.66914 
1 1 1   35    9    5 o   70.766   27.177   3.8867   4.1354   3.8867   4.1354   0.0000   0.0000   70.766   27.177  ?   ?  0.000000 27.17745 
1 1 1   35    9    6 o   97.818   26.797   8.9360   4.1307   8.9360   4.1307   0.0000   0.0000   97.818   26.797  ?   ?  0.000000 26.79742 
1 1 1   35    9    7 o   53.250   22.511   0.9215   3.1586  -2.1313   4.1935   4.9241   4.8018   50.087   23.173   76.724   29.328 -26.63651 37.37819 
1 1 1   35    9    8 o   47.582   21.446  -0.8548   3.2979   2.0713   4.3465  -4.8253   5.0631   63.763   26.648   49.674   23.728 14.08899 35.68130 
1 1 1   35    9    9 o   49.446   21.858  -0.2009   3.2555   1.8657   4.3096  -2.9477   4.9685   62.757   26.400   52.747   24.678 10.01007 36.13817 
1 1 1   35    9   10 o   60.007   24.115   2.2163   3.3874  -1.2781   4.4010   7.2949   5.3057   53.349   24.332   87.158   31.276 -33.80926 39.62633 
1 1 1   35    9   11 o   76.325   30.705   4.6136   5.4983   0.0000   0.0000   4.6136   5.4983  ?   ?    76.325   30.705 0.000000 30.70493 
1 1 1   35    9   12 o   40.890   19.517  -3.5940   3.4112   1.3251   4.4645 -10.4939   5.2875   61.216   26.346   42.537   21.122 18.67880 33.76771 
1 1 1   35    9   13 o  112.126   22.993   11.309   3.8137   11.264   4.8851   11.379   6.1026  107.173   29.052  103.833   33.630 3.339912 44.44080 
1 1 1   35    9   14 o   89.603   25.772   7.5735   3.7238   3.7571   4.8169   13.242   5.8706   70.944   28.669  113.107   32.305 -42.16342 43.19197 
1 1 1   35    9   15 o   95.076   25.279   8.4982   3.7423   7.5154   4.8411   9.9575   5.8991   87.251   29.988   97.224   33.110 -9.972908 44.67170 
1 1 1   35    9   16 o   43.574   20.643  -3.1695   3.6756  -3.2028   4.6858  -3.1162   5.9262   49.970   23.562   56.599   26.630 -6.628670 35.55768 
1 1 1   35   10    1 o   60.926   24.697   2.1571   3.5867   2.1571   3.5867   0.0000   0.0000   60.926   24.697  ?   ?  0.000000 24.69738 
1 1 1   35   10    2 o   59.840   25.395   1.3468   4.0442   1.3468   4.0442   0.0000   0.0000   59.840   25.395  ?   ?  0.000000 25.39463 
1 1 1   35   10    3 o   96.473   29.069   8.9288   4.6469   8.9288   4.6469   0.0000   0.0000   96.473   29.069  ?   ?  0.000000 29.06867 
1 1 1   35   10    4 o   92.043   30.456   8.1909   4.9944   8.1909   4.9944   0.0000   0.0000   92.043   30.456  ?   ?  0.000000 30.45640 
1 1 1   35   10    5 o   67.027   26.627   3.1285   4.0820   3.1285   4.0820   0.0000   0.0000   67.027   26.627  ?   ?  0.000000 26.62698 
1 1 1   35   10    6 o   51.860   22.226   0.6076   3.1530  -5.4710   4.1329   9.0718   4.8769   42.584   20.617   96.512   29.916 -53.92755 36.33268 
1 1 1   35   10    7 o   69.075   24.525   4.0251   3.2541   3.8079   4.2440   4.3350   5.0689   70.355   27.390   74.639   29.665 -4.284225 40.37645 
1 1 1   35   10    8 o   87.492   24.549   7.0219   3.4215   5.8452   4.4488   8.7255   5.3531   80.123   28.651   93.770   31.542 -13.64683 42.61233 
1 1 1   35   10    9 o   44.530   20.592  -1.8433   3.3049   1.0445   4.3990  -5.5858   5.0077   60.150   26.019   47.848   23.049 12.30218 34.75975 
1 1 1   35   10   10 o  132.037   18.043   14.710   3.5511   13.146   4.5849   17.054   5.6139  119.106   25.888  133.969   28.266 -14.86235 38.32971 
1 1 1   35   10   11 f  144.822   20.708   18.174   4.4597   16.969   6.9183   19.030   5.8335  126.591   34.680  141.941   27.845 -15.34923 44.47548 
1 1 1   35   10   12 o   57.369   23.957   1.5520   3.5090   1.3133   4.5032   1.9209   5.5988   61.202   26.400   67.434   29.261 -6.231998 39.41044 
1 1 1   35   10   13 o  122.673   21.260   13.237   3.8472   8.7012   4.9498   20.160   6.1145   93.216   30.295  144.995   28.567 -51.77904 41.63975 
1 1 1   35   10   14 f   57.607   24.166   1.5505   3.5950   3.7990   4.6569  -1.7656   5.6555   70.520   28.297   58.175   26.914 12.34552 39.05245 
1 1 1   35   10   15 o   41.335   19.822  -3.9848   3.6095  -0.2556   4.6470  -9.6563   5.7308   56.826   25.549   45.724   22.575 11.10186 34.09358 
1 1 1   35   11    1 o   39.868   18.517  -1.8437   2.7164  -1.8437   2.7164   0.0000   0.0000   39.868   18.517  ?   ?  0.000000 18.51699 
1 1 1   35   11    2 o   57.097   24.383   1.0277   3.7709   1.0277   3.7709   0.0000   0.0000   57.097   24.383  ?   ?  0.000000 24.38348 
1 1 1   35   11    4 o  158.086   22.524   21.891   5.2960   21.891   5.2960   0.0000   0.0000  158.086   22.524  ?   ?  0.000000 22.52386 
1 1 1   35   11    5 o   80.679   30.194   5.8427   5.0273   5.8427   5.0273   0.0000   0.0000   80.679   30.194  ?   ?  0.000000 30.19390 
1 1 1   35   11    6 f   44.867   21.358  -3.8673   4.0289  -3.8673   4.0289   0.0000   0.0000   44.867   21.358  ?   ?  0.000000 21.35845 
1 1 1   35   11    7 o   67.663   27.149   3.1987   4.2861   3.1987   4.2861   0.0000   0.0000   67.663   27.149  ?   ?  0.000000 27.14865 
1 1 1   35   11    8 o   45.772   20.945  -1.3752   3.2960  -3.1588   4.2861   1.2056   5.1558   48.005   22.605   63.926   27.905 -15.92070 35.91218 
1 1 1   35   11    9 o   61.111   24.520   2.3972   3.4965  -1.7118   4.5065   8.6125   5.5424   52.667   24.244   92.498   32.070 -39.83032 40.20290 
1 1 1   35   11   10 o   60.737   24.209   2.4337   3.3848  -2.0481   4.3692   9.1603   5.3527   50.970   23.607   95.104   31.533 -44.13388 39.39060 
1 1 1   35   11   11 o   67.823   26.882   3.4296   4.1516  -0.0313   6.7647   5.5208   5.2584   66.688   30.319   78.827   30.544 -12.13926 43.03711 
1 1 1   35   11   12 o   37.501   18.300  -5.3282   3.4345  -6.5249   4.5298  -3.7100   5.2674   43.123   21.038   52.354   24.776 -9.230881 32.50323 
1 1 1   35   11   13 o   60.254   24.653   2.1668   3.6145   2.7650   4.7276   1.3252   5.6077   66.804   27.845   65.447   28.821 1.357208 40.07469 
1 1 1   35   11   14 o   35.213   17.509  -7.9481   3.6833 -10.8855   4.7988  -3.7364   5.7461   38.991   19.482   54.594   25.849 -15.60339 32.36805 
1 1 1   35   12    1 f   77.647   21.661   5.3627   2.6718   5.3627   2.6718   0.0000   0.0000   77.647   21.661  ?   ?  0.000000 21.66068 
1 1 1   35   12    2 o   63.789   24.449   3.0362   3.3426   3.0362   3.3426   0.0000   0.0000   63.789   24.449  ?   ?  0.000000 24.44889 
1 1 1   35   12    4 o   81.656   29.915   6.1476   4.8876   6.1476   4.8876   0.0000   0.0000   81.656   29.915  ?   ?  0.000000 29.91493 
1 1 1   35   12    5 o  127.457   28.970   15.633   5.5236   15.633   5.5236   0.0000   0.0000  127.457   28.970  ?   ?  0.000000 28.97004 
1 1 1   35   12    6 o   67.942   27.011   3.3613   4.2035   3.3613   4.2035   0.0000   0.0000   67.942   27.011  ?   ?  0.000000 27.01105 
1 1 1   35   12    7 o   62.998   26.214   2.1762   4.1799   2.1762   4.1799   0.0000   0.0000   62.998   26.214  ?   ?  0.000000 26.21366 
1 1 1   35   12    8 o   45.467   21.766  -4.4163   4.3098  -4.4163   4.3098   0.0000   0.0000   45.467   21.766  ?   ?  0.000000 21.76560 
1 1 1   35   12    9 o   51.977   22.880   0.1043   3.5305  -3.0371   4.3908   5.8502   5.9384   48.767   22.938   81.005   32.136 -32.23811 39.48274 
1 1 1   35   12   10 o   44.084   20.547  -2.1690   3.3913  -1.3388   4.4717  -3.2931   5.2032   53.211   24.367   52.853   24.894 0.3574486 34.83424 
1 1 1   35   12   11 o  113.323   25.720   12.028   4.3592   20.028   7.3012   7.5961   5.4340  137.192   34.735   87.348   31.612 49.84379 46.96636 
1 1 1   35   12   12 o   59.274   24.152   2.1115   3.4510   2.1442   4.4669   2.0630   5.4352   63.608   26.824   66.898   28.930 -3.289719 39.45189 
1 1 1   35   13    1 o   37.175   17.042  -1.1764   2.1958  -1.1764   2.1958   0.0000   0.0000   37.175   17.042  ?   ?  0.000000 17.04220 
1 1 1   35   13    2 o   90.090   23.356   7.3919   3.2474   7.3919   3.2474   0.0000   0.0000   90.090   23.356  ?   ?  0.000000 23.35565 
1 1 1   35   13    4 o   50.682   23.522  -2.1788   4.3706  -2.1788   4.3706   0.0000   0.0000   50.682   23.522  ?   ?  0.000000 23.52218 
1 1 1   35   13    5 o   70.203   29.227   3.1981   5.2002   3.1981   5.2002   0.0000   0.0000   70.203   29.227  ?   ?  0.000000 29.22733 
1 1 1   35   13    6 o   79.063   28.736   5.7439   4.4973   5.7439   4.4973   0.0000   0.0000   79.063   28.736  ?   ?  0.000000 28.73628 
1 1 1   35   13    7 o   65.619   26.986   2.7293   4.3588   2.7293   4.3588   0.0000   0.0000   65.619   26.986  ?   ?  0.000000 26.98606 
1 1 1   35   13    8 o   64.315   26.947   2.3008   4.4607   2.3008   4.4607   0.0000   0.0000   64.315   26.947  ?   ?  0.000000 26.94684 
1 1 1   35   13    9 o   82.646   29.120   6.5360   4.5794   6.5360   4.5794   0.0000   0.0000   82.646   29.120  ?   ?  0.000000 29.12041 
1 1 1   35   13   10 o   75.865   28.683   5.1174   4.5612   5.1174   4.5612   0.0000   0.0000   75.865   28.683  ?   ?  0.000000 28.68256 
1 1 1   35   14    4 o  104.069   27.412   10.419   4.4271   10.419   4.4271   0.0000   0.0000  104.069   27.412  ?   ?  0.000000 27.41175 
1 1 1   35   14    5 o   70.363   28.813   3.5209   4.9423   3.5209   4.9423   0.0000   0.0000   70.363   28.813  ?   ?  0.000000 28.81263 
1 1 1   35   14    6 o   82.626   28.121   6.5080   4.2554   6.5080   4.2554   0.0000   0.0000   82.626   28.121  ?   ?  0.000000 28.12131 
1 1 1   35   14    7 o   88.419   28.957   7.6684   4.5190   7.6684   4.5190   0.0000   0.0000   88.419   28.957  ?   ?  0.000000 28.95678 
1 1 1   36    0    0 o  193.736   18.411   30.117   5.3463   30.117   5.3463   30.117   5.3463  193.736   18.411  193.736   18.411 0.000000 0.000000 
1 1 1   36    0    1 o   64.101   29.427   5.0119   3.1594   5.0119   3.1594   5.0119   3.1594   64.101   29.427   64.101   29.427 0.000000 0.000000 
1 1 1   36    0    2 o   70.265   29.896   5.8288   3.2682   5.8288   3.2682   5.8288   3.2682   70.265   29.896   70.265   29.896 0.000000 0.000000 
1 1 1   36    0    3 o   87.034   28.112   7.8368   3.3086   7.8368   3.3086   7.8368   3.3086   87.034   28.112   87.034   28.112 0.000000 0.000000 
1 1 1   36    0    4 o   34.722   22.733  -0.0554   2.9989  -0.0554   2.9989  -0.0554   2.9989   34.722   22.733   34.722   22.733 0.000000 0.000000 
1 1 1   36    0    5 o  140.685   16.569   16.293   3.4381   16.293   3.4381   16.293   3.4381  140.685   16.569  140.685   16.569 0.000000 0.000000 
1 1 1   36    0    6 o   69.651   30.097   5.7909   3.3039   5.7909   3.3039   5.7909   3.3039   69.651   30.097   69.651   30.097 0.000000 0.000000 
1 1 1   36    0    7 o  187.556   10.724   27.609   3.0557   27.609   3.0557   27.609   3.0557  187.556   10.724  187.556   10.724 0.000000 0.000000 
1 1 1   36    0    8 o  150.194   12.702   18.012   2.8721   18.012   2.8721   18.012   2.8721  150.194   12.702  150.194   12.702 0.000000 0.000000 
1 1 1   36    0    9 o   51.769   26.194   3.3199   2.5811   3.3199   2.5811   3.3199   2.5811   51.769   26.194   51.769   26.194 0.000000 0.000000 
1 1 1   36    0   10 o  123.087   14.585   12.408   2.6463   12.408   2.6463   12.408   2.6463  123.087   14.585  123.087   14.585 0.000000 0.000000 
1 1 1   36    0   11 o   43.353   24.416   2.1955   2.4664   2.1955   2.4664   2.1955   2.4664   43.353   24.416   43.353   24.416 0.000000 0.000000 
1 1 1   36    0   12 o   42.998   23.803   2.1933   2.2958   2.1933   2.2958   2.1933   2.2958   42.998   23.803   42.998   23.803 0.000000 0.000000 
1 1 1   36    0   13 o   38.249   24.944   0.2270   3.5581   0.2270   3.5581   0.2270   3.5581   38.249   24.944   38.249   24.944 0.000000 0.000000 
1 1 1   36    0   14 o   56.714   35.316   3.4503   6.2075   3.4503   6.2075   3.4503   6.2075   56.714   35.316   56.714   35.316 0.000000 0.000000 
1 1 1   36    1    0 o   52.251   28.774   3.3651   3.3351   3.3651   3.3351   3.3651   3.3351   52.251   28.774   52.251   28.774 0.000000 0.000000 
1 1 1   36    1    1 o   45.366   19.226   0.4997   2.3132  -0.2639   3.3207   1.2194   3.2240   49.575   21.987   54.677   22.909 -5.102531 31.75278 
1 1 1   36    1    2 o   93.412   19.999   7.6077   2.7731   6.3114   3.4990   9.7975   4.5475   82.737   25.290  100.824   28.306 -18.08727 37.95814 
1 1 1   36    1    3 f   74.657   20.379   4.9046   2.3939   6.5833   3.5831   3.5510   3.2174   84.272   25.555   66.115   24.264 18.15766 35.23924 
1 1 1   36    1    4 o   49.550   18.370   1.7399   1.8523  -1.4175   2.7959   4.2098   2.4729   41.757   19.175   69.300   21.273 -27.54332 28.63973 
1 1 1   36    1    5 o   53.638   19.030   2.2310   1.9589   1.1356   3.2234   2.8725   2.4667   54.239   22.825   59.870   21.342 -5.631157 31.24876 
1 1 1   36    1    6 o   90.191   13.819   6.6770   1.8469   11.309   2.7828   3.0307   2.4691  116.662   16.006   60.887   21.389 55.77484 26.71438 
1 1 1   36    1    7 o   40.458   16.907   0.4797   1.7492  -2.1053   2.6322   2.5244   2.3410   38.200   17.901   57.075   20.734 -18.87551 27.39268 
1 1 1   36    1    8 o   52.977   20.463   1.8743   2.3545   2.6819   3.2701   1.0048   3.3929   61.434   24.008   54.516   23.201 6.917927 33.38683 
1 1 1   36    1    9 o   39.219   17.778  -0.8782   2.3044  -1.1769   3.0840  -0.5007   3.4674   44.650   20.366   49.507   22.178 -4.857033 30.11005 
1 1 1   36    1   10 o  107.560   11.643   9.2966   1.8863   11.529   3.2291   8.1401   2.3240  115.846   18.860   98.568   15.949 17.27770 24.69938 
1 1 1   36    1   11 o   55.966   17.592   2.6362   1.6798   4.9922   2.6443   1.0422   2.1750   74.482   21.803   46.927   19.153 27.55512 29.02066 
1 1 1   36    1   12 o   61.898   19.111   3.3093   1.9925   4.1944   2.5012   1.7718   3.2964   68.732   21.444   56.948   23.450 11.78362 31.77619 
1 1 1   36    1   13 o   58.557   20.573   2.8167   2.2845   1.8554   2.4589   8.8789   6.1751   53.136   20.804   91.577   33.613 -38.44130 39.53045 
1 1 1   36    1   14 o   34.209   16.878  -6.0295   3.1840  -2.3201   3.7808 -15.0774   5.9047   46.162   21.575   40.967   20.626 5.195698 29.84816 
1 1 1   36    2    0 f   50.064   31.370   2.0790   4.9743   2.0790   4.9743   2.0790   4.9743   50.064   31.370   50.064   31.370 0.000000 0.000000 
1 1 1   36    2    1 o   58.913   22.281   2.5441   2.7529   1.9905   3.4143   3.5726   4.6539   59.024   24.033   70.294   28.259 -11.26997 37.09717 
1 1 1   36    2    2 o  107.816   15.398   9.6122   2.4688   12.409   3.5206   6.9063   3.4630  120.030   19.857   86.510   24.844 33.51994 31.80457 
1 1 1   36    2    3 o   36.579   16.579  -0.8382   2.0030  -0.1057   3.3670  -1.2395   2.4919   50.390   22.254   39.732   18.193 10.65836 28.74404 
1 1 1   36    2    4 o   41.822   18.017   0.1545   2.0919  -6.3053   3.6885   3.2175   2.5398   37.864   18.579   62.367   21.705 -24.50380 28.57073 
1 1 1   36    2    5 f   97.888   12.911   7.7798   1.8873   6.6119   2.8898   8.6484   2.4921   85.899   21.910  101.508   16.614 -15.60939 27.49693 
1 1 1   36    2    6 o   64.025   20.332   3.5260   2.2390   5.3697   3.2057   1.7698   3.1287   76.871   24.320   56.485   23.004 20.38629 33.47562 
1 1 1   36    2    7 o   47.001   17.790   1.4747   1.7558   2.5691   2.7138   0.6869   2.3026   58.732   22.144   46.099   19.340 12.63268 29.40025 
1 1 1   36    2    8 o   48.556   17.935   1.6854   1.7622   1.1358   2.7152   2.0853   2.3164   51.073   21.179   54.075   20.441 -3.002430 29.43468 
1 1 1   36    2    9 o   39.354   16.408   0.4671   1.6424   0.2638   2.5831   0.6051   2.1280   46.151   19.951   44.279   18.585 1.871498 27.26583 
1 1 1   36    2   10 o   41.015   16.454   0.8233   1.5740   4.0493   2.6350  -0.9664   1.9626   67.852   22.106   35.546   16.227 32.30509 27.42242 
1 1 1   36    2   11 o   70.399   20.672   4.3990   2.3739   3.9607   2.6163   6.4404   5.6461   67.157   22.035   82.339   31.722 -15.18268 38.62381 
1 1 1   36    2   12 o   50.751   22.311   0.1491   3.3480   5.2244   4.1561  -9.2328   5.6507   75.675   27.607   45.750   22.556 29.92474 35.64945 
1 1 1   36    2   13 o   61.138   24.245   2.6252   3.3790   2.1298   4.0994   3.6752   5.9678   61.832   25.864   72.923   30.892 -11.09069 40.28957 
1 1 1   36    2   14 o   60.340   24.005   2.5211   3.3222   2.7268   4.0228   2.0800   5.8918   63.808   26.046   67.948   29.741 -4.139587 39.53391 
1 1 1   36    3    0 o   74.456   30.008   6.3822   3.3347   6.3822   3.3347   6.3822   3.3347   74.456   30.008   74.456   30.008 0.000000 0.000000 
1 1 1   36    3    1 o   42.986   19.138  -0.4609   2.5397   2.9656   4.4793  -2.0843   3.0832   67.308   27.481   42.112   19.615 25.19593 33.76324 
1 1 1   36    3    2 o   53.875   21.192   1.8189   2.5620   0.6260   4.7484   2.3089   3.0430   60.403   26.562   58.810   23.108 1.593521 35.20689 
1 1 1   36    3    3 o   40.054   17.168   0.1791   1.8817   2.1098   3.2499  -0.7945   2.3079   58.747   23.616   39.669   17.904 19.07783 29.63563 
1 1 1   36    3    4 o   75.870   18.041   4.9650   2.0645   9.3775   2.8352  -0.0154   3.0121  104.836   18.336   48.267   21.192 56.56877 28.02388 
1 1 1   36    3    5 o   33.160   15.069  -0.7947   1.6688  -0.9869   2.7245  -0.6793   2.1111   42.542   19.303   38.255   17.208 4.286755 25.85929 
1 1 1   36    3    6 o   46.040   17.251   1.4390   1.6420   4.8911   2.7890  -0.3924   2.0314   73.901   22.577   38.690   17.176 35.21066 28.36783 
1 1 1   36    3    7 o   56.511   17.148   2.6924   1.6129   6.3720   3.1149   1.3444   1.8854   83.480   23.424   46.912   18.258 36.56827 29.69884 
1 1 1   36    3    8 o   21.873   10.754  -2.4891   1.2555  -2.5214   2.6452  -2.4797   1.4265   37.104   17.559   24.182   11.799 12.92212 21.15533 
1 1 1   36    3    9 f   45.759   20.804  -1.0528   3.1851  -0.2923   3.9131  -2.5458   5.4831   52.882   23.634   55.756   26.033 -2.874317 35.16087 
1 1 1   36    3   10 o   54.645   25.666  -3.0051   5.4636   0.0000   0.0000  -3.0051   5.4636  ?   ?    54.645   25.666 0.000000 25.66568 
1 1 1   36    3   11 o   89.628   23.666   7.4279   3.2947   8.7872   4.1191   5.0136   5.4895   95.337   27.001   76.689   30.741 18.64801 40.91528 
1 1 1   36    3   12 o   46.669   21.289  -1.1375   3.3710  -2.3587   4.1770   1.1435   5.7085   48.709   22.736   65.046   28.839 -16.33699 36.72358 
1 1 1   36    3   13 o   51.264   22.427   0.3166   3.3463  -3.1615   4.1443   6.8328   5.6725   46.624   22.038   83.442   31.881 -36.81747 38.75660 
1 1 1   36    4    0 o   49.584   27.372   2.9922   3.0263   2.9922   3.0263   2.9922   3.0263   49.584   27.372   49.584   27.372 0.000000 0.000000 
1 1 1   36    4    1 o   45.433   18.733   0.8282   2.1071   4.5166   3.0601  -2.4975   2.9057   71.521   23.848   39.510   18.607 32.01045 30.24831 
1 1 1   36    4    2 o   49.600   20.673   0.9520   2.6058  -0.0658   3.0931   3.4409   4.8369   48.640   21.413   70.160   28.591 -21.52019 35.72016 
1 1 1   36    4    3 o   52.825   17.950   2.2342   1.7338   1.8246   3.1366   2.4145   2.0806   56.803   23.071   55.416   19.617 1.387394 30.28414 
1 1 1   36    4    4 o   55.303   17.686   2.5402   1.6919   0.5477   3.4427   3.1747   1.9426   53.134   23.001   61.017   18.876 -7.883240 29.75457 
1 1 1   36    4    5 o   66.502   16.833   3.7843   1.7150   2.1324   3.5695   4.2802   1.9555   60.166   24.544   70.348   18.067 -10.18195 30.47664 
1 1 1   36    4    6 o   50.300   20.195   1.3912   2.3735   0.9156   2.6794   3.1246   5.1156   49.820   20.879   69.630   28.989 -19.81060 35.72535 
1 1 1   36    4    7 o   53.115   22.266   1.1496   3.0484  -0.2120   3.6417   4.3369   5.5718   51.572   22.941   74.930   30.627 -23.35803 38.26682 
1 1 1   36    4    8 o   51.906   23.382  -0.6232   3.9141   5.0305   5.3525  -7.1217   5.7384   76.892   30.508   49.229   23.941 27.66356 38.78037 
1 1 1   36    4    9 o   56.354   22.904   1.8293   3.0938   1.5748   3.6332   2.5007   5.9008   57.887   24.290   69.766   30.157 -11.87859 38.72234 
1 1 1   36    4   10 o   57.100   23.192   1.9243   3.1692   2.9583   3.8568  -0.2257   5.5614   64.545   25.804   61.165   27.682 3.380154 37.84371 
1 1 1   36    4   11 o   74.357   24.789   5.0554   3.3064   5.9252   3.9783   3.1124   5.9459   79.261   27.188   71.387   30.556 7.873650 40.90055 
1 1 1   36    4   12 o   58.637   23.680   2.1716   3.2837   6.4837   3.9697  -7.1726   5.8437   82.213   27.150   49.437   24.069 32.77604 36.28317 
1 1 1   36    4   13 o   57.858   25.131   0.9895   4.1379   0.9895   4.1379   0.0000   0.0000   57.858   25.131  ?   ?  0.000000 25.13091 
1 1 1   36    5    0 o   41.252   24.719   1.6690   2.7911   1.6690   2.7911   1.6690   2.7911   41.252   24.719   41.252   24.719 0.000000 0.000000 
1 1 1   36    5    1 o   47.596   19.969   0.7589   2.4551   1.2024   2.9260  -0.2963   4.5131   52.749   21.939   56.424   25.287 -3.675579 33.47787 
1 1 1   36    5    2 o   57.226   17.946   2.7516   1.7493  -0.6071   3.0040   4.4747   2.1517   46.026   20.629   71.585   19.229 -25.55906 28.20089 
1 1 1   36    5    3 o   60.365   17.160   3.1077   1.6604   2.8188   3.0284   3.2319   1.9855   61.328   23.327   61.497   19.093 -0.1691475 30.14425 
1 1 1   36    5    4 o  112.898   9.2111   10.048   1.5779   10.426   2.8537   9.8814   1.8936  111.139   17.342  111.151   11.287 -0.1146698E-01 20.69130 
1 1 1   36    5    5 o   67.791   23.021   3.9885   2.8518   5.3376   3.4966   1.3082   4.9285   76.461   25.492   62.994   27.394 13.46757 37.42063 
1 1 1   36    5    6 o   58.493   22.819   2.3667   2.9501   1.2295   3.5812   4.7679   5.2039   56.378   23.910   75.734   30.071 -19.35552 38.41799 
1 1 1   36    5    7 o   30.390   15.191  -7.2679   2.9313  -7.4687   3.5365  -6.8272   5.2397   34.858   17.303   46.923   22.833 -12.06555 28.64873 
1 1 1   36    5    8 o   63.447   25.707   2.6585   3.8839   0.4803   5.3532   5.0794   5.6437   62.195   27.730   77.445   31.125 -15.24977 41.68614 
1 1 1   36    5    9 o   60.626   23.296   2.7331   3.0397  -1.6476   3.6400   12.828   5.5256   47.138   21.732  112.003   31.117 -64.86543 37.95441 
1 1 1   36    5   10 o   94.255   22.682   8.0967   3.2328   5.9569   3.8691   13.044   5.8835   79.514   26.816  111.358   32.500 -31.84414 42.13483 
1 1 1   36    5   11 o   83.743   27.203   6.7521   3.9913   6.7521   3.9913   0.0000   0.0000   83.743   27.203  ?   ?  0.000000 27.20327 
1 1 1   36    5   12 o   44.841   21.316  -3.5112   3.9853  -3.5112   3.9853   0.0000   0.0000   44.841   21.316  ?   ?  0.000000 21.31622 
1 1 1   36    6    0 o  147.232   23.022   18.823   4.8098   18.823   4.8098   18.823   4.8098  147.232   23.022  147.232   23.022 0.000000 0.000000 
1 1 1   36    6    1 o   79.703   17.820   5.4682   2.1195   9.7544   3.1279   1.8296   2.8819  105.821   20.045   55.460   22.258 50.36097 29.95407 
1 1 1   36    6    2 o   57.548   17.483   2.8010   1.6758   2.8677   3.2252   2.7764   1.9614   62.221   23.974   57.755   19.085 4.465981 30.64258 
1 1 1   36    6    3 o   74.567   24.688   5.0261   3.2816   11.896   4.6175  -1.9849   4.6646  111.649   27.257   52.778   24.426 58.87120 36.60029 
1 1 1   36    6    4 o   44.590   20.458  -1.4194   3.1725  -2.6202   4.2404   0.1074   4.7814   48.745   22.804   58.758   26.202 -10.01217 34.73546 
1 1 1   36    6    5 o   48.112   20.749   0.3885   2.7806   0.6163   3.4215  -0.0545   4.7716   53.118   22.962   58.216   26.052 -5.097469 34.72688 
1 1 1   36    6    6 o   87.137   22.297   6.8768   2.9861   3.9477   3.5772   13.609   5.4232   68.667   25.515  116.762   30.139 -48.09557 39.48890 
1 1 1   36    6    7 f   57.609   22.853   2.1717   3.0031   0.6761   3.6144   5.5058   5.3965   54.362   23.550   78.630   30.810 -24.26852 38.77951 
1 1 1   36    6    8 o   91.323   21.980   7.5304   3.0352   7.2059   3.6567   8.2493   5.4427   87.253   25.667   90.023   31.744 -2.770256 40.82199 
1 1 1   36    6    9 o   54.814   24.159   0.3041   3.9486  -0.3049   5.6118   0.9013   5.5568   61.122   27.721   63.948   28.398 -2.826023 39.68518 
1 1 1   36    6   10 o   80.100   26.826   6.0790   3.8717   6.0790   3.8717   0.0000   0.0000   80.100   26.826  ?   ?  0.000000 26.82554 
1 1 1   36    6   11 o   56.408   23.255   1.7253   3.2466   1.2610   3.9591   2.6785   5.6728   58.008   24.884   69.125   29.724 -11.11663 38.76485 
1 1 1   36    7    0 o   32.681   21.586  -0.2940   2.7967  -0.2940   2.7967  -0.2940   2.7967   32.681   21.586   32.681   21.586 0.000000 0.000000 
1 1 1   36    7    1 o  142.265   13.599   16.432   2.9252   0.0000   0.0000   16.432   2.9252  ?   ?   142.265   13.599 0.000000 13.59922 
1 1 1   36    7    2 o   68.337   24.278   4.0113   3.1894   0.7786   4.3165   7.8982   4.7332   58.474   25.529   89.482   29.651 -31.00820 39.12683 
1 1 1   36    7    3 o   57.897   23.575   1.9483   3.2855  -1.7016   4.5462   5.9387   4.7535   52.701   24.293   79.939   29.469 -27.23771 38.19126 
1 1 1   36    7    4 o   62.979   24.700   2.8753   3.4708   1.0795   4.9176   4.6578   4.8994   62.093   27.175   74.572   29.314 -12.47934 39.97266 
1 1 1   36    7    5 o   92.302   25.463   8.0321   3.7144   6.1194   5.2010   10.023   5.3066   80.929   30.621   98.846   31.292 -17.91753 43.78165 
1 1 1   36    7    6 o  138.001   18.504   16.231   3.8102   14.531   5.4688   17.835   5.3114  121.022   29.736  138.313   26.044 -17.29005 39.52907 
1 1 1   36    7    7 o  104.964   21.423   9.8138   3.3254   6.8919   4.1339   15.171   5.5978   84.561   27.696  123.447   29.934 -38.88628 40.78135 
1 1 1   36    7    8 o   47.023   21.944  -2.3107   3.8870  -2.3107   3.8870   0.0000   0.0000   47.023   21.944  ?   ?  0.000000 21.94355 
1 1 1   36    7    9 o   77.632   26.834   5.6323   3.8790   5.6323   3.8790   0.0000   0.0000   77.632   26.834  ?   ?  0.000000 26.83435 
1 1 1   36    7   10 o   49.793   22.940  -1.5795   4.0467  -0.4886   5.8541  -2.5778   5.6001   61.529   28.063   55.923   26.176 5.606495 38.37556 
1 1 1   36    8    0 o   37.574   24.644   0.0061   3.5471   0.0061   3.5471   0.0061   3.5471   37.574   24.644   37.574   24.644 0.000000 0.000000 
1 1 1   36    8    1 o   72.942   26.734   4.6804   3.9042   4.6804   3.9042   0.0000   0.0000   72.942   26.734  ?   ?  0.000000 26.73442 
1 1 1   36    8    2 o  166.050   13.965   22.432   3.5165   18.202   4.5005   29.063   5.6345  144.284   20.994  183.290   20.431 -39.00522 29.29525 
1 1 1   36    8    3 o  135.846   17.871   15.628   3.6258   13.110   4.9396   18.569   5.3390  116.313   28.067  141.678   25.560 -25.36495 37.96197 
1 1 1   36    8    4 o   56.842   23.803   1.5165   3.4776  -0.7307   4.8810   3.8333   4.9560   56.795   25.795   71.332   28.990 -14.53751 38.80484 
1 1 1   36    8    5 o   58.879   23.004   2.4326   3.0018   0.2486   3.8473   5.8314   4.7994   54.116   23.850   79.207   29.529 -25.09098 37.95776 
1 1 1   36    8    6 o  112.172   24.253   11.600   4.0429   11.600   4.0429   0.0000   0.0000  112.172   24.253  ?   ?  0.000000 24.25337 
1 1 1   36    8    7 o   59.265   25.391   1.3828   4.1127   1.3828   4.1127   0.0000   0.0000   59.265   25.391  ?   ?  0.000000 25.39115 
1 1 1   36    8    8 o   49.402   21.832  -0.0393   3.2453  -5.5297   4.0228   10.193   5.4918   41.272   20.066   98.624   31.898 -57.35164 37.68474 
1 1 1   36    8    9 o   57.945   24.803   1.2978   3.9179  -3.8625   5.4799   6.6935   5.6035   52.860   25.090   82.920   31.685 -30.05972 40.41611 
1 1 1   36    9    3 o   49.853   21.959   0.0480   3.2571   1.6339   4.4096  -1.8560   4.8318   61.504   26.319   53.734   24.866 7.769157 36.20778 
1 1 1   36    9    4 o   80.467   29.714   6.1335   4.8368   6.1335   4.8368   0.0000   0.0000   80.467   29.714  ?   ?  0.000000 29.71437 
1 1 1   36    9    5 o   40.127   19.547  -5.5907   3.8692  -5.5907   3.8692   0.0000   0.0000   40.127   19.547  ?   ?  0.000000 19.54679 
1 1 1   36    9    6 o   91.905   22.891   7.7406   3.2081   6.1155   4.0380   10.522   5.2828   80.204   27.393  100.868   31.115 -20.66379 41.45477 
#END OF REFLECTIONS
